smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000005096988 181202890 /nfs/dbraw/zinc/20/28/90/181202890.db2.gz BJAKZXSZGVRNPU-ZDUSSCGKSA-N 2 1 315.288 4.348 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000005096988 181202893 /nfs/dbraw/zinc/20/28/93/181202893.db2.gz BJAKZXSZGVRNPU-ZDUSSCGKSA-N 2 1 315.288 4.348 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000021510259 182276784 /nfs/dbraw/zinc/27/67/84/182276784.db2.gz ORFQWBMMJQHMIO-NSHDSACASA-N 2 1 301.261 4.128 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)oc2cc1C ZINC000152399127 335056534 /nfs/dbraw/zinc/05/65/34/335056534.db2.gz YRZWUYVOQHRULU-HOTGVXAUSA-N 2 1 312.457 4.185 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)oc2cc1C ZINC000152399127 335056536 /nfs/dbraw/zinc/05/65/36/335056536.db2.gz YRZWUYVOQHRULU-HOTGVXAUSA-N 2 1 312.457 4.185 20 0 DIADMP CSCCCCC[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274817213 130264981 /nfs/dbraw/zinc/26/49/81/130264981.db2.gz XEKDAWCAUYQSFM-PKOBYXMFSA-N 2 1 320.546 4.020 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000274927690 130275086 /nfs/dbraw/zinc/27/50/86/130275086.db2.gz QDXRQFYLVCTKKQ-QMMLZNLJSA-N 2 1 323.484 4.033 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCc3sc(Cl)cc32)CC1 ZINC000127467720 332002511 /nfs/dbraw/zinc/00/25/11/332002511.db2.gz CZKYWZZUBMJJMX-CQSZACIVSA-N 2 1 312.910 4.241 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000559273052 332011656 /nfs/dbraw/zinc/01/16/56/332011656.db2.gz KKOKFKOKFPUDIU-UHFFFAOYSA-N 2 1 306.881 4.145 20 0 DIADMP C[C@H](C[NH2+][C@H]1C[C@H](C)Sc2sccc21)C[NH+]1CCCCC1 ZINC000130370886 332024199 /nfs/dbraw/zinc/02/41/99/332024199.db2.gz LKYQFWROZYGJBH-YCPHGPKFSA-N 2 1 324.559 4.385 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C/C=C/c2ccccc2)C[C@@H]1c1ccccc1 ZINC000518407647 332027339 /nfs/dbraw/zinc/02/73/39/332027339.db2.gz HONSJOIAGSPZEK-FFLQPZBESA-N 2 1 306.453 4.125 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C/C=C/c2ccccc2)C[C@@H]1c1ccccc1 ZINC000518407647 332027340 /nfs/dbraw/zinc/02/73/40/332027340.db2.gz HONSJOIAGSPZEK-FFLQPZBESA-N 2 1 306.453 4.125 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CCC2 ZINC000569522987 332123804 /nfs/dbraw/zinc/12/38/04/332123804.db2.gz FFSAXFOKXJCCPF-TVPLGVNVSA-N 2 1 318.892 4.324 20 0 DIADMP CN1CC[C@@H]([NH2+]Cc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000559722575 332277985 /nfs/dbraw/zinc/27/79/85/332277985.db2.gz XXKPDWAMMVNKAC-IEBWSBKVSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCC2CCCC2)C[C@@H]1c1ccccc1 ZINC000559737189 332278580 /nfs/dbraw/zinc/27/85/80/332278580.db2.gz VLRMZYCFFJHERZ-WOJBJXKFSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCC2CCCC2)C[C@@H]1c1ccccc1 ZINC000559737189 332278582 /nfs/dbraw/zinc/27/85/82/332278582.db2.gz VLRMZYCFFJHERZ-WOJBJXKFSA-N 2 1 300.490 4.382 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000559744071 332278602 /nfs/dbraw/zinc/27/86/02/332278602.db2.gz VCIMETOGZABZPT-HJNYFJLDSA-N 2 1 320.480 4.407 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000559744071 332278603 /nfs/dbraw/zinc/27/86/03/332278603.db2.gz VCIMETOGZABZPT-HJNYFJLDSA-N 2 1 320.480 4.407 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)C[C@H]1c1ccccc1 ZINC000559766063 332279718 /nfs/dbraw/zinc/27/97/18/332279718.db2.gz FHQDWXKZFZPAJT-RQUKQETFSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)C[C@H]1c1ccccc1 ZINC000559766063 332279719 /nfs/dbraw/zinc/27/97/19/332279719.db2.gz FHQDWXKZFZPAJT-RQUKQETFSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559845825 332284942 /nfs/dbraw/zinc/28/49/42/332284942.db2.gz VMJKZLVBLWFWJN-BTHPGYMESA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559845825 332284944 /nfs/dbraw/zinc/28/49/44/332284944.db2.gz VMJKZLVBLWFWJN-BTHPGYMESA-N 2 1 300.490 4.380 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2(C)CCC2)CC1 ZINC000559920950 332294145 /nfs/dbraw/zinc/29/41/45/332294145.db2.gz CKUWJRSEZFDRFK-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(-c2ccncc2)c1 ZINC000119735907 332377174 /nfs/dbraw/zinc/37/71/74/332377174.db2.gz BTMDRUSHOSLXIN-INIZCTEOSA-N 2 1 321.468 4.026 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC000566534386 332468990 /nfs/dbraw/zinc/46/89/90/332468990.db2.gz GVNHJIIMFKTUBJ-UHFFFAOYSA-N 2 1 313.489 4.102 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000178296516 333007100 /nfs/dbraw/zinc/00/71/00/333007100.db2.gz CDJKADRKRXCEPK-UIFIKXQLSA-N 2 1 308.469 4.043 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000178296516 333007101 /nfs/dbraw/zinc/00/71/01/333007101.db2.gz CDJKADRKRXCEPK-UIFIKXQLSA-N 2 1 308.469 4.043 20 0 DIADMP Cc1cc([C@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)cs1 ZINC000394531967 333032658 /nfs/dbraw/zinc/03/26/58/333032658.db2.gz RDMTXVQCWAYQLA-INIZCTEOSA-N 2 1 302.487 4.229 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000314142025 333089229 /nfs/dbraw/zinc/08/92/29/333089229.db2.gz PMNWOJFDKFAUQX-CYBMUJFWSA-N 2 1 314.395 4.230 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000314142030 333089240 /nfs/dbraw/zinc/08/92/40/333089240.db2.gz PMNWOJFDKFAUQX-ZDUSSCGKSA-N 2 1 314.395 4.230 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccs2)c1 ZINC000177977278 333133700 /nfs/dbraw/zinc/13/37/00/333133700.db2.gz HCURGTQTJVSQNL-OAHLLOKOSA-N 2 1 302.487 4.439 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)o1 ZINC000177979983 333134022 /nfs/dbraw/zinc/13/40/22/333134022.db2.gz WSVOLPGQDFPXDD-INIZCTEOSA-N 2 1 300.446 4.279 20 0 DIADMP c1cn2c(cccc2C[N@H+]2C[C@@H](c3ccccc3)[C@@H]3CCC[C@@H]32)n1 ZINC000582089599 333208906 /nfs/dbraw/zinc/20/89/06/333208906.db2.gz MYLDSCWEMCKJSK-UFYCRDLUSA-N 2 1 317.436 4.102 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)C1 ZINC000320684162 335123619 /nfs/dbraw/zinc/12/36/19/335123619.db2.gz PHGUAZHIAKMYSN-ROUUACIJSA-N 2 1 308.469 4.346 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390565371 333300815 /nfs/dbraw/zinc/30/08/15/333300815.db2.gz BJECZBSKAIWAJF-NEWSRXKRSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390565371 333300816 /nfs/dbraw/zinc/30/08/16/333300816.db2.gz BJECZBSKAIWAJF-NEWSRXKRSA-N 2 1 300.490 4.065 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000020549201 333322152 /nfs/dbraw/zinc/32/21/52/333322152.db2.gz SOQDIKNATSWSSO-ZDUSSCGKSA-N 2 1 302.384 4.088 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000390756997 333324348 /nfs/dbraw/zinc/32/43/48/333324348.db2.gz WXEQOQRNQNMWFQ-UYAOXDASSA-N 2 1 308.469 4.168 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@@H](C)C1 ZINC000390762142 333333528 /nfs/dbraw/zinc/33/35/28/333333528.db2.gz BTTNWADXZZSIQH-YRWFTTLQSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccc(Cl)cc2)C[C@@H]1C ZINC000531378787 333347381 /nfs/dbraw/zinc/34/73/81/333347381.db2.gz YTDKGTMGQQEUSL-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccc(Cl)cc2)C[C@@H]1C ZINC000531378787 333347383 /nfs/dbraw/zinc/34/73/83/333347383.db2.gz YTDKGTMGQQEUSL-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccc(Cl)cc2)C[C@@H]1C ZINC000531378787 333347385 /nfs/dbraw/zinc/34/73/85/333347385.db2.gz YTDKGTMGQQEUSL-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccc(Cl)cc2)C[C@@H]1C ZINC000531378785 333347520 /nfs/dbraw/zinc/34/75/20/333347520.db2.gz YTDKGTMGQQEUSL-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccc(Cl)cc2)C[C@@H]1C ZINC000531378785 333347521 /nfs/dbraw/zinc/34/75/21/333347521.db2.gz YTDKGTMGQQEUSL-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccc(Cl)cc2)C[C@@H]1C ZINC000531378785 333347522 /nfs/dbraw/zinc/34/75/22/333347522.db2.gz YTDKGTMGQQEUSL-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+]C3CCC4(CC4)CC3)CC2)cc1 ZINC000463237692 333355963 /nfs/dbraw/zinc/35/59/63/333355963.db2.gz MUWMMVLPOKRTBT-UHFFFAOYSA-N 2 1 312.501 4.006 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000221790524 333366746 /nfs/dbraw/zinc/36/67/46/333366746.db2.gz OIFUJLQMXFGDGV-UHFFFAOYSA-N 2 1 302.487 4.235 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000221920654 333379894 /nfs/dbraw/zinc/37/98/94/333379894.db2.gz IDRKKDXBPJPBDL-CYBMUJFWSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@@H+](C)CCCN[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000221920654 333379892 /nfs/dbraw/zinc/37/98/92/333379892.db2.gz IDRKKDXBPJPBDL-CYBMUJFWSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000221920654 333379893 /nfs/dbraw/zinc/37/98/93/333379893.db2.gz IDRKKDXBPJPBDL-CYBMUJFWSA-N 2 1 302.384 4.086 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ccc(F)cc2)CC1 ZINC000521428791 333382092 /nfs/dbraw/zinc/38/20/92/333382092.db2.gz UWHWBRAHENQWER-INIZCTEOSA-N 2 1 306.469 4.331 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390788138 333393608 /nfs/dbraw/zinc/39/36/08/333393608.db2.gz ACNPIMCSRAGFMW-LMCOJAPRSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]CC1CCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390800894 333394396 /nfs/dbraw/zinc/39/43/96/333394396.db2.gz ORZBQRLSFPUEOF-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](CC1CCCC1)c1ccccc1 ZINC000338021555 333467856 /nfs/dbraw/zinc/46/78/56/333467856.db2.gz VKSRRXLRFBUOHY-HXUWFJFHSA-N 2 1 311.473 4.493 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1 ZINC000338010222 333467962 /nfs/dbraw/zinc/46/79/62/333467962.db2.gz JPEVGVHOLGJALV-NSHDSACASA-N 2 1 312.244 4.239 20 0 DIADMP CC[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000401770769 333595608 /nfs/dbraw/zinc/59/56/08/333595608.db2.gz JHSFILSUGPAOCT-OAHLLOKOSA-N 2 1 312.244 4.010 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)[C@H]1C[C@H]1C ZINC000414067283 333890326 /nfs/dbraw/zinc/89/03/26/333890326.db2.gz AGTXMJBMLXQJKA-YKCBXCCJSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000280344735 334116681 /nfs/dbraw/zinc/11/66/81/334116681.db2.gz RRKGYHRKXAKOOH-PXNSSMCTSA-N 2 1 315.505 4.167 20 0 DIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cs1 ZINC000294956621 334214771 /nfs/dbraw/zinc/21/47/71/334214771.db2.gz DOHYHDIAORCHBP-UHFFFAOYSA-N 2 1 302.487 4.187 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C(C)(C)c1ccccc1 ZINC000415086022 334274651 /nfs/dbraw/zinc/27/46/51/334274651.db2.gz RDVKBQLSJOODOO-IOMROCGXSA-N 2 1 322.496 4.436 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+]C[C@H]1CC[N@@H+](CC)C1 ZINC000320382367 334248781 /nfs/dbraw/zinc/24/87/81/334248781.db2.gz VUZUBWZRLUDDQD-MRXNPFEDSA-N 2 1 314.473 4.207 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)Cc1ccccc1 ZINC000415087426 334275753 /nfs/dbraw/zinc/27/57/53/334275753.db2.gz UHWVPOVJGORSMC-RTWAWAEBSA-N 2 1 322.496 4.338 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)Cc1ccccc1 ZINC000415087427 334275772 /nfs/dbraw/zinc/27/57/72/334275772.db2.gz UHWVPOVJGORSMC-SFTDATJTSA-N 2 1 322.496 4.338 20 0 DIADMP Cc1ccccc1C(C)(C)C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415092647 334280370 /nfs/dbraw/zinc/28/03/70/334280370.db2.gz UBLXOLLSZXPFLR-CTNGQTDRSA-N 2 1 322.496 4.356 20 0 DIADMP Cc1ccccc1C1(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC000415098511 334281277 /nfs/dbraw/zinc/28/12/77/334281277.db2.gz FJXOKUXBPQZIIU-CTNGQTDRSA-N 2 1 320.480 4.110 20 0 DIADMP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415113191 334282264 /nfs/dbraw/zinc/28/22/64/334282264.db2.gz BOSVDSFMXWEKSV-AKHDSKFASA-N 2 1 300.490 4.284 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117071 334284012 /nfs/dbraw/zinc/28/40/12/334284012.db2.gz FWALRRLGILVVJB-ZMYBRWDISA-N 2 1 314.860 4.484 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303781805 334330395 /nfs/dbraw/zinc/33/03/95/334330395.db2.gz SPFXNUWBQVKHIO-UGKGYDQZSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303781805 334330396 /nfs/dbraw/zinc/33/03/96/334330396.db2.gz SPFXNUWBQVKHIO-UGKGYDQZSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781805 334330398 /nfs/dbraw/zinc/33/03/98/334330398.db2.gz SPFXNUWBQVKHIO-UGKGYDQZSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781805 334330399 /nfs/dbraw/zinc/33/03/99/334330399.db2.gz SPFXNUWBQVKHIO-UGKGYDQZSA-N 2 1 322.496 4.214 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000531970786 334331251 /nfs/dbraw/zinc/33/12/51/334331251.db2.gz PXULOTCNJNCEQE-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000531970794 334331321 /nfs/dbraw/zinc/33/13/21/334331321.db2.gz PXULOTCNJNCEQE-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000534908387 334345653 /nfs/dbraw/zinc/34/56/53/334345653.db2.gz JIMXKEDKEJMDNU-IERDGZPVSA-N 2 1 312.501 4.261 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000535051619 334360384 /nfs/dbraw/zinc/36/03/84/334360384.db2.gz NADWHPGKXXRVFR-UHFFFAOYSA-N 2 1 319.452 4.381 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000535051619 334360385 /nfs/dbraw/zinc/36/03/85/334360385.db2.gz NADWHPGKXXRVFR-UHFFFAOYSA-N 2 1 319.452 4.381 20 0 DIADMP C[NH+](C)CCc1ccc(CNc2cc[nH+]c3ccsc32)cc1 ZINC000341485575 334447229 /nfs/dbraw/zinc/44/72/29/334447229.db2.gz UQIOTKVGMIVJAI-UHFFFAOYSA-N 2 1 311.454 4.013 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H](C)Cn2cc[nH+]c2C)C2CCCC2)o1 ZINC000342801235 334573175 /nfs/dbraw/zinc/57/31/75/334573175.db2.gz CKUAGWPMIATGFD-IFXJQAMLSA-N 2 1 315.461 4.250 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1cc2cc(F)ccc2o1)C(C)C ZINC000343876872 335199318 /nfs/dbraw/zinc/19/93/18/335199318.db2.gz MTCVPCZAOCPGCI-UHFFFAOYSA-N 2 1 306.425 4.170 20 0 DIADMP CC[C@H](c1cccc(OC)c1)[N@@H+](C)CCCCn1ccnc1C ZINC000343952314 335207353 /nfs/dbraw/zinc/20/73/53/335207353.db2.gz ZZWLXSHANMREQM-LJQANCHMSA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@H](c1cccc(OC)c1)[N@H+](C)CCCCn1cc[nH+]c1C ZINC000343952314 335207355 /nfs/dbraw/zinc/20/73/55/335207355.db2.gz ZZWLXSHANMREQM-LJQANCHMSA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@H](c1cccc(OC)c1)[N@@H+](C)CCCCn1cc[nH+]c1C ZINC000343952314 335207357 /nfs/dbraw/zinc/20/73/57/335207357.db2.gz ZZWLXSHANMREQM-LJQANCHMSA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000344302002 335238472 /nfs/dbraw/zinc/23/84/72/335238472.db2.gz SFHZNWYAXGJGIW-NRFANRHFSA-N 2 1 324.468 4.151 20 0 DIADMP Clc1ccc([C@@H](CC2CC2)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000345682959 335341455 /nfs/dbraw/zinc/34/14/55/335341455.db2.gz NYAGBTZIDFBSLZ-HNAYVOBHSA-N 2 1 318.892 4.255 20 0 DIADMP Clc1ccc([C@H](CC2CC2)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000345719158 335345623 /nfs/dbraw/zinc/34/56/23/335345623.db2.gz LFIUBWOIOOUJSM-QRVBRYPASA-N 2 1 318.892 4.398 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C(C)C)C1CCCCC1 ZINC000346180768 335378363 /nfs/dbraw/zinc/37/83/63/335378363.db2.gz QRNPSAWYNXSVJG-UHFFFAOYSA-N 2 1 312.461 4.119 20 0 DIADMP C[C@H](c1cccs1)[N@@H+](CCn1ccnc1)Cc1ccccc1 ZINC000346305539 335398182 /nfs/dbraw/zinc/39/81/82/335398182.db2.gz INVLIQKLLGQXGJ-MRXNPFEDSA-N 2 1 311.454 4.208 20 0 DIADMP C[C@@H](CC[NH2+][C@H]1CCSc2ccc(F)cc21)[NH+]1CCCCC1 ZINC000346877641 335447368 /nfs/dbraw/zinc/44/73/68/335447368.db2.gz KJACQOVKQFELHP-YOEHRIQHSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H](CC[NH2+][C@@H]1CCSc2ccccc21)[NH+]1CCCCC1 ZINC000346869181 335451458 /nfs/dbraw/zinc/45/14/58/335451458.db2.gz TXATZRSFSFQVSY-DOTOQJQBSA-N 2 1 304.503 4.078 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C2CC(C(F)(F)F)C2)cc1 ZINC000348752719 335606072 /nfs/dbraw/zinc/60/60/72/335606072.db2.gz HDPAMNJQWXVETJ-VCANKDNSSA-N 2 1 323.362 4.172 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN([C@@H](C)c2cccc(Cl)c2F)C1 ZINC000480555891 336031162 /nfs/dbraw/zinc/03/11/62/336031162.db2.gz RLNHQAJUWYPIPG-UONOGXRCSA-N 2 1 312.860 4.204 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000395239385 336053759 /nfs/dbraw/zinc/05/37/59/336053759.db2.gz XWHZSQUSDFAVEY-SFHVURJKSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000395239385 336053761 /nfs/dbraw/zinc/05/37/61/336053761.db2.gz XWHZSQUSDFAVEY-SFHVURJKSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000352090931 336194366 /nfs/dbraw/zinc/19/43/66/336194366.db2.gz FUPBYTXZASCGKJ-JEYLPNPQSA-N 2 1 317.864 4.017 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000532393494 336245201 /nfs/dbraw/zinc/24/52/01/336245201.db2.gz JXQDATFSTRFGSN-DOTOQJQBSA-N 2 1 321.534 4.011 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1Cl ZINC000532462197 336249014 /nfs/dbraw/zinc/24/90/14/336249014.db2.gz FGAOILBWRCBWLS-ZDUSSCGKSA-N 2 1 322.880 4.016 20 0 DIADMP CCC(CC)(C[NH2+][C@@H]1C[C@@H](C)[N@@H+](C)C[C@@H]1C)c1ccccc1 ZINC000532532234 336254043 /nfs/dbraw/zinc/25/40/43/336254043.db2.gz TZUIVFIDUKXLHK-YQVWRLOYSA-N 2 1 302.506 4.063 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000532542149 336254780 /nfs/dbraw/zinc/25/47/80/336254780.db2.gz PENZACQCULRHJG-JBYIUTFZSA-N 2 1 322.496 4.214 20 0 DIADMP C[N@@H+]1CCC[C@@H](CNc2cc[nH+]cc2Cl)[C@H]1c1cccs1 ZINC000301554277 336314500 /nfs/dbraw/zinc/31/45/00/336314500.db2.gz MYJIZTRPDBDOFM-LRDDRELGSA-N 2 1 321.877 4.292 20 0 DIADMP C[N@H+]1CCC[C@@H](CNc2cc[nH+]cc2Cl)[C@H]1c1cccs1 ZINC000301554277 336314501 /nfs/dbraw/zinc/31/45/01/336314501.db2.gz MYJIZTRPDBDOFM-LRDDRELGSA-N 2 1 321.877 4.292 20 0 DIADMP Cc1cc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811240 336370175 /nfs/dbraw/zinc/37/01/75/336370175.db2.gz GZGCBPJPKLHMEN-IRXDYDNUSA-N 2 1 319.811 4.040 20 0 DIADMP Cc1cc(N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811240 336370176 /nfs/dbraw/zinc/37/01/76/336370176.db2.gz GZGCBPJPKLHMEN-IRXDYDNUSA-N 2 1 319.811 4.040 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261663839 336382284 /nfs/dbraw/zinc/38/22/84/336382284.db2.gz GNXADENKKHBQCI-INIZCTEOSA-N 2 1 308.469 4.365 20 0 DIADMP c1ccc(C(C[NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000193090499 336397057 /nfs/dbraw/zinc/39/70/57/336397057.db2.gz HEGHMNDEOXKHPD-UHFFFAOYSA-N 2 1 320.480 4.035 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](C)C(F)(F)F)cc1 ZINC000359541904 336676830 /nfs/dbraw/zinc/67/68/30/336676830.db2.gz SFNOEHKDINQLGV-NWDGAFQWSA-N 2 1 311.351 4.030 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCC(C)(C)c2ccccc21 ZINC000360656782 336717810 /nfs/dbraw/zinc/71/78/10/336717810.db2.gz KSLSZUBYYFALTG-HNAYVOBHSA-N 2 1 311.473 4.230 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(-c2cccs2)cc1 ZINC000360933469 336728191 /nfs/dbraw/zinc/72/81/91/336728191.db2.gz POMBZQYUZIUAKM-CQSZACIVSA-N 2 1 311.454 4.271 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c2ccsc2S1 ZINC000361973874 336780686 /nfs/dbraw/zinc/78/06/86/336780686.db2.gz YXDFZXFXMDVLAA-OSFYFWSMSA-N 2 1 310.532 4.136 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1cc2cc(Cl)ccc2o1 ZINC000377798943 337061334 /nfs/dbraw/zinc/06/13/34/337061334.db2.gz OTMIXEXWTDIPRW-GXFFZTMASA-N 2 1 315.804 4.017 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CC(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584365345 337102157 /nfs/dbraw/zinc/10/21/57/337102157.db2.gz QPPMUJLHEGMSGW-JYAXOCDNSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CC(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584365345 337102158 /nfs/dbraw/zinc/10/21/58/337102158.db2.gz QPPMUJLHEGMSGW-JYAXOCDNSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1ccc(Cl)s1)C1CCCCC1 ZINC000037860336 337147085 /nfs/dbraw/zinc/14/70/85/337147085.db2.gz FGSZOUDBEIJYTM-UHFFFAOYSA-N 2 1 300.899 4.146 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1ccc(Cl)s1)C1CCCCC1 ZINC000037860336 337147086 /nfs/dbraw/zinc/14/70/86/337147086.db2.gz FGSZOUDBEIJYTM-UHFFFAOYSA-N 2 1 300.899 4.146 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000178409542 337164541 /nfs/dbraw/zinc/16/45/41/337164541.db2.gz DAJFTDZYAFTCNA-CQSZACIVSA-N 2 1 309.523 4.102 20 0 DIADMP C[C@H](NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccoc1 ZINC000178795146 337165067 /nfs/dbraw/zinc/16/50/67/337165067.db2.gz VWQNLKMBKLMREJ-ZQIUZPCESA-N 2 1 304.459 4.075 20 0 DIADMP C[C@H](NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccoc1 ZINC000178795146 337165068 /nfs/dbraw/zinc/16/50/68/337165068.db2.gz VWQNLKMBKLMREJ-ZQIUZPCESA-N 2 1 304.459 4.075 20 0 DIADMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000178707199 337166187 /nfs/dbraw/zinc/16/61/87/337166187.db2.gz LFLSZRPTIIPMGE-DYVFJYSZSA-N 2 1 305.853 4.222 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000392193143 337179223 /nfs/dbraw/zinc/17/92/23/337179223.db2.gz IJSJHZGTOZPAKY-IBGZPJMESA-N 2 1 322.496 4.138 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+]CC2=CC[N@@H+](C)CC2)c2ccccc2)c1 ZINC000392283755 337199974 /nfs/dbraw/zinc/19/99/74/337199974.db2.gz TYUVTIMKIKGSKC-JOCHJYFZSA-N 2 1 320.480 4.244 20 0 DIADMP CC(C)(C)c1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)s1 ZINC000149738035 337275496 /nfs/dbraw/zinc/27/54/96/337275496.db2.gz KURKJFFHFOMBGN-UHFFFAOYSA-N 2 1 308.535 4.398 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000398033083 337304924 /nfs/dbraw/zinc/30/49/24/337304924.db2.gz OGSQBBQPBZBHPP-XQBPLPMBSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000398033083 337304925 /nfs/dbraw/zinc/30/49/25/337304925.db2.gz OGSQBBQPBZBHPP-XQBPLPMBSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1nccc2ccccc21 ZINC000584439552 337325751 /nfs/dbraw/zinc/32/57/51/337325751.db2.gz APCGCNXWUYCIOI-DLBZAZTESA-N 2 1 311.473 4.150 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1nccc2ccccc21 ZINC000584439552 337325752 /nfs/dbraw/zinc/32/57/52/337325752.db2.gz APCGCNXWUYCIOI-DLBZAZTESA-N 2 1 311.473 4.150 20 0 DIADMP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1sc2ccccc2c1Cl ZINC000420370942 337499991 /nfs/dbraw/zinc/49/99/91/337499991.db2.gz WFXSMGMIUWHDRB-AWEZNQCLSA-N 2 1 308.878 4.032 20 0 DIADMP Cc1cccc(N2CCC([NH2+]Cc3cccc(C4CC4)c3)CC2)[nH+]1 ZINC000421366588 337532622 /nfs/dbraw/zinc/53/26/22/337532622.db2.gz SEPMVJSRJKBDEH-UHFFFAOYSA-N 2 1 321.468 4.026 20 0 DIADMP CSC1(C[NH2+]CC2([NH2+][C@H](C)c3ccccc3)CCCC2)CC1 ZINC000571842914 337578832 /nfs/dbraw/zinc/57/88/32/337578832.db2.gz YSFVKPVKOJZNNM-MRXNPFEDSA-N 2 1 318.530 4.135 20 0 DIADMP Clc1ccc([C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000422766858 337685583 /nfs/dbraw/zinc/68/55/83/337685583.db2.gz QIZLLZIUWQJMTH-MOPGFXCFSA-N 2 1 314.860 4.161 20 0 DIADMP COc1ccc([C@H]([NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C(C)C)cc1 ZINC000422791795 337686829 /nfs/dbraw/zinc/68/68/29/337686829.db2.gz VFDHUTNVBCVIKU-SLFFLAALSA-N 2 1 310.441 4.127 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C)c1c[nH+]ccc1N ZINC000422924294 337691767 /nfs/dbraw/zinc/69/17/67/337691767.db2.gz UDNMBDQTCHEZMV-NZRMSGFPSA-N 2 1 315.848 4.195 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)c2ccccc21 ZINC000422935312 337692375 /nfs/dbraw/zinc/69/23/75/337692375.db2.gz HEEVKUBKIDYVCW-ROUUACIJSA-N 2 1 312.844 4.454 20 0 DIADMP CC(F)(F)c1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000423134486 337701105 /nfs/dbraw/zinc/70/11/05/337701105.db2.gz MEKGEGFDTYJKHD-DLBZAZTESA-N 2 1 302.368 4.033 20 0 DIADMP Clc1ccccc1C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccsc1 ZINC000423187111 337703041 /nfs/dbraw/zinc/70/30/41/337703041.db2.gz OZLGMBMKXBEWHZ-KRWDZBQOSA-N 2 1 320.889 4.027 20 0 DIADMP c1ccc([C@H](CC2CCC2)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423189060 337703065 /nfs/dbraw/zinc/70/30/65/337703065.db2.gz OTFJRFQDXKLQLJ-NRFANRHFSA-N 2 1 323.484 4.082 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)c2ccccc2)c1 ZINC000423369414 337715143 /nfs/dbraw/zinc/71/51/43/337715143.db2.gz BYAYRPKKHWFPJS-YFVAEKQCSA-N 2 1 308.469 4.123 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](CCc1ccccc1)C(C)C ZINC000536861298 337746693 /nfs/dbraw/zinc/74/66/93/337746693.db2.gz BULIYNRWAYFOHJ-YLJYHZDGSA-N 2 1 313.489 4.075 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc2ccc(C)cc2o1 ZINC000426032360 338019726 /nfs/dbraw/zinc/01/97/26/338019726.db2.gz XXGXPXGSSOZEHG-GJZGRUSLSA-N 2 1 311.429 4.233 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+][C@H]3CCC[C@@H]([NH+](C)C)C3)oc2c1 ZINC000426032180 338019747 /nfs/dbraw/zinc/01/97/47/338019747.db2.gz XDKOEZBLHHYGLP-BHYGNILZSA-N 2 1 300.446 4.265 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@@H](C)C1 ZINC000426290779 338024781 /nfs/dbraw/zinc/02/47/81/338024781.db2.gz KJLOYXVEPBDNDQ-FPMFFAJLSA-N 2 1 312.910 4.099 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@@H](C)C1 ZINC000426290779 338024782 /nfs/dbraw/zinc/02/47/82/338024782.db2.gz KJLOYXVEPBDNDQ-FPMFFAJLSA-N 2 1 312.910 4.099 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(C(F)(F)F)s1)C(C)(C)C ZINC000428890020 338064605 /nfs/dbraw/zinc/06/46/05/338064605.db2.gz SHTNAXHOKOABJQ-LBPRGKRZSA-N 2 1 322.440 4.223 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000429537011 338083280 /nfs/dbraw/zinc/08/32/80/338083280.db2.gz GEBMYCCXSMQCLX-KRWDZBQOSA-N 2 1 306.519 4.103 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000429537011 338083281 /nfs/dbraw/zinc/08/32/81/338083281.db2.gz GEBMYCCXSMQCLX-KRWDZBQOSA-N 2 1 306.519 4.103 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](CCCc2cccc3ccccc32)CC1 ZINC000429534474 338083316 /nfs/dbraw/zinc/08/33/16/338083316.db2.gz DUTLNKOPQZGLSE-HXUWFJFHSA-N 2 1 310.485 4.189 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000430040535 338094390 /nfs/dbraw/zinc/09/43/90/338094390.db2.gz JAJOKQASIATDPZ-QGZVFWFLSA-N 2 1 324.459 4.170 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000431332104 338128238 /nfs/dbraw/zinc/12/82/38/338128238.db2.gz IWEKAGSNLZHFSO-GJYPPUQNSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000431332104 338128239 /nfs/dbraw/zinc/12/82/39/338128239.db2.gz IWEKAGSNLZHFSO-GJYPPUQNSA-N 2 1 316.489 4.096 20 0 DIADMP CC[C@@H](C)[NH+](C)Cc1cc(C[N@H+](C)[C@H](C)CC)cc(OC)c1 ZINC000432831500 338169790 /nfs/dbraw/zinc/16/97/90/338169790.db2.gz KAZOHAONWXAAFG-HZPDHXFCSA-N 2 1 306.494 4.156 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)CCC2)cc1C ZINC000433084993 338180823 /nfs/dbraw/zinc/18/08/23/338180823.db2.gz UXYJDIDONAHFAN-NLWGTHIKSA-N 2 1 314.517 4.043 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386718 338204186 /nfs/dbraw/zinc/20/41/86/338204186.db2.gz KCVKZCFITQNEDK-RYUDHWBXSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386718 338204187 /nfs/dbraw/zinc/20/41/87/338204187.db2.gz KCVKZCFITQNEDK-RYUDHWBXSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]1CCC[C@H](C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)C1 ZINC000434672138 338223065 /nfs/dbraw/zinc/22/30/65/338223065.db2.gz XUMZAEHVHSZTGR-IRXDYDNUSA-N 2 1 315.505 4.225 20 0 DIADMP CC1(C)CCc2ccccc2[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000436307936 338268320 /nfs/dbraw/zinc/26/83/20/338268320.db2.gz OTVQBBKUBNIBOY-QWFCFKBJSA-N 2 1 312.501 4.307 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155592897 338294839 /nfs/dbraw/zinc/29/48/39/338294839.db2.gz YNRJBSYZDHVHSR-BBTUJRGHSA-N 2 1 322.496 4.279 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155592897 338294840 /nfs/dbraw/zinc/29/48/40/338294840.db2.gz YNRJBSYZDHVHSR-BBTUJRGHSA-N 2 1 322.496 4.279 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000437778908 338321003 /nfs/dbraw/zinc/32/10/03/338321003.db2.gz BGCHNJXCMDCXOK-JFIYKMOQSA-N 2 1 318.480 4.172 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(Cl)cc2F)C1 ZINC000438089361 338330811 /nfs/dbraw/zinc/33/08/11/338330811.db2.gz UYJAZWNJDHSVLY-AWEZNQCLSA-N 2 1 312.860 4.081 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438112807 338332722 /nfs/dbraw/zinc/33/27/22/338332722.db2.gz IGMZTACHNBWPAG-SESVDKBCSA-N 2 1 314.517 4.161 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2)CC1 ZINC000438827239 338352707 /nfs/dbraw/zinc/35/27/07/338352707.db2.gz IBSLULZFTLBSJV-UHFFFAOYSA-N 2 1 308.469 4.219 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC[C@@H](C)c2ccccc2)CC1 ZINC000447091961 338545123 /nfs/dbraw/zinc/54/51/23/338545123.db2.gz WOXMPUYMHCLTGE-QGZVFWFLSA-N 2 1 324.468 4.427 20 0 DIADMP C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(CC2CCC(F)(F)CC2)C1 ZINC000459373376 339025379 /nfs/dbraw/zinc/02/53/79/339025379.db2.gz RZTBAPFVRFALSJ-UXLLHSPISA-N 2 1 314.464 4.149 20 0 DIADMP CCCC[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(OC)cc1 ZINC000459397368 339027085 /nfs/dbraw/zinc/02/70/85/339027085.db2.gz DFIIMKPMFXECRJ-HXUWFJFHSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@@H]1C[C@H]1[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000459403974 339027271 /nfs/dbraw/zinc/02/72/71/339027271.db2.gz BYTAMYRJENRSOK-ZNOIYHFQSA-N 2 1 318.892 4.254 20 0 DIADMP CC(C)(C[NH2+]C1CC[NH+](C2CC2)CC1)Cc1cccc(Cl)c1 ZINC000459436741 339029074 /nfs/dbraw/zinc/02/90/74/339029074.db2.gz KBLFZAYGZSNLJA-UHFFFAOYSA-N 2 1 320.908 4.125 20 0 DIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)c1 ZINC000459563492 339036040 /nfs/dbraw/zinc/03/60/40/339036040.db2.gz QOOSEDLORGQCBZ-QAPCUYQASA-N 2 1 318.892 4.193 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082579 339058317 /nfs/dbraw/zinc/05/83/17/339058317.db2.gz IFYCSBTZNBGSSV-XJKSGUPXSA-N 2 1 312.860 4.252 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082579 339058318 /nfs/dbraw/zinc/05/83/18/339058318.db2.gz IFYCSBTZNBGSSV-XJKSGUPXSA-N 2 1 312.860 4.252 20 0 DIADMP CCC(CC)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000462108325 339072177 /nfs/dbraw/zinc/07/21/77/339072177.db2.gz DZJQIVZXWYYYGR-UHFFFAOYSA-N 2 1 300.446 4.190 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000462356021 339076522 /nfs/dbraw/zinc/07/65/22/339076522.db2.gz CNZRDQKRLOSIJD-NVXWUHKLSA-N 2 1 315.436 4.378 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]C[C@H](C)Cn2cc[nH+]c2C)CC1 ZINC000462741029 339086299 /nfs/dbraw/zinc/08/62/99/339086299.db2.gz DIVIUQYPQCRPFM-ZLPCBKJTSA-N 2 1 305.510 4.412 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]C[C@@H](C)Cn2cc[nH+]c2C)CC1 ZINC000462741022 339086336 /nfs/dbraw/zinc/08/63/36/339086336.db2.gz DIVIUQYPQCRPFM-FAEJEUNOSA-N 2 1 305.510 4.412 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(C2CCCC2)cc1 ZINC000462785298 339088490 /nfs/dbraw/zinc/08/84/90/339088490.db2.gz LWQDOBWTFYFADY-INIZCTEOSA-N 2 1 311.473 4.275 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801021 339089727 /nfs/dbraw/zinc/08/97/27/339089727.db2.gz BAXYSZQEZUGDFL-SNRMKQJTSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801021 339089728 /nfs/dbraw/zinc/08/97/28/339089728.db2.gz BAXYSZQEZUGDFL-SNRMKQJTSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801020 339089748 /nfs/dbraw/zinc/08/97/48/339089748.db2.gz BAXYSZQEZUGDFL-KFKAGJAMSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801020 339089749 /nfs/dbraw/zinc/08/97/49/339089749.db2.gz BAXYSZQEZUGDFL-KFKAGJAMSA-N 2 1 316.489 4.141 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000462842930 339093874 /nfs/dbraw/zinc/09/38/74/339093874.db2.gz SXNITHCLPISKIW-WERVVEIQSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911835 339097582 /nfs/dbraw/zinc/09/75/82/339097582.db2.gz PACFSWWGAAYBKV-OXQOHEQNSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911835 339097583 /nfs/dbraw/zinc/09/75/83/339097583.db2.gz PACFSWWGAAYBKV-OXQOHEQNSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911835 339097584 /nfs/dbraw/zinc/09/75/84/339097584.db2.gz PACFSWWGAAYBKV-OXQOHEQNSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911835 339097585 /nfs/dbraw/zinc/09/75/85/339097585.db2.gz PACFSWWGAAYBKV-OXQOHEQNSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000463075786 339104568 /nfs/dbraw/zinc/10/45/68/339104568.db2.gz RFUGNUBPBBIAQR-OXJNMPFZSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463138264 339106886 /nfs/dbraw/zinc/10/68/86/339106886.db2.gz CJULGSASRRCINL-OXJNMPFZSA-N 2 1 318.480 4.001 20 0 DIADMP CC(C)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207281 339109373 /nfs/dbraw/zinc/10/93/73/339109373.db2.gz RPAGXGPUMZOCFQ-IEBWSBKVSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207281 339109374 /nfs/dbraw/zinc/10/93/74/339109374.db2.gz RPAGXGPUMZOCFQ-IEBWSBKVSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207279 339109394 /nfs/dbraw/zinc/10/93/94/339109394.db2.gz RPAGXGPUMZOCFQ-HKUYNNGSSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207279 339109395 /nfs/dbraw/zinc/10/93/95/339109395.db2.gz RPAGXGPUMZOCFQ-HKUYNNGSSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207283 339109443 /nfs/dbraw/zinc/10/94/43/339109443.db2.gz RPAGXGPUMZOCFQ-MJGOQNOKSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207283 339109444 /nfs/dbraw/zinc/10/94/44/339109444.db2.gz RPAGXGPUMZOCFQ-MJGOQNOKSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000463244069 339111600 /nfs/dbraw/zinc/11/16/00/339111600.db2.gz NKFKGHYSEMACJD-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000463244069 339111601 /nfs/dbraw/zinc/11/16/01/339111601.db2.gz NKFKGHYSEMACJD-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CCC3(CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463248917 339112073 /nfs/dbraw/zinc/11/20/73/339112073.db2.gz CAYMBKDDXBIHKK-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CCC3(CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463248917 339112074 /nfs/dbraw/zinc/11/20/74/339112074.db2.gz CAYMBKDDXBIHKK-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000464773423 339152710 /nfs/dbraw/zinc/15/27/10/339152710.db2.gz HERJGENKNNGPSH-QGZVFWFLSA-N 2 1 320.480 4.420 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464830163 339155762 /nfs/dbraw/zinc/15/57/62/339155762.db2.gz KRAVPJXOCGVCCR-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1CCCCC1 ZINC000464841307 339156781 /nfs/dbraw/zinc/15/67/81/339156781.db2.gz XQDQMFQGFFMZLO-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCCCC1 ZINC000464841307 339156782 /nfs/dbraw/zinc/15/67/82/339156782.db2.gz XQDQMFQGFFMZLO-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCCCC1 ZINC000464841307 339156783 /nfs/dbraw/zinc/15/67/83/339156783.db2.gz XQDQMFQGFFMZLO-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC(C)(C)CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464858614 339158316 /nfs/dbraw/zinc/15/83/16/339158316.db2.gz XDBPINSAXFGUMU-LJQANCHMSA-N 2 1 302.506 4.267 20 0 DIADMP CCC(C)(C)CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464858614 339158317 /nfs/dbraw/zinc/15/83/17/339158317.db2.gz XDBPINSAXFGUMU-LJQANCHMSA-N 2 1 302.506 4.267 20 0 DIADMP CCC(C)(C)CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464858614 339158318 /nfs/dbraw/zinc/15/83/18/339158318.db2.gz XDBPINSAXFGUMU-LJQANCHMSA-N 2 1 302.506 4.267 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCCC[C@H]1C ZINC000466357956 339200502 /nfs/dbraw/zinc/20/05/02/339200502.db2.gz ZYZWYJVONFGCRQ-QVOMUQBLSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCCC[C@H]1C ZINC000466357956 339200503 /nfs/dbraw/zinc/20/05/03/339200503.db2.gz ZYZWYJVONFGCRQ-QVOMUQBLSA-N 2 1 320.443 4.208 20 0 DIADMP CCCCOc1ccc(C[NH2+]C2CC[NH+](CC)CC2)cc1Cl ZINC000467359489 339233983 /nfs/dbraw/zinc/23/39/83/339233983.db2.gz SJOBVEKQANEEPD-UHFFFAOYSA-N 2 1 324.896 4.093 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1Cl ZINC000467382221 339235735 /nfs/dbraw/zinc/23/57/35/339235735.db2.gz OIPYGDCTHYUPPB-ZBFHGGJFSA-N 2 1 324.896 4.091 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1Cl ZINC000467382221 339235736 /nfs/dbraw/zinc/23/57/36/339235736.db2.gz OIPYGDCTHYUPPB-ZBFHGGJFSA-N 2 1 324.896 4.091 20 0 DIADMP CC(C)Oc1cccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)c1 ZINC000467768508 339246206 /nfs/dbraw/zinc/24/62/06/339246206.db2.gz HRWBQPZDINRNBG-UHFFFAOYSA-N 2 1 306.494 4.072 20 0 DIADMP c1ccc(CC[C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000468357028 339260457 /nfs/dbraw/zinc/26/04/57/339260457.db2.gz ODVPOGKOOWAOIX-BURNTYAHSA-N 2 1 312.501 4.004 20 0 DIADMP c1ccc(CC[C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000468357027 339260493 /nfs/dbraw/zinc/26/04/93/339260493.db2.gz ODVPOGKOOWAOIX-BQJUDKOJSA-N 2 1 312.501 4.004 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)C[C@H]1C ZINC000468392716 339261487 /nfs/dbraw/zinc/26/14/87/339261487.db2.gz PCFJQQPEDMVEFJ-PRLABOORSA-N 2 1 320.443 4.160 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CC2CCC(C(F)(F)F)CC2)C[C@H]1C ZINC000468392716 339261488 /nfs/dbraw/zinc/26/14/88/339261488.db2.gz PCFJQQPEDMVEFJ-PRLABOORSA-N 2 1 320.443 4.160 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CC2CCC(C(F)(F)F)CC2)C[C@H]1C ZINC000468392716 339261489 /nfs/dbraw/zinc/26/14/89/339261489.db2.gz PCFJQQPEDMVEFJ-PRLABOORSA-N 2 1 320.443 4.160 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468404065 339262107 /nfs/dbraw/zinc/26/21/07/339262107.db2.gz AWMCQEUSGSCCFE-GOSISDBHSA-N 2 1 306.881 4.099 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468404065 339262108 /nfs/dbraw/zinc/26/21/08/339262108.db2.gz AWMCQEUSGSCCFE-GOSISDBHSA-N 2 1 306.881 4.099 20 0 DIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000469004783 339277250 /nfs/dbraw/zinc/27/72/50/339277250.db2.gz QPGDAGSPBKFGQF-KGLIPLIRSA-N 2 1 314.926 4.420 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000469004783 339277251 /nfs/dbraw/zinc/27/72/51/339277251.db2.gz QPGDAGSPBKFGQF-KGLIPLIRSA-N 2 1 314.926 4.420 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469740358 339297566 /nfs/dbraw/zinc/29/75/66/339297566.db2.gz XGXKSGWTVKURAK-IERDGZPVSA-N 2 1 318.420 4.449 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)CC[C@@H]1[NH3+] ZINC000469995420 339307596 /nfs/dbraw/zinc/30/75/96/339307596.db2.gz AHQYCJBISQFOBM-WBMJQRKESA-N 2 1 320.889 4.238 20 0 DIADMP COc1ccsc1[C@@H](C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000472157905 339364490 /nfs/dbraw/zinc/36/44/90/339364490.db2.gz NHVVGNDJBTUYFD-LSDHHAIUSA-N 2 1 310.507 4.062 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472462675 339372386 /nfs/dbraw/zinc/37/23/86/339372386.db2.gz MDRCLSJGUOINKZ-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472462675 339372387 /nfs/dbraw/zinc/37/23/87/339372387.db2.gz MDRCLSJGUOINKZ-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000472462675 339372388 /nfs/dbraw/zinc/37/23/88/339372388.db2.gz MDRCLSJGUOINKZ-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000472462675 339372389 /nfs/dbraw/zinc/37/23/89/339372389.db2.gz MDRCLSJGUOINKZ-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CC[C@H]2CCCC[NH+]2C)C1 ZINC000472579393 339374144 /nfs/dbraw/zinc/37/41/44/339374144.db2.gz OIJOUPHNOFVDCW-IPMKNSEASA-N 2 1 300.490 4.047 20 0 DIADMP CCSc1cccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000473148186 339382917 /nfs/dbraw/zinc/38/29/17/339382917.db2.gz QSJFIPRBGBOPKV-WBVHZDCISA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000473148186 339382918 /nfs/dbraw/zinc/38/29/18/339382918.db2.gz QSJFIPRBGBOPKV-WBVHZDCISA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@H](C)C2)c1 ZINC000473148186 339382919 /nfs/dbraw/zinc/38/29/19/339382919.db2.gz QSJFIPRBGBOPKV-WBVHZDCISA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)c1 ZINC000473148186 339382920 /nfs/dbraw/zinc/38/29/20/339382920.db2.gz QSJFIPRBGBOPKV-WBVHZDCISA-N 2 1 306.519 4.103 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)C1CCC(F)(F)CC1 ZINC000474029959 339397723 /nfs/dbraw/zinc/39/77/23/339397723.db2.gz GRDJHMIQEXYLDF-HUUCEWRRSA-N 2 1 302.453 4.055 20 0 DIADMP CC(C)c1ncc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)s1 ZINC000479598647 339542983 /nfs/dbraw/zinc/54/29/83/339542983.db2.gz BVOPXFRJDVSDNN-UHFFFAOYSA-N 2 1 323.550 4.401 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000484173927 339682527 /nfs/dbraw/zinc/68/25/27/339682527.db2.gz QWWZVCOGIDZNSP-QGZVFWFLSA-N 2 1 323.484 4.272 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC000499054348 340028705 /nfs/dbraw/zinc/02/87/05/340028705.db2.gz JYEHIHDYQXCHSA-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC000499054348 340028706 /nfs/dbraw/zinc/02/87/06/340028706.db2.gz JYEHIHDYQXCHSA-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499145272 340031066 /nfs/dbraw/zinc/03/10/66/340031066.db2.gz FTHQXXXGXIATFP-DKUWSORSSA-N 2 1 320.480 4.280 20 0 DIADMP CC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000499223538 340032709 /nfs/dbraw/zinc/03/27/09/340032709.db2.gz RSBJVNFDZWPMSK-ACDBMABISA-N 2 1 312.501 4.352 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000500426007 340058246 /nfs/dbraw/zinc/05/82/46/340058246.db2.gz YFFRXVOSWMSABE-UHFFFAOYSA-N 2 1 319.452 4.381 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000500426007 340058247 /nfs/dbraw/zinc/05/82/47/340058247.db2.gz YFFRXVOSWMSABE-UHFFFAOYSA-N 2 1 319.452 4.381 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCSC1CCCCC1 ZINC000501914424 340090678 /nfs/dbraw/zinc/09/06/78/340090678.db2.gz INEWLCGUPJXMCG-UHFFFAOYSA-N 2 1 323.550 4.223 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCSC1CCCCC1 ZINC000501914424 340090679 /nfs/dbraw/zinc/09/06/79/340090679.db2.gz INEWLCGUPJXMCG-UHFFFAOYSA-N 2 1 323.550 4.223 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3C[C@]32C)CC1 ZINC000502287345 340098865 /nfs/dbraw/zinc/09/88/65/340098865.db2.gz NKKMSTUORQYMRH-XRULBBBTSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCC23CCC3)C[N@H+]1Cc1ccccc1 ZINC000502412001 340102381 /nfs/dbraw/zinc/10/23/81/340102381.db2.gz BFEDHWZFUBQHLH-YZGWKJHDSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1cnn(C2CCCC2)c1 ZINC000502728156 340112593 /nfs/dbraw/zinc/11/25/93/340112593.db2.gz QZJYNJNMCJCUOQ-CRAIPNDOSA-N 2 1 320.525 4.015 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2cccc(C)c2)CCCC1 ZINC000503060490 340119925 /nfs/dbraw/zinc/11/99/25/340119925.db2.gz AXBLLACDKWFECD-UHFFFAOYSA-N 2 1 311.473 4.339 20 0 DIADMP CC[NH+](CC)CCCC1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000503598361 340132232 /nfs/dbraw/zinc/13/22/32/340132232.db2.gz SUTXKPZRKFOGEV-UHFFFAOYSA-N 2 1 309.885 4.073 20 0 DIADMP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000504929014 340156620 /nfs/dbraw/zinc/15/66/20/340156620.db2.gz FUUVDRSQMJXNTI-LMMKCTJWSA-N 2 1 300.490 4.253 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cc3ccccc3s2)CC1 ZINC000506324606 340192211 /nfs/dbraw/zinc/19/22/11/340192211.db2.gz IEOVTCRXRKHDBW-UHFFFAOYSA-N 2 1 302.487 4.206 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000506380188 340193722 /nfs/dbraw/zinc/19/37/22/340193722.db2.gz IPUSEDKLAZQIFT-UHFFFAOYSA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)ccc2F)CC1 ZINC000506882766 340203235 /nfs/dbraw/zinc/20/32/35/340203235.db2.gz XZXYANRYMIDWCI-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000508720382 340251423 /nfs/dbraw/zinc/25/14/23/340251423.db2.gz RIWADGFUYNTLAC-WDSOQIARSA-N 2 1 302.506 4.311 20 0 DIADMP c1cc2cc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)ccc2o1 ZINC000510209434 340292502 /nfs/dbraw/zinc/29/25/02/340292502.db2.gz PSKJEUPZXFUHMJ-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)CCC2 ZINC000510359438 340296895 /nfs/dbraw/zinc/29/68/95/340296895.db2.gz SUMPBCONNFGMNI-OXJNMPFZSA-N 2 1 316.464 4.011 20 0 DIADMP Fc1ccc2c(c1)[C@@H]([N@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)CCC2 ZINC000510359437 340296920 /nfs/dbraw/zinc/29/69/20/340296920.db2.gz SUMPBCONNFGMNI-JXFKEZNVSA-N 2 1 316.464 4.011 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2C2CCC2)CC1 ZINC000510665148 340305670 /nfs/dbraw/zinc/30/56/70/340305670.db2.gz BOONOUODWJEZQK-MAODMQOUSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@@H]1CCCF)Cc1ccccc1 ZINC000510672990 340306073 /nfs/dbraw/zinc/30/60/73/340306073.db2.gz XRGBVNHINXEMNG-RTBURBONSA-N 2 1 306.469 4.017 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1cccc(C)c1)c1cccc(F)c1 ZINC000510729384 340308525 /nfs/dbraw/zinc/30/85/25/340308525.db2.gz DCDNFQQPGBSBKS-HXUWFJFHSA-N 2 1 323.415 4.018 20 0 DIADMP C(=C/c1ccccc1)\C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303176531 340309602 /nfs/dbraw/zinc/30/96/02/340309602.db2.gz JQFRCPPYPZQWSA-NBILRRPASA-N 2 1 312.501 4.288 20 0 DIADMP C(=C/c1ccccc1)\C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303176531 340309603 /nfs/dbraw/zinc/30/96/03/340309603.db2.gz JQFRCPPYPZQWSA-NBILRRPASA-N 2 1 312.501 4.288 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000303219322 340313392 /nfs/dbraw/zinc/31/33/92/340313392.db2.gz ADRBJOWIZUTCFD-CTNGQTDRSA-N 2 1 314.517 4.455 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000510958503 340316116 /nfs/dbraw/zinc/31/61/16/340316116.db2.gz LUOSNUUFMULHIR-UONOGXRCSA-N 2 1 305.853 4.017 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000510958493 340316120 /nfs/dbraw/zinc/31/61/20/340316120.db2.gz LUOSNUUFMULHIR-KBPBESRZSA-N 2 1 305.853 4.017 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000510962027 340316518 /nfs/dbraw/zinc/31/65/18/340316518.db2.gz YJZYVFPBBYJBGQ-RBUKOAKNSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000510962027 340316519 /nfs/dbraw/zinc/31/65/19/340316519.db2.gz YJZYVFPBBYJBGQ-RBUKOAKNSA-N 2 1 312.501 4.209 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511110188 340321168 /nfs/dbraw/zinc/32/11/68/340321168.db2.gz LVMKNZXIGWUUBQ-SFHVURJKSA-N 2 1 320.546 4.351 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511110188 340321169 /nfs/dbraw/zinc/32/11/69/340321169.db2.gz LVMKNZXIGWUUBQ-SFHVURJKSA-N 2 1 320.546 4.351 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000511132129 340321842 /nfs/dbraw/zinc/32/18/42/340321842.db2.gz RNGJWGYWNQLQEX-LPHOPBHVSA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000511132129 340321843 /nfs/dbraw/zinc/32/18/43/340321843.db2.gz RNGJWGYWNQLQEX-LPHOPBHVSA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000511132129 340321844 /nfs/dbraw/zinc/32/18/44/340321844.db2.gz RNGJWGYWNQLQEX-LPHOPBHVSA-N 2 1 320.546 4.349 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]Cc2ncc(C[NH+](C)C)s2)CC(C)(C)C1 ZINC000511772608 340337748 /nfs/dbraw/zinc/33/77/48/340337748.db2.gz MTPMPWKDFUZQMV-GJZGRUSLSA-N 2 1 323.550 4.147 20 0 DIADMP CC(C)CC[C@@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C(C)(C)C ZINC000512038141 340346215 /nfs/dbraw/zinc/34/62/15/340346215.db2.gz IRCIXTFWLYNLRW-OAHLLOKOSA-N 2 1 311.539 4.145 20 0 DIADMP c1cc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc2o1 ZINC000512031171 340346031 /nfs/dbraw/zinc/34/60/31/340346031.db2.gz NWBAIRQDPYBANK-UHFFFAOYSA-N 2 1 312.457 4.320 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC000512135622 340349615 /nfs/dbraw/zinc/34/96/15/340349615.db2.gz MOCCFILBHLVLFH-IQIBNGDESA-N 2 1 322.443 4.222 20 0 DIADMP Cc1ccsc1C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000512165977 340350546 /nfs/dbraw/zinc/35/05/46/340350546.db2.gz JAXHPFWVSPGLSP-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccsc1C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000512165979 340350661 /nfs/dbraw/zinc/35/06/61/340350661.db2.gz JAXHPFWVSPGLSP-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000512318424 340356698 /nfs/dbraw/zinc/35/66/98/340356698.db2.gz PDRVZRLBVZCNHZ-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1ccc(C)c(C[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000512318424 340356699 /nfs/dbraw/zinc/35/66/99/340356699.db2.gz PDRVZRLBVZCNHZ-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000236783769 340665047 /nfs/dbraw/zinc/66/50/47/340665047.db2.gz UJQDOLGTLOFGKF-IBGZPJMESA-N 2 1 302.506 4.365 20 0 DIADMP CCc1ccccc1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237005247 340667284 /nfs/dbraw/zinc/66/72/84/340667284.db2.gz ULUQBHBYBPDZEY-UHFFFAOYSA-N 2 1 308.469 4.003 20 0 DIADMP C[NH+]1CCC([NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000237169097 340668519 /nfs/dbraw/zinc/66/85/19/340668519.db2.gz JEUFBXWSTGUCSZ-UHFFFAOYSA-N 2 1 320.889 4.252 20 0 DIADMP CC(C)(C)CCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000313268768 340668768 /nfs/dbraw/zinc/66/87/68/340668768.db2.gz XAMMQPGEWLVOHK-UHFFFAOYSA-N 2 1 302.506 4.109 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237362679 340670398 /nfs/dbraw/zinc/67/03/98/340670398.db2.gz HWLKTNDBFGBEIV-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000237460787 340671147 /nfs/dbraw/zinc/67/11/47/340671147.db2.gz UUIACVXSCRDHFA-LJQANCHMSA-N 2 1 322.496 4.434 20 0 DIADMP C[C@@H](CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000237563809 340672154 /nfs/dbraw/zinc/67/21/54/340672154.db2.gz UUIACVXSCRDHFA-IBGZPJMESA-N 2 1 322.496 4.434 20 0 DIADMP C[C@H]1CCCC[C@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237553826 340672166 /nfs/dbraw/zinc/67/21/66/340672166.db2.gz HWLKTNDBFGBEIV-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000037786489 340786989 /nfs/dbraw/zinc/78/69/89/340786989.db2.gz RHZFOLGVEUNFNI-UHFFFAOYSA-N 2 1 315.288 4.346 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(C2CCCCC2)cc1 ZINC000530407448 340790659 /nfs/dbraw/zinc/79/06/59/340790659.db2.gz JCHSJORKAPIVCU-INIZCTEOSA-N 2 1 311.473 4.361 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C3(c4ccccc4)CC3)CC2)C1 ZINC000538524066 340831176 /nfs/dbraw/zinc/83/11/76/340831176.db2.gz ZBBOGOOYGHXPSE-XLIONFOSSA-N 2 1 312.501 4.308 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000128142580 340861203 /nfs/dbraw/zinc/86/12/03/340861203.db2.gz HLNUSYXBLJAURT-HNNXBMFYSA-N 2 1 315.486 4.080 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c(C)c1 ZINC000128191388 340861848 /nfs/dbraw/zinc/86/18/48/340861848.db2.gz GAZOACOXGMJAIZ-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000539069707 340870269 /nfs/dbraw/zinc/87/02/69/340870269.db2.gz SQIDUDDOSGKPGJ-PXNSSMCTSA-N 2 1 313.489 4.219 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](CC(C)C)CC(C)(C)C ZINC000542469209 341008725 /nfs/dbraw/zinc/00/87/25/341008725.db2.gz QKSOIFRIMWGBFB-UHFFFAOYSA-N 2 1 314.477 4.080 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1Cl ZINC000542488268 341009914 /nfs/dbraw/zinc/00/99/14/341009914.db2.gz GNIFFKYZVDJCCV-LSDHHAIUSA-N 2 1 324.896 4.264 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000542534198 341012531 /nfs/dbraw/zinc/01/25/31/341012531.db2.gz YOMUSFQZDJDBTA-QZTJIDSGSA-N 2 1 300.490 4.046 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C2CCC2)o1 ZINC000542663920 341015912 /nfs/dbraw/zinc/01/59/12/341015912.db2.gz PZDCXJUSUDMKGU-HXUWFJFHSA-N 2 1 316.489 4.426 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1F ZINC000542843899 341023141 /nfs/dbraw/zinc/02/31/41/341023141.db2.gz KCWVCHXDBCELLS-SCLBCKFNSA-N 2 1 324.871 4.250 20 0 DIADMP C[C@@H](CCc1cccc(F)c1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000543080900 341031072 /nfs/dbraw/zinc/03/10/72/341031072.db2.gz JUXQARNHGNKHDI-FXAWDEMLSA-N 2 1 318.480 4.097 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)s2)C1 ZINC000543600111 341050523 /nfs/dbraw/zinc/05/05/23/341050523.db2.gz BKPQJXRMJQJSMD-CVEARBPZSA-N 2 1 314.498 4.408 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)c(F)c1 ZINC000543775007 341058092 /nfs/dbraw/zinc/05/80/92/341058092.db2.gz HDKVZBVIEDTXNL-BEFAXECRSA-N 2 1 324.459 4.372 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCC(F)(F)F)c1 ZINC000544372218 341078748 /nfs/dbraw/zinc/07/87/48/341078748.db2.gz ZORFNIIBWXKPKU-AWEZNQCLSA-N 2 1 316.411 4.347 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578317 341086967 /nfs/dbraw/zinc/08/69/67/341086967.db2.gz ZNYLXUROAACWQL-HZPDHXFCSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578317 341086968 /nfs/dbraw/zinc/08/69/68/341086968.db2.gz ZNYLXUROAACWQL-HZPDHXFCSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000131838152 341112495 /nfs/dbraw/zinc/11/24/95/341112495.db2.gz NHEINYFSDQUSGY-GCJKJVERSA-N 2 1 322.496 4.138 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000545521253 341128528 /nfs/dbraw/zinc/12/85/28/341128528.db2.gz QCEGHFLRSVWWNK-CQSZACIVSA-N 2 1 323.550 4.348 20 0 DIADMP C[NH+]1CCC([NH2+][C@H](CCCc2ccccc2)c2ccccc2)CC1 ZINC000237170556 341208460 /nfs/dbraw/zinc/20/84/60/341208460.db2.gz AZRURNCRIHPHCN-JOCHJYFZSA-N 2 1 322.496 4.434 20 0 DIADMP C[C@H]1C[C@H]1c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)o1 ZINC000237463872 341214509 /nfs/dbraw/zinc/21/45/09/341214509.db2.gz MRVHGOXZMIPISM-SOLBZPMBSA-N 2 1 304.478 4.005 20 0 DIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(Cl)cc2F)CC1 ZINC000548404414 341259095 /nfs/dbraw/zinc/25/90/95/341259095.db2.gz GYXHQUAGOWHRJZ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(Cl)cc2F)CC1 ZINC000548404414 341259096 /nfs/dbraw/zinc/25/90/96/341259096.db2.gz GYXHQUAGOWHRJZ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[C@@H]([NH2+]CC1(C2CC2)CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481910 341263182 /nfs/dbraw/zinc/26/31/82/341263182.db2.gz ODKADGBGCHLCJA-IEBWSBKVSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548483644 341263249 /nfs/dbraw/zinc/26/32/49/341263249.db2.gz CCQJDEWSZOLZER-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000548497104 341264168 /nfs/dbraw/zinc/26/41/68/341264168.db2.gz XYFGWGBGMXIOOT-KRWDZBQOSA-N 2 1 311.473 4.072 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@@H+]1C ZINC000548721906 341270690 /nfs/dbraw/zinc/27/06/90/341270690.db2.gz DAFCTDJJPAMHOK-CZOVOBHWSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000548721906 341270691 /nfs/dbraw/zinc/27/06/91/341270691.db2.gz DAFCTDJJPAMHOK-CZOVOBHWSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721906 341270692 /nfs/dbraw/zinc/27/06/92/341270692.db2.gz DAFCTDJJPAMHOK-CZOVOBHWSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721906 341270693 /nfs/dbraw/zinc/27/06/93/341270693.db2.gz DAFCTDJJPAMHOK-CZOVOBHWSA-N 2 1 314.517 4.375 20 0 DIADMP CC(C)Oc1ccccc1[C@@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000548729017 341270885 /nfs/dbraw/zinc/27/08/85/341270885.db2.gz HCFXGXYRPLJIQI-QGZVFWFLSA-N 2 1 304.478 4.000 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000548927677 341281188 /nfs/dbraw/zinc/28/11/88/341281188.db2.gz MIEGCVOKUOSIQG-WKCHPHFGSA-N 2 1 323.484 4.382 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000548927677 341281189 /nfs/dbraw/zinc/28/11/89/341281189.db2.gz MIEGCVOKUOSIQG-WKCHPHFGSA-N 2 1 323.484 4.382 20 0 DIADMP CC(C)[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000549085635 341285768 /nfs/dbraw/zinc/28/57/68/341285768.db2.gz DPJALNJWIPAUDT-ONQFOCNCSA-N 2 1 306.881 4.252 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)N(C)CC[C@H]1CCC[N@H+]1C ZINC000245564131 341302310 /nfs/dbraw/zinc/30/23/10/341302310.db2.gz DFQUWUKLFCFWCW-HUUCEWRRSA-N 2 1 309.523 4.052 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000549764282 341302522 /nfs/dbraw/zinc/30/25/22/341302522.db2.gz PCXLHONQNBIYAR-AAEUAGOBSA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000549764282 341302523 /nfs/dbraw/zinc/30/25/23/341302523.db2.gz PCXLHONQNBIYAR-AAEUAGOBSA-N 2 1 322.905 4.435 20 0 DIADMP CN1CCC[C@@]2(CC[N@H+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840365 341304699 /nfs/dbraw/zinc/30/46/99/341304699.db2.gz WKPJIMBZWCVGAU-JOCHJYFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[N@@H+]1CCC[C@@]2(CC[NH+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840365 341304700 /nfs/dbraw/zinc/30/47/00/341304700.db2.gz WKPJIMBZWCVGAU-JOCHJYFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[N@H+]1CCC[C@@]2(CC[NH+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840365 341304701 /nfs/dbraw/zinc/30/47/01/341304701.db2.gz WKPJIMBZWCVGAU-JOCHJYFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840365 341304702 /nfs/dbraw/zinc/30/47/02/341304702.db2.gz WKPJIMBZWCVGAU-JOCHJYFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@H+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840365 341304703 /nfs/dbraw/zinc/30/47/03/341304703.db2.gz WKPJIMBZWCVGAU-JOCHJYFZSA-N 2 1 318.464 4.174 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725894 341312013 /nfs/dbraw/zinc/31/20/13/341312013.db2.gz PNXBZDYSOBVEPZ-FRYIKTPZSA-N 2 1 300.490 4.206 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000550613009 341319530 /nfs/dbraw/zinc/31/95/30/341319530.db2.gz WCKFDZJJNJMZBA-QUCCMNQESA-N 2 1 312.432 4.059 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000550613009 341319531 /nfs/dbraw/zinc/31/95/31/341319531.db2.gz WCKFDZJJNJMZBA-QUCCMNQESA-N 2 1 312.432 4.059 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550623029 341319719 /nfs/dbraw/zinc/31/97/19/341319719.db2.gz RKUCMVIACVYZOF-MNEFBYGVSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550623029 341319720 /nfs/dbraw/zinc/31/97/20/341319720.db2.gz RKUCMVIACVYZOF-MNEFBYGVSA-N 2 1 314.498 4.104 20 0 DIADMP CC1CCC(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550621551 341319725 /nfs/dbraw/zinc/31/97/25/341319725.db2.gz BAXSRZXXZHLWHF-TZJYRCSTSA-N 2 1 300.490 4.238 20 0 DIADMP CC1CCC(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550621551 341319726 /nfs/dbraw/zinc/31/97/26/341319726.db2.gz BAXSRZXXZHLWHF-TZJYRCSTSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000550624690 341319732 /nfs/dbraw/zinc/31/97/32/341319732.db2.gz XTRLYDFMHGNYTP-WMQCIHAUSA-N 2 1 308.469 4.481 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000550624690 341319733 /nfs/dbraw/zinc/31/97/33/341319733.db2.gz XTRLYDFMHGNYTP-WMQCIHAUSA-N 2 1 308.469 4.481 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000550847885 341324476 /nfs/dbraw/zinc/32/44/76/341324476.db2.gz PCKKVUWVFLNEGH-QZTJIDSGSA-N 2 1 302.506 4.484 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000550847885 341324477 /nfs/dbraw/zinc/32/44/77/341324477.db2.gz PCKKVUWVFLNEGH-QZTJIDSGSA-N 2 1 302.506 4.484 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)CCCC2)c(C)c1 ZINC000550921560 341326760 /nfs/dbraw/zinc/32/67/60/341326760.db2.gz SHUQADWNEYFZRV-MOPGFXCFSA-N 2 1 314.517 4.188 20 0 DIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551010299 341329078 /nfs/dbraw/zinc/32/90/78/341329078.db2.gz ZRXOXWKIQNTPGD-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551010299 341329079 /nfs/dbraw/zinc/32/90/79/341329079.db2.gz ZRXOXWKIQNTPGD-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000551030147 341329634 /nfs/dbraw/zinc/32/96/34/341329634.db2.gz YHTYDGUWUKKAFE-IRXDYDNUSA-N 2 1 300.490 4.335 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCCc1ccc(Cl)s1 ZINC000551519796 341343624 /nfs/dbraw/zinc/34/36/24/341343624.db2.gz LBMFRXKEXSYDAF-NFAWXSAZSA-N 2 1 314.926 4.043 20 0 DIADMP FCCCCC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000551700448 341349356 /nfs/dbraw/zinc/34/93/56/341349356.db2.gz ZAADFSBCHIBMAI-PMACEKPBSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246747616 341356673 /nfs/dbraw/zinc/35/66/73/341356673.db2.gz FRQWAPDAIXZARS-KGLIPLIRSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246747616 341356674 /nfs/dbraw/zinc/35/66/74/341356674.db2.gz FRQWAPDAIXZARS-KGLIPLIRSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000246747616 341356675 /nfs/dbraw/zinc/35/66/75/341356675.db2.gz FRQWAPDAIXZARS-KGLIPLIRSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246747616 341356676 /nfs/dbraw/zinc/35/66/76/341356676.db2.gz FRQWAPDAIXZARS-KGLIPLIRSA-N 2 1 314.395 4.040 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC000246906643 341358593 /nfs/dbraw/zinc/35/85/93/341358593.db2.gz GCEOAVXMKOPBOR-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2c3ccccc3C[C@H]2C)c1 ZINC000247000976 341359796 /nfs/dbraw/zinc/35/97/96/341359796.db2.gz LPLUBLXATRLMDA-IIBYNOLFSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC[N@@H+]1C ZINC000247078209 341360845 /nfs/dbraw/zinc/36/08/45/341360845.db2.gz QPIVLGKDGSUXDF-CCKFTAQKSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC[N@H+]1C ZINC000247078209 341360846 /nfs/dbraw/zinc/36/08/46/341360846.db2.gz QPIVLGKDGSUXDF-CCKFTAQKSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H](Cc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000247133111 341361218 /nfs/dbraw/zinc/36/12/18/341361218.db2.gz QJXAZRMZIFLUNI-BVYCBKJFSA-N 2 1 322.496 4.085 20 0 DIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000247175479 341361818 /nfs/dbraw/zinc/36/18/18/341361818.db2.gz UWVOPQVYSRBOKP-CVEARBPZSA-N 2 1 300.446 4.042 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000247175479 341361819 /nfs/dbraw/zinc/36/18/19/341361819.db2.gz UWVOPQVYSRBOKP-CVEARBPZSA-N 2 1 300.446 4.042 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000247222243 341362332 /nfs/dbraw/zinc/36/23/32/341362332.db2.gz WJVSLZVWGIKLLS-ZUJOMPCJSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000247222243 341362333 /nfs/dbraw/zinc/36/23/33/341362333.db2.gz WJVSLZVWGIKLLS-ZUJOMPCJSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000247222234 341362375 /nfs/dbraw/zinc/36/23/75/341362375.db2.gz WJVSLZVWGIKLLS-OUSUWRMNSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000247222234 341362376 /nfs/dbraw/zinc/36/23/76/341362376.db2.gz WJVSLZVWGIKLLS-OUSUWRMNSA-N 2 1 316.464 4.054 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000552043367 341364432 /nfs/dbraw/zinc/36/44/32/341364432.db2.gz JXQHRKXDGAWYNZ-VDGAXYAQSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1F ZINC000248408275 341376900 /nfs/dbraw/zinc/37/69/00/341376900.db2.gz VIPRKIAJZPYSKD-JYJNAYRXSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1F ZINC000248408275 341376901 /nfs/dbraw/zinc/37/69/01/341376901.db2.gz VIPRKIAJZPYSKD-JYJNAYRXSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248542540 341379578 /nfs/dbraw/zinc/37/95/78/341379578.db2.gz BZZDHYGIZVKXJY-LMMKCTJWSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000248981243 341391302 /nfs/dbraw/zinc/39/13/02/341391302.db2.gz IXHZZRGVKUZQGF-QGPMSJSTSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000248981243 341391303 /nfs/dbraw/zinc/39/13/03/341391303.db2.gz IXHZZRGVKUZQGF-QGPMSJSTSA-N 2 1 306.519 4.299 20 0 DIADMP CC(C)Oc1cccc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000261951334 341510214 /nfs/dbraw/zinc/51/02/14/341510214.db2.gz WHWGXFWATDWVAV-GKCIPKSASA-N 2 1 310.441 4.269 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3[nH]ccc32)c1 ZINC000236668189 519629050 /nfs/dbraw/zinc/62/90/50/519629050.db2.gz RINGIZTUTOLRDS-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000366429569 519781442 /nfs/dbraw/zinc/78/14/42/519781442.db2.gz GRGSGQYQQYVMJD-IPJUCJBFSA-N 2 1 316.489 4.141 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000163280802 521717726 /nfs/dbraw/zinc/71/77/26/521717726.db2.gz NLQNRWYWVXJVHQ-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]CCCn1cc[nH+]c1C ZINC000338014049 521780538 /nfs/dbraw/zinc/78/05/38/521780538.db2.gz DCGGPWWTOLZCJZ-AWEZNQCLSA-N 2 1 303.475 4.044 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)s1 ZINC000157908918 522219840 /nfs/dbraw/zinc/21/98/40/522219840.db2.gz CGJINFXFHJNPDR-LSDHHAIUSA-N 2 1 323.550 4.177 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCCn2cc[nH+]c2C)c2ccccc12 ZINC000338006948 525320066 /nfs/dbraw/zinc/32/00/66/525320066.db2.gz DWVOUXYJPGDLAW-HNNXBMFYSA-N 2 1 323.440 4.094 20 0 DIADMP Cc1sccc1C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000339295792 526918645 /nfs/dbraw/zinc/91/86/45/526918645.db2.gz SGCULUMZPIRBSQ-CYBMUJFWSA-N 2 1 311.454 4.401 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000338008579 527420840 /nfs/dbraw/zinc/42/08/40/527420840.db2.gz PJRWKGXWOHFZNB-NSHDSACASA-N 2 1 312.244 4.239 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccccc2)cc1F ZINC000337952146 527420949 /nfs/dbraw/zinc/42/09/49/527420949.db2.gz RVXMNYZTTVIZMG-UHFFFAOYSA-N 2 1 323.415 4.178 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000338024788 527421946 /nfs/dbraw/zinc/42/19/46/527421946.db2.gz WTINFGJQYZADHL-OAHLLOKOSA-N 2 1 324.255 4.166 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(-c2ccccc2)o1 ZINC000338011062 527421970 /nfs/dbraw/zinc/42/19/70/527421970.db2.gz MHYDTYPFROUMEI-OAHLLOKOSA-N 2 1 309.413 4.192 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1 ZINC000338016054 527422437 /nfs/dbraw/zinc/42/24/37/527422437.db2.gz ZLMWABKKKXIHJR-GFCCVEGCSA-N 2 1 317.820 4.332 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000338008918 527422917 /nfs/dbraw/zinc/42/29/17/527422917.db2.gz BWJWWPVAFJLBAJ-SFHVURJKSA-N 2 1 317.864 4.366 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCc2ccc(C(C)C)cc21 ZINC000338023333 527423164 /nfs/dbraw/zinc/42/31/64/527423164.db2.gz RXRFVECWEFJVLS-HXUWFJFHSA-N 2 1 311.473 4.372 20 0 DIADMP Cc1c[nH+]cn1C1CC[NH+]([C@@H]2CCc3c2cccc3Cl)CC1 ZINC000225409645 563753821 /nfs/dbraw/zinc/75/38/21/563753821.db2.gz YMVXVIZBNDXWAK-GOSISDBHSA-N 2 1 315.848 4.169 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000321148769 1035625092 /nfs/dbraw/zinc/62/50/92/1035625092.db2.gz OQUWNVKRHBGTRH-MRXNPFEDSA-N 2 1 314.473 4.207 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)[C@H](C)c1cccc(OC)c1 ZINC000179408933 1035869704 /nfs/dbraw/zinc/86/97/04/1035869704.db2.gz CQKXTNCGZZETQH-MRXNPFEDSA-N 2 1 315.461 4.063 20 0 DIADMP CC[N@@H+](CCCCn1cc[nH+]c1C)[C@H](C)c1cccc(OC)c1 ZINC000179408933 1035869726 /nfs/dbraw/zinc/86/97/26/1035869726.db2.gz CQKXTNCGZZETQH-MRXNPFEDSA-N 2 1 315.461 4.063 20 0 DIADMP Clc1cccc2c1SCC[C@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119721656 1035869977 /nfs/dbraw/zinc/86/99/77/1035869977.db2.gz KFFSRRGARBLDIC-MRXNPFEDSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119721501 1035871388 /nfs/dbraw/zinc/87/13/88/1035871388.db2.gz KFFSRRGARBLDIC-INIZCTEOSA-N 2 1 322.905 4.093 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1Cc2cc(C)ccc2CC1(C)C ZINC000339634503 1035893049 /nfs/dbraw/zinc/89/30/49/1035893049.db2.gz WXGDKDDNJJVGMJ-UHFFFAOYSA-N 2 1 311.473 4.117 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1Cc2cc(C)ccc2CC1(C)C ZINC000339634503 1035893064 /nfs/dbraw/zinc/89/30/64/1035893064.db2.gz WXGDKDDNJJVGMJ-UHFFFAOYSA-N 2 1 311.473 4.117 20 0 DIADMP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000037197194 1035961077 /nfs/dbraw/zinc/96/10/77/1035961077.db2.gz LEYHHEICWMCMAG-CQSZACIVSA-N 2 1 312.910 4.054 20 0 DIADMP Clc1ccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC000037318623 1036018367 /nfs/dbraw/zinc/01/83/67/1036018367.db2.gz ACVPJVRWBGYFHA-SFHVURJKSA-N 2 1 304.865 4.008 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccs1 ZINC000154856578 1036039716 /nfs/dbraw/zinc/03/97/16/1036039716.db2.gz MNDMKRJYOWRXCB-HNNXBMFYSA-N 2 1 302.487 4.439 20 0 DIADMP c1ccc(CC[C@@H]2CCC[N@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC001209452967 1036195024 /nfs/dbraw/zinc/19/50/24/1036195024.db2.gz AVFAAKRTKBHFEN-NRFANRHFSA-N 2 1 314.517 4.207 20 0 DIADMP CC[C@H](C)[N@H+](CCCn1cc[nH+]c1C)CCc1ccccc1F ZINC001167244713 1036313355 /nfs/dbraw/zinc/31/33/55/1036313355.db2.gz ZFXMZIJMJICWSY-INIZCTEOSA-N 2 1 317.452 4.064 20 0 DIADMP CC[C@H](C)[N@@H+](CCCn1cc[nH+]c1C)CCc1ccccc1F ZINC001167244713 1036313373 /nfs/dbraw/zinc/31/33/73/1036313373.db2.gz ZFXMZIJMJICWSY-INIZCTEOSA-N 2 1 317.452 4.064 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CC(C)(C)C[C@H]1C ZINC001648805484 1036409119 /nfs/dbraw/zinc/40/91/19/1036409119.db2.gz SHNPVQRVTZUMSZ-APWZRJJASA-N 2 1 302.506 4.441 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CC(C)(C)C[C@@H]1C ZINC001648805486 1036409985 /nfs/dbraw/zinc/40/99/85/1036409985.db2.gz SHNPVQRVTZUMSZ-QFBILLFUSA-N 2 1 302.506 4.441 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001648811194 1036491169 /nfs/dbraw/zinc/49/11/69/1036491169.db2.gz GVUPECIKXUVOOR-IYBDPMFKSA-N 2 1 322.924 4.496 20 0 DIADMP Cc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)ccc1Cl ZINC001648817098 1036578081 /nfs/dbraw/zinc/57/80/81/1036578081.db2.gz UVKVGERMJLVXBE-HNNXBMFYSA-N 2 1 308.897 4.250 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CCC(c2ccccc2)CC1 ZINC000121436082 1036580902 /nfs/dbraw/zinc/58/09/02/1036580902.db2.gz CTBOFYVUIDLWRS-PBPGXSGUSA-N 2 1 311.473 4.144 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000315580822 1036581738 /nfs/dbraw/zinc/58/17/38/1036581738.db2.gz QQCAXXOUVOZIRK-PBHICJAKSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000315580822 1036581751 /nfs/dbraw/zinc/58/17/51/1036581751.db2.gz QQCAXXOUVOZIRK-PBHICJAKSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H](C[NH2+]C[C@H](C1CC1)[NH+](C)C)Cc1ccc(C(C)(C)C)cc1 ZINC001648837412 1036617490 /nfs/dbraw/zinc/61/74/90/1036617490.db2.gz QEQJRXSJIRZXOG-OXJNMPFZSA-N 2 1 316.533 4.093 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H]2CCCC[C@H]2C)cc1F ZINC001648902911 1036682148 /nfs/dbraw/zinc/68/21/48/1036682148.db2.gz ARMJPDDPMBGDNV-RHSMWYFYSA-N 2 1 315.436 4.236 20 0 DIADMP Cc1cccc(C)c1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001167326922 1036744716 /nfs/dbraw/zinc/74/47/16/1036744716.db2.gz YBCNTMYGSQCWTG-HXUWFJFHSA-N 2 1 314.517 4.391 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCCCF)CC[N@@H+]1Cc1ccccc1 ZINC000556497904 1036958471 /nfs/dbraw/zinc/95/84/71/1036958471.db2.gz QVMATDIHKAZPBJ-IEBWSBKVSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCCCF)CC[N@H+]1Cc1ccccc1 ZINC000556497904 1036958485 /nfs/dbraw/zinc/95/84/85/1036958485.db2.gz QVMATDIHKAZPBJ-IEBWSBKVSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497904 1036958499 /nfs/dbraw/zinc/95/84/99/1036958499.db2.gz QVMATDIHKAZPBJ-IEBWSBKVSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497904 1036958512 /nfs/dbraw/zinc/95/85/12/1036958512.db2.gz QVMATDIHKAZPBJ-IEBWSBKVSA-N 2 1 306.469 4.111 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398019151 1037085740 /nfs/dbraw/zinc/08/57/40/1037085740.db2.gz JCSKRLVSTIEYAJ-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398019151 1037085758 /nfs/dbraw/zinc/08/57/58/1037085758.db2.gz JCSKRLVSTIEYAJ-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]CCCc1c(Cl)cccc1Cl)c1c[nH+]ccc1N ZINC000656200512 1037093784 /nfs/dbraw/zinc/09/37/84/1037093784.db2.gz NZTCHAKPQHBJBA-LLVKDONJSA-N 2 1 324.255 4.084 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398032528 1037101435 /nfs/dbraw/zinc/10/14/35/1037101435.db2.gz OAGFFBFTCRSADG-WSTZPKSXSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398032528 1037101440 /nfs/dbraw/zinc/10/14/40/1037101440.db2.gz OAGFFBFTCRSADG-WSTZPKSXSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398038581 1037105451 /nfs/dbraw/zinc/10/54/51/1037105451.db2.gz QXSYOUFZBGBRGA-NSHGMRRFSA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398038581 1037105460 /nfs/dbraw/zinc/10/54/60/1037105460.db2.gz QXSYOUFZBGBRGA-NSHGMRRFSA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398038579 1037105616 /nfs/dbraw/zinc/10/56/16/1037105616.db2.gz QXSYOUFZBGBRGA-CMKODMSKSA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398038579 1037105619 /nfs/dbraw/zinc/10/56/19/1037105619.db2.gz QXSYOUFZBGBRGA-CMKODMSKSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@H](CC[NH2+]Cc1cc2ccccc2[nH]1)[N@@H+](C)Cc1ccccc1 ZINC000683929285 1037118984 /nfs/dbraw/zinc/11/89/84/1037118984.db2.gz JTQMQNXDQJJZGY-QGZVFWFLSA-N 2 1 321.468 4.168 20 0 DIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000539508134 1037129098 /nfs/dbraw/zinc/12/90/98/1037129098.db2.gz SIGFNDRWAZVJCN-MRXNPFEDSA-N 2 1 324.921 4.062 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C=CCCCCC1 ZINC000398179719 1037270061 /nfs/dbraw/zinc/27/00/61/1037270061.db2.gz WSZZBPSWUOMEDB-HLAWJBBLSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C=CCCCCC1 ZINC000398179719 1037270080 /nfs/dbraw/zinc/27/00/80/1037270080.db2.gz WSZZBPSWUOMEDB-HLAWJBBLSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C[C@@H](C)C1 ZINC000398193537 1037278429 /nfs/dbraw/zinc/27/84/29/1037278429.db2.gz NKYXQLXPRCBQML-MTFRMWQMSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C[C@@H](C)C1 ZINC000398193537 1037278441 /nfs/dbraw/zinc/27/84/41/1037278441.db2.gz NKYXQLXPRCBQML-MTFRMWQMSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc(Cl)s1 ZINC000222594845 1037278874 /nfs/dbraw/zinc/27/88/74/1037278874.db2.gz RJUGKTVRKXSXES-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)s1 ZINC000222594845 1037278883 /nfs/dbraw/zinc/27/88/83/1037278883.db2.gz RJUGKTVRKXSXES-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP CCC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398228698 1037298003 /nfs/dbraw/zinc/29/80/03/1037298003.db2.gz YZBIVOYNUVDDRI-AXIYNFMDSA-N 2 1 314.517 4.455 20 0 DIADMP CCC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398228698 1037298014 /nfs/dbraw/zinc/29/80/14/1037298014.db2.gz YZBIVOYNUVDDRI-AXIYNFMDSA-N 2 1 314.517 4.455 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@@H+]2CC2CCCC2)cc1 ZINC000656401157 1037442863 /nfs/dbraw/zinc/44/28/63/1037442863.db2.gz AJYIUYCMKSMVPX-KJJMTIBFSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@@H+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2CC2CCCC2)cc1 ZINC000656401157 1037442869 /nfs/dbraw/zinc/44/28/69/1037442869.db2.gz AJYIUYCMKSMVPX-KJJMTIBFSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2CC2CCCC2)cc1 ZINC000656401157 1037442875 /nfs/dbraw/zinc/44/28/75/1037442875.db2.gz AJYIUYCMKSMVPX-KJJMTIBFSA-N 2 1 324.512 4.019 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@H+]2CCC[NH+](CC)CC)o1 ZINC001167452998 1037515788 /nfs/dbraw/zinc/51/57/88/1037515788.db2.gz HGJFKQKGMPTONU-GOSISDBHSA-N 2 1 306.494 4.491 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@@H+]2CCC[NH+](CC)CC)o1 ZINC001167452998 1037515793 /nfs/dbraw/zinc/51/57/93/1037515793.db2.gz HGJFKQKGMPTONU-GOSISDBHSA-N 2 1 306.494 4.491 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1C(C)=CCC[C@@H]1C ZINC000581694067 1037921583 /nfs/dbraw/zinc/92/15/83/1037921583.db2.gz BLBSHURJJLHISS-ROUUACIJSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1C(C)=CCC[C@@H]1C ZINC000581694067 1037921589 /nfs/dbraw/zinc/92/15/89/1037921589.db2.gz BLBSHURJJLHISS-ROUUACIJSA-N 2 1 303.494 4.150 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](CC)c2ccccc2OCC)CC1 ZINC000153940773 1038278804 /nfs/dbraw/zinc/27/88/04/1038278804.db2.gz OFHCZOIHWJXWCN-SFHVURJKSA-N 2 1 304.478 4.000 20 0 DIADMP CC(C)Oc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1 ZINC000535811402 1038341122 /nfs/dbraw/zinc/34/11/22/1038341122.db2.gz UZQSKKVZELVART-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)[C@H](C[NH2+][C@@H](C)C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914713 1038376899 /nfs/dbraw/zinc/37/68/99/1038376899.db2.gz YGOFVMRRDZXBEN-HBFSDRIKSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@H](C[NH2+][C@@H](C)C[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914713 1038376913 /nfs/dbraw/zinc/37/69/13/1038376913.db2.gz YGOFVMRRDZXBEN-HBFSDRIKSA-N 2 1 302.506 4.136 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226941 1038379404 /nfs/dbraw/zinc/37/94/04/1038379404.db2.gz DUROSBDESLFWQZ-WBVHZDCISA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226941 1038379405 /nfs/dbraw/zinc/37/94/05/1038379405.db2.gz DUROSBDESLFWQZ-WBVHZDCISA-N 2 1 322.443 4.065 20 0 DIADMP CC(C[NH+]1CCC[C@H]1C1CCC1)C[N@H+]1CCC[C@H]1C1CCC1 ZINC000605573263 1038536496 /nfs/dbraw/zinc/53/64/96/1038536496.db2.gz UGVDFCYUNCTGER-PMACEKPBSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@H](C1CC1)[NH+](C[C@H](C)C[N@@H+]([C@@H](C)C1CC1)C1CC1)C1CC1 ZINC000605573356 1038537045 /nfs/dbraw/zinc/53/70/45/1038537045.db2.gz NWGKUJCSDBHDCF-MUJYYYPQSA-N 2 1 304.522 4.148 20 0 DIADMP C[C@H](C[NH+]([C@@H](C)C1CC1)C1CC1)C[N@H+]([C@H](C)C1CC1)C1CC1 ZINC000605573356 1038537051 /nfs/dbraw/zinc/53/70/51/1038537051.db2.gz NWGKUJCSDBHDCF-MUJYYYPQSA-N 2 1 304.522 4.148 20 0 DIADMP C[C@H](C[NH+]([C@@H](C)C1CC1)C1CC1)C[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000605573356 1038537054 /nfs/dbraw/zinc/53/70/54/1038537054.db2.gz NWGKUJCSDBHDCF-MUJYYYPQSA-N 2 1 304.522 4.148 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000684773100 1038596610 /nfs/dbraw/zinc/59/66/10/1038596610.db2.gz CDMOWBWMBIWLAA-NVXWUHKLSA-N 2 1 306.519 4.066 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000606432843 1038601311 /nfs/dbraw/zinc/60/13/11/1038601311.db2.gz DWWUXIIZSMTTOI-LJQANCHMSA-N 2 1 306.469 4.329 20 0 DIADMP c1ccc2cc(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447745 1038603188 /nfs/dbraw/zinc/60/31/88/1038603188.db2.gz DDSWEZMLEFLPEC-OAQYLSRUSA-N 2 1 308.469 4.290 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000607358449 1038675105 /nfs/dbraw/zinc/67/51/05/1038675105.db2.gz DVTRYPSYLYZUIJ-STQMWFEESA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000607358449 1038675108 /nfs/dbraw/zinc/67/51/08/1038675108.db2.gz DVTRYPSYLYZUIJ-STQMWFEESA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000607358449 1038675112 /nfs/dbraw/zinc/67/51/12/1038675112.db2.gz DVTRYPSYLYZUIJ-STQMWFEESA-N 2 1 315.288 4.328 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC001167586616 1038714595 /nfs/dbraw/zinc/71/45/95/1038714595.db2.gz OXROSFRCHDDGRJ-QFBILLFUSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC001167586616 1038714603 /nfs/dbraw/zinc/71/46/03/1038714603.db2.gz OXROSFRCHDDGRJ-QFBILLFUSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC001167586616 1038714616 /nfs/dbraw/zinc/71/46/16/1038714616.db2.gz OXROSFRCHDDGRJ-QFBILLFUSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001167586616 1038714624 /nfs/dbraw/zinc/71/46/24/1038714624.db2.gz OXROSFRCHDDGRJ-QFBILLFUSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001167586616 1038714633 /nfs/dbraw/zinc/71/46/33/1038714633.db2.gz OXROSFRCHDDGRJ-QFBILLFUSA-N 2 1 310.485 4.317 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCC1(C)C ZINC000342714407 1038735078 /nfs/dbraw/zinc/73/50/78/1038735078.db2.gz VFHOUTVPGZUNCA-LJQANCHMSA-N 2 1 312.457 4.190 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)s2)cc1 ZINC000608061658 1038761434 /nfs/dbraw/zinc/76/14/34/1038761434.db2.gz XVPKYYUSVBKGEJ-DOTOQJQBSA-N 2 1 314.498 4.296 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)s2)cc1 ZINC000608061658 1038761440 /nfs/dbraw/zinc/76/14/40/1038761440.db2.gz XVPKYYUSVBKGEJ-DOTOQJQBSA-N 2 1 314.498 4.296 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000608061590 1038761716 /nfs/dbraw/zinc/76/17/16/1038761716.db2.gz ZJUQMEOIDQSMIR-BBRMVZONSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000608061590 1038761720 /nfs/dbraw/zinc/76/17/20/1038761720.db2.gz ZJUQMEOIDQSMIR-BBRMVZONSA-N 2 1 318.461 4.127 20 0 DIADMP Cc1ccc([C@H]([NH2+]CCCCn2cc[nH+]c2C)C2CCCC2)o1 ZINC000342780519 1038774211 /nfs/dbraw/zinc/77/42/11/1038774211.db2.gz KXHASOFSRDTVSZ-LJQANCHMSA-N 2 1 315.461 4.394 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](CC1CCC1)[C@@H](C)c1ccccc1 ZINC000342861006 1038926625 /nfs/dbraw/zinc/92/66/25/1038926625.db2.gz ULEPYLYASWEXIN-KRWDZBQOSA-N 2 1 311.473 4.445 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](CC1CCC1)[C@@H](C)c1ccccc1 ZINC000342861006 1038926640 /nfs/dbraw/zinc/92/66/40/1038926640.db2.gz ULEPYLYASWEXIN-KRWDZBQOSA-N 2 1 311.473 4.445 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342866193 1038935420 /nfs/dbraw/zinc/93/54/20/1038935420.db2.gz YKBUDNUGYQVKHL-SFHVURJKSA-N 2 1 315.461 4.354 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342866193 1038935425 /nfs/dbraw/zinc/93/54/25/1038935425.db2.gz YKBUDNUGYQVKHL-SFHVURJKSA-N 2 1 315.461 4.354 20 0 DIADMP CC1(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCC1 ZINC001167648698 1039084508 /nfs/dbraw/zinc/08/45/08/1039084508.db2.gz WYLALHYAZGUXBY-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000714804011 1039090181 /nfs/dbraw/zinc/09/01/81/1039090181.db2.gz SIWANOXSXAOASP-ZXNZYJFHSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000714804011 1039090198 /nfs/dbraw/zinc/09/01/98/1039090198.db2.gz SIWANOXSXAOASP-ZXNZYJFHSA-N 2 1 312.501 4.065 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2oc(C(C)C)nc2C)CC1 ZINC000428474378 1039220217 /nfs/dbraw/zinc/22/02/17/1039220217.db2.gz RSIBAZNWLGIKGQ-UHFFFAOYSA-N 2 1 321.509 4.050 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000539817218 1039345328 /nfs/dbraw/zinc/34/53/28/1039345328.db2.gz BZFQVBKILOHYMU-LJQANCHMSA-N 2 1 324.468 4.397 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000539817218 1039345341 /nfs/dbraw/zinc/34/53/41/1039345341.db2.gz BZFQVBKILOHYMU-LJQANCHMSA-N 2 1 324.468 4.397 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2csc3ccccc23)C[C@@H]1C ZINC000539818119 1039347615 /nfs/dbraw/zinc/34/76/15/1039347615.db2.gz QPQFOZQPUIGGIP-HOCLYGCPSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2csc3ccccc23)C[C@@H]1C ZINC000539818119 1039347621 /nfs/dbraw/zinc/34/76/21/1039347621.db2.gz QPQFOZQPUIGGIP-HOCLYGCPSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2csc3ccccc23)C[C@@H]1C ZINC000539818119 1039347639 /nfs/dbraw/zinc/34/76/39/1039347639.db2.gz QPQFOZQPUIGGIP-HOCLYGCPSA-N 2 1 302.487 4.206 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccsc1 ZINC000669850677 1039382717 /nfs/dbraw/zinc/38/27/17/1039382717.db2.gz FFTNHVPFHZOVIY-VKJFTORMSA-N 2 1 306.519 4.442 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000657774323 1039396826 /nfs/dbraw/zinc/39/68/26/1039396826.db2.gz DHDGMDRTVUBGIT-LJQANCHMSA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000657774323 1039396837 /nfs/dbraw/zinc/39/68/37/1039396837.db2.gz DHDGMDRTVUBGIT-LJQANCHMSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1cnc([C@@H](C)[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)o1 ZINC000540052836 1039410095 /nfs/dbraw/zinc/41/00/95/1039410095.db2.gz KQKFQJRPQQTPCF-NVXWUHKLSA-N 2 1 319.493 4.021 20 0 DIADMP Cc1cnc([C@@H](C)[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)o1 ZINC000540052836 1039410105 /nfs/dbraw/zinc/41/01/05/1039410105.db2.gz KQKFQJRPQQTPCF-NVXWUHKLSA-N 2 1 319.493 4.021 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCCC2 ZINC000540168867 1039437203 /nfs/dbraw/zinc/43/72/03/1039437203.db2.gz NXSRXVRGZYVRME-CVEARBPZSA-N 2 1 311.473 4.057 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000540162267 1039440301 /nfs/dbraw/zinc/44/03/01/1039440301.db2.gz IBGPPHHTSKEILG-KBAYOESNSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000540162267 1039440305 /nfs/dbraw/zinc/44/03/05/1039440305.db2.gz IBGPPHHTSKEILG-KBAYOESNSA-N 2 1 322.443 4.207 20 0 DIADMP Cc1cc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)ccc1F ZINC000540299878 1039469934 /nfs/dbraw/zinc/46/99/34/1039469934.db2.gz UIRGMTMCAUOJOE-JXFKEZNVSA-N 2 1 318.480 4.295 20 0 DIADMP COc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C(C)C)cc1 ZINC000540299532 1039470141 /nfs/dbraw/zinc/47/01/41/1039470141.db2.gz KQFLZTCSEBYQRX-XLIONFOSSA-N 2 1 318.505 4.102 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](c2ccc(C)o2)C2CCCC2)CC1 ZINC000540467326 1039498243 /nfs/dbraw/zinc/49/82/43/1039498243.db2.gz HPUNQNWNMVNMLX-LJQANCHMSA-N 2 1 304.478 4.283 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC000540521484 1039513651 /nfs/dbraw/zinc/51/36/51/1039513651.db2.gz RHFWTQKAQHQZNE-FSPWUOQZSA-N 2 1 317.864 4.222 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000584060191 1039585200 /nfs/dbraw/zinc/58/52/00/1039585200.db2.gz PICHGEWJPWVZGB-JAXLGGSGSA-N 2 1 320.480 4.142 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000584060191 1039585215 /nfs/dbraw/zinc/58/52/15/1039585215.db2.gz PICHGEWJPWVZGB-JAXLGGSGSA-N 2 1 320.480 4.142 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000541013151 1039612549 /nfs/dbraw/zinc/61/25/49/1039612549.db2.gz FGKBQGWUDBWCKA-SUESZEJSSA-N 2 1 318.480 4.170 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](CCCCC(F)(F)F)C2)CC1 ZINC000151637822 1039612558 /nfs/dbraw/zinc/61/25/58/1039612558.db2.gz UXKLQCDIORUMJX-INIZCTEOSA-N 2 1 320.443 4.163 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCCC(F)(F)F)C2)CC1 ZINC000151637822 1039612561 /nfs/dbraw/zinc/61/25/61/1039612561.db2.gz UXKLQCDIORUMJX-INIZCTEOSA-N 2 1 320.443 4.163 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CCCCC[C@H]1/C=C\c1cccs1 ZINC000541203184 1039631699 /nfs/dbraw/zinc/63/16/99/1039631699.db2.gz VHTQDTUPKKDHEQ-JJEJIETFSA-N 2 1 315.486 4.211 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CCCCC[C@H]1/C=C\c1cccs1 ZINC000541203184 1039631709 /nfs/dbraw/zinc/63/17/09/1039631709.db2.gz VHTQDTUPKKDHEQ-JJEJIETFSA-N 2 1 315.486 4.211 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)C(C)(C)C(F)F ZINC000657839079 1039677217 /nfs/dbraw/zinc/67/72/17/1039677217.db2.gz LKDMKIGJFRDLSB-QLFBSQMISA-N 2 1 304.469 4.014 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C2CCCCCC2)[C@H](C)C1 ZINC000541544991 1039696775 /nfs/dbraw/zinc/69/67/75/1039696775.db2.gz CBDZIXUJVKWPTD-HBFSDRIKSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1ccccc1CCC[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541601904 1039716591 /nfs/dbraw/zinc/71/65/91/1039716591.db2.gz VWESNWHALOUMTI-QUCCMNQESA-N 2 1 314.517 4.170 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccccc2F)cc1 ZINC000086279360 1039757559 /nfs/dbraw/zinc/75/75/59/1039757559.db2.gz LHHPOISTRHBZTF-CQSZACIVSA-N 2 1 309.388 4.171 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000657859180 1039774829 /nfs/dbraw/zinc/77/48/29/1039774829.db2.gz QLHCECJGAUUQCV-DOTOQJQBSA-N 2 1 324.459 4.168 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000685424832 1040041947 /nfs/dbraw/zinc/04/19/47/1040041947.db2.gz HNCHWTIBNANQKX-BQFCYCMXSA-N 2 1 308.535 4.403 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000685424832 1040041952 /nfs/dbraw/zinc/04/19/52/1040041952.db2.gz HNCHWTIBNANQKX-BQFCYCMXSA-N 2 1 308.535 4.403 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC000685455721 1040059290 /nfs/dbraw/zinc/05/92/90/1040059290.db2.gz TYHIXEICWRMURK-OBXNSHGQSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470309 1040067397 /nfs/dbraw/zinc/06/73/97/1040067397.db2.gz FHTZFTRFZVEQIU-DNVCBOLYSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470309 1040067413 /nfs/dbraw/zinc/06/74/13/1040067413.db2.gz FHTZFTRFZVEQIU-DNVCBOLYSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470309 1040067421 /nfs/dbraw/zinc/06/74/21/1040067421.db2.gz FHTZFTRFZVEQIU-DNVCBOLYSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470309 1040067437 /nfs/dbraw/zinc/06/74/37/1040067437.db2.gz FHTZFTRFZVEQIU-DNVCBOLYSA-N 2 1 314.498 4.187 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]C2CCC(c3ccc(F)cc3)CC2)[C@@H](C)C1 ZINC000493078444 1040079983 /nfs/dbraw/zinc/07/99/83/1040079983.db2.gz JKVZKSMRGHXWLV-VRQFRERNSA-N 2 1 318.480 4.172 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC000309689067 1040086369 /nfs/dbraw/zinc/08/63/69/1040086369.db2.gz CITBNXRSTJCGNY-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000309684123 1040087122 /nfs/dbraw/zinc/08/71/22/1040087122.db2.gz BGLHJZPZFFIYRL-ZIFCJYIRSA-N 2 1 312.457 4.149 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000309684123 1040087143 /nfs/dbraw/zinc/08/71/43/1040087143.db2.gz BGLHJZPZFFIYRL-ZIFCJYIRSA-N 2 1 312.457 4.149 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000309684118 1040087496 /nfs/dbraw/zinc/08/74/96/1040087496.db2.gz BGLHJZPZFFIYRL-JENIJYKNSA-N 2 1 312.457 4.149 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000309684118 1040087513 /nfs/dbraw/zinc/08/75/13/1040087513.db2.gz BGLHJZPZFFIYRL-JENIJYKNSA-N 2 1 312.457 4.149 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001648921408 1040090419 /nfs/dbraw/zinc/09/04/19/1040090419.db2.gz YPNBIBXKLBEBTF-SFHVURJKSA-N 2 1 300.490 4.166 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309885438 1040100073 /nfs/dbraw/zinc/10/00/73/1040100073.db2.gz YVJCVHWPTQXCSY-RLLQIKCJSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCSCC2)cc1 ZINC000657903602 1040100340 /nfs/dbraw/zinc/10/03/40/1040100340.db2.gz NBNVUYWLDOUVDF-RHSMWYFYSA-N 2 1 315.486 4.117 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000309991089 1040103125 /nfs/dbraw/zinc/10/31/25/1040103125.db2.gz ZYAZUOOEKFOPGZ-UYAOXDASSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)C1CCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309928416 1040103161 /nfs/dbraw/zinc/10/31/61/1040103161.db2.gz UWIYTLPLJHMQRQ-QKLQHJQFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310282569 1040115901 /nfs/dbraw/zinc/11/59/01/1040115901.db2.gz WSDYJRDBZDZVBQ-WOIUINJBSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1nccc2ccccc21 ZINC000685647659 1040184283 /nfs/dbraw/zinc/18/42/83/1040184283.db2.gz PMJJLDRCSSHQNP-CRAIPNDOSA-N 2 1 313.489 4.252 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309766815 1040257782 /nfs/dbraw/zinc/25/77/82/1040257782.db2.gz ZQPVOOSZZOVWJE-MISYRCLQSA-N 2 1 300.490 4.067 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@]2(C)CC2(F)F)CC1 ZINC000658224736 1040365681 /nfs/dbraw/zinc/36/56/81/1040365681.db2.gz VNHSQNVUTYLPCW-ABHNRTSZSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCC(F)CC1 ZINC000658293123 1040410276 /nfs/dbraw/zinc/41/02/76/1040410276.db2.gz JDGIYUXLAHFKQC-IVMQYODDSA-N 2 1 318.480 4.157 20 0 DIADMP C[N@H+](Cc1sc2ccccc2c1Cl)CC1CC[NH+](C)CC1 ZINC001207398619 1040424696 /nfs/dbraw/zinc/42/46/96/1040424696.db2.gz CVECFSQEFKNIDS-UHFFFAOYSA-N 2 1 322.905 4.328 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC000154098154 1040685968 /nfs/dbraw/zinc/68/59/68/1040685968.db2.gz GAQVSLQCYYGCGN-IMUUDWKMSA-N 2 1 317.864 4.017 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CC(C)=C[C@@H](C)C1 ZINC000570371577 1040706698 /nfs/dbraw/zinc/70/66/98/1040706698.db2.gz SGEOIQCBFMGKSL-AEFFLSMTSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CC(C)=C[C@@H](C)C1 ZINC000570371577 1040706709 /nfs/dbraw/zinc/70/67/09/1040706709.db2.gz SGEOIQCBFMGKSL-AEFFLSMTSA-N 2 1 303.494 4.150 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000280756451 1040722005 /nfs/dbraw/zinc/72/20/05/1040722005.db2.gz CEXRLOWLGZHXJC-NJAFHUGGSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000280756451 1040722014 /nfs/dbraw/zinc/72/20/14/1040722014.db2.gz CEXRLOWLGZHXJC-NJAFHUGGSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753455 1040722828 /nfs/dbraw/zinc/72/28/28/1040722828.db2.gz WMRNPDMSBCLVKI-SJLPKXTDSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753455 1040722843 /nfs/dbraw/zinc/72/28/43/1040722843.db2.gz WMRNPDMSBCLVKI-SJLPKXTDSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753450 1040723631 /nfs/dbraw/zinc/72/36/31/1040723631.db2.gz WMRNPDMSBCLVKI-AEFFLSMTSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753450 1040723640 /nfs/dbraw/zinc/72/36/40/1040723640.db2.gz WMRNPDMSBCLVKI-AEFFLSMTSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299450 1040890416 /nfs/dbraw/zinc/89/04/16/1040890416.db2.gz CPOIOFIQNOTLEU-XLIONFOSSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299450 1040890424 /nfs/dbraw/zinc/89/04/24/1040890424.db2.gz CPOIOFIQNOTLEU-XLIONFOSSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299446 1040891066 /nfs/dbraw/zinc/89/10/66/1040891066.db2.gz CPOIOFIQNOTLEU-PXNSSMCTSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299446 1040891081 /nfs/dbraw/zinc/89/10/81/1040891081.db2.gz CPOIOFIQNOTLEU-PXNSSMCTSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cc(Cl)sc1Cl ZINC000414168534 1040950618 /nfs/dbraw/zinc/95/06/18/1040950618.db2.gz AIUSIYLLICFEJC-QWRGUYRKSA-N 2 1 321.317 4.437 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000414169216 1040951579 /nfs/dbraw/zinc/95/15/79/1040951579.db2.gz AUPYWOVZGIDTCP-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000414172996 1040955847 /nfs/dbraw/zinc/95/58/47/1040955847.db2.gz FXWXOOSIAIBEFU-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000414188367 1040971076 /nfs/dbraw/zinc/97/10/76/1040971076.db2.gz QPABJJCHHNGHIZ-HOTGVXAUSA-N 2 1 306.519 4.181 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000414194479 1040984123 /nfs/dbraw/zinc/98/41/23/1040984123.db2.gz UUSMVRVLUYJXOJ-DZGCQCFKSA-N 2 1 323.550 4.132 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCO[C@@H]2CCCC[C@H]2C)CC1 ZINC000613491443 1041003650 /nfs/dbraw/zinc/00/36/50/1041003650.db2.gz RTHBCEWYJMLLIK-UYAOXDASSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000613492367 1041006470 /nfs/dbraw/zinc/00/64/70/1041006470.db2.gz KBCBUHFDQBFBQC-UHFFFAOYSA-N 2 1 308.897 4.284 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)ccc1C(F)(F)F ZINC000414371582 1041186521 /nfs/dbraw/zinc/18/65/21/1041186521.db2.gz NAIWLGXPOWEGOT-AWEZNQCLSA-N 2 1 323.362 4.117 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]CCC2CCCCCC2)cn1 ZINC000809608540 1041193875 /nfs/dbraw/zinc/19/38/75/1041193875.db2.gz VWPRMYUQEWGQCS-UHFFFAOYSA-N 2 1 312.461 4.026 20 0 DIADMP CC(C)C[C@@H](C)C[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000809631332 1041207353 /nfs/dbraw/zinc/20/73/53/1041207353.db2.gz VCDXAZYEPYLQSX-QGZVFWFLSA-N 2 1 317.521 4.311 20 0 DIADMP C[C@H]1C[C@@H](Nc2nc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000301900373 1041255612 /nfs/dbraw/zinc/25/56/12/1041255612.db2.gz YZTWYLBVJXQJNG-RDJZCZTQSA-N 2 1 320.440 4.028 20 0 DIADMP CCCCCC[C@H](CC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170590116 1041276920 /nfs/dbraw/zinc/27/69/20/1041276920.db2.gz GDXNUHAKJNVHGU-FHWLQOOXSA-N 2 1 324.553 4.486 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001170592569 1041288551 /nfs/dbraw/zinc/28/85/51/1041288551.db2.gz FHWPMRZIMXROQB-IRLDBZIGSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001170592569 1041288571 /nfs/dbraw/zinc/28/85/71/1041288571.db2.gz FHWPMRZIMXROQB-IRLDBZIGSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001170592569 1041288580 /nfs/dbraw/zinc/28/85/80/1041288580.db2.gz FHWPMRZIMXROQB-IRLDBZIGSA-N 2 1 320.480 4.118 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1 ZINC000624121708 1041352288 /nfs/dbraw/zinc/35/22/88/1041352288.db2.gz BKNSAFLIYJCMSE-HZPDHXFCSA-N 2 1 306.519 4.181 20 0 DIADMP c1c[nH+]c(C2CC[NH+](Cc3ccc(-c4ccccc4)o3)CC2)[nH]1 ZINC000271173337 1041503000 /nfs/dbraw/zinc/50/30/00/1041503000.db2.gz DUNBLYXYQOJGTB-UHFFFAOYSA-N 2 1 307.397 4.049 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310103786 1041631596 /nfs/dbraw/zinc/63/15/96/1041631596.db2.gz ZBTVDWGIVWGXHG-PZJWPPBQSA-N 2 1 322.496 4.292 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH2+]C3(C)CC[NH+](Cc4ccccc4)CC3)C[C@@H]21 ZINC001170736040 1041800686 /nfs/dbraw/zinc/80/06/86/1041800686.db2.gz DLBMJXIALSZAID-REPLKXPHSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([N@@H+](Cc3ccccc3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170739187 1041808227 /nfs/dbraw/zinc/80/82/27/1041808227.db2.gz QKPVLGDVRCKJBM-DHUDUYKCSA-N 2 1 312.501 4.193 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC([NH3+])(c4ccccc4Cl)CC3)C[C@@H]21 ZINC001170739174 1041808580 /nfs/dbraw/zinc/80/85/80/1041808580.db2.gz QDQNTKIBZPVAOZ-MKZZRHPPSA-N 2 1 318.892 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCc2ccc(F)c(Cl)c21 ZINC000651719646 1041892932 /nfs/dbraw/zinc/89/29/32/1041892932.db2.gz ADXXAXXYBHIBKS-OAHLLOKOSA-N 2 1 321.827 4.041 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)o1 ZINC000124013208 1041998260 /nfs/dbraw/zinc/99/82/60/1041998260.db2.gz JGGIMBARPYBUAV-HNNXBMFYSA-N 2 1 300.446 4.145 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CCC1(F)F ZINC001170805974 1042000998 /nfs/dbraw/zinc/00/09/98/1042000998.db2.gz VSJMQWTYVYZNBA-INIZCTEOSA-N 2 1 322.443 4.150 20 0 DIADMP CCC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(OC)cc1 ZINC000164599393 1042019629 /nfs/dbraw/zinc/01/96/29/1042019629.db2.gz ZMABIDWAJQOOSJ-IBGZPJMESA-N 2 1 315.461 4.111 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000164625128 1042026212 /nfs/dbraw/zinc/02/62/12/1042026212.db2.gz DPJDVJTYSLXBQH-WFASDCNBSA-N 2 1 321.515 4.248 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161560800 1042110756 /nfs/dbraw/zinc/11/07/56/1042110756.db2.gz ONIQZCYTWKHSDR-BLLLJJGKSA-N 2 1 310.844 4.004 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161560800 1042110760 /nfs/dbraw/zinc/11/07/60/1042110760.db2.gz ONIQZCYTWKHSDR-BLLLJJGKSA-N 2 1 310.844 4.004 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000161591481 1042112215 /nfs/dbraw/zinc/11/22/15/1042112215.db2.gz ZTIOFHKSJHKNNI-QGZVFWFLSA-N 2 1 322.880 4.018 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccccc1SC(C)(C)C ZINC000817970675 1042134487 /nfs/dbraw/zinc/13/44/87/1042134487.db2.gz BULFUBAPUJSKLO-RBSFLKMASA-N 2 1 306.519 4.368 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc(Cl)c2)c1 ZINC000065976610 1042139017 /nfs/dbraw/zinc/13/90/17/1042139017.db2.gz IRWMGPXNKWWABF-UHFFFAOYSA-N 2 1 316.876 4.470 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000663467862 1042179012 /nfs/dbraw/zinc/17/90/12/1042179012.db2.gz IIWHWGPSNWGEEJ-GIVPXCGWSA-N 2 1 312.501 4.034 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470288 1042181864 /nfs/dbraw/zinc/18/18/64/1042181864.db2.gz UJXUCLOGTWPNEF-DOTOQJQBSA-N 2 1 312.457 4.205 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470288 1042181868 /nfs/dbraw/zinc/18/18/68/1042181868.db2.gz UJXUCLOGTWPNEF-DOTOQJQBSA-N 2 1 312.457 4.205 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c(C)s1 ZINC000663472130 1042183549 /nfs/dbraw/zinc/18/35/49/1042183549.db2.gz YYRRWJBUTMIERC-PBHICJAKSA-N 2 1 306.519 4.138 20 0 DIADMP CCC(CC)(C[NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)cc1 ZINC000663480308 1042193661 /nfs/dbraw/zinc/19/36/61/1042193661.db2.gz YXTAGHJUTBJXJI-UHFFFAOYSA-N 2 1 318.480 4.100 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001167824734 1042212297 /nfs/dbraw/zinc/21/22/97/1042212297.db2.gz GBSXBHCYIZGOPV-QFBILLFUSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001167825813 1042214164 /nfs/dbraw/zinc/21/41/64/1042214164.db2.gz KUWLLUMRIJJBAP-DLBZAZTESA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC001167826955 1042216837 /nfs/dbraw/zinc/21/68/37/1042216837.db2.gz SIIFVQCZQZRGLV-QGZVFWFLSA-N 2 1 313.489 4.177 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001167833624 1042236509 /nfs/dbraw/zinc/23/65/09/1042236509.db2.gz CXJGRXBOEZXPSW-PKOBYXMFSA-N 2 1 303.494 4.037 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC000432789400 1042245497 /nfs/dbraw/zinc/24/54/97/1042245497.db2.gz RTRXHPJJFYUHBX-NRFANRHFSA-N 2 1 308.469 4.270 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@@H](C)Cc1ccccc1OC ZINC001167840366 1042253084 /nfs/dbraw/zinc/25/30/84/1042253084.db2.gz FQPXWJWUBNFJOZ-MSOLQXFVSA-N 2 1 320.521 4.069 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@@H]3CCc4[nH+]ccn4C3)oc2cc1C ZINC000278971430 1042255194 /nfs/dbraw/zinc/25/51/94/1042255194.db2.gz NPDYIXULVQNENR-HOTGVXAUSA-N 2 1 323.440 4.159 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@H]34)cc2)cc1 ZINC000319790211 1042260651 /nfs/dbraw/zinc/26/06/51/1042260651.db2.gz HWZSPVVOBGDYPN-NHCUHLMSSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@H]34)cc2)cc1 ZINC000319790211 1042260659 /nfs/dbraw/zinc/26/06/59/1042260659.db2.gz HWZSPVVOBGDYPN-NHCUHLMSSA-N 2 1 306.453 4.070 20 0 DIADMP c1csc([C@@H]([NH2+]C[C@H]2CCc3[nH+]ccn3C2)C2CCCC2)c1 ZINC000279035139 1042262871 /nfs/dbraw/zinc/26/28/71/1042262871.db2.gz WPCAKVYNFLMGGT-KDOFPFPSSA-N 2 1 315.486 4.028 20 0 DIADMP Cc1ccc(C)c([C@@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)c1 ZINC000324629217 1042270328 /nfs/dbraw/zinc/27/03/28/1042270328.db2.gz UDYBFRRTXDLYPY-UGKGYDQZSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1ccc(C)c([C@@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)c2ccccc2)c1 ZINC000324629217 1042270329 /nfs/dbraw/zinc/27/03/29/1042270329.db2.gz UDYBFRRTXDLYPY-UGKGYDQZSA-N 2 1 322.496 4.324 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482863 1042374852 /nfs/dbraw/zinc/37/48/52/1042374852.db2.gz RGOHZNOUUMCSGV-WWMYMODYSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482863 1042374856 /nfs/dbraw/zinc/37/48/56/1042374856.db2.gz RGOHZNOUUMCSGV-WWMYMODYSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482862 1042375226 /nfs/dbraw/zinc/37/52/26/1042375226.db2.gz RGOHZNOUUMCSGV-LLGFUMIMSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482862 1042375230 /nfs/dbraw/zinc/37/52/30/1042375230.db2.gz RGOHZNOUUMCSGV-LLGFUMIMSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2CCC(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000647252553 1042405785 /nfs/dbraw/zinc/40/57/85/1042405785.db2.gz JWCKPVHJFPTVEH-CLPROHDKSA-N 2 1 318.480 4.157 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2CCC(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000647252553 1042405787 /nfs/dbraw/zinc/40/57/87/1042405787.db2.gz JWCKPVHJFPTVEH-CLPROHDKSA-N 2 1 318.480 4.157 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@@H]34)c2)cc1 ZINC000614328412 1042466817 /nfs/dbraw/zinc/46/68/17/1042466817.db2.gz BUMTXLOOSOZDRT-RTWAWAEBSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@@H]34)c2)cc1 ZINC000614328412 1042466819 /nfs/dbraw/zinc/46/68/19/1042466819.db2.gz BUMTXLOOSOZDRT-RTWAWAEBSA-N 2 1 306.453 4.070 20 0 DIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2csc(CCC)n2)CC1 ZINC000052209315 1042484330 /nfs/dbraw/zinc/48/43/30/1042484330.db2.gz CUDCYZVPCSSKPM-UHFFFAOYSA-N 2 1 323.550 4.040 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2csc(CCC)n2)CC1 ZINC000052209315 1042484334 /nfs/dbraw/zinc/48/43/34/1042484334.db2.gz CUDCYZVPCSSKPM-UHFFFAOYSA-N 2 1 323.550 4.040 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204727597 1042505904 /nfs/dbraw/zinc/50/59/04/1042505904.db2.gz FAFTUNBCTZLIIP-GOSISDBHSA-N 2 1 324.553 4.074 20 0 DIADMP Clc1cc(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c(Cl)s1 ZINC001204734945 1042529363 /nfs/dbraw/zinc/52/93/63/1042529363.db2.gz GNOBNFAQLJWXTN-UHFFFAOYSA-N 2 1 319.301 4.021 20 0 DIADMP Clc1cc(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)c(Cl)s1 ZINC001204734945 1042529367 /nfs/dbraw/zinc/52/93/67/1042529367.db2.gz GNOBNFAQLJWXTN-UHFFFAOYSA-N 2 1 319.301 4.021 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CC2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000513349388 1042534697 /nfs/dbraw/zinc/53/46/97/1042534697.db2.gz YBTLYKBKSSLTFR-AHRSYUTCSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CC2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000513349388 1042534701 /nfs/dbraw/zinc/53/47/01/1042534701.db2.gz YBTLYKBKSSLTFR-AHRSYUTCSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccsc2)C[N@H+]1Cc1ccccc1 ZINC000513514269 1042549459 /nfs/dbraw/zinc/54/94/59/1042549459.db2.gz WUTMNPNKZBQONO-SJLPKXTDSA-N 2 1 314.498 4.138 20 0 DIADMP C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000420306988 1042599311 /nfs/dbraw/zinc/59/93/11/1042599311.db2.gz LMWMZTPUQYXKIK-LBPRGKRZSA-N 2 1 313.272 4.130 20 0 DIADMP C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000420306984 1042599393 /nfs/dbraw/zinc/59/93/93/1042599393.db2.gz LMWMZTPUQYXKIK-GFCCVEGCSA-N 2 1 313.272 4.130 20 0 DIADMP Cc1cc(C)cc(-c2ccc(C[NH2+]C3CC[NH+](C)CC3)cc2)c1 ZINC000237168837 1042626304 /nfs/dbraw/zinc/62/63/04/1042626304.db2.gz ULNNCIKKNWZDGY-UHFFFAOYSA-N 2 1 308.469 4.154 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H](CC(F)F)c2ccccc2)CC1 ZINC000421377615 1042634363 /nfs/dbraw/zinc/63/43/63/1042634363.db2.gz UBVRMDKTTPVNNL-INIZCTEOSA-N 2 1 310.432 4.235 20 0 DIADMP c1ccc(C[NH+]2CCC3(CCC[N@H+]([C@@H]4C[C@H]5C[C@H]5C4)C3)CC2)cc1 ZINC001167949123 1042682904 /nfs/dbraw/zinc/68/29/04/1042682904.db2.gz SSTCYYNAURHWTI-WKCHPHFGSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC3(CCC[N@H+]([C@H]4C[C@H]5C[C@H]5C4)C3)CC2)cc1 ZINC001167949122 1042682981 /nfs/dbraw/zinc/68/29/81/1042682981.db2.gz SSTCYYNAURHWTI-AERCQKQUSA-N 2 1 324.512 4.163 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)cc2)C2CCC2)c2ccccc21 ZINC000422716792 1042689110 /nfs/dbraw/zinc/68/91/10/1042689110.db2.gz NXAWRKCXHCVQNM-AABGKKOBSA-N 2 1 310.416 4.401 20 0 DIADMP CC(C)c1ccc([C@@H]([NH2+][C@@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000422788743 1042690690 /nfs/dbraw/zinc/69/06/90/1042690690.db2.gz RINUPLNYWBDUIC-IFXJQAMLSA-N 2 1 314.498 4.158 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(N2CCCC2)c1 ZINC000422876507 1042691741 /nfs/dbraw/zinc/69/17/41/1042691741.db2.gz QFMBJPYWELYTHX-RVHYNSKXSA-N 2 1 321.468 4.082 20 0 DIADMP CCCCOc1cccc(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000422886978 1042692278 /nfs/dbraw/zinc/69/22/78/1042692278.db2.gz AHFIUFRDJVJOBG-PMACEKPBSA-N 2 1 310.441 4.100 20 0 DIADMP Cc1cc([C@H]([NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C2CC2)ccc1F ZINC000423018029 1042695518 /nfs/dbraw/zinc/69/55/18/1042695518.db2.gz XXZVGGNSDLLDNX-SLFFLAALSA-N 2 1 310.416 4.320 20 0 DIADMP Cc1cccc(C)c1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000423040367 1042695938 /nfs/dbraw/zinc/69/59/38/1042695938.db2.gz UANVYENSFTWFCR-DFQSSKMNSA-N 2 1 308.469 4.447 20 0 DIADMP Clc1ccc([C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423212698 1042699549 /nfs/dbraw/zinc/69/95/49/1042699549.db2.gz MAUXMFMXPVSZCF-KXBFYZLASA-N 2 1 314.860 4.019 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)c2ccccc21 ZINC000423167858 1042699647 /nfs/dbraw/zinc/69/96/47/1042699647.db2.gz FWDGRIVKIXAHST-BASLNEPJSA-N 2 1 316.807 4.069 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc21 ZINC000423190888 1042700753 /nfs/dbraw/zinc/70/07/53/1042700753.db2.gz RYVMNBWCUHFTKC-SFTDATJTSA-N 2 1 323.484 4.036 20 0 DIADMP CCC([NH3+])(CC)C[NH2+][C@H](C)c1sc(-c2ccccc2)nc1C ZINC000423282601 1042703659 /nfs/dbraw/zinc/70/36/59/1042703659.db2.gz CVLMVIVSOMZTHT-CYBMUJFWSA-N 2 1 317.502 4.287 20 0 DIADMP [NH3+][C@H](C[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1)C1CC1 ZINC000423313559 1042705211 /nfs/dbraw/zinc/70/52/11/1042705211.db2.gz FVXOEUSJAWCSRA-IAGOWNOFSA-N 2 1 320.889 4.012 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cs1 ZINC000423295623 1042706307 /nfs/dbraw/zinc/70/63/07/1042706307.db2.gz XAUSBZYYVSNPTC-OLZOCXBDSA-N 2 1 303.475 4.137 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000423395367 1042710256 /nfs/dbraw/zinc/71/02/56/1042710256.db2.gz SPPHMRSWYSXWJH-ZHALLVOQSA-N 2 1 324.468 4.057 20 0 DIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000423451014 1042712297 /nfs/dbraw/zinc/71/22/97/1042712297.db2.gz UIGLCWZQNYGACI-DCAQKATOSA-N 2 1 323.893 4.158 20 0 DIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@H](Cc1ccccc1Cl)c1cccs1 ZINC000423465037 1042714213 /nfs/dbraw/zinc/71/42/13/1042714213.db2.gz MJJRTCMVGKFEKT-SLEUVZQESA-N 2 1 308.878 4.011 20 0 DIADMP CS[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C(C)(C)C ZINC000517187494 1042871692 /nfs/dbraw/zinc/87/16/92/1042871692.db2.gz KJHLQDYKAVGZGW-OKZBNKHCSA-N 2 1 320.546 4.189 20 0 DIADMP CS[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C(C)(C)C ZINC000517187494 1042871697 /nfs/dbraw/zinc/87/16/97/1042871697.db2.gz KJHLQDYKAVGZGW-OKZBNKHCSA-N 2 1 320.546 4.189 20 0 DIADMP Cc1ccc(C[N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)nc1 ZINC000664656729 1042872489 /nfs/dbraw/zinc/87/24/89/1042872489.db2.gz DKJOAXOBOINUBN-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CCCSc2ccc(Cl)cc21)C[NH+](C)C ZINC000425926365 1042875509 /nfs/dbraw/zinc/87/55/09/1042875509.db2.gz RYMAFPWZDSUWQT-WFASDCNBSA-N 2 1 312.910 4.054 20 0 DIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1nccc2ccccc21 ZINC000517441816 1042879952 /nfs/dbraw/zinc/87/99/52/1042879952.db2.gz GLOMLKKXNDZLMQ-DLBZAZTESA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc4ccccc4c3)C2)CC1 ZINC000517782391 1042897725 /nfs/dbraw/zinc/89/77/25/1042897725.db2.gz JRZAFXQSAWBJQB-OAQYLSRUSA-N 2 1 308.469 4.004 20 0 DIADMP Cc1ccc(C(C)(C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167965452 1042930359 /nfs/dbraw/zinc/93/03/59/1042930359.db2.gz GHTLAVODAZCORU-IHWFROFDSA-N 2 1 312.501 4.225 20 0 DIADMP CCCc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167965657 1042932200 /nfs/dbraw/zinc/93/22/00/1042932200.db2.gz JLIWKTFXWKEEFE-SEJPIABJSA-N 2 1 312.501 4.134 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c1 ZINC000262004477 1042932369 /nfs/dbraw/zinc/93/23/69/1042932369.db2.gz QZJRGLXPGRWOII-BEFAXECRSA-N 2 1 312.457 4.145 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC(C)(C)C1 ZINC001167967602 1042953944 /nfs/dbraw/zinc/95/39/44/1042953944.db2.gz IKLVASCBNYFUAU-VAYAGCRFSA-N 2 1 304.522 4.196 20 0 DIADMP Cc1ccc(F)cc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167974257 1042967147 /nfs/dbraw/zinc/96/71/47/1042967147.db2.gz SQDVGWASTSAEKS-AQXGTKIOSA-N 2 1 316.464 4.190 20 0 DIADMP c1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167975866 1042972116 /nfs/dbraw/zinc/97/21/16/1042972116.db2.gz XUMVYALPQFOOKE-SEJPIABJSA-N 2 1 324.512 4.004 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167977517 1042973291 /nfs/dbraw/zinc/97/32/91/1042973291.db2.gz DADZVRWQSHVSON-GLHNNUHNSA-N 2 1 324.512 4.318 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000188068959 1043011023 /nfs/dbraw/zinc/01/10/23/1043011023.db2.gz WRKOASFQBXPENY-UXHICEINSA-N 2 1 311.473 4.072 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000520205078 1043024491 /nfs/dbraw/zinc/02/44/91/1043024491.db2.gz SFEXUOPNSWPQFK-LQTQSQFVSA-N 2 1 314.517 4.438 20 0 DIADMP CC(C)[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)cc1F ZINC000541917376 1043052758 /nfs/dbraw/zinc/05/27/58/1043052758.db2.gz LWVWCTNJJLQWCC-KRWDZBQOSA-N 2 1 310.844 4.028 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167993948 1043064817 /nfs/dbraw/zinc/06/48/17/1043064817.db2.gz UFLGYXUUZZLUJY-WCRBZPEASA-N 2 1 312.501 4.304 20 0 DIADMP CCC[NH+](Cc1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167993948 1043064828 /nfs/dbraw/zinc/06/48/28/1043064828.db2.gz UFLGYXUUZZLUJY-WCRBZPEASA-N 2 1 312.501 4.304 20 0 DIADMP CCC[NH+](Cc1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167993948 1043064837 /nfs/dbraw/zinc/06/48/37/1043064837.db2.gz UFLGYXUUZZLUJY-WCRBZPEASA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995083 1043066631 /nfs/dbraw/zinc/06/66/31/1043066631.db2.gz VLUGDJONAHGMDO-JGUMPVPUSA-N 2 1 312.501 4.475 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC(N1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001167994653 1043069111 /nfs/dbraw/zinc/06/91/11/1043069111.db2.gz IZEZTRSPNUNICN-QDSUGMFFSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001167994653 1043069125 /nfs/dbraw/zinc/06/91/25/1043069125.db2.gz IZEZTRSPNUNICN-QDSUGMFFSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001167994653 1043069136 /nfs/dbraw/zinc/06/91/36/1043069136.db2.gz IZEZTRSPNUNICN-QDSUGMFFSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@@H+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001167994653 1043069146 /nfs/dbraw/zinc/06/91/46/1043069146.db2.gz IZEZTRSPNUNICN-QDSUGMFFSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@H+]1CCC[C@H]3CCCC[C@@H]31)C2 ZINC001167994653 1043069153 /nfs/dbraw/zinc/06/91/53/1043069153.db2.gz IZEZTRSPNUNICN-QDSUGMFFSA-N 2 1 302.506 4.046 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000188775746 1043125146 /nfs/dbraw/zinc/12/51/46/1043125146.db2.gz KYQCWSWDRIDGHB-CYBMUJFWSA-N 2 1 314.395 4.229 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000178699416 1043136945 /nfs/dbraw/zinc/13/69/45/1043136945.db2.gz AFPJBXIFWIDWNI-XUJVJEKNSA-N 2 1 321.515 4.104 20 0 DIADMP CCCOc1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000178787416 1043137556 /nfs/dbraw/zinc/13/75/56/1043137556.db2.gz KYDZSOISEJRCCJ-MRXNPFEDSA-N 2 1 315.461 4.111 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)nc2)c1 ZINC000179121344 1043141250 /nfs/dbraw/zinc/14/12/50/1043141250.db2.gz FZPQCNHTFCFNNS-AWEZNQCLSA-N 2 1 317.864 4.038 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccccn2)C(C)C)c1 ZINC000866260615 1043167171 /nfs/dbraw/zinc/16/71/71/1043167171.db2.gz VVYAEXCCZBVJNT-HXUWFJFHSA-N 2 1 311.473 4.020 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc2c(ccnc2Cl)o1 ZINC000866370356 1043191870 /nfs/dbraw/zinc/19/18/70/1043191870.db2.gz VFWRFOOCRVJAHR-GFCCVEGCSA-N 2 1 321.852 4.006 20 0 DIADMP Clc1ccc2c(c1)CN(C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)C2 ZINC001168004775 1043235924 /nfs/dbraw/zinc/23/59/24/1043235924.db2.gz YVPYWTHDMTUFQN-DFNIBXOVSA-N 2 1 316.876 4.061 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccncc1 ZINC001168004993 1043238956 /nfs/dbraw/zinc/23/89/56/1043238956.db2.gz DCHHUIQRDDTLED-BMQTXXJKSA-N 2 1 323.484 4.174 20 0 DIADMP C[C@@H]1CC([NH2+]Cc2ccsc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168005111 1043243512 /nfs/dbraw/zinc/24/35/12/1043243512.db2.gz FZIJRRMCJBBSDD-HZPDHXFCSA-N 2 1 314.498 4.279 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+]CC(c1ccccc1)c1ccccc1)C2 ZINC000192605272 1043272062 /nfs/dbraw/zinc/27/20/62/1043272062.db2.gz KQTAGXMJSXDBAA-SEJPIABJSA-N 2 1 320.480 4.033 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCNc3ccccc32)c1 ZINC000192827906 1043275246 /nfs/dbraw/zinc/27/52/46/1043275246.db2.gz BDCBRBSRWIESAA-OAQYLSRUSA-N 2 1 323.484 4.175 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012444 1043338835 /nfs/dbraw/zinc/33/88/35/1043338835.db2.gz AGJMTUUFTDWNAY-GNBUJSLZSA-N 2 1 302.506 4.452 20 0 DIADMP C[C@@H]([NH2+]C1CCN(C2CCC2)CC1)c1ccc(F)c(Cl)c1 ZINC000269023737 1043351301 /nfs/dbraw/zinc/35/13/01/1043351301.db2.gz QCTVNEUIENGNIG-GFCCVEGCSA-N 2 1 310.844 4.147 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(F)c(Cl)c1 ZINC000269023737 1043351312 /nfs/dbraw/zinc/35/13/12/1043351312.db2.gz QCTVNEUIENGNIG-GFCCVEGCSA-N 2 1 310.844 4.147 20 0 DIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2csc(C)n2)c1 ZINC000269440645 1043365795 /nfs/dbraw/zinc/36/57/95/1043365795.db2.gz SNVDIZWVNISHCS-AWEZNQCLSA-N 2 1 317.502 4.144 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cccc(-c3cccnc3)c2)CC1 ZINC000271039884 1043399103 /nfs/dbraw/zinc/39/91/03/1043399103.db2.gz LXZQXFAXFOUOAN-UHFFFAOYSA-N 2 1 323.484 4.053 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000271331966 1043412653 /nfs/dbraw/zinc/41/26/53/1043412653.db2.gz CMJFCKXDWBVIGP-HBFSDRIKSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000271331966 1043412661 /nfs/dbraw/zinc/41/26/61/1043412661.db2.gz CMJFCKXDWBVIGP-HBFSDRIKSA-N 2 1 323.484 4.094 20 0 DIADMP C[C@@H](CC[NH2+]C1CCC(C(F)F)CC1)[N@@H+](C)Cc1ccccc1 ZINC000442760906 1043413036 /nfs/dbraw/zinc/41/30/36/1043413036.db2.gz AUNIUZHHZPVSRA-ZLPCBKJTSA-N 2 1 324.459 4.311 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2cnccc2C)CC1 ZINC000271403242 1043414993 /nfs/dbraw/zinc/41/49/93/1043414993.db2.gz LULIWPTXMCGPLK-GOSISDBHSA-N 2 1 323.484 4.014 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2S1 ZINC000872025954 1043424046 /nfs/dbraw/zinc/42/40/46/1043424046.db2.gz WEIQMXLUHISIKP-UXLLHSPISA-N 2 1 316.514 4.219 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)Sc3ccccc32)CC[N@@H+]1C ZINC000872040701 1043431429 /nfs/dbraw/zinc/43/14/29/1043431429.db2.gz ZSWYNCLTJVBRQC-YCPHGPKFSA-N 2 1 304.503 4.074 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)Sc3ccccc32)CC[N@H+]1C ZINC000872040701 1043431438 /nfs/dbraw/zinc/43/14/38/1043431438.db2.gz ZSWYNCLTJVBRQC-YCPHGPKFSA-N 2 1 304.503 4.074 20 0 DIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000872052200 1043435807 /nfs/dbraw/zinc/43/58/07/1043435807.db2.gz MGCWXPWOHZFVHA-GJZGRUSLSA-N 2 1 308.432 4.065 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000442859426 1043436557 /nfs/dbraw/zinc/43/65/57/1043436557.db2.gz VJERRVKSVUACHO-SMDDNHRTSA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000442859426 1043436560 /nfs/dbraw/zinc/43/65/60/1043436560.db2.gz VJERRVKSVUACHO-SMDDNHRTSA-N 2 1 322.905 4.435 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000442875681 1043442818 /nfs/dbraw/zinc/44/28/18/1043442818.db2.gz UFQVZINBJAMIAS-IRXDYDNUSA-N 2 1 320.546 4.427 20 0 DIADMP CC[C@H](CCC(F)(F)F)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000872060445 1043443495 /nfs/dbraw/zinc/44/34/95/1043443495.db2.gz QBAUAASKJUTJEU-SOUVJXGZSA-N 2 1 320.443 4.350 20 0 DIADMP CCC1([NH3+])CC[NH+]([C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000925755026 1043464492 /nfs/dbraw/zinc/46/44/92/1043464492.db2.gz BBJCEJHWEOPMJE-CQSZACIVSA-N 2 1 310.894 4.080 20 0 DIADMP CCC1([NH3+])CC[NH+]([C@H]2CCSc3c(Cl)cccc32)CC1 ZINC000925756367 1043465291 /nfs/dbraw/zinc/46/52/91/1043465291.db2.gz LDQIVBJZSYEHAX-AWEZNQCLSA-N 2 1 310.894 4.080 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(SC)cc1 ZINC000349197102 1043496785 /nfs/dbraw/zinc/49/67/85/1043496785.db2.gz VPHDNTIWBFDORM-UHFFFAOYSA-N 2 1 317.502 4.080 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(SC)cc1 ZINC000349197102 1043496794 /nfs/dbraw/zinc/49/67/94/1043496794.db2.gz VPHDNTIWBFDORM-UHFFFAOYSA-N 2 1 317.502 4.080 20 0 DIADMP CC(C)C[C@H](C[NH2+]C[C@@H]1CC[N@H+](C(C)C)C1)c1ccccc1 ZINC000558419430 1043505848 /nfs/dbraw/zinc/50/58/48/1043505848.db2.gz WNGFWBSGQKOWMW-AZUAARDMSA-N 2 1 302.506 4.136 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H](C)Cc1ccccc1 ZINC000558420327 1043506297 /nfs/dbraw/zinc/50/62/97/1043506297.db2.gz OUYYIPDBGKSTPC-SFHVURJKSA-N 2 1 313.489 4.036 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H](C)Cc1ccccc1 ZINC000558420327 1043506308 /nfs/dbraw/zinc/50/63/08/1043506308.db2.gz OUYYIPDBGKSTPC-SFHVURJKSA-N 2 1 313.489 4.036 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)c1nccc2ccccc21)[NH+]1CCCCC1 ZINC000558506366 1043524019 /nfs/dbraw/zinc/52/40/19/1043524019.db2.gz ZIGYWOYIHJNAAG-IRXDYDNUSA-N 2 1 311.473 4.150 20 0 DIADMP CC1(C)CCC[C@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000388892265 1043530104 /nfs/dbraw/zinc/53/01/04/1043530104.db2.gz LHMIFBVZGHCVFQ-SFHVURJKSA-N 2 1 300.490 4.067 20 0 DIADMP CCCCc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000314643674 1043558843 /nfs/dbraw/zinc/55/88/43/1043558843.db2.gz FNVCZVAXXRLBLW-FUHWJXTLSA-N 2 1 300.490 4.164 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000718338014 1043563399 /nfs/dbraw/zinc/56/33/99/1043563399.db2.gz LFAPYFSPDWRGKS-QGZVFWFLSA-N 2 1 324.459 4.312 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000718338014 1043563414 /nfs/dbraw/zinc/56/34/14/1043563414.db2.gz LFAPYFSPDWRGKS-QGZVFWFLSA-N 2 1 324.459 4.312 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCC23CCCC3)CC1 ZINC000474065610 1043566152 /nfs/dbraw/zinc/56/61/52/1043566152.db2.gz KDLLNUGSLOOBHL-FQEVSTJZSA-N 2 1 312.501 4.272 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1csc(C(F)(F)F)c1 ZINC000926541130 1043596604 /nfs/dbraw/zinc/59/66/04/1043596604.db2.gz KYKCLBFSQYGJKV-NSNUZPRRSA-N 2 1 318.408 4.043 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1csc(C(F)(F)F)c1 ZINC000926541130 1043596596 /nfs/dbraw/zinc/59/65/96/1043596596.db2.gz KYKCLBFSQYGJKV-NSNUZPRRSA-N 2 1 318.408 4.043 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2cccc(F)c2o1 ZINC000474101610 1043610231 /nfs/dbraw/zinc/61/02/31/1043610231.db2.gz WEIJFJMUPIRSSA-CYBMUJFWSA-N 2 1 318.436 4.485 20 0 DIADMP CC(C)[C@H](C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000474104649 1043610278 /nfs/dbraw/zinc/61/02/78/1043610278.db2.gz ICLJSIXSFPCQBM-FQEVSTJZSA-N 2 1 302.506 4.231 20 0 DIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000443613021 1043618398 /nfs/dbraw/zinc/61/83/98/1043618398.db2.gz CEPNNUXEQWWARV-HOTGVXAUSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000443613021 1043618407 /nfs/dbraw/zinc/61/84/07/1043618407.db2.gz CEPNNUXEQWWARV-HOTGVXAUSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCCC(F)(F)F)C1 ZINC000443613021 1043618414 /nfs/dbraw/zinc/61/84/14/1043618414.db2.gz CEPNNUXEQWWARV-HOTGVXAUSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000443613021 1043618424 /nfs/dbraw/zinc/61/84/24/1043618424.db2.gz CEPNNUXEQWWARV-HOTGVXAUSA-N 2 1 320.443 4.305 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C)c1cccc(F)c1 ZINC000191471390 1043643917 /nfs/dbraw/zinc/64/39/17/1043643917.db2.gz TUCUVMZQGQJXTO-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)c1cccc(F)c1 ZINC000191471390 1043643921 /nfs/dbraw/zinc/64/39/21/1043643921.db2.gz TUCUVMZQGQJXTO-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)c1cccc(F)c1 ZINC000191471390 1043643926 /nfs/dbraw/zinc/64/39/26/1043643926.db2.gz TUCUVMZQGQJXTO-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000191471368 1043644733 /nfs/dbraw/zinc/64/47/33/1043644733.db2.gz TUCUVMZQGQJXTO-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000191471368 1043644740 /nfs/dbraw/zinc/64/47/40/1043644740.db2.gz TUCUVMZQGQJXTO-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000191471368 1043644749 /nfs/dbraw/zinc/64/47/49/1043644749.db2.gz TUCUVMZQGQJXTO-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)c1ccc(F)cc1F ZINC000191505125 1043651464 /nfs/dbraw/zinc/65/14/64/1043651464.db2.gz NGBSPQUDVOJRGS-CQSZACIVSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)c1ccc(F)cc1F ZINC000191505125 1043651471 /nfs/dbraw/zinc/65/14/71/1043651471.db2.gz NGBSPQUDVOJRGS-CQSZACIVSA-N 2 1 321.415 4.197 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876917750 1043724462 /nfs/dbraw/zinc/72/44/62/1043724462.db2.gz VMWJRVUNAUBNHI-BLIXFSHQSA-N 2 1 324.468 4.168 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876917750 1043724476 /nfs/dbraw/zinc/72/44/76/1043724476.db2.gz VMWJRVUNAUBNHI-BLIXFSHQSA-N 2 1 324.468 4.168 20 0 DIADMP CSCC[C@H](C)[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877056554 1043740765 /nfs/dbraw/zinc/74/07/65/1043740765.db2.gz VITGLXOHELSARE-KVSKMBFKSA-N 2 1 318.530 4.086 20 0 DIADMP CSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877056554 1043740779 /nfs/dbraw/zinc/74/07/79/1043740779.db2.gz VITGLXOHELSARE-KVSKMBFKSA-N 2 1 318.530 4.086 20 0 DIADMP CCCCN(C)c1ccc(N[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000777683705 1043740847 /nfs/dbraw/zinc/74/08/47/1043740847.db2.gz GSAXHXLJFLHJIH-QFBILLFUSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@H+](C)c1ccc(N[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000777683705 1043740859 /nfs/dbraw/zinc/74/08/59/1043740859.db2.gz GSAXHXLJFLHJIH-QFBILLFUSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@@H+](C)c1ccc(N[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000777683705 1043740876 /nfs/dbraw/zinc/74/08/76/1043740876.db2.gz GSAXHXLJFLHJIH-QFBILLFUSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000777683705 1043740882 /nfs/dbraw/zinc/74/08/82/1043740882.db2.gz GSAXHXLJFLHJIH-QFBILLFUSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000777683705 1043740893 /nfs/dbraw/zinc/74/08/93/1043740893.db2.gz GSAXHXLJFLHJIH-QFBILLFUSA-N 2 1 303.494 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2(CC3CC3)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168033482 1043751434 /nfs/dbraw/zinc/75/14/34/1043751434.db2.gz LFSRPGJRZZDWGD-XEMDLRDOSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CCC1 ZINC001168033882 1043762213 /nfs/dbraw/zinc/76/22/13/1043762213.db2.gz MWLJIBPEKAWGSY-AXVVYFOYSA-N 2 1 300.490 4.206 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000237335894 1043762305 /nfs/dbraw/zinc/76/23/05/1043762305.db2.gz RSLRLNXOHCRYHP-IBGZPJMESA-N 2 1 322.496 4.353 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474480130 1043797175 /nfs/dbraw/zinc/79/71/75/1043797175.db2.gz YXPZHGMCYSRGRO-AIEDFZFUSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039246 1043853052 /nfs/dbraw/zinc/85/30/52/1043853052.db2.gz CMUPLSWZGFPHCP-GCLMUHHRSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039246 1043853064 /nfs/dbraw/zinc/85/30/64/1043853064.db2.gz CMUPLSWZGFPHCP-GCLMUHHRSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@H]1C[C@@H](CF)[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039246 1043853084 /nfs/dbraw/zinc/85/30/84/1043853084.db2.gz CMUPLSWZGFPHCP-GCLMUHHRSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@H]1C[C@@H](CF)[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039246 1043853105 /nfs/dbraw/zinc/85/31/05/1043853105.db2.gz CMUPLSWZGFPHCP-GCLMUHHRSA-N 2 1 318.480 4.108 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cnccc2C)cc1 ZINC000356700867 1043862329 /nfs/dbraw/zinc/86/23/29/1043862329.db2.gz ROCPMVWOBKGOSH-CVEARBPZSA-N 2 1 320.440 4.296 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2nccc3ccccc32)C1 ZINC000289704557 1043865457 /nfs/dbraw/zinc/86/54/57/1043865457.db2.gz KNZYLGBXLZJQJN-IAGOWNOFSA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2nccc3ccccc32)C1 ZINC000289704557 1043865477 /nfs/dbraw/zinc/86/54/77/1043865477.db2.gz KNZYLGBXLZJQJN-IAGOWNOFSA-N 2 1 311.473 4.006 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCC[C@@H]3C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039979 1043870284 /nfs/dbraw/zinc/87/02/84/1043870284.db2.gz JFHZLRYVYSINBX-UJZAFDIWSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2C[C@@H]3CCC[C@@H]3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039979 1043870304 /nfs/dbraw/zinc/87/03/04/1043870304.db2.gz JFHZLRYVYSINBX-UJZAFDIWSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3CCC[C@@H]3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039979 1043870320 /nfs/dbraw/zinc/87/03/20/1043870320.db2.gz JFHZLRYVYSINBX-UJZAFDIWSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1C[C@@H](N2CCCC[C@@H](F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168040046 1043872606 /nfs/dbraw/zinc/87/26/06/1043872606.db2.gz JZSQVEFUWNRDTE-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@H](F)C2)C[C@H](C)N1Cc1ccccc1 ZINC001168040046 1043872618 /nfs/dbraw/zinc/87/26/18/1043872618.db2.gz JZSQVEFUWNRDTE-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H](F)C2)C[C@H](C)N1Cc1ccccc1 ZINC001168040046 1043872634 /nfs/dbraw/zinc/87/26/34/1043872634.db2.gz JZSQVEFUWNRDTE-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@H](F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168040046 1043872653 /nfs/dbraw/zinc/87/26/53/1043872653.db2.gz JZSQVEFUWNRDTE-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@H](F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168040046 1043872674 /nfs/dbraw/zinc/87/26/74/1043872674.db2.gz JZSQVEFUWNRDTE-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@H](F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040046 1043872692 /nfs/dbraw/zinc/87/26/92/1043872692.db2.gz JZSQVEFUWNRDTE-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H](F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040046 1043872707 /nfs/dbraw/zinc/87/27/07/1043872707.db2.gz JZSQVEFUWNRDTE-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C2CCC2)C[C@@H]1c1ccccc1 ZINC000453303784 1043882027 /nfs/dbraw/zinc/88/20/27/1043882027.db2.gz DCPVEWIVGMRMBV-RTBURBONSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C2CCC2)C[C@@H]1c1ccccc1 ZINC000453303784 1043882041 /nfs/dbraw/zinc/88/20/41/1043882041.db2.gz DCPVEWIVGMRMBV-RTBURBONSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC[C@@H]2CCCC2(F)F)CC1 ZINC000878523165 1043899342 /nfs/dbraw/zinc/89/93/42/1043899342.db2.gz ZBHCTRHABLSBJH-HNNXBMFYSA-N 2 1 324.415 4.059 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCSc2c(Cl)cccc21)C1CC1 ZINC000453405888 1043912568 /nfs/dbraw/zinc/91/25/68/1043912568.db2.gz QRDUBDCEWIAULV-MRXNPFEDSA-N 2 1 324.921 4.341 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000443855002 1044040913 /nfs/dbraw/zinc/04/09/13/1044040913.db2.gz OZUCROAYMGLHML-PNYFIKQUSA-N 2 1 304.522 4.221 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCC(F)(F)C2)cc1 ZINC000358287155 1044048118 /nfs/dbraw/zinc/04/81/18/1044048118.db2.gz AKLNLWSLSWLSPO-CJNGLKHVSA-N 2 1 319.399 4.409 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000358337939 1044057200 /nfs/dbraw/zinc/05/72/00/1044057200.db2.gz GEONCZFQVCBFAC-NVXWUHKLSA-N 2 1 306.519 4.083 20 0 DIADMP C[C@H]1CC([NH+]2CCC3(CC3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168048314 1044080888 /nfs/dbraw/zinc/08/08/88/1044080888.db2.gz VHRPZACOQBZOSW-ROUUACIJSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000798934238 1044087029 /nfs/dbraw/zinc/08/70/29/1044087029.db2.gz CMEOUGMQRDYWBY-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1nccn1CC[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000346320781 1044091956 /nfs/dbraw/zinc/09/19/56/1044091956.db2.gz ZNKMXISKWIPIRR-UHFFFAOYSA-N 2 1 323.415 4.033 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1 ZINC000346320781 1044091984 /nfs/dbraw/zinc/09/19/84/1044091984.db2.gz ZNKMXISKWIPIRR-UHFFFAOYSA-N 2 1 323.415 4.033 20 0 DIADMP C[C@@H](C[N@H+]1CCCC2(CC[NH+](C)CC2)C1)c1cccc(Cl)c1 ZINC000798956757 1044154150 /nfs/dbraw/zinc/15/41/50/1044154150.db2.gz NESDYWKQPJNXHV-INIZCTEOSA-N 2 1 320.908 4.251 20 0 DIADMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1F ZINC000359411642 1044163767 /nfs/dbraw/zinc/16/37/67/1044163767.db2.gz DWKMNTGAIHMFKT-BLLLJJGKSA-N 2 1 323.843 4.361 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc32)cc1 ZINC000346979017 1044178030 /nfs/dbraw/zinc/17/80/30/1044178030.db2.gz WXQBGKCSZNWRBI-BEFAXECRSA-N 2 1 317.436 4.171 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCSc3ccccc32)C1 ZINC000359935481 1044216515 /nfs/dbraw/zinc/21/65/15/1044216515.db2.gz POUJYMVNKSIPJP-SJLPKXTDSA-N 2 1 318.530 4.325 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444187481 1044234174 /nfs/dbraw/zinc/23/41/74/1044234174.db2.gz APFWMLUOKGPRFX-VQIMIIECSA-N 2 1 304.453 4.085 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444187481 1044234188 /nfs/dbraw/zinc/23/41/88/1044234188.db2.gz APFWMLUOKGPRFX-VQIMIIECSA-N 2 1 304.453 4.085 20 0 DIADMP CC[C@@H]1CCC[N@H+]1C1C[C@@H](C)N(Cc2ccccc2)[C@H](C)C1 ZINC001168054719 1044262972 /nfs/dbraw/zinc/26/29/72/1044262972.db2.gz TUPWDHORMGWSNK-ZHALLVOQSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[N@@H+]1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168054719 1044262981 /nfs/dbraw/zinc/26/29/81/1044262981.db2.gz TUPWDHORMGWSNK-ZHALLVOQSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[N@H+]1C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168054719 1044262985 /nfs/dbraw/zinc/26/29/85/1044262985.db2.gz TUPWDHORMGWSNK-ZHALLVOQSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2CC(F)(F)C2)CC1 ZINC000293279295 1044266783 /nfs/dbraw/zinc/26/67/83/1044266783.db2.gz CRAQHBRJJKNSRL-UHFFFAOYSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](CC2CC2)C2CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168056060 1044270648 /nfs/dbraw/zinc/27/06/48/1044270648.db2.gz BXSNAFHMPMORCG-UPHUGPLXSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](CC2CC2)C2CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168056060 1044270657 /nfs/dbraw/zinc/27/06/57/1044270657.db2.gz BXSNAFHMPMORCG-UPHUGPLXSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](CC2CC2)C2CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168056060 1044270673 /nfs/dbraw/zinc/27/06/73/1044270673.db2.gz BXSNAFHMPMORCG-UPHUGPLXSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](CC2CC2)C2CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168056060 1044270686 /nfs/dbraw/zinc/27/06/86/1044270686.db2.gz BXSNAFHMPMORCG-UPHUGPLXSA-N 2 1 312.501 4.302 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360497159 1044278114 /nfs/dbraw/zinc/27/81/14/1044278114.db2.gz XWXIPOAMLHKOBK-CYBMUJFWSA-N 2 1 321.534 4.242 20 0 DIADMP Cc1nccn1CCC[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000360736877 1044303708 /nfs/dbraw/zinc/30/37/08/1044303708.db2.gz KWJRJHXTZGCFPX-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000360736877 1044303718 /nfs/dbraw/zinc/30/37/18/1044303718.db2.gz KWJRJHXTZGCFPX-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000360736877 1044303733 /nfs/dbraw/zinc/30/37/33/1044303733.db2.gz KWJRJHXTZGCFPX-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCSc2ccc(Cl)cc21 ZINC000360948258 1044333295 /nfs/dbraw/zinc/33/32/95/1044333295.db2.gz QHMLRVUXKLSYSG-OAHLLOKOSA-N 2 1 321.877 4.062 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475288858 1044345827 /nfs/dbraw/zinc/34/58/27/1044345827.db2.gz UYUPPFQQJZOYRZ-QUCCMNQESA-N 2 1 300.490 4.233 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCCC[C@@H]3C3CC3)C2)cc1 ZINC000475285720 1044346772 /nfs/dbraw/zinc/34/67/72/1044346772.db2.gz HDYFLYBXUKRCJE-NRSPTQNISA-N 2 1 312.501 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1c(C)ccc2ccccc21 ZINC000348257923 1044378297 /nfs/dbraw/zinc/37/82/97/1044378297.db2.gz TXSKBGSILCRIMO-UHFFFAOYSA-N 2 1 307.441 4.175 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1c(C)ccc2ccccc21 ZINC000348257923 1044378311 /nfs/dbraw/zinc/37/83/11/1044378311.db2.gz TXSKBGSILCRIMO-UHFFFAOYSA-N 2 1 307.441 4.175 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@H](CF)C2)C[C@H](C)N1Cc1ccccc1 ZINC001168062354 1044379531 /nfs/dbraw/zinc/37/95/31/1044379531.db2.gz KDYYYMYLXKBWOT-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](CF)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168062354 1044379545 /nfs/dbraw/zinc/37/95/45/1044379545.db2.gz KDYYYMYLXKBWOT-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](CF)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168062354 1044379556 /nfs/dbraw/zinc/37/95/56/1044379556.db2.gz KDYYYMYLXKBWOT-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168062354 1044379565 /nfs/dbraw/zinc/37/95/65/1044379565.db2.gz KDYYYMYLXKBWOT-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@H](CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168062354 1044379590 /nfs/dbraw/zinc/37/95/90/1044379590.db2.gz KDYYYMYLXKBWOT-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H](N2CCc3occc3C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168062674 1044383554 /nfs/dbraw/zinc/38/35/54/1044383554.db2.gz LHQDOJYOKOMCRC-XEMDLRDOSA-N 2 1 324.468 4.079 20 0 DIADMP C[C@H]1CC([NH+]2CCC(CF)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168062701 1044385850 /nfs/dbraw/zinc/38/58/50/1044385850.db2.gz LTEAVDHKKQDDFW-IRXDYDNUSA-N 2 1 318.480 4.110 20 0 DIADMP CC[C@@H]1CC[N@H+]([C@@H]2C[C@@H](C)N(Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168066249 1044421216 /nfs/dbraw/zinc/42/12/16/1044421216.db2.gz MEJRXEIBFPHHMY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168066249 1044421219 /nfs/dbraw/zinc/42/12/19/1044421219.db2.gz MEJRXEIBFPHHMY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CC[N@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168066249 1044421223 /nfs/dbraw/zinc/42/12/23/1044421223.db2.gz MEJRXEIBFPHHMY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168066249 1044421227 /nfs/dbraw/zinc/42/12/27/1044421227.db2.gz MEJRXEIBFPHHMY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168066249 1044421229 /nfs/dbraw/zinc/42/12/29/1044421229.db2.gz MEJRXEIBFPHHMY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP Cc1cc2cc(CN(C)C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)oc2cc1C ZINC000565507974 1044440029 /nfs/dbraw/zinc/44/00/29/1044440029.db2.gz KRAAEBZVVCPGBJ-JWTNVVGKSA-N 2 1 312.457 4.107 20 0 DIADMP Cc1cc2cc(C[N@@H+](C)C3C[C@H]4CC[C@@H](C3)[NH+]4C)oc2cc1C ZINC000565507974 1044440034 /nfs/dbraw/zinc/44/00/34/1044440034.db2.gz KRAAEBZVVCPGBJ-JWTNVVGKSA-N 2 1 312.457 4.107 20 0 DIADMP Cc1cc2cc(C[N@H+](C)C3C[C@H]4CC[C@@H](C3)[NH+]4C)oc2cc1C ZINC000565507974 1044440039 /nfs/dbraw/zinc/44/00/39/1044440039.db2.gz KRAAEBZVVCPGBJ-JWTNVVGKSA-N 2 1 312.457 4.107 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC000566413686 1044489315 /nfs/dbraw/zinc/48/93/15/1044489315.db2.gz HHGJVIRUVVWATC-UHFFFAOYSA-N 2 1 317.436 4.055 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC000566413686 1044489323 /nfs/dbraw/zinc/48/93/23/1044489323.db2.gz HHGJVIRUVVWATC-UHFFFAOYSA-N 2 1 317.436 4.055 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000121431735 1044524379 /nfs/dbraw/zinc/52/43/79/1044524379.db2.gz RIKXXPQGGLWCST-CHWSQXEVSA-N 2 1 320.506 4.067 20 0 DIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000567373754 1044560016 /nfs/dbraw/zinc/56/00/16/1044560016.db2.gz ZSCQHHOBMCBYRC-ROUUACIJSA-N 2 1 314.498 4.024 20 0 DIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000567373754 1044560027 /nfs/dbraw/zinc/56/00/27/1044560027.db2.gz ZSCQHHOBMCBYRC-ROUUACIJSA-N 2 1 314.498 4.024 20 0 DIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000567373752 1044560138 /nfs/dbraw/zinc/56/01/38/1044560138.db2.gz ZSCQHHOBMCBYRC-MSOLQXFVSA-N 2 1 314.498 4.024 20 0 DIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000567373752 1044560153 /nfs/dbraw/zinc/56/01/53/1044560153.db2.gz ZSCQHHOBMCBYRC-MSOLQXFVSA-N 2 1 314.498 4.024 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccoc1 ZINC000353520276 1044578156 /nfs/dbraw/zinc/57/81/56/1044578156.db2.gz NSNUCZBSCJOTOF-IEBWSBKVSA-N 2 1 306.494 4.467 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccoc1 ZINC000353520276 1044578172 /nfs/dbraw/zinc/57/81/72/1044578172.db2.gz NSNUCZBSCJOTOF-IEBWSBKVSA-N 2 1 306.494 4.467 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CCN1C ZINC000444651975 1044581490 /nfs/dbraw/zinc/58/14/90/1044581490.db2.gz QPPFXGVGXLKVCM-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651975 1044581503 /nfs/dbraw/zinc/58/15/03/1044581503.db2.gz QPPFXGVGXLKVCM-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651975 1044581520 /nfs/dbraw/zinc/58/15/20/1044581520.db2.gz QPPFXGVGXLKVCM-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651975 1044581532 /nfs/dbraw/zinc/58/15/32/1044581532.db2.gz QPPFXGVGXLKVCM-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651975 1044581547 /nfs/dbraw/zinc/58/15/47/1044581547.db2.gz QPPFXGVGXLKVCM-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651975 1044581564 /nfs/dbraw/zinc/58/15/64/1044581564.db2.gz QPPFXGVGXLKVCM-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651975 1044581576 /nfs/dbraw/zinc/58/15/76/1044581576.db2.gz QPPFXGVGXLKVCM-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP CCc1ccccc1CC[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000444669583 1044599168 /nfs/dbraw/zinc/59/91/68/1044599168.db2.gz GTJABBAYXQOIDA-FXAWDEMLSA-N 2 1 314.517 4.034 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2CCc2ccccc2)C1 ZINC000568140566 1044605993 /nfs/dbraw/zinc/60/59/93/1044605993.db2.gz PLUMYDNNCZCHLX-NJYVYQBISA-N 2 1 314.517 4.108 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1c[nH+]ccc1N)CCC2 ZINC000568499886 1044632018 /nfs/dbraw/zinc/63/20/18/1044632018.db2.gz SXENGBGFEAGPLE-VBKZILBWSA-N 2 1 309.457 4.346 20 0 DIADMP Cc1ccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524051 1044632672 /nfs/dbraw/zinc/63/26/72/1044632672.db2.gz PTEOVRIGOPEVHR-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524051 1044632677 /nfs/dbraw/zinc/63/26/77/1044632677.db2.gz PTEOVRIGOPEVHR-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524051 1044632684 /nfs/dbraw/zinc/63/26/84/1044632684.db2.gz PTEOVRIGOPEVHR-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524051 1044632692 /nfs/dbraw/zinc/63/26/92/1044632692.db2.gz PTEOVRIGOPEVHR-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C3CCC4(CC4)CC3)CC23CC3)cc1 ZINC000568748380 1044646398 /nfs/dbraw/zinc/64/63/98/1044646398.db2.gz GOSMRKLYQIGQEI-FQEVSTJZSA-N 2 1 324.512 4.496 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C3CCC4(CC4)CC3)CC23CC3)cc1 ZINC000568748380 1044646404 /nfs/dbraw/zinc/64/64/04/1044646404.db2.gz GOSMRKLYQIGQEI-FQEVSTJZSA-N 2 1 324.512 4.496 20 0 DIADMP Cc1[nH]c(C2CC[NH+](C[C@@H]3C[C@H]3c3ccccc3)CC2)[nH+]c1C ZINC000886660859 1044677335 /nfs/dbraw/zinc/67/73/35/1044677335.db2.gz HOGTWULYHCOYNY-OALUTQOASA-N 2 1 309.457 4.010 20 0 DIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000445315723 1044701793 /nfs/dbraw/zinc/70/17/93/1044701793.db2.gz IVJAKSDGQLWYPE-QZTJIDSGSA-N 2 1 324.468 4.423 20 0 DIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000445315723 1044701810 /nfs/dbraw/zinc/70/18/10/1044701810.db2.gz IVJAKSDGQLWYPE-QZTJIDSGSA-N 2 1 324.468 4.423 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000570603869 1044769530 /nfs/dbraw/zinc/76/95/30/1044769530.db2.gz FLMKYRDOASNWNZ-UHFFFAOYSA-N 2 1 323.843 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000570603869 1044769548 /nfs/dbraw/zinc/76/95/48/1044769548.db2.gz FLMKYRDOASNWNZ-UHFFFAOYSA-N 2 1 323.843 4.150 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000570694607 1044776481 /nfs/dbraw/zinc/77/64/81/1044776481.db2.gz KRTNMQRNRWIKAR-GOSISDBHSA-N 2 1 317.864 4.233 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000570694607 1044776493 /nfs/dbraw/zinc/77/64/93/1044776493.db2.gz KRTNMQRNRWIKAR-GOSISDBHSA-N 2 1 317.864 4.233 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2)c1 ZINC000123981427 1044791650 /nfs/dbraw/zinc/79/16/50/1044791650.db2.gz VLGRIQNZJVJRNT-OAHLLOKOSA-N 2 1 300.421 4.128 20 0 DIADMP Cc1cc(C)c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(C)c1 ZINC000524597482 1044885798 /nfs/dbraw/zinc/88/57/98/1044885798.db2.gz BJUXNDJHVNPJDT-IBGZPJMESA-N 2 1 300.490 4.062 20 0 DIADMP CCC[N@H+](CCCc1c[nH+]cn1C)Cc1c(F)cccc1Cl ZINC000573383094 1044906493 /nfs/dbraw/zinc/90/64/93/1044906493.db2.gz HESMABPYQHQQAV-UHFFFAOYSA-N 2 1 323.843 4.057 20 0 DIADMP CCC[N@@H+](CCCc1c[nH+]cn1C)Cc1c(F)cccc1Cl ZINC000573383094 1044906505 /nfs/dbraw/zinc/90/65/05/1044906505.db2.gz HESMABPYQHQQAV-UHFFFAOYSA-N 2 1 323.843 4.057 20 0 DIADMP Cc1ccccc1[C@H](C)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000372524859 1044917434 /nfs/dbraw/zinc/91/74/34/1044917434.db2.gz GDDRPFMWCBWSOU-CUWPLCDZSA-N 2 1 323.484 4.076 20 0 DIADMP Cc1ccncc1C[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411663373 1045023327 /nfs/dbraw/zinc/02/33/27/1045023327.db2.gz HTGQNXFHBVJGOD-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP C[N@H+](C/C=C/c1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268839 1045024564 /nfs/dbraw/zinc/02/45/64/1045024564.db2.gz BOHVTFCHTUCRAC-MKGTUJQCSA-N 2 1 320.480 4.154 20 0 DIADMP C[N@@H+](C/C=C/c1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268839 1045024578 /nfs/dbraw/zinc/02/45/78/1045024578.db2.gz BOHVTFCHTUCRAC-MKGTUJQCSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C/c1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000525268839 1045024588 /nfs/dbraw/zinc/02/45/88/1045024588.db2.gz BOHVTFCHTUCRAC-MKGTUJQCSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C/c1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000525268839 1045024602 /nfs/dbraw/zinc/02/46/02/1045024602.db2.gz BOHVTFCHTUCRAC-MKGTUJQCSA-N 2 1 320.480 4.154 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)C2CCCC2)cc1 ZINC000446838690 1045055011 /nfs/dbraw/zinc/05/50/11/1045055011.db2.gz LBUKNFWWEYJYBB-LSTHTHJFSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)C2CCCC2)cc1 ZINC000446838690 1045055021 /nfs/dbraw/zinc/05/50/21/1045055021.db2.gz LBUKNFWWEYJYBB-LSTHTHJFSA-N 2 1 300.490 4.299 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(F)c1 ZINC000446942701 1045074955 /nfs/dbraw/zinc/07/49/55/1045074955.db2.gz UCRVPCZWPLPBJE-APWZRJJASA-N 2 1 306.469 4.234 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@H]2CCC[C@H]21 ZINC000576774299 1045078218 /nfs/dbraw/zinc/07/82/18/1045078218.db2.gz DUBREGYITUNZGU-RXABAKJHSA-N 2 1 318.892 4.048 20 0 DIADMP CSc1ccc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)s1 ZINC000577327707 1045116416 /nfs/dbraw/zinc/11/64/16/1045116416.db2.gz CXDUYXICEQJAGU-UHFFFAOYSA-N 2 1 324.559 4.214 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447572422 1045146907 /nfs/dbraw/zinc/14/69/07/1045146907.db2.gz BTIZMLJEFXVXLD-LWYYNNOASA-N 2 1 300.490 4.350 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CCCc3c(Cl)ccnc32)CC(C)(C)[NH2+]1 ZINC000924570270 1045177623 /nfs/dbraw/zinc/17/76/23/1045177623.db2.gz NXDNYHBNQQQQPS-HNNXBMFYSA-N 2 1 321.896 4.011 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1csc2ccccc12 ZINC000924648574 1045186972 /nfs/dbraw/zinc/18/69/72/1045186972.db2.gz LTJVKZRUEFFTGF-ZIAGYGMSSA-N 2 1 300.471 4.036 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1csc2ccccc12 ZINC000924648572 1045187653 /nfs/dbraw/zinc/18/76/53/1045187653.db2.gz LTJVKZRUEFFTGF-KGLIPLIRSA-N 2 1 300.471 4.036 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccccn2)C2CCC2)C1 ZINC000924684150 1045189782 /nfs/dbraw/zinc/18/97/82/1045189782.db2.gz CEZIEPGKDQSGEH-YLJYHZDGSA-N 2 1 315.505 4.025 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1csc(C(F)(F)F)c1 ZINC000924718349 1045194172 /nfs/dbraw/zinc/19/41/72/1045194172.db2.gz YSAHVOALUZUBAI-JTQLQIEISA-N 2 1 317.380 4.013 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527116158 1045197379 /nfs/dbraw/zinc/19/73/79/1045197379.db2.gz DDJDSOGMSHXUSP-JKSUJKDBSA-N 2 1 308.897 4.107 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527116158 1045197384 /nfs/dbraw/zinc/19/73/84/1045197384.db2.gz DDJDSOGMSHXUSP-JKSUJKDBSA-N 2 1 308.897 4.107 20 0 DIADMP C[C@H](C[NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527115757 1045198264 /nfs/dbraw/zinc/19/82/64/1045198264.db2.gz HLXRPRNQQHQAOR-IAGOWNOFSA-N 2 1 306.469 4.173 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](CCC(C)C)CC1)c1ccccn1 ZINC000924945721 1045213711 /nfs/dbraw/zinc/21/37/11/1045213711.db2.gz HMDSXHLANKPDLI-IBGZPJMESA-N 2 1 303.494 4.023 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@](C)(Cc1ccc(Cl)cc1)C(C)C ZINC000578343531 1045233799 /nfs/dbraw/zinc/23/37/99/1045233799.db2.gz VFDQPDLNMDAGIB-SFHVURJKSA-N 2 1 319.880 4.092 20 0 DIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)ccn1 ZINC000527638548 1045243522 /nfs/dbraw/zinc/24/35/22/1045243522.db2.gz KSKZDKMUWWTOAJ-SFHVURJKSA-N 2 1 323.484 4.054 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668278 1045246052 /nfs/dbraw/zinc/24/60/52/1045246052.db2.gz VHYSXUUHCQMTDR-GQSKVQJVSA-N 2 1 318.530 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668278 1045246062 /nfs/dbraw/zinc/24/60/62/1045246062.db2.gz VHYSXUUHCQMTDR-GQSKVQJVSA-N 2 1 318.530 4.155 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)CC[N@@H+]1C ZINC000527664022 1045246445 /nfs/dbraw/zinc/24/64/45/1045246445.db2.gz CHQDLSAUXBKMEK-RSPOEFSDSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)CC[N@H+]1C ZINC000527664022 1045246454 /nfs/dbraw/zinc/24/64/54/1045246454.db2.gz CHQDLSAUXBKMEK-RSPOEFSDSA-N 2 1 300.490 4.175 20 0 DIADMP c1cn2c([nH+]1)CC[C@H](C[NH2+][C@@H]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC000527695191 1045250670 /nfs/dbraw/zinc/25/06/70/1045250670.db2.gz LUPJUPQPPIGSDA-MISYRCLQSA-N 2 1 323.484 4.152 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768598 1045270224 /nfs/dbraw/zinc/27/02/24/1045270224.db2.gz JLHWUPOZKVHGRL-SCTDSRPQSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768598 1045270231 /nfs/dbraw/zinc/27/02/31/1045270231.db2.gz JLHWUPOZKVHGRL-SCTDSRPQSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@H]1CC12CC2 ZINC000527897792 1045275864 /nfs/dbraw/zinc/27/58/64/1045275864.db2.gz HZQJQVGKDDWYAQ-QXAKKESOSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@H]1CC12CC2 ZINC000527897792 1045275870 /nfs/dbraw/zinc/27/58/70/1045275870.db2.gz HZQJQVGKDDWYAQ-QXAKKESOSA-N 2 1 312.501 4.065 20 0 DIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC000578905126 1045279988 /nfs/dbraw/zinc/27/99/88/1045279988.db2.gz PJGUUGKHXIRISS-FQEVSTJZSA-N 2 1 316.464 4.200 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000579010493 1045288403 /nfs/dbraw/zinc/28/84/03/1045288403.db2.gz AAQSWHYNNPUKEP-BTHPGYMESA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000579010493 1045288414 /nfs/dbraw/zinc/28/84/14/1045288414.db2.gz AAQSWHYNNPUKEP-BTHPGYMESA-N 2 1 300.490 4.380 20 0 DIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)C2)cc1 ZINC000449078396 1045345544 /nfs/dbraw/zinc/34/55/44/1045345544.db2.gz UWQOBFWAKANCPW-LESCRADOSA-N 2 1 318.892 4.050 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106935 1045347196 /nfs/dbraw/zinc/34/71/96/1045347196.db2.gz NTTMFBFPDYHIQG-QAPCUYQASA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106935 1045347200 /nfs/dbraw/zinc/34/72/00/1045347200.db2.gz NTTMFBFPDYHIQG-QAPCUYQASA-N 2 1 306.519 4.128 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000449093709 1045349135 /nfs/dbraw/zinc/34/91/35/1045349135.db2.gz XEQWXHLYOJEQPY-AEFFLSMTSA-N 2 1 317.864 4.161 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)Cc2coc3ccccc23)C1 ZINC000449129630 1045350142 /nfs/dbraw/zinc/35/01/42/1045350142.db2.gz DABVCRFRUPCUBS-DLBZAZTESA-N 2 1 314.473 4.074 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)cs1 ZINC000449149659 1045351739 /nfs/dbraw/zinc/35/17/39/1045351739.db2.gz OGJVRTLHQBPGFT-MRXNPFEDSA-N 2 1 314.498 4.372 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@@H+]1C ZINC000449177445 1045354424 /nfs/dbraw/zinc/35/44/24/1045354424.db2.gz VQHWUIFEJMBDGW-CCKFTAQKSA-N 2 1 318.892 4.348 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@H+]1C ZINC000449177445 1045354425 /nfs/dbraw/zinc/35/44/25/1045354425.db2.gz VQHWUIFEJMBDGW-CCKFTAQKSA-N 2 1 318.892 4.348 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CCC1 ZINC000449160148 1045355714 /nfs/dbraw/zinc/35/57/14/1045355714.db2.gz LBMOZNPYKMKMHI-BQFCYCMXSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CCC1 ZINC000449160148 1045355717 /nfs/dbraw/zinc/35/57/17/1045355717.db2.gz LBMOZNPYKMKMHI-BQFCYCMXSA-N 2 1 306.519 4.299 20 0 DIADMP CSCC1CCC([NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000449231300 1045365398 /nfs/dbraw/zinc/36/53/98/1045365398.db2.gz DCUZWTHDMBVVOX-RZZCCWGQSA-N 2 1 324.578 4.151 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CC2)cc1Cl ZINC000449448137 1045394987 /nfs/dbraw/zinc/39/49/87/1045394987.db2.gz FGSXHNZPXNQZEB-HDMKZQKVSA-N 2 1 322.855 4.147 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449559635 1045413871 /nfs/dbraw/zinc/41/38/71/1045413871.db2.gz CHUMOLWNVUBJJX-XUBOLADHSA-N 2 1 300.490 4.003 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@]2(C)CCCS2)cc1 ZINC000120449976 1045472891 /nfs/dbraw/zinc/47/28/91/1045472891.db2.gz ISHDICGGZZIICJ-RDTXWAMCSA-N 2 1 315.486 4.117 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)C2CC(F)(F)C2)cc1 ZINC000529540614 1045491093 /nfs/dbraw/zinc/49/10/93/1045491093.db2.gz FJDASEQFBGZWKY-QWHCGFSZSA-N 2 1 319.399 4.265 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CC(F)(F)C1 ZINC000529550896 1045496292 /nfs/dbraw/zinc/49/62/92/1045496292.db2.gz QOGYNTSMMLGVGD-HUUCEWRRSA-N 2 1 322.443 4.235 20 0 DIADMP Fc1ccc(C[N@H+]2CCC23CCC3)cc1CN1CCC12CCC2 ZINC000450466042 1045510899 /nfs/dbraw/zinc/51/08/99/1045510899.db2.gz FNUNDUSXBSRMJP-UHFFFAOYSA-N 2 1 314.448 4.083 20 0 DIADMP Fc1ccc(C[N@@H+]2CCC23CCC3)cc1C[NH+]1CCC12CCC2 ZINC000450466042 1045510907 /nfs/dbraw/zinc/51/09/07/1045510907.db2.gz FNUNDUSXBSRMJP-UHFFFAOYSA-N 2 1 314.448 4.083 20 0 DIADMP Fc1ccc(C[N@H+]2CCC23CCC3)cc1C[NH+]1CCC12CCC2 ZINC000450466042 1045510911 /nfs/dbraw/zinc/51/09/11/1045510911.db2.gz FNUNDUSXBSRMJP-UHFFFAOYSA-N 2 1 314.448 4.083 20 0 DIADMP Fc1ccc(C[NH+]2CCC23CCC3)cc1C[N@@H+]1CCC12CCC2 ZINC000450466042 1045510915 /nfs/dbraw/zinc/51/09/15/1045510915.db2.gz FNUNDUSXBSRMJP-UHFFFAOYSA-N 2 1 314.448 4.083 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC000450493298 1045512982 /nfs/dbraw/zinc/51/29/82/1045512982.db2.gz BEPBHBXMHZXWQS-HNNXBMFYSA-N 2 1 314.464 4.008 20 0 DIADMP C(=C/c1ccccc1)\CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000450602780 1045524977 /nfs/dbraw/zinc/52/49/77/1045524977.db2.gz RTRXKWZQUAGLSC-OKANSMROSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C/c1ccccc1)\CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000450602780 1045524998 /nfs/dbraw/zinc/52/49/98/1045524998.db2.gz RTRXKWZQUAGLSC-OKANSMROSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C/c1ccccc1)\CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000450602780 1045525009 /nfs/dbraw/zinc/52/50/09/1045525009.db2.gz RTRXKWZQUAGLSC-OKANSMROSA-N 2 1 310.485 4.039 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380965849 1045555488 /nfs/dbraw/zinc/55/54/88/1045555488.db2.gz CPMMROXMAICYBW-HOJAQTOUSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]CCc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450724603 1045556051 /nfs/dbraw/zinc/55/60/51/1045556051.db2.gz GRIFLYDUGZMGKV-WBVHZDCISA-N 2 1 320.908 4.125 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCCF ZINC000391023551 1045592498 /nfs/dbraw/zinc/59/24/98/1045592498.db2.gz QVTUOZQGBFFPDX-GOSISDBHSA-N 2 1 306.469 4.017 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCCCF ZINC000391023551 1045592506 /nfs/dbraw/zinc/59/25/06/1045592506.db2.gz QVTUOZQGBFFPDX-GOSISDBHSA-N 2 1 306.469 4.017 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629548929 1045678572 /nfs/dbraw/zinc/67/85/72/1045678572.db2.gz OPBCKYGYQKRKOI-CEXWTWQISA-N 2 1 312.844 4.452 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccccc2CC(F)(F)F)c2ccccc21 ZINC000629553610 1045678874 /nfs/dbraw/zinc/67/88/74/1045678874.db2.gz BCTOUDOCBGQDPQ-SJORKVTESA-N 2 1 320.358 4.026 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000530513166 1045687201 /nfs/dbraw/zinc/68/72/01/1045687201.db2.gz MTGMDMHNSWABIT-MRXNPFEDSA-N 2 1 324.255 4.010 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666057 1045708138 /nfs/dbraw/zinc/70/81/38/1045708138.db2.gz SNKRRJUKDULZFX-TZMCWYRMSA-N 2 1 315.288 4.298 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666057 1045708147 /nfs/dbraw/zinc/70/81/47/1045708147.db2.gz SNKRRJUKDULZFX-TZMCWYRMSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666057 1045708157 /nfs/dbraw/zinc/70/81/57/1045708157.db2.gz SNKRRJUKDULZFX-TZMCWYRMSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666057 1045708163 /nfs/dbraw/zinc/70/81/63/1045708163.db2.gz SNKRRJUKDULZFX-TZMCWYRMSA-N 2 1 315.288 4.298 20 0 DIADMP Cc1nccn1CC[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC000451738074 1045724086 /nfs/dbraw/zinc/72/40/86/1045724086.db2.gz RNMNVBWKKLGIAD-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP CC[C@@H](c1ccc(F)cc1F)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000530863916 1045741440 /nfs/dbraw/zinc/74/14/40/1045741440.db2.gz RGJFFMUMLPKHDG-KXBFYZLASA-N 2 1 322.443 4.080 20 0 DIADMP CC(C)[N@H+](C)CC1CC[NH+]([C@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000530869226 1045744220 /nfs/dbraw/zinc/74/42/20/1045744220.db2.gz YXLRUWLKBULYSP-OAHLLOKOSA-N 2 1 321.509 4.085 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000530869226 1045744231 /nfs/dbraw/zinc/74/42/31/1045744231.db2.gz YXLRUWLKBULYSP-OAHLLOKOSA-N 2 1 321.509 4.085 20 0 DIADMP FC1(F)CCC([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000688309639 1045754149 /nfs/dbraw/zinc/75/41/49/1045754149.db2.gz ZCDPOFIKMBWQGF-QGZVFWFLSA-N 2 1 322.443 4.066 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CCN1C ZINC000531143662 1045791392 /nfs/dbraw/zinc/79/13/92/1045791392.db2.gz MUDJWLKKWBVGGP-LAUBAEHRSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143662 1045791420 /nfs/dbraw/zinc/79/14/20/1045791420.db2.gz MUDJWLKKWBVGGP-LAUBAEHRSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143662 1045791429 /nfs/dbraw/zinc/79/14/29/1045791429.db2.gz MUDJWLKKWBVGGP-LAUBAEHRSA-N 2 1 308.469 4.268 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(F)c2ccccc12 ZINC000631079986 1045813510 /nfs/dbraw/zinc/81/35/10/1045813510.db2.gz MSHUBXFKQQYGNP-UHFFFAOYSA-N 2 1 311.404 4.054 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc(C)ccn1 ZINC000631584013 1045877906 /nfs/dbraw/zinc/87/79/06/1045877906.db2.gz ASCKSUQGKNYKBL-IBGZPJMESA-N 2 1 315.505 4.228 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC000531687437 1045891424 /nfs/dbraw/zinc/89/14/24/1045891424.db2.gz WKCYBPACXRGKKC-WQUXRXDGSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@@H+]1C ZINC000531683322 1045896999 /nfs/dbraw/zinc/89/69/99/1045896999.db2.gz GPBXWGUUHCDUSN-FHLIZLRMSA-N 2 1 306.469 4.375 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@H+]1C ZINC000531683322 1045897010 /nfs/dbraw/zinc/89/70/10/1045897010.db2.gz GPBXWGUUHCDUSN-FHLIZLRMSA-N 2 1 306.469 4.375 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2CCCC24CC4)C3)cc1 ZINC000631665962 1045901109 /nfs/dbraw/zinc/90/11/09/1045901109.db2.gz VDGWASYYMZIGLK-YRPNKDGESA-N 2 1 310.485 4.104 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000531707614 1045902408 /nfs/dbraw/zinc/90/24/08/1045902408.db2.gz NQAXVMZTYNNDTC-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000531707614 1045902418 /nfs/dbraw/zinc/90/24/18/1045902418.db2.gz NQAXVMZTYNNDTC-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000531715402 1045904342 /nfs/dbraw/zinc/90/43/42/1045904342.db2.gz XOCJEKAUBHZRLJ-KSSFIOAISA-N 2 1 306.881 4.039 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CC1 ZINC000531723447 1045912898 /nfs/dbraw/zinc/91/28/98/1045912898.db2.gz AEKDUACSXOSLGG-VDGAXYAQSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CC1 ZINC000531723447 1045912906 /nfs/dbraw/zinc/91/29/06/1045912906.db2.gz AEKDUACSXOSLGG-VDGAXYAQSA-N 2 1 300.490 4.064 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2C)CC1)c1ccncc1 ZINC000453072940 1045916928 /nfs/dbraw/zinc/91/69/28/1045916928.db2.gz ZFZGNIOBMRIHAX-OAQYLSRUSA-N 2 1 323.484 4.095 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H](C3CC3)C3CCC3)C2)c1 ZINC000453099761 1045948916 /nfs/dbraw/zinc/94/89/16/1045948916.db2.gz ZGQJFNLCNSWQIK-DNVCBOLYSA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H](C3CC3)C3CCC3)C2)c1 ZINC000453099761 1045948929 /nfs/dbraw/zinc/94/89/29/1045948929.db2.gz ZGQJFNLCNSWQIK-DNVCBOLYSA-N 2 1 318.530 4.128 20 0 DIADMP CC[C@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccncc1 ZINC000453147713 1045951195 /nfs/dbraw/zinc/95/11/95/1045951195.db2.gz YMRSCAFENRKBOI-XLIONFOSSA-N 2 1 311.473 4.033 20 0 DIADMP CC[C@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccncc1 ZINC000453147712 1045951503 /nfs/dbraw/zinc/95/15/03/1045951503.db2.gz YMRSCAFENRKBOI-PXNSSMCTSA-N 2 1 311.473 4.033 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccsc1 ZINC000453200008 1045979357 /nfs/dbraw/zinc/97/93/57/1045979357.db2.gz UCLJZPLEGWOQQZ-VKJFTORMSA-N 2 1 306.519 4.442 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC000902456685 1046000696 /nfs/dbraw/zinc/00/06/96/1046000696.db2.gz QMLXURDXCVQHFZ-ZWKOTPCHSA-N 2 1 322.443 4.285 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@@H+]1C ZINC000453308365 1046027145 /nfs/dbraw/zinc/02/71/45/1046027145.db2.gz DLRURMMQQLYQHB-HYSWKAIVSA-N 2 1 310.844 4.003 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@H+]1C ZINC000453308365 1046027159 /nfs/dbraw/zinc/02/71/59/1046027159.db2.gz DLRURMMQQLYQHB-HYSWKAIVSA-N 2 1 310.844 4.003 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)C1(c2ccccc2)CCCC1 ZINC000453338385 1046043513 /nfs/dbraw/zinc/04/35/13/1046043513.db2.gz FWYSNPIMTXKUNW-OHSMVPPVSA-N 2 1 312.501 4.102 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[C@H]2c2ccccc2)CC[N@H+]1C ZINC000453341085 1046044965 /nfs/dbraw/zinc/04/49/65/1046044965.db2.gz DWVKXJZQABPGIG-MDNKFWRPSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(-c2ccncc2)cc1 ZINC000453386187 1046062736 /nfs/dbraw/zinc/06/27/36/1046062736.db2.gz AGWYXCSWEPNULL-QGZVFWFLSA-N 2 1 323.484 4.274 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453378704 1046072761 /nfs/dbraw/zinc/07/27/61/1046072761.db2.gz ZMZYFKIWVXDSHK-DLZDZTESSA-N 2 1 300.490 4.297 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)c(F)c1 ZINC000453412770 1046080434 /nfs/dbraw/zinc/08/04/34/1046080434.db2.gz WKILZWIEXSXJOL-SFHVURJKSA-N 2 1 310.432 4.126 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21)C1CC1 ZINC000453392431 1046082158 /nfs/dbraw/zinc/08/21/58/1046082158.db2.gz FIQSFTNHIANINQ-MRXNPFEDSA-N 2 1 324.921 4.341 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H](C2CC2)C2CCC2)C3)cc1 ZINC000453439159 1046083475 /nfs/dbraw/zinc/08/34/75/1046083475.db2.gz VXPDFEXBGCKAMN-CIAFKFPVSA-N 2 1 324.512 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H](C2CC2)C2CCC2)C3)cc1 ZINC000453439162 1046084718 /nfs/dbraw/zinc/08/47/18/1046084718.db2.gz VXPDFEXBGCKAMN-YUMYIRISSA-N 2 1 324.512 4.350 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000453419063 1046087485 /nfs/dbraw/zinc/08/74/85/1046087485.db2.gz KWZXSXKVYJEQTL-YJBOKZPZSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000453419063 1046087502 /nfs/dbraw/zinc/08/75/02/1046087502.db2.gz KWZXSXKVYJEQTL-YJBOKZPZSA-N 2 1 322.443 4.065 20 0 DIADMP CN1CCC([N@@H+](Cc2ccc3ncccc3c2)C2CCCC2)CC1 ZINC001138113917 1046100448 /nfs/dbraw/zinc/10/04/48/1046100448.db2.gz YLCPQMFAAKGOEB-UHFFFAOYSA-N 2 1 323.484 4.074 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC[N@H+]1C ZINC000532216937 1046117429 /nfs/dbraw/zinc/11/74/29/1046117429.db2.gz MGXLSTKJXPRZKG-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000532214871 1046117630 /nfs/dbraw/zinc/11/76/30/1046117630.db2.gz YWEQIAUONJLJHY-KBXCAEBGSA-N 2 1 306.881 4.037 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000532233657 1046122070 /nfs/dbraw/zinc/12/20/70/1046122070.db2.gz BYMRDOQDZPGEGA-IXDOHACOSA-N 2 1 320.546 4.268 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000532246939 1046122392 /nfs/dbraw/zinc/12/23/92/1046122392.db2.gz HSCHXRUVRWIORX-RKVPGOIHSA-N 2 1 322.924 4.227 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000532235993 1046124155 /nfs/dbraw/zinc/12/41/55/1046124155.db2.gz TYCIDHLEFXOAOJ-MUQADHOPSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000532235993 1046124161 /nfs/dbraw/zinc/12/41/61/1046124161.db2.gz TYCIDHLEFXOAOJ-MUQADHOPSA-N 2 1 306.519 4.299 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccccn2)C2CC2)c1 ZINC000903079415 1046159416 /nfs/dbraw/zinc/15/94/16/1046159416.db2.gz AHFSKMQUUOUCQR-OAQYLSRUSA-N 2 1 323.484 4.163 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](c2ccccn2)C2CC2)c1 ZINC000903079413 1046159751 /nfs/dbraw/zinc/15/97/51/1046159751.db2.gz AHFSKMQUUOUCQR-NRFANRHFSA-N 2 1 323.484 4.163 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccc(F)cc1F ZINC000903098025 1046162668 /nfs/dbraw/zinc/16/26/68/1046162668.db2.gz KTKYDYHHGAPUHB-QGGWKKEGSA-N 2 1 320.427 4.163 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(F)cc1F ZINC000903098025 1046162673 /nfs/dbraw/zinc/16/26/73/1046162673.db2.gz KTKYDYHHGAPUHB-QGGWKKEGSA-N 2 1 320.427 4.163 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccc(F)cc1Cl ZINC000903098439 1046163437 /nfs/dbraw/zinc/16/34/37/1046163437.db2.gz OZDACCWNSDFEKL-BPZRQAJTSA-N 2 1 322.855 4.288 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(F)cc1Cl ZINC000903098439 1046163440 /nfs/dbraw/zinc/16/34/40/1046163440.db2.gz OZDACCWNSDFEKL-BPZRQAJTSA-N 2 1 322.855 4.288 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1cc2cccc(F)c2o1 ZINC000475706328 1046165680 /nfs/dbraw/zinc/16/56/80/1046165680.db2.gz NYHBNTIKUROLTH-CQSZACIVSA-N 2 1 304.409 4.099 20 0 DIADMP Clc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)CC2)c1 ZINC000903137476 1046172628 /nfs/dbraw/zinc/17/26/28/1046172628.db2.gz MKQLJJCQBZVJSM-ZNXRZULTSA-N 2 1 316.876 4.077 20 0 DIADMP Clc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)CC2)c1 ZINC000903137476 1046172634 /nfs/dbraw/zinc/17/26/34/1046172634.db2.gz MKQLJJCQBZVJSM-ZNXRZULTSA-N 2 1 316.876 4.077 20 0 DIADMP Cc1ccc2[nH]c(C[N@H+](C)CC3CC[NH+](C(C)C)CC3)cc2c1 ZINC001138415722 1046172858 /nfs/dbraw/zinc/17/28/58/1046172858.db2.gz JGZAUYGKVZRMEY-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1cccc(C2CC2)c1 ZINC000903176913 1046184568 /nfs/dbraw/zinc/18/45/68/1046184568.db2.gz GEAPYPGAJYRUPZ-XMKUNMAOSA-N 2 1 310.485 4.372 20 0 DIADMP CC[C@H](CCc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903207416 1046193913 /nfs/dbraw/zinc/19/39/13/1046193913.db2.gz XZRYHBPGGBXPGC-GAUHOVIDSA-N 2 1 312.501 4.145 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)Cc2cccc(C)c2)cc1 ZINC001138543585 1046219825 /nfs/dbraw/zinc/21/98/25/1046219825.db2.gz PYHHKHZOOHSBHH-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)Cc2cccc(C)c2)cc1 ZINC001138543585 1046219833 /nfs/dbraw/zinc/21/98/33/1046219833.db2.gz PYHHKHZOOHSBHH-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)cc1 ZINC001138550347 1046222683 /nfs/dbraw/zinc/22/26/83/1046222683.db2.gz QMAPYRNLIVPCED-RTBURBONSA-N 2 1 309.457 4.193 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)cc1 ZINC001138550347 1046222699 /nfs/dbraw/zinc/22/26/99/1046222699.db2.gz QMAPYRNLIVPCED-RTBURBONSA-N 2 1 309.457 4.193 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)Cc2ccccc2C)cc1 ZINC001138547974 1046223519 /nfs/dbraw/zinc/22/35/19/1046223519.db2.gz YLMHWHWETGSZAT-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)Cc2ccccc2C)cc1 ZINC001138547974 1046223537 /nfs/dbraw/zinc/22/35/37/1046223537.db2.gz YLMHWHWETGSZAT-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1cc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)c(C)s1 ZINC001138571435 1046231766 /nfs/dbraw/zinc/23/17/66/1046231766.db2.gz XSVYLCUMGCSPFJ-ZWKOTPCHSA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c(C)s1 ZINC001138571435 1046231775 /nfs/dbraw/zinc/23/17/75/1046231775.db2.gz XSVYLCUMGCSPFJ-ZWKOTPCHSA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c(C)s1 ZINC001138571435 1046231789 /nfs/dbraw/zinc/23/17/89/1046231789.db2.gz XSVYLCUMGCSPFJ-ZWKOTPCHSA-N 2 1 306.519 4.204 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+][C@H]1CC[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000903380527 1046260837 /nfs/dbraw/zinc/26/08/37/1046260837.db2.gz NFHBAPOIEWLHHD-GIVPXCGWSA-N 2 1 323.484 4.000 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc2occc2c1 ZINC001138825754 1046301176 /nfs/dbraw/zinc/30/11/76/1046301176.db2.gz WAXSPUVVZCGABJ-RBUKOAKNSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc2occc2c1 ZINC001138825754 1046301190 /nfs/dbraw/zinc/30/11/90/1046301190.db2.gz WAXSPUVVZCGABJ-RBUKOAKNSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc2occc2c1 ZINC001138825754 1046301206 /nfs/dbraw/zinc/30/12/06/1046301206.db2.gz WAXSPUVVZCGABJ-RBUKOAKNSA-N 2 1 312.457 4.272 20 0 DIADMP c1cc(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)cs1 ZINC000638277908 1046309060 /nfs/dbraw/zinc/30/90/60/1046309060.db2.gz WVKMTZKZFZBCFH-IEBWSBKVSA-N 2 1 312.482 4.206 20 0 DIADMP c1cc(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)cs1 ZINC000638277908 1046309076 /nfs/dbraw/zinc/30/90/76/1046309076.db2.gz WVKMTZKZFZBCFH-IEBWSBKVSA-N 2 1 312.482 4.206 20 0 DIADMP c1cc(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)cs1 ZINC000638277886 1046309636 /nfs/dbraw/zinc/30/96/36/1046309636.db2.gz WVKMTZKZFZBCFH-HKUYNNGSSA-N 2 1 312.482 4.206 20 0 DIADMP c1cc(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)cs1 ZINC000638277886 1046309649 /nfs/dbraw/zinc/30/96/49/1046309649.db2.gz WVKMTZKZFZBCFH-HKUYNNGSSA-N 2 1 312.482 4.206 20 0 DIADMP CCCCOc1cccc(C[N@@H+](C(C)C)C2CCN(C)CC2)c1 ZINC001138957860 1046336746 /nfs/dbraw/zinc/33/67/46/1046336746.db2.gz PSTFMDNHPQRIST-UHFFFAOYSA-N 2 1 318.505 4.170 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(-c2cccs2)s1 ZINC001139018581 1046357542 /nfs/dbraw/zinc/35/75/42/1046357542.db2.gz HCODANOSHOQYNH-UHFFFAOYSA-N 2 1 308.516 4.250 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(-c2cccs2)s1 ZINC001139018581 1046357558 /nfs/dbraw/zinc/35/75/58/1046357558.db2.gz HCODANOSHOQYNH-UHFFFAOYSA-N 2 1 308.516 4.250 20 0 DIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1ccc(-c2cccs2)s1 ZINC001139019006 1046360086 /nfs/dbraw/zinc/36/00/86/1046360086.db2.gz PNHRZYHWNCRBTN-UHFFFAOYSA-N 2 1 320.527 4.394 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(-c2cccs2)s1 ZINC001139019006 1046360097 /nfs/dbraw/zinc/36/00/97/1046360097.db2.gz PNHRZYHWNCRBTN-UHFFFAOYSA-N 2 1 320.527 4.394 20 0 DIADMP C[N@H+]1CC[C@@]2(CCN(Cc3ccc(-c4cccs4)s3)C2)C1 ZINC001139023619 1046362670 /nfs/dbraw/zinc/36/26/70/1046362670.db2.gz VDGMKPYLWGODFL-QGZVFWFLSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(-c4cccs4)s3)C2)C1 ZINC001139023619 1046362689 /nfs/dbraw/zinc/36/26/89/1046362689.db2.gz VDGMKPYLWGODFL-QGZVFWFLSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4cccs4)s3)C2)C1 ZINC001139023619 1046362696 /nfs/dbraw/zinc/36/26/96/1046362696.db2.gz VDGMKPYLWGODFL-QGZVFWFLSA-N 2 1 318.511 4.004 20 0 DIADMP FC1(CC[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CCC1 ZINC000639181628 1046367073 /nfs/dbraw/zinc/36/70/73/1046367073.db2.gz VPZPZYPFEGZULD-PKOBYXMFSA-N 2 1 316.464 4.226 20 0 DIADMP FC1(CC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CCC1 ZINC000639181628 1046367085 /nfs/dbraw/zinc/36/70/85/1046367085.db2.gz VPZPZYPFEGZULD-PKOBYXMFSA-N 2 1 316.464 4.226 20 0 DIADMP CC1CCC([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)CC1 ZINC001168222006 1046432111 /nfs/dbraw/zinc/43/21/11/1046432111.db2.gz VJJWHLWIWLMZFQ-UHFFFAOYSA-N 2 1 318.480 4.301 20 0 DIADMP CC1CCC([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)CC1 ZINC001168222006 1046432117 /nfs/dbraw/zinc/43/21/17/1046432117.db2.gz VJJWHLWIWLMZFQ-UHFFFAOYSA-N 2 1 318.480 4.301 20 0 DIADMP CC1CCC([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC001168222041 1046432628 /nfs/dbraw/zinc/43/26/28/1046432628.db2.gz VUWJINGKNXDAII-ODKCFSPTSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC001168222041 1046432636 /nfs/dbraw/zinc/43/26/36/1046432636.db2.gz VUWJINGKNXDAII-ODKCFSPTSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC001168222041 1046432642 /nfs/dbraw/zinc/43/26/42/1046432642.db2.gz VUWJINGKNXDAII-ODKCFSPTSA-N 2 1 312.501 4.019 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C[C@@H]1CC=CCC1 ZINC000676903307 1046446441 /nfs/dbraw/zinc/44/64/41/1046446441.db2.gz JLWSAXSTROKYFV-GOSISDBHSA-N 2 1 324.468 4.358 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202938702 1046452728 /nfs/dbraw/zinc/45/27/28/1046452728.db2.gz JUQDTCVCMIGKRG-CGXNFDGLSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124777979 1046459936 /nfs/dbraw/zinc/45/99/36/1046459936.db2.gz STRQEZSKIGLZPJ-CRAIPNDOSA-N 2 1 315.461 4.346 20 0 DIADMP Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124777979 1046459944 /nfs/dbraw/zinc/45/99/44/1046459944.db2.gz STRQEZSKIGLZPJ-CRAIPNDOSA-N 2 1 315.461 4.346 20 0 DIADMP c1ccc2ncc(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)cc2c1 ZINC001137282141 1046460478 /nfs/dbraw/zinc/46/04/78/1046460478.db2.gz DZDGNCFRGOVLBY-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc2ncc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)cc2c1 ZINC001137282141 1046460482 /nfs/dbraw/zinc/46/04/82/1046460482.db2.gz DZDGNCFRGOVLBY-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000125478715 1046467870 /nfs/dbraw/zinc/46/78/70/1046467870.db2.gz YKQOLGHRVVJABL-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000125478715 1046467877 /nfs/dbraw/zinc/46/78/77/1046467877.db2.gz YKQOLGHRVVJABL-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125809538 1046471968 /nfs/dbraw/zinc/47/19/68/1046471968.db2.gz SNQJKWMZHUJLGE-SQWLQELKSA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125809538 1046471972 /nfs/dbraw/zinc/47/19/72/1046471972.db2.gz SNQJKWMZHUJLGE-SQWLQELKSA-N 2 1 324.559 4.384 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125871116 1046474348 /nfs/dbraw/zinc/47/43/48/1046474348.db2.gz XJIVFCNFEZMOOX-KDOFPFPSSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125871116 1046474356 /nfs/dbraw/zinc/47/43/56/1046474356.db2.gz XJIVFCNFEZMOOX-KDOFPFPSSA-N 2 1 310.432 4.126 20 0 DIADMP c1ccc(-c2cccc(CC[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)c2)cc1 ZINC000677239872 1046476161 /nfs/dbraw/zinc/47/61/61/1046476161.db2.gz NKUAGEGYBRNWMX-VXKWHMMOSA-N 2 1 320.480 4.113 20 0 DIADMP Fc1ccccc1[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)C1CCCC1 ZINC000677240323 1046476511 /nfs/dbraw/zinc/47/65/11/1046476511.db2.gz GHKQSYRWIDZRBS-ABSDTBQOSA-N 2 1 316.464 4.273 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccs1 ZINC000677237880 1046477431 /nfs/dbraw/zinc/47/74/31/1046477431.db2.gz PDSXHBJFSHMUHL-NUJGCVRESA-N 2 1 306.519 4.442 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)c2)c1 ZINC000677238213 1046477805 /nfs/dbraw/zinc/47/78/05/1046477805.db2.gz YCVZYEWGCQTAMH-FGZHOGPDSA-N 2 1 320.480 4.378 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1cccnc1 ZINC000359864102 1046527766 /nfs/dbraw/zinc/52/77/66/1046527766.db2.gz ABRPJJURSGBZAV-PCCBWWKXSA-N 2 1 323.484 4.205 20 0 DIADMP CN1CCC([N@@H+](Cc2ccccc2C2CC2)C2CCCC2)CC1 ZINC001139883982 1046543000 /nfs/dbraw/zinc/54/30/00/1046543000.db2.gz PXDRBOCWEOVRRU-UHFFFAOYSA-N 2 1 312.501 4.403 20 0 DIADMP c1ccc2cc(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ncc2c1 ZINC001139997736 1046567031 /nfs/dbraw/zinc/56/70/31/1046567031.db2.gz KMUIYUXZEPHELX-NRFANRHFSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc2cc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ncc2c1 ZINC001139997736 1046567043 /nfs/dbraw/zinc/56/70/43/1046567043.db2.gz KMUIYUXZEPHELX-NRFANRHFSA-N 2 1 323.484 4.075 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)Cc1ccc(C)cc1 ZINC001140025966 1046570264 /nfs/dbraw/zinc/57/02/64/1046570264.db2.gz ULDYBNKUGSCANI-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)Cc1ccc(C)cc1 ZINC001140025966 1046570278 /nfs/dbraw/zinc/57/02/78/1046570278.db2.gz ULDYBNKUGSCANI-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)Cc1cccc(C)c1 ZINC001140023682 1046572217 /nfs/dbraw/zinc/57/22/17/1046572217.db2.gz VIIAFZUVBVBOTD-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)Cc1cccc(C)c1 ZINC001140023682 1046572229 /nfs/dbraw/zinc/57/22/29/1046572229.db2.gz VIIAFZUVBVBOTD-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP c1cc2cnccc2c(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001140145041 1046600606 /nfs/dbraw/zinc/60/06/06/1046600606.db2.gz XYXQOWREDAJBAW-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc(C2CC2)c(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000678339456 1046621295 /nfs/dbraw/zinc/62/12/95/1046621295.db2.gz MNEPMXGUDYKEEJ-RXVVDRJESA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000678339456 1046621300 /nfs/dbraw/zinc/62/13/00/1046621300.db2.gz MNEPMXGUDYKEEJ-RXVVDRJESA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000678339456 1046621307 /nfs/dbraw/zinc/62/13/07/1046621307.db2.gz MNEPMXGUDYKEEJ-RXVVDRJESA-N 2 1 310.485 4.013 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(C)n1 ZINC000678413614 1046632055 /nfs/dbraw/zinc/63/20/55/1046632055.db2.gz LEAHRKKDGFFNKZ-SJORKVTESA-N 2 1 303.494 4.004 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(C)nc2C)c1 ZINC000678424612 1046634654 /nfs/dbraw/zinc/63/46/54/1046634654.db2.gz QEELYGYBCQSIHO-INIZCTEOSA-N 2 1 311.473 4.001 20 0 DIADMP C[C@@H]1C[C@H]1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000248825281 1046636718 /nfs/dbraw/zinc/63/67/18/1046636718.db2.gz FYMVSILIKKXRRI-FNEVGXLHSA-N 2 1 318.892 4.252 20 0 DIADMP Cc1ccc(CC[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000533060732 1046648667 /nfs/dbraw/zinc/64/86/67/1046648667.db2.gz MCECKFAGGSREJT-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP Cc1ccc(CC[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000533060732 1046648673 /nfs/dbraw/zinc/64/86/73/1046648673.db2.gz MCECKFAGGSREJT-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000678594010 1046667414 /nfs/dbraw/zinc/66/74/14/1046667414.db2.gz TUHAIVJRRXFYDH-QWQQUQAHSA-N 2 1 318.892 4.254 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000678594012 1046668036 /nfs/dbraw/zinc/66/80/36/1046668036.db2.gz TUHAIVJRRXFYDH-RBPQIDMKSA-N 2 1 318.892 4.254 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548904 1046672587 /nfs/dbraw/zinc/67/25/87/1046672587.db2.gz XHECNWXBLABHFC-OAHLLOKOSA-N 2 1 304.437 4.021 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccccn1 ZINC000245949612 1046676634 /nfs/dbraw/zinc/67/66/34/1046676634.db2.gz SGLKHLSZNUEKDO-ZWKOTPCHSA-N 2 1 323.484 4.164 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000678609539 1046679023 /nfs/dbraw/zinc/67/90/23/1046679023.db2.gz PHFABJASGLKEAM-DYXWJJEUSA-N 2 1 312.501 4.404 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000533307352 1046693667 /nfs/dbraw/zinc/69/36/67/1046693667.db2.gz CMNMXSOKGOSHCZ-VOMPUTFMSA-N 2 1 300.490 4.048 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2csc3ccccc23)CC1 ZINC001140638672 1046823815 /nfs/dbraw/zinc/82/38/15/1046823815.db2.gz WFEMAINUNIPLTL-UHFFFAOYSA-N 2 1 316.514 4.454 20 0 DIADMP c1csc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000249053880 1046857549 /nfs/dbraw/zinc/85/75/49/1046857549.db2.gz YFWUFGLJGSXTGX-NNZMDNLPSA-N 2 1 312.482 4.033 20 0 DIADMP CC(C)[N@@H+](CCCc1cccc(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206580547 1046867408 /nfs/dbraw/zinc/86/74/08/1046867408.db2.gz DQCACNAUOGRADJ-GOSISDBHSA-N 2 1 308.897 4.125 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1F ZINC000679773144 1046903686 /nfs/dbraw/zinc/90/36/86/1046903686.db2.gz RCEKCKBTQNEPOI-RKVPGOIHSA-N 2 1 324.871 4.393 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1F ZINC000679773144 1046903710 /nfs/dbraw/zinc/90/37/10/1046903710.db2.gz RCEKCKBTQNEPOI-RKVPGOIHSA-N 2 1 324.871 4.393 20 0 DIADMP CC1(c2ccccc2)CC[NH+](Cc2c[nH]c3cc[nH+]cc23)CC1 ZINC001140805402 1046907594 /nfs/dbraw/zinc/90/75/94/1046907594.db2.gz DRWDFLOUJLVJPJ-UHFFFAOYSA-N 2 1 305.425 4.117 20 0 DIADMP C[C@@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@@]1(C)CC[NH2+]C1 ZINC000261897107 1046955167 /nfs/dbraw/zinc/95/51/67/1046955167.db2.gz VCZXQJAXHSGITA-LPHOPBHVSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H](c1cccs1)[N@@H+](Cc1ccccc1)C[C@@]1(C)CC[NH2+]C1 ZINC000261897107 1046955171 /nfs/dbraw/zinc/95/51/71/1046955171.db2.gz VCZXQJAXHSGITA-LPHOPBHVSA-N 2 1 314.498 4.311 20 0 DIADMP Clc1scc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c1Cl ZINC000262030745 1046958590 /nfs/dbraw/zinc/95/85/90/1046958590.db2.gz XCFDTWUEINPANM-GFCCVEGCSA-N 2 1 319.301 4.019 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccncc1 ZINC000647294675 1046969201 /nfs/dbraw/zinc/96/92/01/1046969201.db2.gz KIDBLFYMYDKMMJ-QUCCMNQESA-N 2 1 317.521 4.126 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccoc1 ZINC000680351853 1046969657 /nfs/dbraw/zinc/96/96/57/1046969657.db2.gz GTLHIPXROXIYKA-AGKXRFJRSA-N 2 1 324.468 4.231 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000647343307 1046983655 /nfs/dbraw/zinc/98/36/55/1046983655.db2.gz LRVIXJJNEQNPJA-HKBOAZHASA-N 2 1 308.469 4.073 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000680461824 1046984131 /nfs/dbraw/zinc/98/41/31/1046984131.db2.gz YFZIKMZLRLYJHP-MRHSLFKSSA-N 2 1 318.892 4.193 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000647344635 1046985181 /nfs/dbraw/zinc/98/51/81/1046985181.db2.gz VWYZVFNNHCSSMA-SXLOBPIMSA-N 2 1 300.490 4.056 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccccc1-c1cccs1 ZINC001141095716 1047009934 /nfs/dbraw/zinc/00/99/34/1047009934.db2.gz UKRAZYAPSHXYES-UHFFFAOYSA-N 2 1 314.498 4.333 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SCC)cc2)C1 ZINC000533783170 1047017253 /nfs/dbraw/zinc/01/72/53/1047017253.db2.gz FNKZBCNDHOWFBO-HOTGVXAUSA-N 2 1 306.519 4.181 20 0 DIADMP CCc1ccccc1C[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001141229584 1047056120 /nfs/dbraw/zinc/05/61/20/1047056120.db2.gz OQDPZLAHMZTECD-UHFFFAOYSA-N 2 1 314.517 4.478 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536695325 1047071643 /nfs/dbraw/zinc/07/16/43/1047071643.db2.gz AECIQKKXGSWFMT-OAHLLOKOSA-N 2 1 308.535 4.209 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536695325 1047071658 /nfs/dbraw/zinc/07/16/58/1047071658.db2.gz AECIQKKXGSWFMT-OAHLLOKOSA-N 2 1 308.535 4.209 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000536695900 1047077150 /nfs/dbraw/zinc/07/71/50/1047077150.db2.gz DWLNMQBXHDUFRN-KRWDZBQOSA-N 2 1 312.457 4.049 20 0 DIADMP Cc1nccn1CCC[N@H+](C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000536733000 1047087380 /nfs/dbraw/zinc/08/73/80/1047087380.db2.gz PIGOKMWRWNRBJX-HUUCEWRRSA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000536733000 1047087395 /nfs/dbraw/zinc/08/73/95/1047087395.db2.gz PIGOKMWRWNRBJX-HUUCEWRRSA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000536733000 1047087408 /nfs/dbraw/zinc/08/74/08/1047087408.db2.gz PIGOKMWRWNRBJX-HUUCEWRRSA-N 2 1 319.880 4.359 20 0 DIADMP Cc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379641913 1047093413 /nfs/dbraw/zinc/09/34/13/1047093413.db2.gz DMKVQPBWGBCQIY-WIYYLYMNSA-N 2 1 308.469 4.138 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658309 1047093891 /nfs/dbraw/zinc/09/38/91/1047093891.db2.gz VYZLLGXZDDANJT-LMCOJAPRSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658309 1047093905 /nfs/dbraw/zinc/09/39/05/1047093905.db2.gz VYZLLGXZDDANJT-LMCOJAPRSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379657301 1047096697 /nfs/dbraw/zinc/09/66/97/1047096697.db2.gz RZXMJMFELKSXIP-XQBPLPMBSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379657301 1047096714 /nfs/dbraw/zinc/09/67/14/1047096714.db2.gz RZXMJMFELKSXIP-XQBPLPMBSA-N 2 1 322.496 4.433 20 0 DIADMP CCCCCOc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC001116018434 1047100667 /nfs/dbraw/zinc/10/06/67/1047100667.db2.gz CJXLIEXYJJXKIJ-LJQANCHMSA-N 2 1 318.505 4.077 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000536833852 1047105775 /nfs/dbraw/zinc/10/57/75/1047105775.db2.gz PCDFTIQNBPXGRO-RCCFBDPRSA-N 2 1 320.546 4.246 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000536833852 1047105779 /nfs/dbraw/zinc/10/57/79/1047105779.db2.gz PCDFTIQNBPXGRO-RCCFBDPRSA-N 2 1 320.546 4.246 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@H+](C)C[C@H]1C)CCC2 ZINC000536835512 1047106998 /nfs/dbraw/zinc/10/69/98/1047106998.db2.gz UHKPUIPMKYEBCC-YSGRDPCXSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C)CCC2 ZINC000536835512 1047107004 /nfs/dbraw/zinc/10/70/04/1047107004.db2.gz UHKPUIPMKYEBCC-YSGRDPCXSA-N 2 1 300.490 4.117 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000536843470 1047108459 /nfs/dbraw/zinc/10/84/59/1047108459.db2.gz DATWJMODWQAHHW-UUEOMSGBSA-N 2 1 314.517 4.205 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](CCc1ccccc1)C(C)C ZINC000536861296 1047115273 /nfs/dbraw/zinc/11/52/73/1047115273.db2.gz BULIYNRWAYFOHJ-XLIONFOSSA-N 2 1 313.489 4.075 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@H](C)c2ncc(C)o2)CC1)CC(C)C ZINC000536887862 1047121354 /nfs/dbraw/zinc/12/13/54/1047121354.db2.gz XWTXWUFLZUMJGH-QGZVFWFLSA-N 2 1 321.509 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](CN[C@H](C)c2oc3ccccc3c2C)C1 ZINC001116293261 1047127408 /nfs/dbraw/zinc/12/74/08/1047127408.db2.gz LFIZHXXSMBVTHQ-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC001116293261 1047127412 /nfs/dbraw/zinc/12/74/12/1047127412.db2.gz LFIZHXXSMBVTHQ-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](CN[C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293160 1047127762 /nfs/dbraw/zinc/12/77/62/1047127762.db2.gz KXMPUAWPOBICFL-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293160 1047127767 /nfs/dbraw/zinc/12/77/67/1047127767.db2.gz KXMPUAWPOBICFL-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293160 1047127772 /nfs/dbraw/zinc/12/77/72/1047127772.db2.gz KXMPUAWPOBICFL-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000537015892 1047131466 /nfs/dbraw/zinc/13/14/66/1047131466.db2.gz ORQNKDZKFOPIBH-YJYMSZOUSA-N 2 1 315.436 4.016 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]CCn1cc[nH+]c1C ZINC000537292270 1047159175 /nfs/dbraw/zinc/15/91/75/1047159175.db2.gz HIEWXGKYUZCYEK-AWEZNQCLSA-N 2 1 311.429 4.159 20 0 DIADMP CC(C)C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)cc1 ZINC000537307133 1047163085 /nfs/dbraw/zinc/16/30/85/1047163085.db2.gz LJYKLYZDXWOLFE-SFHVURJKSA-N 2 1 306.881 4.279 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc2ccccc21 ZINC000682130203 1047173664 /nfs/dbraw/zinc/17/36/64/1047173664.db2.gz BXUPXIGWDOTACR-KKSFZXQISA-N 2 1 308.469 4.365 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc(Cl)s1 ZINC000035285788 1047227960 /nfs/dbraw/zinc/22/79/60/1047227960.db2.gz RJUGKTVRKXSXES-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)s1 ZINC000035285788 1047227975 /nfs/dbraw/zinc/22/79/75/1047227975.db2.gz RJUGKTVRKXSXES-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@H]3CCc4c3cccc4F)CC2)[nH+]c1C ZINC001119376336 1047329847 /nfs/dbraw/zinc/32/98/47/1047329847.db2.gz OVFZOTAVLGQCSN-SFHVURJKSA-N 2 1 313.420 4.033 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@@H]3CCc4c3cccc4F)CC2)[nH+]c1C ZINC001119376335 1047330237 /nfs/dbraw/zinc/33/02/37/1047330237.db2.gz OVFZOTAVLGQCSN-GOSISDBHSA-N 2 1 313.420 4.033 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000651829470 1047330531 /nfs/dbraw/zinc/33/05/31/1047330531.db2.gz DCBAROCFJDRERH-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1 ZINC000652140359 1047343867 /nfs/dbraw/zinc/34/38/67/1047343867.db2.gz MDXYDHBONHNRMR-FHWLQOOXSA-N 2 1 304.453 4.129 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H](c1cccnc1)C1CCCCC1)C1CC1 ZINC000652207840 1047346262 /nfs/dbraw/zinc/34/62/62/1047346262.db2.gz VBUJBBOOCMZNJH-FQEVSTJZSA-N 2 1 315.505 4.167 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)s1 ZINC001142029060 1047353698 /nfs/dbraw/zinc/35/36/98/1047353698.db2.gz HSWWMXVLADLUCH-GJZGRUSLSA-N 2 1 324.559 4.309 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)s1 ZINC001142029060 1047353710 /nfs/dbraw/zinc/35/37/10/1047353710.db2.gz HSWWMXVLADLUCH-GJZGRUSLSA-N 2 1 324.559 4.309 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)s1 ZINC001142029060 1047353715 /nfs/dbraw/zinc/35/37/15/1047353715.db2.gz HSWWMXVLADLUCH-GJZGRUSLSA-N 2 1 324.559 4.309 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)s1 ZINC001142029060 1047353723 /nfs/dbraw/zinc/35/37/23/1047353723.db2.gz HSWWMXVLADLUCH-GJZGRUSLSA-N 2 1 324.559 4.309 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC1 ZINC001168323805 1047448346 /nfs/dbraw/zinc/44/83/46/1047448346.db2.gz CTMYCZIYQFSWKC-JXQTWKCFSA-N 2 1 312.910 4.411 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000119695945 1047469809 /nfs/dbraw/zinc/46/98/09/1047469809.db2.gz MDAYCOUKNFABAD-OAHLLOKOSA-N 2 1 318.530 4.465 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168334260 1047480758 /nfs/dbraw/zinc/48/07/58/1047480758.db2.gz OEUOGDYXHXHRMH-UHFFFAOYSA-N 2 1 317.864 4.161 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H](C2CCC2)C2CCCCC2)s1 ZINC000842762004 1047502588 /nfs/dbraw/zinc/50/25/88/1047502588.db2.gz DKLYRSJKCNYCEL-SFHVURJKSA-N 2 1 321.534 4.043 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2cccs2)c1)C1CCC([NH3+])CC1 ZINC000843055541 1047525967 /nfs/dbraw/zinc/52/59/67/1047525967.db2.gz GQBHKKUNGJOQKE-UHFFFAOYSA-N 2 1 318.461 4.256 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1sc2ccccc2c1Cl ZINC000843361824 1047543755 /nfs/dbraw/zinc/54/37/55/1047543755.db2.gz MHNCOILGDODHBJ-YHWZYXNKSA-N 2 1 320.889 4.399 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1sc2ccccc2c1Cl ZINC000843361824 1047543758 /nfs/dbraw/zinc/54/37/58/1047543758.db2.gz MHNCOILGDODHBJ-YHWZYXNKSA-N 2 1 320.889 4.399 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC001203136741 1047549685 /nfs/dbraw/zinc/54/96/85/1047549685.db2.gz SRGRAJXVGDLDLF-HKBKRHGFSA-N 2 1 306.881 4.065 20 0 DIADMP c1sc2ccccc2c1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000537649539 1047560733 /nfs/dbraw/zinc/56/07/33/1047560733.db2.gz ZAYKWCLTAYKKRJ-MRXNPFEDSA-N 2 1 314.498 4.209 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(C)(C)c2ccccc2)C1 ZINC000314961583 1047591774 /nfs/dbraw/zinc/59/17/74/1047591774.db2.gz UWAFAHHRZDUCQX-ROUUACIJSA-N 2 1 302.506 4.063 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2cc(-c3ccsc3)cs2)C1 ZINC001206640395 1047593702 /nfs/dbraw/zinc/59/37/02/1047593702.db2.gz JJPNJPOVEAHAOI-ZDUSSCGKSA-N 2 1 306.500 4.037 20 0 DIADMP CC(C)Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000315125587 1047598412 /nfs/dbraw/zinc/59/84/12/1047598412.db2.gz BBQCWDYAGOPYHC-FAXKSRBJSA-N 2 1 300.490 4.161 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(F)c(-c3ccccc3)c2)C1 ZINC001206648605 1047630345 /nfs/dbraw/zinc/63/03/45/1047630345.db2.gz NHVWYCWONLEXHZ-KRWDZBQOSA-N 2 1 312.432 4.054 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000537944907 1047645857 /nfs/dbraw/zinc/64/58/57/1047645857.db2.gz SGHRKGHFOXIZNL-JENIJYKNSA-N 2 1 312.457 4.231 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(-c2ccccc2)c1 ZINC000538406875 1047673021 /nfs/dbraw/zinc/67/30/21/1047673021.db2.gz XKBUPVZDWXDQDI-QGZVFWFLSA-N 2 1 306.453 4.266 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000538406767 1047674466 /nfs/dbraw/zinc/67/44/66/1047674466.db2.gz TXQWPBSTLOBKMA-GOSISDBHSA-N 2 1 304.453 4.155 20 0 DIADMP Cc1cccc2c1cc[nH+]c2NCc1cccc(C[NH+](C)C)c1 ZINC001156047890 1047698066 /nfs/dbraw/zinc/69/80/66/1047698066.db2.gz JYGJVLIPLQOYEV-UHFFFAOYSA-N 2 1 305.425 4.217 20 0 DIADMP C[N@H+]1CCC[C@H](CCNc2nccc3cc(Cl)ccc32)C1 ZINC001156380185 1047708466 /nfs/dbraw/zinc/70/84/66/1047708466.db2.gz YJWZJXKERIWEDA-CYBMUJFWSA-N 2 1 303.837 4.032 20 0 DIADMP Cc1ccc(C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000538944084 1047720834 /nfs/dbraw/zinc/72/08/34/1047720834.db2.gz UBTAJUUPEFOLFR-UHFFFAOYSA-N 2 1 323.484 4.129 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000539041661 1047726241 /nfs/dbraw/zinc/72/62/41/1047726241.db2.gz NXXMBUANDCRWDJ-BJLQDIEVSA-N 2 1 323.484 4.033 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@H](C)c2cccnc2)CC1)CC(C)C ZINC000539100144 1047736544 /nfs/dbraw/zinc/73/65/44/1047736544.db2.gz RASHKQCMKITRLY-GOSISDBHSA-N 2 1 317.521 4.223 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@@H](C)c2cccnc2)CC1)CC(C)C ZINC000539100145 1047736553 /nfs/dbraw/zinc/73/65/53/1047736553.db2.gz RASHKQCMKITRLY-SFHVURJKSA-N 2 1 317.521 4.223 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000539159761 1047738930 /nfs/dbraw/zinc/73/89/30/1047738930.db2.gz XTKFBRMOEYXPOM-FXAWDEMLSA-N 2 1 300.490 4.239 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)N1CCC2(CCC[N@H+]2C)CC1 ZINC000539196029 1047740093 /nfs/dbraw/zinc/74/00/93/1047740093.db2.gz LHTRAXSUYMGWHJ-QGZVFWFLSA-N 2 1 306.881 4.351 20 0 DIADMP CC([NH2+]CCC[NH+]1CCCC1)(c1ccccc1)c1ccccc1 ZINC000539303463 1047747398 /nfs/dbraw/zinc/74/73/98/1047747398.db2.gz AIQHIAWANUXBSZ-UHFFFAOYSA-N 2 1 308.469 4.026 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(-c2ccncc2)cc1 ZINC000539339018 1047748373 /nfs/dbraw/zinc/74/83/73/1047748373.db2.gz APDOVYKCUOQGOL-DYESRHJHSA-N 2 1 323.484 4.274 20 0 DIADMP Cc1[nH+]c2c(Nc3ccc([C@@H]4CCC[NH2+]4)cc3)cccn2c1C ZINC001159394954 1047839560 /nfs/dbraw/zinc/83/95/60/1047839560.db2.gz CMBZJMHFKWQKLW-KRWDZBQOSA-N 2 1 306.413 4.119 20 0 DIADMP c1cc(Nc2ccc([NH+]3CCCCCC3)cc2)cc2c1C[NH2+]C2 ZINC001159542243 1047863704 /nfs/dbraw/zinc/86/37/04/1047863704.db2.gz NQKWJOWWNRYKTL-UHFFFAOYSA-N 2 1 307.441 4.414 20 0 DIADMP c1cc2cc(Nc3ccc(OC4CC[NH2+]CC4)cc3)ccc2c[nH+]1 ZINC001159622731 1047885519 /nfs/dbraw/zinc/88/55/19/1047885519.db2.gz XGTAZFBFDWPJHF-UHFFFAOYSA-N 2 1 319.408 4.109 20 0 DIADMP c1cc(Nc2cccc3cc[nH+]cc32)cc(C2CC[NH2+]CC2)c1 ZINC001159756932 1047915548 /nfs/dbraw/zinc/91/55/48/1047915548.db2.gz GBMMRWXEFBMPSA-UHFFFAOYSA-N 2 1 303.409 4.445 20 0 DIADMP CCCOc1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479535714 1047922318 /nfs/dbraw/zinc/92/23/18/1047922318.db2.gz ISPOJNRAOZURDT-IVMQYODDSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001183378721 1047926025 /nfs/dbraw/zinc/92/60/25/1047926025.db2.gz ATXPOVCAKHXJNY-UZLBHIALSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001183378721 1047926031 /nfs/dbraw/zinc/92/60/31/1047926031.db2.gz ATXPOVCAKHXJNY-UZLBHIALSA-N 2 1 318.480 4.143 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1Nc1ccc2c(c1)CC[NH2+]C2 ZINC001159818175 1047930348 /nfs/dbraw/zinc/93/03/48/1047930348.db2.gz HKWZCGJJCKZHFK-UHFFFAOYSA-N 2 1 321.468 4.375 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479558876 1047930704 /nfs/dbraw/zinc/93/07/04/1047930704.db2.gz YTEOQHFBZOCYEL-PBPGXSGUSA-N 2 1 300.490 4.478 20 0 DIADMP c1ccc(C2([NH+]3CCCC3)CC[NH+]([C@H]3C=CCCC3)CC2)cc1 ZINC001198202050 1047933394 /nfs/dbraw/zinc/93/33/94/1047933394.db2.gz IMXKHIPTKJYSNM-FQEVSTJZSA-N 2 1 310.485 4.182 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)cc1 ZINC001203315312 1047937203 /nfs/dbraw/zinc/93/72/03/1047937203.db2.gz YSPVJRJNUYTXSI-JOCHJYFZSA-N 2 1 320.480 4.175 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)cc1 ZINC001203315312 1047937219 /nfs/dbraw/zinc/93/72/19/1047937219.db2.gz YSPVJRJNUYTXSI-JOCHJYFZSA-N 2 1 320.480 4.175 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)cc1 ZINC001203315312 1047937228 /nfs/dbraw/zinc/93/72/28/1047937228.db2.gz YSPVJRJNUYTXSI-JOCHJYFZSA-N 2 1 320.480 4.175 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC001183571143 1047944478 /nfs/dbraw/zinc/94/44/78/1047944478.db2.gz FMESUKBOIAPDJA-VMXMFDLUSA-N 2 1 314.517 4.455 20 0 DIADMP c1ccc(C2=CC[NH2+]CC2)c(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001160023395 1047972920 /nfs/dbraw/zinc/97/29/20/1047972920.db2.gz NVMRFEZBPPXKOL-UHFFFAOYSA-N 2 1 301.393 4.355 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000479873648 1047989750 /nfs/dbraw/zinc/98/97/50/1047989750.db2.gz NHEINYFSDQUSGY-XMSQKQJNSA-N 2 1 322.496 4.138 20 0 DIADMP CC(C)C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000479911702 1048006223 /nfs/dbraw/zinc/00/62/23/1048006223.db2.gz LDYCLOYWXWGBNZ-HKUYNNGSSA-N 2 1 303.494 4.023 20 0 DIADMP CC(C)C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000479911702 1048006237 /nfs/dbraw/zinc/00/62/37/1048006237.db2.gz LDYCLOYWXWGBNZ-HKUYNNGSSA-N 2 1 303.494 4.023 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC001198917420 1048016494 /nfs/dbraw/zinc/01/64/94/1048016494.db2.gz AGHZOKGSGKLFTF-IBGZPJMESA-N 2 1 316.533 4.500 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC001198917425 1048016886 /nfs/dbraw/zinc/01/68/86/1048016886.db2.gz AGHZOKGSGKLFTF-LJQANCHMSA-N 2 1 316.533 4.500 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)cn1 ZINC001198908615 1048020867 /nfs/dbraw/zinc/02/08/67/1048020867.db2.gz WJXHPCPVMKFFBE-UHFFFAOYSA-N 2 1 317.521 4.024 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)cn1 ZINC001198908615 1048020886 /nfs/dbraw/zinc/02/08/86/1048020886.db2.gz WJXHPCPVMKFFBE-UHFFFAOYSA-N 2 1 317.521 4.024 20 0 DIADMP C[N@@H+](CCC[NH2+]C[C@@H]1CCCC(C)(C)C1)Cc1ccccc1 ZINC001199038720 1048028190 /nfs/dbraw/zinc/02/81/90/1048028190.db2.gz YPPBZFYDNIKEDO-LJQANCHMSA-N 2 1 302.506 4.315 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](CCc2ccc(Cl)cc2)C(C)C)CC1 ZINC000480027816 1048032190 /nfs/dbraw/zinc/03/21/90/1048032190.db2.gz CFDRVUYQJPGJCI-LJQANCHMSA-N 2 1 322.924 4.371 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CCCCC2)cc1 ZINC001199277272 1048053938 /nfs/dbraw/zinc/05/39/38/1048053938.db2.gz YVBNQYQTRFHVOD-QGZVFWFLSA-N 2 1 300.490 4.483 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1Cl ZINC001199346367 1048056956 /nfs/dbraw/zinc/05/69/56/1048056956.db2.gz ZXPPKBRNPZBNRC-HNNXBMFYSA-N 2 1 308.897 4.250 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001199329163 1048057948 /nfs/dbraw/zinc/05/79/48/1048057948.db2.gz OHVFHHMVWUHEDL-HDICACEKSA-N 2 1 306.538 4.447 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329749 1048059151 /nfs/dbraw/zinc/05/91/51/1048059151.db2.gz YZKDRZWJYKEHCB-SXTSRPLYSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329588 1048059289 /nfs/dbraw/zinc/05/92/89/1048059289.db2.gz WMXDLDWRDUSDNF-IYBDPMFKSA-N 2 1 314.473 4.199 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329588 1048059298 /nfs/dbraw/zinc/05/92/98/1048059298.db2.gz WMXDLDWRDUSDNF-IYBDPMFKSA-N 2 1 314.473 4.199 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)CCCC(F)(F)F)C1 ZINC000480145681 1048068696 /nfs/dbraw/zinc/06/86/96/1048068696.db2.gz HNZHCWWYODJRAR-LSDHHAIUSA-N 2 1 308.432 4.065 20 0 DIADMP CC(C)C[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000480186992 1048087045 /nfs/dbraw/zinc/08/70/45/1048087045.db2.gz YLTDECKLGFHJQJ-LSDHHAIUSA-N 2 1 308.432 4.208 20 0 DIADMP CC(C)C[N@H+]1CCCC[C@@H]1C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000480186992 1048087059 /nfs/dbraw/zinc/08/70/59/1048087059.db2.gz YLTDECKLGFHJQJ-LSDHHAIUSA-N 2 1 308.432 4.208 20 0 DIADMP Cc1ccc2c(C)cc(NCc3ccccc3C[NH3+])[nH+]c2c1C ZINC001160908607 1048095582 /nfs/dbraw/zinc/09/55/82/1048095582.db2.gz POJKYGVNILRCMK-UHFFFAOYSA-N 2 1 305.425 4.231 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000480223792 1048095785 /nfs/dbraw/zinc/09/57/85/1048095785.db2.gz JEHQIYGYEANOOE-LSDHHAIUSA-N 2 1 308.432 4.209 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc2c(c1)COC2 ZINC000480262501 1048110593 /nfs/dbraw/zinc/11/05/93/1048110593.db2.gz KOAHDWMYYXRWAZ-MRXNPFEDSA-N 2 1 316.489 4.022 20 0 DIADMP C[C@@H](NCCC[N@@H+](C)C1CCCCC1)c1ccc(Cl)cn1 ZINC000480324594 1048122913 /nfs/dbraw/zinc/12/29/13/1048122913.db2.gz GHNPBMXVHQKBBA-CQSZACIVSA-N 2 1 309.885 4.040 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](Cc2ccc(CC(C)C)cc2)CC1 ZINC001175119619 1048150288 /nfs/dbraw/zinc/15/02/88/1048150288.db2.gz IFEZTABHGNLLTP-UHFFFAOYSA-N 2 1 302.506 4.191 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC001200942372 1048167422 /nfs/dbraw/zinc/16/74/22/1048167422.db2.gz PCQAHXLSJBRGKD-LJQANCHMSA-N 2 1 312.501 4.354 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC001200942372 1048167425 /nfs/dbraw/zinc/16/74/25/1048167425.db2.gz PCQAHXLSJBRGKD-LJQANCHMSA-N 2 1 312.501 4.354 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)s1 ZINC000480600516 1048188071 /nfs/dbraw/zinc/18/80/71/1048188071.db2.gz ISJNOIBWOPGMLM-KFWWJZLASA-N 2 1 323.550 4.033 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000480610486 1048192161 /nfs/dbraw/zinc/19/21/61/1048192161.db2.gz JHRMKEKHTXXXLQ-KXBFYZLASA-N 2 1 304.453 4.057 20 0 DIADMP CC(C)C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000480618844 1048196244 /nfs/dbraw/zinc/19/62/44/1048196244.db2.gz PTIKSZRZFFNIKY-QUCCMNQESA-N 2 1 317.521 4.271 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(F)c1 ZINC000480607466 1048196339 /nfs/dbraw/zinc/19/63/39/1048196339.db2.gz GDWSGMYXYKBFLI-JKSUJKDBSA-N 2 1 322.468 4.140 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1F ZINC000480620889 1048197633 /nfs/dbraw/zinc/19/76/33/1048197633.db2.gz BZSXUKDSPVDNPF-HOTGVXAUSA-N 2 1 322.468 4.140 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)cc(F)c1 ZINC000480634756 1048202610 /nfs/dbraw/zinc/20/26/10/1048202610.db2.gz VHAPAFOHUVEJGK-CABCVRRESA-N 2 1 310.432 4.270 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCCC2 ZINC000480743106 1048233200 /nfs/dbraw/zinc/23/32/00/1048233200.db2.gz FWKDPTHRDUBYIQ-YQVWRLOYSA-N 2 1 318.892 4.324 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000554941114 1048236872 /nfs/dbraw/zinc/23/68/72/1048236872.db2.gz WFIQCOQERQNSAV-MSOLQXFVSA-N 2 1 314.517 4.463 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000554991936 1048246459 /nfs/dbraw/zinc/24/64/59/1048246459.db2.gz SDRMYIURFSQIHO-XDQVBPFNSA-N 2 1 314.926 4.212 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000554991936 1048246471 /nfs/dbraw/zinc/24/64/71/1048246471.db2.gz SDRMYIURFSQIHO-XDQVBPFNSA-N 2 1 314.926 4.212 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+](C[C@H]4CC=CCC4)C3)CC2)cc1 ZINC001201416930 1048261083 /nfs/dbraw/zinc/26/10/83/1048261083.db2.gz CPKPQGFHJDGACO-NRFANRHFSA-N 2 1 324.512 4.331 20 0 DIADMP C[NH+]1CCC([N@@H+](Cc2ccc(F)cc2)C[C@@H]2CC=CCC2)CC1 ZINC001201427081 1048263542 /nfs/dbraw/zinc/26/35/42/1048263542.db2.gz KVUASPRNOQOHEI-QGZVFWFLSA-N 2 1 316.464 4.078 20 0 DIADMP C[NH+]1CCC([N@H+](Cc2ccc(F)cc2)C[C@@H]2CC=CCC2)CC1 ZINC001201427081 1048263553 /nfs/dbraw/zinc/26/35/53/1048263553.db2.gz KVUASPRNOQOHEI-QGZVFWFLSA-N 2 1 316.464 4.078 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000480897097 1048267881 /nfs/dbraw/zinc/26/78/81/1048267881.db2.gz FBAQOGFMQFWEDG-GJZGRUSLSA-N 2 1 323.550 4.348 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2CCSC(C)(C)C)CC1 ZINC001175351991 1048272379 /nfs/dbraw/zinc/27/23/79/1048272379.db2.gz NSBKTVSXBYYSBV-KRWDZBQOSA-N 2 1 312.567 4.105 20 0 DIADMP CC[C@@H](C)C[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001201509505 1048291536 /nfs/dbraw/zinc/29/15/36/1048291536.db2.gz QYCSSDPVCGNHPH-TTYHFUOFSA-N 2 1 300.490 4.143 20 0 DIADMP CC[C@@H](C)C[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001201509505 1048291550 /nfs/dbraw/zinc/29/15/50/1048291550.db2.gz QYCSSDPVCGNHPH-TTYHFUOFSA-N 2 1 300.490 4.143 20 0 DIADMP CC[C@@H](C)C[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001201509505 1048291566 /nfs/dbraw/zinc/29/15/66/1048291566.db2.gz QYCSSDPVCGNHPH-TTYHFUOFSA-N 2 1 300.490 4.143 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC000481028231 1048296260 /nfs/dbraw/zinc/29/62/60/1048296260.db2.gz YEAYJPYQMLLNSD-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3c(s2)CCCC3)C1 ZINC000481041993 1048298487 /nfs/dbraw/zinc/29/84/87/1048298487.db2.gz BUQSEDJTDXUQQL-LSDHHAIUSA-N 2 1 306.519 4.009 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201541181 1048301059 /nfs/dbraw/zinc/30/10/59/1048301059.db2.gz DFFAWXUSRJPJCD-IEBWSBKVSA-N 2 1 318.505 4.392 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001201543670 1048302249 /nfs/dbraw/zinc/30/22/49/1048302249.db2.gz JGYKVQDDZPZRIM-QGZVFWFLSA-N 2 1 304.478 4.004 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201552222 1048305421 /nfs/dbraw/zinc/30/54/21/1048305421.db2.gz BVCFUDKHFZMHSB-INIZCTEOSA-N 2 1 306.469 4.158 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201552222 1048305435 /nfs/dbraw/zinc/30/54/35/1048305435.db2.gz BVCFUDKHFZMHSB-INIZCTEOSA-N 2 1 306.469 4.158 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC001201558702 1048318530 /nfs/dbraw/zinc/31/85/30/1048318530.db2.gz UQFNPNMJTZCLNQ-FPOVZHCZSA-N 2 1 316.533 4.213 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC[N@H+]1C ZINC000481178443 1048320159 /nfs/dbraw/zinc/32/01/59/1048320159.db2.gz GJRYOGBMOUEISM-LPHOPBHVSA-N 2 1 318.480 4.100 20 0 DIADMP CC(C)CC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201617033 1048331402 /nfs/dbraw/zinc/33/14/02/1048331402.db2.gz FFHFDCKXUJKDQT-QXAKKESOSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201617033 1048331412 /nfs/dbraw/zinc/33/14/12/1048331412.db2.gz FFHFDCKXUJKDQT-QXAKKESOSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201617033 1048331428 /nfs/dbraw/zinc/33/14/28/1048331428.db2.gz FFHFDCKXUJKDQT-QXAKKESOSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201614018 1048331711 /nfs/dbraw/zinc/33/17/11/1048331711.db2.gz CFMXCBCFMOSXSU-GOSISDBHSA-N 2 1 304.478 4.002 20 0 DIADMP CCC[NH+]1CCC2(CCC[N@@H+](Cc3ccc(C)cc3)C2)CC1 ZINC001201642391 1048343400 /nfs/dbraw/zinc/34/34/00/1048343400.db2.gz WVYRFFWWTHSMFY-UHFFFAOYSA-N 2 1 300.490 4.083 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCCC(C)C)cc2)C1 ZINC000481337693 1048373043 /nfs/dbraw/zinc/37/30/43/1048373043.db2.gz NLRPILRSEOIJRW-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2-c2cccc(C3=[NH+]CCC3)c2)c1 ZINC001162913542 1048387149 /nfs/dbraw/zinc/38/71/49/1048387149.db2.gz HRNGEKYCTLLCBY-CQSZACIVSA-N 2 1 303.409 4.233 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2-c2ccc([C@@H]3CC[N@@H+](C)C3)cc2)c1 ZINC001162913288 1048387248 /nfs/dbraw/zinc/38/72/48/1048387248.db2.gz DZCUBKGJAHZOEQ-DNVCBOLYSA-N 2 1 319.452 4.069 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000481421596 1048399684 /nfs/dbraw/zinc/39/96/84/1048399684.db2.gz FWMHUZAJSVPFGC-OAHLLOKOSA-N 2 1 312.457 4.409 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000481432025 1048402306 /nfs/dbraw/zinc/40/23/06/1048402306.db2.gz JASKDSQWGYUVTL-HNNXBMFYSA-N 2 1 318.530 4.466 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC000555598274 1048402489 /nfs/dbraw/zinc/40/24/89/1048402489.db2.gz PUGQLHXFDPQKSQ-LJQANCHMSA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC000555598274 1048402496 /nfs/dbraw/zinc/40/24/96/1048402496.db2.gz PUGQLHXFDPQKSQ-LJQANCHMSA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1 ZINC000555598274 1048402505 /nfs/dbraw/zinc/40/25/05/1048402505.db2.gz PUGQLHXFDPQKSQ-LJQANCHMSA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC000555598274 1048402513 /nfs/dbraw/zinc/40/25/13/1048402513.db2.gz PUGQLHXFDPQKSQ-LJQANCHMSA-N 2 1 318.530 4.105 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001201947415 1048408091 /nfs/dbraw/zinc/40/80/91/1048408091.db2.gz YJBQKJTZMXEXCS-AKHDSKFASA-N 2 1 306.538 4.445 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@H](c2ccc(C)cc2)C1(C)C ZINC001175717176 1048422567 /nfs/dbraw/zinc/42/25/67/1048422567.db2.gz XZNCWOQHUZMZRY-LJQANCHMSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@H](c2ccc(C)cc2)C1(C)C ZINC001175717176 1048422573 /nfs/dbraw/zinc/42/25/73/1048422573.db2.gz XZNCWOQHUZMZRY-LJQANCHMSA-N 2 1 311.473 4.158 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001202114884 1048454541 /nfs/dbraw/zinc/45/45/41/1048454541.db2.gz HASDTDOVKGVZGK-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001202114884 1048454546 /nfs/dbraw/zinc/45/45/46/1048454546.db2.gz HASDTDOVKGVZGK-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](CC1CCCC1)CC2 ZINC001202140046 1048460101 /nfs/dbraw/zinc/46/01/01/1048460101.db2.gz ULKBNUFUEHEPPR-IBGZPJMESA-N 2 1 316.489 4.146 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202204829 1048480475 /nfs/dbraw/zinc/48/04/75/1048480475.db2.gz ICZVEBOXXKHSKF-RTWAWAEBSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]3C[NH+](CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202204829 1048480481 /nfs/dbraw/zinc/48/04/81/1048480481.db2.gz ICZVEBOXXKHSKF-RTWAWAEBSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]3C[NH+](CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202204829 1048480485 /nfs/dbraw/zinc/48/04/85/1048480485.db2.gz ICZVEBOXXKHSKF-RTWAWAEBSA-N 2 1 312.501 4.021 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C ZINC000481988732 1048540314 /nfs/dbraw/zinc/54/03/14/1048540314.db2.gz GIFFFFYSJKGLTO-FUHWJXTLSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C ZINC000481988732 1048540328 /nfs/dbraw/zinc/54/03/28/1048540328.db2.gz GIFFFFYSJKGLTO-FUHWJXTLSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C ZINC000481988732 1048540341 /nfs/dbraw/zinc/54/03/41/1048540341.db2.gz GIFFFFYSJKGLTO-FUHWJXTLSA-N 2 1 313.489 4.089 20 0 DIADMP CC(C)CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000482011507 1048542559 /nfs/dbraw/zinc/54/25/59/1048542559.db2.gz SRQKNWXQSJBBOF-AOIWGVFYSA-N 2 1 318.505 4.245 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)C2CCCCC2)[C@@H](C)C1 ZINC000482017702 1048548355 /nfs/dbraw/zinc/54/83/55/1048548355.db2.gz PFWMZBIXFZWRBC-IHPCNDPISA-N 2 1 324.553 4.072 20 0 DIADMP Cc1cc(Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)cc(C)[nH+]1 ZINC001176056138 1048555161 /nfs/dbraw/zinc/55/51/61/1048555161.db2.gz QTXDNRDQXUBILY-UHFFFAOYSA-N 2 1 320.440 4.232 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)C(C)(C)c2ccccc2)C1 ZINC000482343529 1048590764 /nfs/dbraw/zinc/59/07/64/1048590764.db2.gz HRLJKQGLTQXKLS-MSOLQXFVSA-N 2 1 302.506 4.063 20 0 DIADMP Cc1cccc(C[C@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)c1 ZINC000482341722 1048591270 /nfs/dbraw/zinc/59/12/70/1048591270.db2.gz CFSDVNCPSZFLKN-CTNGQTDRSA-N 2 1 314.517 4.026 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CC(C)(C)c3ccccc32)C1 ZINC000482330515 1048591544 /nfs/dbraw/zinc/59/15/44/1048591544.db2.gz UTKVOPUYXPFVAE-LPHOPBHVSA-N 2 1 300.490 4.119 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3c(s2)CCC3)C1 ZINC000482361458 1048594101 /nfs/dbraw/zinc/59/41/01/1048594101.db2.gz UERMLNNJTMUWLX-HUUCEWRRSA-N 2 1 306.519 4.008 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3c(C)cccc3Cl)CC2)[nH+]c1C ZINC001176200462 1048615784 /nfs/dbraw/zinc/61/57/84/1048615784.db2.gz BYPRGANAXVBWLJ-UHFFFAOYSA-N 2 1 317.864 4.368 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000850467389 1048667463 /nfs/dbraw/zinc/66/74/63/1048667463.db2.gz VGPLYQRYEWGASS-HNAYVOBHSA-N 2 1 324.459 4.168 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC(C)(C)[C@@H](c2ccccc2)C1 ZINC001176567884 1048726317 /nfs/dbraw/zinc/72/63/17/1048726317.db2.gz SFKCOXVABAAXSJ-LJQANCHMSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC(C)(C)[C@@H](c2ccccc2)C1 ZINC001176567884 1048726325 /nfs/dbraw/zinc/72/63/25/1048726325.db2.gz SFKCOXVABAAXSJ-LJQANCHMSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC(C)(C)[C@H](c2ccccc2)C1 ZINC001176567862 1048727315 /nfs/dbraw/zinc/72/73/15/1048727315.db2.gz SFKCOXVABAAXSJ-IBGZPJMESA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC(C)(C)[C@H](c2ccccc2)C1 ZINC001176567862 1048727328 /nfs/dbraw/zinc/72/73/28/1048727328.db2.gz SFKCOXVABAAXSJ-IBGZPJMESA-N 2 1 311.473 4.097 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCC(C)(C)C[C@@H]3C)CC2)[nH+]1 ZINC000483158998 1048746063 /nfs/dbraw/zinc/74/60/63/1048746063.db2.gz MTRXVPRMJYOTAP-MAUKXSAKSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@@]1(Cc2cccs2)CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001176663613 1048753825 /nfs/dbraw/zinc/75/38/25/1048753825.db2.gz HBIZDLALEZMFGW-SFHVURJKSA-N 2 1 306.519 4.021 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@]1(C)Cc1ccc(Cl)s1 ZINC001176663297 1048769277 /nfs/dbraw/zinc/76/92/77/1048769277.db2.gz FBNICGYYHSOKOO-MRXNPFEDSA-N 2 1 323.893 4.004 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@]1(C)Cc1ccc(Cl)s1 ZINC001176663297 1048769292 /nfs/dbraw/zinc/76/92/92/1048769292.db2.gz FBNICGYYHSOKOO-MRXNPFEDSA-N 2 1 323.893 4.004 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001190650762 1048772380 /nfs/dbraw/zinc/77/23/80/1048772380.db2.gz GDILJWNMMKHYHF-SJORKVTESA-N 2 1 316.480 4.112 20 0 DIADMP CC[C@H](C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181184 1048845229 /nfs/dbraw/zinc/84/52/29/1048845229.db2.gz PHIGAHXVNVJEHT-MJGOQNOKSA-N 2 1 300.490 4.177 20 0 DIADMP CC[C@H](C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181184 1048845245 /nfs/dbraw/zinc/84/52/45/1048845245.db2.gz PHIGAHXVNVJEHT-MJGOQNOKSA-N 2 1 300.490 4.177 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000483724065 1048847124 /nfs/dbraw/zinc/84/71/24/1048847124.db2.gz GBPCVQVJOUVGFW-KPFFTGBYSA-N 2 1 318.505 4.245 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000483724065 1048847140 /nfs/dbraw/zinc/84/71/40/1048847140.db2.gz GBPCVQVJOUVGFW-KPFFTGBYSA-N 2 1 318.505 4.245 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734590 1048848789 /nfs/dbraw/zinc/84/87/89/1048848789.db2.gz WAMQYIHBFHJYFO-ZIBATOQPSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734590 1048848793 /nfs/dbraw/zinc/84/87/93/1048848793.db2.gz WAMQYIHBFHJYFO-ZIBATOQPSA-N 2 1 301.261 4.127 20 0 DIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CC1 ZINC000483731565 1048849958 /nfs/dbraw/zinc/84/99/58/1048849958.db2.gz SNVCYNQMLKMFJU-HXUWFJFHSA-N 2 1 312.457 4.190 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000483732919 1048850578 /nfs/dbraw/zinc/85/05/78/1048850578.db2.gz URZSYJYBGNCFAE-LZQZEXGQSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000483732919 1048850590 /nfs/dbraw/zinc/85/05/90/1048850590.db2.gz URZSYJYBGNCFAE-LZQZEXGQSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001177231600 1048851085 /nfs/dbraw/zinc/85/10/85/1048851085.db2.gz XAJYXGZMGCICDW-UXHICEINSA-N 2 1 302.506 4.423 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1ccc(F)cc1F ZINC001177299443 1048861916 /nfs/dbraw/zinc/86/19/16/1048861916.db2.gz QUWOEJJDQNJARL-IOBAAEILSA-N 2 1 322.443 4.222 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](Cc1ccccc1)CC2 ZINC001203306028 1048862916 /nfs/dbraw/zinc/86/29/16/1048862916.db2.gz BDIBUYRJRYPWBW-HXUWFJFHSA-N 2 1 324.468 4.156 20 0 DIADMP CC[C@H](C[NH2+]CC(C)(C)[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001177483618 1048896618 /nfs/dbraw/zinc/89/66/18/1048896618.db2.gz ZNBGFYGVAGNEPT-QZTJIDSGSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@H](C[NH2+]CC(C)(C)[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001177483618 1048896630 /nfs/dbraw/zinc/89/66/30/1048896630.db2.gz ZNBGFYGVAGNEPT-QZTJIDSGSA-N 2 1 302.506 4.280 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000194843793 1048930940 /nfs/dbraw/zinc/93/09/40/1048930940.db2.gz ZNYZUBRPBLEVAE-HNNXBMFYSA-N 2 1 306.519 4.180 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(O)c1 ZINC000194849447 1048934826 /nfs/dbraw/zinc/93/48/26/1048934826.db2.gz AGAYDQMTUKYVSJ-INIZCTEOSA-N 2 1 312.457 4.083 20 0 DIADMP CC(C)c1ccc(CCC[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001177816434 1048942953 /nfs/dbraw/zinc/94/29/53/1048942953.db2.gz OSQVRDJNXQHEFW-IBGZPJMESA-N 2 1 302.506 4.205 20 0 DIADMP CC(C)C1(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC001177932419 1048966374 /nfs/dbraw/zinc/96/63/74/1048966374.db2.gz JJNWPZLVVYDDTQ-UHFFFAOYSA-N 2 1 302.506 4.170 20 0 DIADMP Cc1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c(C)c1 ZINC001203739636 1048985988 /nfs/dbraw/zinc/98/59/88/1048985988.db2.gz NLMZWKIBEDZXRR-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)c1 ZINC001203739636 1048985999 /nfs/dbraw/zinc/98/59/99/1048985999.db2.gz NLMZWKIBEDZXRR-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC001203739636 1048986011 /nfs/dbraw/zinc/98/60/11/1048986011.db2.gz NLMZWKIBEDZXRR-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cc(C)c(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c(C)c1 ZINC001203745407 1048988396 /nfs/dbraw/zinc/98/83/96/1048988396.db2.gz UVCXGDFNYQQMAM-UHFFFAOYSA-N 2 1 302.506 4.164 20 0 DIADMP CCCc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC001178248580 1049000779 /nfs/dbraw/zinc/00/07/79/1049000779.db2.gz DFPAWXDGHYTDJN-FQEVSTJZSA-N 2 1 302.506 4.097 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)c1Cl ZINC001206324428 1049008764 /nfs/dbraw/zinc/00/87/64/1049008764.db2.gz BFLAUOMPLLEVNL-INIZCTEOSA-N 2 1 315.288 4.253 20 0 DIADMP c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)CCC[C@H]3[NH2+]C[C@H]2CC=CCC2)cc1 ZINC001178285416 1049011989 /nfs/dbraw/zinc/01/19/89/1049011989.db2.gz QELSUCHLRVGEFG-WSWWRLHASA-N 2 1 324.512 4.233 20 0 DIADMP Cc1cccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)c1 ZINC001203891367 1049023129 /nfs/dbraw/zinc/02/31/29/1049023129.db2.gz WUWUYTTUIXIILN-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1cccc(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001203894936 1049025277 /nfs/dbraw/zinc/02/52/77/1049025277.db2.gz NDLWICMNZJFWSP-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1cccc(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC001203894936 1049025284 /nfs/dbraw/zinc/02/52/84/1049025284.db2.gz NDLWICMNZJFWSP-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1cccc(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC001203894936 1049025299 /nfs/dbraw/zinc/02/52/99/1049025299.db2.gz NDLWICMNZJFWSP-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP C[N@H+](Cc1cccs1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001204015423 1049063688 /nfs/dbraw/zinc/06/36/88/1049063688.db2.gz BFWKNFYIBZHPQN-UHFFFAOYSA-N 2 1 314.498 4.092 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195139128 1049070659 /nfs/dbraw/zinc/07/06/59/1049070659.db2.gz QBFLFKPQAYKRIU-WMZOPIPTSA-N 2 1 314.498 4.229 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162776 1049100258 /nfs/dbraw/zinc/10/02/58/1049100258.db2.gz NXTPGFGVEXRMHW-DZKIICNBSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162776 1049100262 /nfs/dbraw/zinc/10/02/62/1049100262.db2.gz NXTPGFGVEXRMHW-DZKIICNBSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162776 1049100264 /nfs/dbraw/zinc/10/02/64/1049100264.db2.gz NXTPGFGVEXRMHW-DZKIICNBSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162776 1049100269 /nfs/dbraw/zinc/10/02/69/1049100269.db2.gz NXTPGFGVEXRMHW-DZKIICNBSA-N 2 1 324.559 4.337 20 0 DIADMP CC(C)c1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001204166474 1049101787 /nfs/dbraw/zinc/10/17/87/1049101787.db2.gz VJZBRURLFLQPTN-UHFFFAOYSA-N 2 1 302.506 4.362 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001178916700 1049109683 /nfs/dbraw/zinc/10/96/83/1049109683.db2.gz NAJCMPWJOOXPSW-VMEIHUARSA-N 2 1 306.881 4.065 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178922199 1049109717 /nfs/dbraw/zinc/10/97/17/1049109717.db2.gz RFSMRFRBQMXFKT-VBSBHUPXSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178922199 1049109723 /nfs/dbraw/zinc/10/97/23/1049109723.db2.gz RFSMRFRBQMXFKT-VBSBHUPXSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCC[N@@H+](C)C2)C[C@@H](c2ccccc2)C1 ZINC001178917152 1049109910 /nfs/dbraw/zinc/10/99/10/1049109910.db2.gz UXAYZDNLVHUAMV-YHELAOLJSA-N 2 1 314.517 4.280 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCc2ccccc2)CC1)CC(C)C ZINC001192491072 1049111603 /nfs/dbraw/zinc/11/16/03/1049111603.db2.gz ZOSLISQBCFXWBK-UHFFFAOYSA-N 2 1 316.533 4.309 20 0 DIADMP CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001192645071 1049127236 /nfs/dbraw/zinc/12/72/36/1049127236.db2.gz GRQWBXOUJAVKDL-XLIONFOSSA-N 2 1 300.490 4.435 20 0 DIADMP COc1ccc(C[NH2+]CCC[N@H+](C)CC(C)C)cc1C(C)(C)C ZINC001179082177 1049129111 /nfs/dbraw/zinc/12/91/11/1049129111.db2.gz UYRMIZZKUWRSSS-UHFFFAOYSA-N 2 1 320.521 4.060 20 0 DIADMP COc1ccc(C[NH2+]CCC[N@@H+](C)CC(C)C)cc1C(C)(C)C ZINC001179082177 1049129118 /nfs/dbraw/zinc/12/91/18/1049129118.db2.gz UYRMIZZKUWRSSS-UHFFFAOYSA-N 2 1 320.521 4.060 20 0 DIADMP CC[N@H+](Cc1ccccc1C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001204325457 1049142074 /nfs/dbraw/zinc/14/20/74/1049142074.db2.gz YGAKGUYRDJYHQV-OAQYLSRUSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccccc1C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001204325457 1049142080 /nfs/dbraw/zinc/14/20/80/1049142080.db2.gz YGAKGUYRDJYHQV-OAQYLSRUSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccccc1C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001204325457 1049142084 /nfs/dbraw/zinc/14/20/84/1049142084.db2.gz YGAKGUYRDJYHQV-OAQYLSRUSA-N 2 1 322.496 4.339 20 0 DIADMP CCC(CC)C[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001193095331 1049181705 /nfs/dbraw/zinc/18/17/05/1049181705.db2.gz XHYZMNZMKZXDAP-YRWFTTLQSA-N 2 1 302.506 4.169 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC001204527010 1049183338 /nfs/dbraw/zinc/18/33/38/1049183338.db2.gz ZROKBGWVRVEPHB-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)c1 ZINC001204527010 1049183343 /nfs/dbraw/zinc/18/33/43/1049183343.db2.gz ZROKBGWVRVEPHB-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001204552670 1049187214 /nfs/dbraw/zinc/18/72/14/1049187214.db2.gz PLDZCKXTPQIPMQ-IBDYFIJFSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001204552670 1049187221 /nfs/dbraw/zinc/18/72/21/1049187221.db2.gz PLDZCKXTPQIPMQ-IBDYFIJFSA-N 2 1 314.517 4.289 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc(C[NH+](C)C)cc2)nc1 ZINC001204621369 1049202903 /nfs/dbraw/zinc/20/29/03/1049202903.db2.gz WXHKEJZHAIIDHF-QGZVFWFLSA-N 2 1 323.484 4.185 20 0 DIADMP C[NH+](C)Cc1ccc(-c2ccc3c(c2)[nH]c2cc[nH+]cc23)cc1 ZINC001204654631 1049211105 /nfs/dbraw/zinc/21/11/05/1049211105.db2.gz UUAIEXKDCPDNTE-UHFFFAOYSA-N 2 1 301.393 4.445 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCN(C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107262 1049218308 /nfs/dbraw/zinc/21/83/08/1049218308.db2.gz MNIHORATMYDZMJ-OLZOCXBDSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107262 1049218324 /nfs/dbraw/zinc/21/83/24/1049218324.db2.gz MNIHORATMYDZMJ-OLZOCXBDSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107262 1049218334 /nfs/dbraw/zinc/21/83/34/1049218334.db2.gz MNIHORATMYDZMJ-OLZOCXBDSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001179878335 1049226043 /nfs/dbraw/zinc/22/60/43/1049226043.db2.gz OIVJZOHLSATOHT-UYAOXDASSA-N 2 1 306.538 4.401 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924894 1049228283 /nfs/dbraw/zinc/22/82/83/1049228283.db2.gz LQRNZMNUKZNUGQ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924894 1049228295 /nfs/dbraw/zinc/22/82/95/1049228295.db2.gz LQRNZMNUKZNUGQ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001179924894 1049228301 /nfs/dbraw/zinc/22/83/01/1049228301.db2.gz LQRNZMNUKZNUGQ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001179924894 1049228311 /nfs/dbraw/zinc/22/83/11/1049228311.db2.gz LQRNZMNUKZNUGQ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP CC1(C)CCC[C@H](C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC001179926507 1049231089 /nfs/dbraw/zinc/23/10/89/1049231089.db2.gz YPCYSZYTQHXLRY-LNLFQRSKSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001179926507 1049231098 /nfs/dbraw/zinc/23/10/98/1049231098.db2.gz YPCYSZYTQHXLRY-LNLFQRSKSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001179926507 1049231104 /nfs/dbraw/zinc/23/11/04/1049231104.db2.gz YPCYSZYTQHXLRY-LNLFQRSKSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC001179926510 1049232010 /nfs/dbraw/zinc/23/20/10/1049232010.db2.gz YPCYSZYTQHXLRY-YQVWRLOYSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001179926510 1049232019 /nfs/dbraw/zinc/23/20/19/1049232019.db2.gz YPCYSZYTQHXLRY-YQVWRLOYSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001179926510 1049232030 /nfs/dbraw/zinc/23/20/30/1049232030.db2.gz YPCYSZYTQHXLRY-YQVWRLOYSA-N 2 1 304.522 4.152 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC001179904455 1049239277 /nfs/dbraw/zinc/23/92/77/1049239277.db2.gz BZUSWHZRJQYOSU-IHPCNDPISA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC001179904455 1049239285 /nfs/dbraw/zinc/23/92/85/1049239285.db2.gz BZUSWHZRJQYOSU-IHPCNDPISA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC001179904455 1049239296 /nfs/dbraw/zinc/23/92/96/1049239296.db2.gz BZUSWHZRJQYOSU-IHPCNDPISA-N 2 1 302.506 4.088 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCC1CCCC1 ZINC001193649287 1049240654 /nfs/dbraw/zinc/24/06/54/1049240654.db2.gz NRKWXDCZRGHSHL-WIYYLYMNSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCC1CCCC1 ZINC001193649287 1049240662 /nfs/dbraw/zinc/24/06/62/1049240662.db2.gz NRKWXDCZRGHSHL-WIYYLYMNSA-N 2 1 314.517 4.457 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)cc2)cc1 ZINC001204727784 1049241716 /nfs/dbraw/zinc/24/17/16/1049241716.db2.gz OXFFHHPKENBKKC-UHFFFAOYSA-N 2 1 320.480 4.319 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(C)(C)C)cc1 ZINC000195651611 1049245333 /nfs/dbraw/zinc/24/53/33/1049245333.db2.gz BBENRTRHLUTFRK-CVEARBPZSA-N 2 1 300.490 4.119 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000485439573 1049246114 /nfs/dbraw/zinc/24/61/14/1049246114.db2.gz OLKJVYPTJGJHFK-JKSUJKDBSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000485439573 1049246123 /nfs/dbraw/zinc/24/61/23/1049246123.db2.gz OLKJVYPTJGJHFK-JKSUJKDBSA-N 2 1 306.881 4.209 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+]([C@@H]4C=CCCC4)C3)CC2)cc1 ZINC000485495450 1049268340 /nfs/dbraw/zinc/26/83/40/1049268340.db2.gz UGZQHXCFSPVIFZ-HXUWFJFHSA-N 2 1 310.485 4.083 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2cc(C)ccc2C)CC1 ZINC001180059362 1049269809 /nfs/dbraw/zinc/26/98/09/1049269809.db2.gz XMOCFVJDOSHMEO-FQEVSTJZSA-N 2 1 300.490 4.172 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001180129053 1049278218 /nfs/dbraw/zinc/27/82/18/1049278218.db2.gz HGFKKKJYLQSDBI-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CCCSC(C)(C)C)CC1 ZINC001193873088 1049279357 /nfs/dbraw/zinc/27/93/57/1049279357.db2.gz RJHMJELUSZGGJU-UHFFFAOYSA-N 2 1 322.518 4.155 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccns2)cc1 ZINC000858577461 1049281516 /nfs/dbraw/zinc/28/15/16/1049281516.db2.gz QCJCLEAENYIXOM-OLZOCXBDSA-N 2 1 312.442 4.049 20 0 DIADMP Cc1cccc([C@H]2CCC[N@H+]2Cc2cc3c(s2)CC[NH2+]C3)c1 ZINC001204848585 1049283753 /nfs/dbraw/zinc/28/37/53/1049283753.db2.gz OCWOXQDQVSHTTK-GOSISDBHSA-N 2 1 312.482 4.039 20 0 DIADMP C[C@H]1C[C@@H](N(C)CC[C@H]2CCCC[N@H+]2C)c2ccsc2S1 ZINC001180099261 1049284584 /nfs/dbraw/zinc/28/45/84/1049284584.db2.gz XIKGBECDBUWRAY-SQWLQELKSA-N 2 1 324.559 4.480 20 0 DIADMP CC(C)[C@@H](C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001180147115 1049296498 /nfs/dbraw/zinc/29/64/98/1049296498.db2.gz DOCXVJOZSAANTL-NHCUHLMSSA-N 2 1 314.517 4.377 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)c(F)c1 ZINC001204893524 1049304050 /nfs/dbraw/zinc/30/40/50/1049304050.db2.gz ISPJVDUKQUGPCX-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)c(F)c1 ZINC001204893524 1049304059 /nfs/dbraw/zinc/30/40/59/1049304059.db2.gz ISPJVDUKQUGPCX-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](C[C@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001205001330 1049337990 /nfs/dbraw/zinc/33/79/90/1049337990.db2.gz PYARBZXURACKQB-MJGOQNOKSA-N 2 1 316.533 4.094 20 0 DIADMP CC[NH+](CC)CCC[NH+]1CCC([C@H](F)c2ccccc2F)CC1 ZINC001194231526 1049338410 /nfs/dbraw/zinc/33/84/10/1049338410.db2.gz MAWHWVDZQGUGAP-IBGZPJMESA-N 2 1 324.459 4.280 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001205009301 1049339570 /nfs/dbraw/zinc/33/95/70/1049339570.db2.gz MWVOHGTXVPBZPO-OAHLLOKOSA-N 2 1 324.493 4.486 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2C)C1 ZINC001205016256 1049344028 /nfs/dbraw/zinc/34/40/28/1049344028.db2.gz HSUQVUXLXIZQKH-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2C)C1 ZINC001205016258 1049344765 /nfs/dbraw/zinc/34/47/65/1049344765.db2.gz HSUQVUXLXIZQKH-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001205058678 1049358057 /nfs/dbraw/zinc/35/80/57/1049358057.db2.gz RGFNMMQUNVQUHX-JSGCOSHPSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001205058678 1049358071 /nfs/dbraw/zinc/35/80/71/1049358071.db2.gz RGFNMMQUNVQUHX-JSGCOSHPSA-N 2 1 312.910 4.022 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)CC1 ZINC001205109065 1049380789 /nfs/dbraw/zinc/38/07/89/1049380789.db2.gz ADMMVQDGOINCEY-SHBDEGQCSA-N 2 1 306.453 4.170 20 0 DIADMP Cc1cccc(N(C)c2ccc(C[N@H+]3CCC[C@H]([NH3+])CC3)cc2)c1 ZINC001205116571 1049383650 /nfs/dbraw/zinc/38/36/50/1049383650.db2.gz CYRHDHUNWBAVSW-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](CC(c2ccccc2)c2ccccc2)CC1 ZINC001205256196 1049418158 /nfs/dbraw/zinc/41/81/58/1049418158.db2.gz NVERXCCYTFNNAE-NRFANRHFSA-N 2 1 308.469 4.022 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC1 ZINC001205263847 1049419538 /nfs/dbraw/zinc/41/95/38/1049419538.db2.gz CPVUJGPKUYUYON-HXUWFJFHSA-N 2 1 310.441 4.182 20 0 DIADMP CC(C)CC[NH+]1CCC([NH2+]Cc2cccc(C(F)F)c2)CC1 ZINC001180897656 1049421776 /nfs/dbraw/zinc/42/17/76/1049421776.db2.gz XKCKGWPEHZCCCJ-UHFFFAOYSA-N 2 1 310.432 4.224 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001205273872 1049422943 /nfs/dbraw/zinc/42/29/43/1049422943.db2.gz QQTYBHAAQLOIAD-FQEVSTJZSA-N 2 1 312.432 4.196 20 0 DIADMP C[C@@H]([NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC001180978365 1049424165 /nfs/dbraw/zinc/42/41/65/1049424165.db2.gz ZRHOUEDQSMSNED-JFIYKMOQSA-N 2 1 314.498 4.309 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC001205303495 1049432519 /nfs/dbraw/zinc/43/25/19/1049432519.db2.gz GGYRNICQDWUTGR-VQIMIIECSA-N 2 1 308.469 4.079 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC001205303494 1049432578 /nfs/dbraw/zinc/43/25/78/1049432578.db2.gz GGYRNICQDWUTGR-QFBILLFUSA-N 2 1 308.469 4.079 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@H]1C[NH3+] ZINC001205306621 1049433168 /nfs/dbraw/zinc/43/31/68/1049433168.db2.gz YIBCUPCVHNTBSV-GDBMZVCRSA-N 2 1 308.425 4.003 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C[C@H]1C[NH3+] ZINC001205303651 1049433325 /nfs/dbraw/zinc/43/33/25/1049433325.db2.gz JBTBZNXMEMRIGA-GOEBONIOSA-N 2 1 308.425 4.003 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cccc1-c1ccccc1 ZINC001205318970 1049436045 /nfs/dbraw/zinc/43/60/45/1049436045.db2.gz XHBQRRTWYIMHKV-UZLBHIALSA-N 2 1 308.469 4.079 20 0 DIADMP C[C@H]1CC[NH2+]CC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001205324931 1049439099 /nfs/dbraw/zinc/43/90/99/1049439099.db2.gz IBBXNHZSSVOEFI-INIZCTEOSA-N 2 1 319.452 4.019 20 0 DIADMP C[C@@H]1CC[NH2+]CC[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001205332847 1049440751 /nfs/dbraw/zinc/44/07/51/1049440751.db2.gz UTGJXRABSRRDPP-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1CC[NH2+]CC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001205331526 1049441000 /nfs/dbraw/zinc/44/10/00/1049441000.db2.gz HOELSMIIYGRIHU-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1CC[NH2+]CC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001205331526 1049441004 /nfs/dbraw/zinc/44/10/04/1049441004.db2.gz HOELSMIIYGRIHU-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[NH2+]CC[C@@H]2C)c1 ZINC001205333234 1049441236 /nfs/dbraw/zinc/44/12/36/1049441236.db2.gz XZNKMWHRQRYLMG-SFHVURJKSA-N 2 1 308.469 4.154 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486699165 1049457205 /nfs/dbraw/zinc/45/72/05/1049457205.db2.gz WOHJFCPXZMTTJZ-HNNXBMFYSA-N 2 1 317.452 4.051 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cc2ccccc2[nH]1 ZINC000775624164 1049457576 /nfs/dbraw/zinc/45/75/76/1049457576.db2.gz YHWLAGHOHDCEFM-QGZVFWFLSA-N 2 1 321.468 4.341 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000173441657 1049466791 /nfs/dbraw/zinc/46/67/91/1049466791.db2.gz DVHLEHZNXCLJQW-AWEZNQCLSA-N 2 1 303.475 4.044 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1ccc2nc(C)ccc2c1 ZINC001181506626 1049485530 /nfs/dbraw/zinc/48/55/30/1049485530.db2.gz UACHVFZVLHEIQM-UHFFFAOYSA-N 2 1 313.489 4.097 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)C/C=C/c1ccc(F)cc1F ZINC001181506915 1049485868 /nfs/dbraw/zinc/48/58/68/1049485868.db2.gz WYOSAGJRSYOEEF-VQHVLOKHSA-N 2 1 310.432 4.032 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)C/C=C/c1ccc(F)cc1F ZINC001181506915 1049485881 /nfs/dbraw/zinc/48/58/81/1049485881.db2.gz WYOSAGJRSYOEEF-VQHVLOKHSA-N 2 1 310.432 4.032 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H]2CC=CCC2)CC1)CC(C)C ZINC001181515017 1049486400 /nfs/dbraw/zinc/48/64/00/1049486400.db2.gz PGHYBQMSFLKSJW-HXUWFJFHSA-N 2 1 306.538 4.423 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@](F)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001205545531 1049495505 /nfs/dbraw/zinc/49/55/05/1049495505.db2.gz IZBCFDUYMYZFOM-JXFKEZNVSA-N 2 1 314.448 4.096 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2sccc2Cl)C1 ZINC000486951717 1049497638 /nfs/dbraw/zinc/49/76/38/1049497638.db2.gz UIPQLPQGTNCIGK-CYBMUJFWSA-N 2 1 300.899 4.003 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccccc2-c2ccccc2)CC1 ZINC001205571623 1049501207 /nfs/dbraw/zinc/50/12/07/1049501207.db2.gz WINCOCQQXXATFM-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccccc2-c2ccccc2)CC1 ZINC001205571622 1049501741 /nfs/dbraw/zinc/50/17/41/1049501741.db2.gz WINCOCQQXXATFM-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccs3)s2)CC[C@H]1C[NH3+] ZINC001205618118 1049511152 /nfs/dbraw/zinc/51/11/52/1049511152.db2.gz RQQFCKRFYIRAFZ-KBPBESRZSA-N 2 1 320.527 4.283 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccccc2Oc2ccccc2)CC[C@@H]1C[NH3+] ZINC001205616440 1049511567 /nfs/dbraw/zinc/51/15/67/1049511567.db2.gz FPYQHHSPZMXHIJ-ZWKOTPCHSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)CC[C@H]1C[NH3+] ZINC001205618256 1049513790 /nfs/dbraw/zinc/51/37/90/1049513790.db2.gz TWOBJJZBVMCVQL-RDJZCZTQSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CC[C@@H]1C[NH3+] ZINC001205626255 1049514618 /nfs/dbraw/zinc/51/46/18/1049514618.db2.gz FBGUKWZBIVYPCM-QFBILLFUSA-N 2 1 320.480 4.065 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)CC[C@@H]1C[NH3+] ZINC001205625952 1049514641 /nfs/dbraw/zinc/51/46/41/1049514641.db2.gz CXFWZQYKRBAKPT-JKSUJKDBSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC[C@@H]1C[NH3+] ZINC001205629146 1049515753 /nfs/dbraw/zinc/51/57/53/1049515753.db2.gz XUVXNAVLAWOPFN-MAUKXSAKSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205638639 1049517455 /nfs/dbraw/zinc/51/74/55/1049517455.db2.gz QKAWWISYWWXAIB-PKOBYXMFSA-N 2 1 322.496 4.469 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c(Cl)c1Cl ZINC001205639085 1049517947 /nfs/dbraw/zinc/51/79/47/1049517947.db2.gz VOOYMEZQFMJVOT-DGCLKSJQSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205638359 1049518528 /nfs/dbraw/zinc/51/85/28/1049518528.db2.gz MZEGBSMZCSCCNP-ZFWWWQNUSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CC[C@@H](C)[C@H](C[NH3+])CC3)c(C)c12 ZINC001205638674 1049518606 /nfs/dbraw/zinc/51/86/06/1049518606.db2.gz QQWIIXOERHTEKW-RISCZKNCSA-N 2 1 322.543 4.386 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205638357 1049518804 /nfs/dbraw/zinc/51/88/04/1049518804.db2.gz MZEGBSMZCSCCNP-HIFRSBDPSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205654159 1049523643 /nfs/dbraw/zinc/52/36/43/1049523643.db2.gz WOVJHUUCQTWPTN-AAEUAGOBSA-N 2 1 315.288 4.109 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)c(C)c1 ZINC001205696569 1049535031 /nfs/dbraw/zinc/53/50/31/1049535031.db2.gz KWUOCPVQUFUUNU-UHFFFAOYSA-N 2 1 316.411 4.178 20 0 DIADMP CCC(CC)(C[NH2+]C[C@@H]1CCSC1)[NH2+][C@@H](C)c1ccccc1 ZINC000487288270 1049545390 /nfs/dbraw/zinc/54/53/90/1049545390.db2.gz MOAGYHZHRBEJIB-IRXDYDNUSA-N 2 1 320.546 4.239 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC001181933823 1049548645 /nfs/dbraw/zinc/54/86/45/1049548645.db2.gz QFGLZZUVLSFXMV-LPHOPBHVSA-N 2 1 306.469 4.029 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC001182152086 1049577526 /nfs/dbraw/zinc/57/75/26/1049577526.db2.gz IJPNVUSVUQGFNM-ROUUACIJSA-N 2 1 304.522 4.453 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC001182152086 1049577539 /nfs/dbraw/zinc/57/75/39/1049577539.db2.gz IJPNVUSVUQGFNM-ROUUACIJSA-N 2 1 304.522 4.453 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001205902200 1049593903 /nfs/dbraw/zinc/59/39/03/1049593903.db2.gz IOSDFYXSEOZCBZ-ZBFHGGJFSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001205901988 1049594774 /nfs/dbraw/zinc/59/47/74/1049594774.db2.gz GQSHTEABZFEZDZ-OLZOCXBDSA-N 2 1 306.500 4.036 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC001205903655 1049596025 /nfs/dbraw/zinc/59/60/25/1049596025.db2.gz QPNBRHXQCBNOAM-FUHWJXTLSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC001205903657 1049598425 /nfs/dbraw/zinc/59/84/25/1049598425.db2.gz QPNBRHXQCBNOAM-SJLPKXTDSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001205903710 1049598791 /nfs/dbraw/zinc/59/87/91/1049598791.db2.gz QVJDAQGJEQHSEI-UONOGXRCSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205913409 1049599817 /nfs/dbraw/zinc/59/98/17/1049599817.db2.gz ICCVEMMSVBUMIU-RDJZCZTQSA-N 2 1 312.432 4.052 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@H](C[NH3+])[C@H]1C ZINC001205915872 1049601714 /nfs/dbraw/zinc/60/17/14/1049601714.db2.gz RFJIBKFTSGMXHP-QZTJIDSGSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1c(C)cccc1C ZINC001196021326 1049604467 /nfs/dbraw/zinc/60/44/67/1049604467.db2.gz FZXVGYUAJVNRLA-IBGZPJMESA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1c(C)cccc1C ZINC001196021326 1049604480 /nfs/dbraw/zinc/60/44/80/1049604480.db2.gz FZXVGYUAJVNRLA-IBGZPJMESA-N 2 1 311.473 4.426 20 0 DIADMP [NH3+][C@@H]1CCCC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001205932714 1049606375 /nfs/dbraw/zinc/60/63/75/1049606375.db2.gz TWLUZKJMFFMUDC-QGZVFWFLSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@@H]1CCCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001205932714 1049606379 /nfs/dbraw/zinc/60/63/79/1049606379.db2.gz TWLUZKJMFFMUDC-QGZVFWFLSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@@H]1CCCC[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001205933098 1049606654 /nfs/dbraw/zinc/60/66/54/1049606654.db2.gz YDAWSMZCGKRHMG-QGZVFWFLSA-N 2 1 319.452 4.148 20 0 DIADMP [NH3+][C@@H]1CCCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001205933098 1049606663 /nfs/dbraw/zinc/60/66/63/1049606663.db2.gz YDAWSMZCGKRHMG-QGZVFWFLSA-N 2 1 319.452 4.148 20 0 DIADMP CC1(C)CCC[N@@H+]1CC[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001182310494 1049617453 /nfs/dbraw/zinc/61/74/53/1049617453.db2.gz ZQBAQQSRQZSZMN-UHFFFAOYSA-N 2 1 314.517 4.351 20 0 DIADMP CC1(C)CCC[N@H+]1CC[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001182310494 1049617456 /nfs/dbraw/zinc/61/74/56/1049617456.db2.gz ZQBAQQSRQZSZMN-UHFFFAOYSA-N 2 1 314.517 4.351 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)cc1 ZINC001205993413 1049620795 /nfs/dbraw/zinc/62/07/95/1049620795.db2.gz HPPMJVNRPDDYKX-HKUYNNGSSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3)s2)CCC[C@H]1C[NH3+] ZINC001206003512 1049626369 /nfs/dbraw/zinc/62/63/69/1049626369.db2.gz IUYDUTJMUJPBGC-RDJZCZTQSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2-c2ccccc2)CCC[C@H]1C[NH3+] ZINC001206011521 1049627644 /nfs/dbraw/zinc/62/76/44/1049627644.db2.gz DCZOCRYLRLNLRO-HKUYNNGSSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cc(-c3ccsc3)cs2)CCC[C@H]1C[NH3+] ZINC001206021747 1049632612 /nfs/dbraw/zinc/63/26/12/1049632612.db2.gz AVXNAMZOOWACTN-KBPBESRZSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1cc(Cl)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(Cl)c1 ZINC001206024607 1049632779 /nfs/dbraw/zinc/63/27/79/1049632779.db2.gz KSKGNSPZWLPUOE-STQMWFEESA-N 2 1 315.288 4.109 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001206056133 1049642428 /nfs/dbraw/zinc/64/24/28/1049642428.db2.gz PIACNGRPOBCMED-YZGWKJHDSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001206056133 1049642431 /nfs/dbraw/zinc/64/24/31/1049642431.db2.gz PIACNGRPOBCMED-YZGWKJHDSA-N 2 1 302.506 4.108 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)CS1 ZINC000488415157 1049648650 /nfs/dbraw/zinc/64/86/50/1049648650.db2.gz PDCZAEFUMGSPHX-RTBURBONSA-N 2 1 320.546 4.147 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488436758 1049652956 /nfs/dbraw/zinc/65/29/56/1049652956.db2.gz VHQFQPBBDUYBSE-IKGGRYGDSA-N 2 1 312.567 4.008 20 0 DIADMP CCCC[N@@H+](Cc1cccnc1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196544480 1049668035 /nfs/dbraw/zinc/66/80/35/1049668035.db2.gz DFVXFWKLCNMXLV-UHFFFAOYSA-N 2 1 317.521 4.301 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)CCC2 ZINC000339070334 1049673454 /nfs/dbraw/zinc/67/34/54/1049673454.db2.gz MNGQSUGDHADKPL-XLIONFOSSA-N 2 1 300.490 4.082 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](CCSC2CCCCC2)CC1 ZINC001196728019 1049683001 /nfs/dbraw/zinc/68/30/01/1049683001.db2.gz READGFVJEDZSRJ-UHFFFAOYSA-N 2 1 324.578 4.393 20 0 DIADMP CCCC[C@H]1CCC[C@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001182542785 1049686229 /nfs/dbraw/zinc/68/62/29/1049686229.db2.gz GAMOGGAVSVMPSU-JSXRDJHFSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC001206263638 1049693062 /nfs/dbraw/zinc/69/30/62/1049693062.db2.gz POZCCAVAMNUPNM-SKWUIDRYSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC001206263638 1049693065 /nfs/dbraw/zinc/69/30/65/1049693065.db2.gz POZCCAVAMNUPNM-SKWUIDRYSA-N 2 1 320.908 4.439 20 0 DIADMP CC(C)C[N@H+](Cc1ccccc1Cl)CC1CC[NH+](C)CC1 ZINC001197194511 1049726928 /nfs/dbraw/zinc/72/69/28/1049726928.db2.gz OGJNOCKNRZFXEV-UHFFFAOYSA-N 2 1 308.897 4.140 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+]C(C1CCCCC1)C1CCCCC1 ZINC001197264036 1049733756 /nfs/dbraw/zinc/73/37/56/1049733756.db2.gz KBBURGIUTNZVGW-UHFFFAOYSA-N 2 1 317.521 4.472 20 0 DIADMP C[N@H+](CC/C=C/c1ccccc1)CCCC[NH+]1CCCCC1 ZINC001197285480 1049738233 /nfs/dbraw/zinc/73/82/33/1049738233.db2.gz QNQNLFQXSVQJCY-MKMNVTDBSA-N 2 1 300.490 4.288 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)C1 ZINC001206540158 1049754013 /nfs/dbraw/zinc/75/40/13/1049754013.db2.gz AQKYWYHZRSJEEF-NRFANRHFSA-N 2 1 324.468 4.430 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1(C)C ZINC001197483952 1049754557 /nfs/dbraw/zinc/75/45/57/1049754557.db2.gz TXLLFGFWRHASDR-QGZVFWFLSA-N 2 1 317.864 4.113 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CC[C@H](c2cccc(Cl)c2)C1(C)C ZINC001197483952 1049754566 /nfs/dbraw/zinc/75/45/66/1049754566.db2.gz TXLLFGFWRHASDR-QGZVFWFLSA-N 2 1 317.864 4.113 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206556067 1049755598 /nfs/dbraw/zinc/75/55/98/1049755598.db2.gz MYNOJXYAOLAGSU-OAQYLSRUSA-N 2 1 308.469 4.305 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccccc2-c2cccs2)C1 ZINC001206556446 1049756012 /nfs/dbraw/zinc/75/60/12/1049756012.db2.gz RYKHALKMCDWVEL-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(-c2ccncc2)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206583438 1049762904 /nfs/dbraw/zinc/76/29/04/1049762904.db2.gz UTUXXKGAGSZDNW-OAQYLSRUSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CCC[NH2+]CC1 ZINC001206580986 1049762976 /nfs/dbraw/zinc/76/29/76/1049762976.db2.gz GYLHSIUDOYVJAH-HNNXBMFYSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CCC[NH2+]CC1 ZINC001206580986 1049762980 /nfs/dbraw/zinc/76/29/80/1049762980.db2.gz GYLHSIUDOYVJAH-HNNXBMFYSA-N 2 1 315.288 4.346 20 0 DIADMP CCn1ccc2c1cccc2C[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206589549 1049763537 /nfs/dbraw/zinc/76/35/37/1049763537.db2.gz HZJJENRVGMOLQI-GOSISDBHSA-N 2 1 313.489 4.014 20 0 DIADMP CC(C)[N@@H+](Cc1c(Cl)[nH]c2ccccc21)[C@H]1CCC[NH2+]CC1 ZINC001206590985 1049763777 /nfs/dbraw/zinc/76/37/77/1049763777.db2.gz OQKHYSLCYCPUNI-AWEZNQCLSA-N 2 1 319.880 4.174 20 0 DIADMP CCOc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1Cl ZINC001206591636 1049763797 /nfs/dbraw/zinc/76/37/97/1049763797.db2.gz UMNLNIKJAYTBRC-MRXNPFEDSA-N 2 1 324.896 4.091 20 0 DIADMP CCCCc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)s1 ZINC001206591846 1049763876 /nfs/dbraw/zinc/76/38/76/1049763876.db2.gz WSZYERXDSMXGJQ-MRXNPFEDSA-N 2 1 308.535 4.443 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2sccc21)[C@@H]1CCC[NH2+]CC1 ZINC001206599745 1049767648 /nfs/dbraw/zinc/76/76/48/1049767648.db2.gz WVBOQDYHZYLPLW-MRXNPFEDSA-N 2 1 302.487 4.254 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCCC[C@@H](C[NH3+])C2)cc1 ZINC001206615490 1049769916 /nfs/dbraw/zinc/76/99/16/1049769916.db2.gz GEACTMUNTMNSMY-IBGZPJMESA-N 2 1 318.505 4.207 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001206615563 1049770321 /nfs/dbraw/zinc/77/03/21/1049770321.db2.gz IYDQARLSKWVKTC-QGZVFWFLSA-N 2 1 312.432 4.054 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001206727476 1049785441 /nfs/dbraw/zinc/78/54/41/1049785441.db2.gz IMUJPJIXCUNDEC-TYPHKJRUSA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001206727476 1049785449 /nfs/dbraw/zinc/78/54/49/1049785449.db2.gz IMUJPJIXCUNDEC-TYPHKJRUSA-N 2 1 312.501 4.379 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001206769262 1049794949 /nfs/dbraw/zinc/79/49/49/1049794949.db2.gz NUDNDGXNENABFP-ZIAGYGMSSA-N 2 1 318.848 4.159 20 0 DIADMP Cc1csc2sc(C[N@@H+]3C[C@H](C[NH3+])CC[C@H]3C)c(C)c12 ZINC001206769081 1049795100 /nfs/dbraw/zinc/79/51/00/1049795100.db2.gz NHKGILVOTFWFGJ-YPMHNXCESA-N 2 1 308.516 4.139 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001206769088 1049795359 /nfs/dbraw/zinc/79/53/59/1049795359.db2.gz NJWCXKBOKNTZFK-SJLPKXTDSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001206767799 1049795745 /nfs/dbraw/zinc/79/57/45/1049795745.db2.gz FGZGMEPFJDVVHK-GDBMZVCRSA-N 2 1 308.425 4.145 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@H]3C)cc2)cc1 ZINC001206769671 1049795830 /nfs/dbraw/zinc/79/58/30/1049795830.db2.gz PEIRKWYGUANVRK-MJGOQNOKSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001206769711 1049796373 /nfs/dbraw/zinc/79/63/73/1049796373.db2.gz POBNLZHIHNDXRW-IRXDYDNUSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001206770124 1049796919 /nfs/dbraw/zinc/79/69/19/1049796919.db2.gz REPMFHLDVZDRQH-LSDHHAIUSA-N 2 1 316.470 4.100 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccc(C)cc2)C[C@H]1C ZINC000490058954 1049797804 /nfs/dbraw/zinc/79/78/04/1049797804.db2.gz TYVLFGICNNOSKP-YLJYHZDGSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccc(C)cc2)C[C@H]1C ZINC000490058954 1049797808 /nfs/dbraw/zinc/79/78/08/1049797808.db2.gz TYVLFGICNNOSKP-YLJYHZDGSA-N 2 1 311.473 4.158 20 0 DIADMP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC001206799791 1049802166 /nfs/dbraw/zinc/80/21/66/1049802166.db2.gz GBFYBYJYGLAZEE-FYZZASKESA-N 2 1 314.517 4.232 20 0 DIADMP CC[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(F)cn1 ZINC000490152908 1049802652 /nfs/dbraw/zinc/80/26/52/1049802652.db2.gz YURWWNJMEJAYPR-SOLBZPMBSA-N 2 1 321.484 4.020 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@H]3C)cc2)c1 ZINC001206809701 1049803900 /nfs/dbraw/zinc/80/39/00/1049803900.db2.gz MJLNSJOBBDCTKY-MJGOQNOKSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccccc1CCc1ccccc1 ZINC001206805679 1049804091 /nfs/dbraw/zinc/80/40/91/1049804091.db2.gz CGQOVGXQGSTJDB-QUCCMNQESA-N 2 1 322.496 4.031 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001206811470 1049805852 /nfs/dbraw/zinc/80/58/52/1049805852.db2.gz UZACRYWEYKBJGZ-NVXWUHKLSA-N 2 1 312.432 4.052 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CSc2ccccc2)C(C)C)C1 ZINC000490171210 1049807700 /nfs/dbraw/zinc/80/77/00/1049807700.db2.gz AQBSDVDPTLWIGL-MJGOQNOKSA-N 2 1 320.546 4.125 20 0 DIADMP CC(C)c1ccc(CC[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC001206826825 1049808631 /nfs/dbraw/zinc/80/86/31/1049808631.db2.gz FDCVFAMJTPIGAG-HXUWFJFHSA-N 2 1 314.517 4.064 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001207286456 1049873763 /nfs/dbraw/zinc/87/37/63/1049873763.db2.gz RWQCKMSINOTNAJ-NRFANRHFSA-N 2 1 322.496 4.222 20 0 DIADMP C[C@@H]1CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001207286413 1049874752 /nfs/dbraw/zinc/87/47/52/1049874752.db2.gz IPZRELYVCHJBQU-GOSISDBHSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207291333 1049875344 /nfs/dbraw/zinc/87/53/44/1049875344.db2.gz NUXCVDRGOOUYNP-GOSISDBHSA-N 2 1 300.490 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CCCC4(CCC4)C3)CC2)cc1 ZINC001207293935 1049875796 /nfs/dbraw/zinc/87/57/96/1049875796.db2.gz NTOCVZBLCRJTAA-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC001207289879 1049876327 /nfs/dbraw/zinc/87/63/27/1049876327.db2.gz YPVDVCZAWOBAKB-RTWAWAEBSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@]1(F)CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001207287641 1049876616 /nfs/dbraw/zinc/87/66/16/1049876616.db2.gz VJSXTALLKLQOSC-HXUWFJFHSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491061211 1049882993 /nfs/dbraw/zinc/88/29/93/1049882993.db2.gz ZSAYHHWFAHNAFM-QZTJIDSGSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491061211 1049882997 /nfs/dbraw/zinc/88/29/97/1049882997.db2.gz ZSAYHHWFAHNAFM-QZTJIDSGSA-N 2 1 318.480 4.475 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2CCC2CC[NH+](C)CC2)c1 ZINC001207487984 1049897352 /nfs/dbraw/zinc/89/73/52/1049897352.db2.gz AQYGZNCMXZFCNB-FQEVSTJZSA-N 2 1 300.490 4.172 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1CCCc1ccccc1F ZINC001207494786 1049899123 /nfs/dbraw/zinc/89/91/23/1049899123.db2.gz JSGHPLJMHNDDLN-RBUKOAKNSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCCc1ccccc1F ZINC001207494786 1049899132 /nfs/dbraw/zinc/89/91/32/1049899132.db2.gz JSGHPLJMHNDDLN-RBUKOAKNSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCCc1ccccc1F ZINC001207494786 1049899137 /nfs/dbraw/zinc/89/91/37/1049899137.db2.gz JSGHPLJMHNDDLN-RBUKOAKNSA-N 2 1 318.480 4.097 20 0 DIADMP CCO[C@@H](C[NH2+]C1CCCCCCCCCCC1)C[NH+](C)C ZINC001207501770 1049901269 /nfs/dbraw/zinc/90/12/69/1049901269.db2.gz JIGWEFQBUPCZHZ-IBGZPJMESA-N 2 1 312.542 4.216 20 0 DIADMP C[N@@H+](C[C@@H]1C[C@H]2C=C[C@@H]1C2)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207626358 1049918092 /nfs/dbraw/zinc/91/80/92/1049918092.db2.gz BGMJMPGFTUVQBX-BDTNDASRSA-N 2 1 324.512 4.043 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001207626901 1049918286 /nfs/dbraw/zinc/91/82/86/1049918286.db2.gz NNLKXWVBXGCIBE-HBMCJLEFSA-N 2 1 324.512 4.185 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCC(C)(C)C2)C[C@@H]1c1ccccc1 ZINC000571174363 1049923653 /nfs/dbraw/zinc/92/36/53/1049923653.db2.gz PXCDNYQUVJHTNZ-IPMKNSEASA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCC(C)(C)C2)C[C@@H]1c1ccccc1 ZINC000571174363 1049923656 /nfs/dbraw/zinc/92/36/56/1049923656.db2.gz PXCDNYQUVJHTNZ-IPMKNSEASA-N 2 1 300.490 4.380 20 0 DIADMP Clc1ccc([C@H]2CCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168379117 1049937102 /nfs/dbraw/zinc/93/71/02/1049937102.db2.gz DRHIGGRZRVHGTP-LJQANCHMSA-N 2 1 318.892 4.351 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168379117 1049937108 /nfs/dbraw/zinc/93/71/08/1049937108.db2.gz DRHIGGRZRVHGTP-LJQANCHMSA-N 2 1 318.892 4.351 20 0 DIADMP CC(C)=CCC[C@H](C)CC[N@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@@H]2C1 ZINC001207783448 1049938975 /nfs/dbraw/zinc/93/89/75/1049938975.db2.gz GUMACBNCSXFWCO-HAGHYFMRSA-N 2 1 306.538 4.421 20 0 DIADMP c1ccc(C2(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)CC2)cc1 ZINC001207838834 1049943545 /nfs/dbraw/zinc/94/35/45/1049943545.db2.gz URALFOGDYRXYRL-HXUWFJFHSA-N 2 1 312.501 4.059 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[NH+]2CCC([NH+]3CCC3)CC2)cc1 ZINC001207936308 1049959300 /nfs/dbraw/zinc/95/93/00/1049959300.db2.gz FGNUZFJBZFRJRU-SFHVURJKSA-N 2 1 314.517 4.159 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001208106068 1049974052 /nfs/dbraw/zinc/97/40/52/1049974052.db2.gz FJDZWXFVXGOWBL-GOSISDBHSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@@H](CCc1ccco1)N[C@H](C[NH3+])c1ccc2ccccc2c1 ZINC000572112041 1049994498 /nfs/dbraw/zinc/99/44/98/1049994498.db2.gz AIGHHHBOMIIIKS-MGPUTAFESA-N 2 1 308.425 4.044 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC001208596582 1049998119 /nfs/dbraw/zinc/99/81/19/1049998119.db2.gz UOLFRBSEFFCGCB-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CCC3CC3)C[C@H]21 ZINC001208683134 1050001246 /nfs/dbraw/zinc/00/12/46/1050001246.db2.gz YODLMQADXGQRIP-QXAKKESOSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CCC3CC3)C[C@H]21 ZINC001208683134 1050001250 /nfs/dbraw/zinc/00/12/50/1050001250.db2.gz YODLMQADXGQRIP-QXAKKESOSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](CCC3CC3)C[C@H]21 ZINC001208683134 1050001254 /nfs/dbraw/zinc/00/12/54/1050001254.db2.gz YODLMQADXGQRIP-QXAKKESOSA-N 2 1 318.530 4.081 20 0 DIADMP CC/C=C\CC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001208729293 1050006664 /nfs/dbraw/zinc/00/66/64/1050006664.db2.gz REIQSQNSPJDOSW-ARJAWSKDSA-N 2 1 312.501 4.331 20 0 DIADMP CC/C=C\CC[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001208728203 1050006774 /nfs/dbraw/zinc/00/67/74/1050006774.db2.gz ZPMZCMQXMADFCL-PHWHVTFISA-N 2 1 316.489 4.312 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)CCCc2ccccc2Cl)CC1 ZINC001208873169 1050019583 /nfs/dbraw/zinc/01/95/83/1050019583.db2.gz AXACMVKRUFVWGI-UHFFFAOYSA-N 2 1 322.924 4.469 20 0 DIADMP C[C@@]1(F)CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208932849 1050023869 /nfs/dbraw/zinc/02/38/69/1050023869.db2.gz RAQHIDZAIVVKMD-WOJBJXKFSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208932849 1050023876 /nfs/dbraw/zinc/02/38/76/1050023876.db2.gz RAQHIDZAIVVKMD-WOJBJXKFSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208932849 1050023880 /nfs/dbraw/zinc/02/38/80/1050023880.db2.gz RAQHIDZAIVVKMD-WOJBJXKFSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929973 1050024312 /nfs/dbraw/zinc/02/43/12/1050024312.db2.gz XPQJXBBJAWEVEH-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929973 1050024317 /nfs/dbraw/zinc/02/43/17/1050024317.db2.gz XPQJXBBJAWEVEH-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929963 1050025453 /nfs/dbraw/zinc/02/54/53/1050025453.db2.gz XPQJXBBJAWEVEH-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929963 1050025461 /nfs/dbraw/zinc/02/54/61/1050025461.db2.gz XPQJXBBJAWEVEH-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208938096 1050026593 /nfs/dbraw/zinc/02/65/93/1050026593.db2.gz WVAFSNDICLXZRT-LJQANCHMSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@@H+]1C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949933 1050029868 /nfs/dbraw/zinc/02/98/68/1050029868.db2.gz ZPWAFVWLGNWVMX-UYAOXDASSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1c2ccccc2CC[NH+]1C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949933 1050029873 /nfs/dbraw/zinc/02/98/73/1050029873.db2.gz ZPWAFVWLGNWVMX-UYAOXDASSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1c2ccccc2CC[NH+]1C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949933 1050029876 /nfs/dbraw/zinc/02/98/76/1050029876.db2.gz ZPWAFVWLGNWVMX-UYAOXDASSA-N 2 1 320.480 4.128 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CC[C@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208959520 1050030217 /nfs/dbraw/zinc/03/02/17/1050030217.db2.gz RXHQKRYBMCKDGH-PWRODBHTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CC[C@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208959520 1050030219 /nfs/dbraw/zinc/03/02/19/1050030219.db2.gz RXHQKRYBMCKDGH-PWRODBHTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CC[C@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208959520 1050030224 /nfs/dbraw/zinc/03/02/24/1050030224.db2.gz RXHQKRYBMCKDGH-PWRODBHTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CC[C@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208959519 1050030248 /nfs/dbraw/zinc/03/02/48/1050030248.db2.gz RXHQKRYBMCKDGH-NJDAHSKKSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@@H+]3CC[C@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208959519 1050030255 /nfs/dbraw/zinc/03/02/55/1050030255.db2.gz RXHQKRYBMCKDGH-NJDAHSKKSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@H+]3CC[C@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208959519 1050030260 /nfs/dbraw/zinc/03/02/60/1050030260.db2.gz RXHQKRYBMCKDGH-NJDAHSKKSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC001208949276 1050030351 /nfs/dbraw/zinc/03/03/51/1050030351.db2.gz JULHFFWZFVPNBE-IRLDBZIGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@@H+]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC001208949276 1050030357 /nfs/dbraw/zinc/03/03/57/1050030357.db2.gz JULHFFWZFVPNBE-IRLDBZIGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@H+]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC001208949276 1050030361 /nfs/dbraw/zinc/03/03/61/1050030361.db2.gz JULHFFWZFVPNBE-IRLDBZIGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC001208949278 1050030646 /nfs/dbraw/zinc/03/06/46/1050030646.db2.gz JULHFFWZFVPNBE-UNMCSNQZSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC001208949278 1050030650 /nfs/dbraw/zinc/03/06/50/1050030650.db2.gz JULHFFWZFVPNBE-UNMCSNQZSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC001208949278 1050030656 /nfs/dbraw/zinc/03/06/56/1050030656.db2.gz JULHFFWZFVPNBE-UNMCSNQZSA-N 2 1 320.480 4.346 20 0 DIADMP Cn1cncc1CCC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000572538998 1050035161 /nfs/dbraw/zinc/03/51/61/1050035161.db2.gz QWBSGACBAWCWJT-OAQYLSRUSA-N 2 1 319.452 4.343 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000572538998 1050035167 /nfs/dbraw/zinc/03/51/67/1050035167.db2.gz QWBSGACBAWCWJT-OAQYLSRUSA-N 2 1 319.452 4.343 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000572538998 1050035170 /nfs/dbraw/zinc/03/51/70/1050035170.db2.gz QWBSGACBAWCWJT-OAQYLSRUSA-N 2 1 319.452 4.343 20 0 DIADMP COc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(Cl)c1 ZINC000589837064 1050060046 /nfs/dbraw/zinc/06/00/46/1050060046.db2.gz ZNYPYXWJGFLXFH-OAHLLOKOSA-N 2 1 324.896 4.093 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC001209449143 1050060461 /nfs/dbraw/zinc/06/04/61/1050060461.db2.gz UVEQFUKPLDXVPK-INIZCTEOSA-N 2 1 306.881 4.005 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001209449143 1050060468 /nfs/dbraw/zinc/06/04/68/1050060468.db2.gz UVEQFUKPLDXVPK-INIZCTEOSA-N 2 1 306.881 4.005 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3c2cccc3C)CC1 ZINC001209490340 1050062079 /nfs/dbraw/zinc/06/20/79/1050062079.db2.gz XGZQGKYMYUSWLF-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]CCCc2c[nH+]cn2C)cc1 ZINC000572971589 1050094806 /nfs/dbraw/zinc/09/48/06/1050094806.db2.gz GGAYREGFGQOYTJ-HNNXBMFYSA-N 2 1 317.502 4.204 20 0 DIADMP Cc1cc(Oc2ccc(Nc3cnc(N)cc3C)cc2)ccn1 ZINC001209969398 1050113527 /nfs/dbraw/zinc/11/35/27/1050113527.db2.gz MWDBEROSTIAPNN-UHFFFAOYSA-N 2 1 306.369 4.212 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCCNc2ccccc21)Cc1ccccc1 ZINC000347952605 1050164006 /nfs/dbraw/zinc/16/40/06/1050164006.db2.gz YIZSXMRWRUBYEN-OAQYLSRUSA-N 2 1 323.484 4.045 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1cccc(F)c1)C(C)C ZINC000348072973 1050175096 /nfs/dbraw/zinc/17/50/96/1050175096.db2.gz KJZXFXRCZVXFIW-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000348072973 1050175103 /nfs/dbraw/zinc/17/51/03/1050175103.db2.gz KJZXFXRCZVXFIW-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1)CC1CCC1 ZINC000348064955 1050179477 /nfs/dbraw/zinc/17/94/77/1050179477.db2.gz BDJIAKIDARTJMC-UHFFFAOYSA-N 2 1 311.473 4.274 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1)CC1CCC1 ZINC000348064955 1050179489 /nfs/dbraw/zinc/17/94/89/1050179489.db2.gz BDJIAKIDARTJMC-UHFFFAOYSA-N 2 1 311.473 4.274 20 0 DIADMP C[C@@H](CC(C)(C)C)[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000824065930 1050181284 /nfs/dbraw/zinc/18/12/84/1050181284.db2.gz IIMZLVDFXNYANE-INIZCTEOSA-N 2 1 317.521 4.454 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccnc(Cl)c1 ZINC000157539692 1050230149 /nfs/dbraw/zinc/23/01/49/1050230149.db2.gz MBFIQKGTEMNDAI-CQSZACIVSA-N 2 1 321.896 4.183 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCc2cccs2)CC1)CC1CC1 ZINC000771475858 1050253592 /nfs/dbraw/zinc/25/35/92/1050253592.db2.gz ORNSYQMXCGGQRH-UHFFFAOYSA-N 2 1 320.546 4.125 20 0 DIADMP CCC1CC([NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000573986940 1050300293 /nfs/dbraw/zinc/30/02/93/1050300293.db2.gz JBGLSLYZQSSKCL-BXXUTWAOSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000480234308 1050350718 /nfs/dbraw/zinc/35/07/18/1050350718.db2.gz WCFCZRDGACFSEZ-HUUCEWRRSA-N 2 1 308.432 4.352 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC000480897099 1050413141 /nfs/dbraw/zinc/41/31/41/1050413141.db2.gz FBAQOGFMQFWEDG-LSDHHAIUSA-N 2 1 323.550 4.348 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+](CCCc1c[nH+]cn1C)CC1CCC1 ZINC000574410314 1050455502 /nfs/dbraw/zinc/45/55/02/1050455502.db2.gz GKNCFWWBIOFLJS-KRWDZBQOSA-N 2 1 311.473 4.216 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](CCCc1c[nH+]cn1C)CC1CCC1 ZINC000574410314 1050455514 /nfs/dbraw/zinc/45/55/14/1050455514.db2.gz GKNCFWWBIOFLJS-KRWDZBQOSA-N 2 1 311.473 4.216 20 0 DIADMP Fc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000574571790 1050498858 /nfs/dbraw/zinc/49/88/58/1050498858.db2.gz OOYJIUJLJZSVOL-FQEVSTJZSA-N 2 1 324.443 4.113 20 0 DIADMP Fc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000574571790 1050498867 /nfs/dbraw/zinc/49/88/67/1050498867.db2.gz OOYJIUJLJZSVOL-FQEVSTJZSA-N 2 1 324.443 4.113 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000738312354 1050529966 /nfs/dbraw/zinc/52/99/66/1050529966.db2.gz QVTQYYBGJHPWJB-LBPRGKRZSA-N 2 1 315.288 4.328 20 0 DIADMP CCc1cccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001144323443 1050541892 /nfs/dbraw/zinc/54/18/92/1050541892.db2.gz DLXZXGXCWQRTPB-JOCHJYFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1cccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001144323443 1050541911 /nfs/dbraw/zinc/54/19/11/1050541911.db2.gz DLXZXGXCWQRTPB-JOCHJYFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1cccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001144323443 1050541925 /nfs/dbraw/zinc/54/19/25/1050541925.db2.gz DLXZXGXCWQRTPB-JOCHJYFZSA-N 2 1 322.496 4.203 20 0 DIADMP CC(C)CCC[C@H](C)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170072231 1050596118 /nfs/dbraw/zinc/59/61/18/1050596118.db2.gz ZLYDAMDUDSWVRB-IHPCNDPISA-N 2 1 317.521 4.368 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@H+]2CC2CC[NH+](C)CC2)o1 ZINC000788480124 1050686674 /nfs/dbraw/zinc/68/66/74/1050686674.db2.gz IFTLOUQJMMLGJD-GOSISDBHSA-N 2 1 304.478 4.101 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCC2CCC2)CC1 ZINC000788671566 1050729178 /nfs/dbraw/zinc/72/91/78/1050729178.db2.gz XYHXCXHQTYFWAV-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccc[nH+]c1N([C@@H](C)CCCC(C)C)C1CC[NH2+]CC1 ZINC001170089682 1050752223 /nfs/dbraw/zinc/75/22/23/1050752223.db2.gz AIEQHEUKRAJCOR-KRWDZBQOSA-N 2 1 303.494 4.163 20 0 DIADMP Cc1ccccc1C[N@H+]([C@@H]1CC[C@@H](C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170121719 1050890902 /nfs/dbraw/zinc/89/09/02/1050890902.db2.gz NREREZHVEGJVGA-HUYLIWGRSA-N 2 1 300.490 4.256 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000348199500 1051006212 /nfs/dbraw/zinc/00/62/12/1051006212.db2.gz CWPZTANQFMWPBR-UHFFFAOYSA-N 2 1 311.473 4.253 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000348199500 1051006224 /nfs/dbraw/zinc/00/62/24/1051006224.db2.gz CWPZTANQFMWPBR-UHFFFAOYSA-N 2 1 311.473 4.253 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC001170149197 1051030476 /nfs/dbraw/zinc/03/04/76/1051030476.db2.gz AUUDRHHVGGIULS-QUCCMNQESA-N 2 1 312.501 4.163 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716714653 1051133959 /nfs/dbraw/zinc/13/39/59/1051133959.db2.gz VEFIJSQYBIOHGH-KSZLIROESA-N 2 1 322.443 4.065 20 0 DIADMP CC(C)C[C@H](C)C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170204964 1051149984 /nfs/dbraw/zinc/14/99/84/1051149984.db2.gz HDJVBILWTHEMFL-PZJWPPBQSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001170259556 1051165451 /nfs/dbraw/zinc/16/54/51/1051165451.db2.gz DQPVYYIFUQIFQL-NVXWUHKLSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001170259556 1051165454 /nfs/dbraw/zinc/16/54/54/1051165454.db2.gz DQPVYYIFUQIFQL-NVXWUHKLSA-N 2 1 320.908 4.268 20 0 DIADMP CC(C)C[N@@H+]([C@H](C)Cc1ccccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170263918 1051167935 /nfs/dbraw/zinc/16/79/35/1051167935.db2.gz RKBQWDUNWYIQOJ-KBAYOESNSA-N 2 1 322.924 4.499 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)C2CC2)nc1 ZINC001171630074 1051171792 /nfs/dbraw/zinc/17/17/92/1051171792.db2.gz HMJYNINQAWZCKA-SFHVURJKSA-N 2 1 315.505 4.082 20 0 DIADMP CC(C)c1ncc(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)s1 ZINC001171625212 1051180560 /nfs/dbraw/zinc/18/05/60/1051180560.db2.gz DYFBFSNVPCKXPH-UHFFFAOYSA-N 2 1 309.523 4.008 20 0 DIADMP C[N@@H+]([C@@H]1CCc2ccccc21)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171644824 1051181677 /nfs/dbraw/zinc/18/16/77/1051181677.db2.gz PTPWGWIJOAPTNN-GOSISDBHSA-N 2 1 300.490 4.257 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]C2(c3ccccc3F)CCC2)CC1(C)C ZINC001171627014 1051182237 /nfs/dbraw/zinc/18/22/37/1051182237.db2.gz IUJWVIPKOXEDOU-UHFFFAOYSA-N 2 1 318.480 4.446 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCCC[C@H](CCC[NH3+])C2)cc1 ZINC001171664474 1051187722 /nfs/dbraw/zinc/18/77/22/1051187722.db2.gz AKDQHQJPNJLFHL-AZUAARDMSA-N 2 1 302.506 4.157 20 0 DIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@H+](C(C)C)C[C@@H]2C)cc1 ZINC001171666543 1051188722 /nfs/dbraw/zinc/18/87/22/1051188722.db2.gz ZFFYKCDHKQUKQT-BJLQDIEVSA-N 2 1 302.506 4.025 20 0 DIADMP C[N@@H+](CCc1cccc(Cl)c1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171639815 1051194287 /nfs/dbraw/zinc/19/42/87/1051194287.db2.gz UVIKCHCTQCCJQE-UHFFFAOYSA-N 2 1 322.924 4.466 20 0 DIADMP C[N@@H+](CCc1ccccc1Cl)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171639340 1051194949 /nfs/dbraw/zinc/19/49/49/1051194949.db2.gz GNBHRFINMUKTAE-UHFFFAOYSA-N 2 1 322.924 4.466 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@@H](Cc3ccccc3)C2)CC1(C)C ZINC001171638504 1051195025 /nfs/dbraw/zinc/19/50/25/1051195025.db2.gz ZQXNNTNREPHUOS-SFHVURJKSA-N 2 1 314.517 4.202 20 0 DIADMP COc1ccc([C@@H](C)[N@@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171639782 1051195664 /nfs/dbraw/zinc/19/56/64/1051195664.db2.gz SWNHPGPTMUBJMW-OAHLLOKOSA-N 2 1 318.505 4.339 20 0 DIADMP C[N@@H+](C/C=C/c1ccccc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171643058 1051196722 /nfs/dbraw/zinc/19/67/22/1051196722.db2.gz RBJAYSDCXFNHDX-JLHYYAGUSA-N 2 1 300.490 4.283 20 0 DIADMP COc1ccccc1[C@H](C)[N@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642265 1051197595 /nfs/dbraw/zinc/19/75/95/1051197595.db2.gz IDWYTFUEBWYOSS-HNNXBMFYSA-N 2 1 318.505 4.339 20 0 DIADMP COc1ccccc1[C@H](C)[N@@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642265 1051197599 /nfs/dbraw/zinc/19/75/99/1051197599.db2.gz IDWYTFUEBWYOSS-HNNXBMFYSA-N 2 1 318.505 4.339 20 0 DIADMP C[C@@H]1C[C@@H](NC(=[NH2+])C2CCCCCC2)C[N@@H+]1Cc1ccccc1 ZINC001171730873 1051202547 /nfs/dbraw/zinc/20/25/47/1051202547.db2.gz ZUGAKHRIEVZIHK-VQIMIIECSA-N 2 1 313.489 4.187 20 0 DIADMP C[C@@H]1C[C@@H](NC(=[NH2+])C2CCCCCC2)C[N@H+]1Cc1ccccc1 ZINC001171730873 1051202559 /nfs/dbraw/zinc/20/25/59/1051202559.db2.gz ZUGAKHRIEVZIHK-VQIMIIECSA-N 2 1 313.489 4.187 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171963707 1051247697 /nfs/dbraw/zinc/24/76/97/1051247697.db2.gz ISQKDUUCTBSSSD-XLIONFOSSA-N 2 1 323.484 4.175 20 0 DIADMP CC1(C)C[C@@H]([NH2+]CC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171966276 1051248506 /nfs/dbraw/zinc/24/85/06/1051248506.db2.gz UNJMNMALYXHAGO-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCC[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171964237 1051250064 /nfs/dbraw/zinc/25/00/64/1051250064.db2.gz LBIDTHOBOKNHMB-QRVBRYPASA-N 2 1 318.480 4.300 20 0 DIADMP CC1(C)C[C@H]([NH2+]C2CCC(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171966645 1051250315 /nfs/dbraw/zinc/25/03/15/1051250315.db2.gz VYFWSYVNIPPPSV-CTWPCTMYSA-N 2 1 318.480 4.300 20 0 DIADMP CC1(C)C[C@H]([NH2+]CC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171968705 1051253555 /nfs/dbraw/zinc/25/35/55/1051253555.db2.gz QVFRVWAGBDTDBK-QGZVFWFLSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C(C)(C)C ZINC001171970097 1051261062 /nfs/dbraw/zinc/26/10/62/1051261062.db2.gz YKERNCIOOVYOSJ-SJLPKXTDSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980124 1051266651 /nfs/dbraw/zinc/26/66/51/1051266651.db2.gz SMTRHKPVDBRZPY-ZHALLVOQSA-N 2 1 314.517 4.454 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C2CC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171980879 1051268005 /nfs/dbraw/zinc/26/80/05/1051268005.db2.gz UIYBMWJEDHTRME-SFHVURJKSA-N 2 1 312.501 4.352 20 0 DIADMP CCC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCC1 ZINC001171980888 1051269088 /nfs/dbraw/zinc/26/90/88/1051269088.db2.gz UNEDTYCCASYOFH-GOSISDBHSA-N 2 1 300.490 4.352 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001171976670 1051269121 /nfs/dbraw/zinc/26/91/21/1051269121.db2.gz MGQZGBMNCNRODI-IBGZPJMESA-N 2 1 300.490 4.306 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171976670 1051269132 /nfs/dbraw/zinc/26/91/32/1051269132.db2.gz MGQZGBMNCNRODI-IBGZPJMESA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1CC[C@@H](C)C1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980121 1051269192 /nfs/dbraw/zinc/26/91/92/1051269192.db2.gz SMTRHKPVDBRZPY-LMMKCTJWSA-N 2 1 314.517 4.454 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC23CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001171982719 1051269742 /nfs/dbraw/zinc/26/97/42/1051269742.db2.gz SMQWXZGGNFLKGW-IBGZPJMESA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171982719 1051269751 /nfs/dbraw/zinc/26/97/51/1051269751.db2.gz SMQWXZGGNFLKGW-IBGZPJMESA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC23CCCC3)CC[NH+]1Cc1ccccc1 ZINC001171982719 1051269759 /nfs/dbraw/zinc/26/97/59/1051269759.db2.gz SMQWXZGGNFLKGW-IBGZPJMESA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC23CCCC3)CC[NH+]1Cc1ccccc1 ZINC001171982719 1051269769 /nfs/dbraw/zinc/26/97/69/1051269769.db2.gz SMQWXZGGNFLKGW-IBGZPJMESA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@H]([NH+]2C[C@@H]3CCC[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001171978163 1051269924 /nfs/dbraw/zinc/26/99/24/1051269924.db2.gz WTHLHWSODMOVRC-SLFFLAALSA-N 2 1 312.501 4.162 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2C3)CC[N@H+]1Cc1ccccc1 ZINC001171977667 1051270105 /nfs/dbraw/zinc/27/01/05/1051270105.db2.gz GEZRDSYOQCVQSW-IYWMVGAKSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCC1 ZINC001172070885 1051274967 /nfs/dbraw/zinc/27/49/67/1051274967.db2.gz SBNZSDMTCJWEDP-DVWBAYGPSA-N 2 1 312.501 4.350 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076905 1051276701 /nfs/dbraw/zinc/27/67/01/1051276701.db2.gz AYIXIYXGBYCIJO-AFDCHOCNSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076905 1051276709 /nfs/dbraw/zinc/27/67/09/1051276709.db2.gz AYIXIYXGBYCIJO-AFDCHOCNSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@@H+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076905 1051276714 /nfs/dbraw/zinc/27/67/14/1051276714.db2.gz AYIXIYXGBYCIJO-AFDCHOCNSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@H+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076905 1051276722 /nfs/dbraw/zinc/27/67/22/1051276722.db2.gz AYIXIYXGBYCIJO-AFDCHOCNSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076906 1051277180 /nfs/dbraw/zinc/27/71/80/1051277180.db2.gz AYIXIYXGBYCIJO-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076906 1051277193 /nfs/dbraw/zinc/27/71/93/1051277193.db2.gz AYIXIYXGBYCIJO-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076906 1051277203 /nfs/dbraw/zinc/27/72/03/1051277203.db2.gz AYIXIYXGBYCIJO-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172076906 1051277219 /nfs/dbraw/zinc/27/72/19/1051277219.db2.gz AYIXIYXGBYCIJO-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2CC24CCCC4)C3)cc1 ZINC001172077621 1051277857 /nfs/dbraw/zinc/27/78/57/1051277857.db2.gz ULNIJQMXXPUDOB-PLACYPQZSA-N 2 1 324.512 4.494 20 0 DIADMP CC1(C)[C@@H]2C[N@@H+]([C@H]3C[C@H]4CCC[C@@H](C3)N4Cc3ccccc3)C[C@@H]21 ZINC001172075811 1051278544 /nfs/dbraw/zinc/27/85/44/1051278544.db2.gz SXSAOKPLPVFKBH-GCFHALSMSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[N@H+]([C@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172075811 1051278551 /nfs/dbraw/zinc/27/85/51/1051278551.db2.gz SXSAOKPLPVFKBH-GCFHALSMSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[N@@H+]([C@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172075811 1051278555 /nfs/dbraw/zinc/27/85/55/1051278555.db2.gz SXSAOKPLPVFKBH-GCFHALSMSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172075811 1051278565 /nfs/dbraw/zinc/27/85/65/1051278565.db2.gz SXSAOKPLPVFKBH-GCFHALSMSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172075811 1051278575 /nfs/dbraw/zinc/27/85/75/1051278575.db2.gz SXSAOKPLPVFKBH-GCFHALSMSA-N 2 1 324.512 4.160 20 0 DIADMP FC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172080337 1051279751 /nfs/dbraw/zinc/27/97/51/1051279751.db2.gz UCUTUZJDKXXIDK-ACDBMABISA-N 2 1 316.464 4.006 20 0 DIADMP FC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172080337 1051279764 /nfs/dbraw/zinc/27/97/64/1051279764.db2.gz UCUTUZJDKXXIDK-ACDBMABISA-N 2 1 316.464 4.006 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1 ZINC001172101634 1051281671 /nfs/dbraw/zinc/28/16/71/1051281671.db2.gz GOMWURPSWILHAD-ZJPYXAASSA-N 2 1 306.881 4.396 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC001172101634 1051281683 /nfs/dbraw/zinc/28/16/83/1051281683.db2.gz GOMWURPSWILHAD-ZJPYXAASSA-N 2 1 306.881 4.396 20 0 DIADMP CC1CC([N@H+](C)[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172067536 1051284706 /nfs/dbraw/zinc/28/47/06/1051284706.db2.gz CVAFZRXNWSLOKD-VIQPCWSMSA-N 2 1 312.501 4.302 20 0 DIADMP CC1CC([N@@H+](C)[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172067536 1051284711 /nfs/dbraw/zinc/28/47/11/1051284711.db2.gz CVAFZRXNWSLOKD-VIQPCWSMSA-N 2 1 312.501 4.302 20 0 DIADMP CC1CC([NH+](C)[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172067536 1051284717 /nfs/dbraw/zinc/28/47/17/1051284717.db2.gz CVAFZRXNWSLOKD-VIQPCWSMSA-N 2 1 312.501 4.302 20 0 DIADMP CC1CC([NH+](C)[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172067536 1051284722 /nfs/dbraw/zinc/28/47/22/1051284722.db2.gz CVAFZRXNWSLOKD-VIQPCWSMSA-N 2 1 312.501 4.302 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc(-c3ccccc3)c1)C2 ZINC001172100518 1051286361 /nfs/dbraw/zinc/28/63/61/1051286361.db2.gz DGACUJWSQWYWTN-KOUNCHBCSA-N 2 1 320.480 4.459 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001172130999 1051291960 /nfs/dbraw/zinc/29/19/60/1051291960.db2.gz SRULFNCHZNZUGL-YDZRNGNQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001172130999 1051291975 /nfs/dbraw/zinc/29/19/75/1051291975.db2.gz SRULFNCHZNZUGL-YDZRNGNQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001172130999 1051291988 /nfs/dbraw/zinc/29/19/88/1051291988.db2.gz SRULFNCHZNZUGL-YDZRNGNQSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130991 1051292417 /nfs/dbraw/zinc/29/24/17/1051292417.db2.gz SRPUEHICLHWENW-BORJPKMPSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130991 1051292432 /nfs/dbraw/zinc/29/24/32/1051292432.db2.gz SRPUEHICLHWENW-BORJPKMPSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130991 1051292446 /nfs/dbraw/zinc/29/24/46/1051292446.db2.gz SRPUEHICLHWENW-BORJPKMPSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130991 1051292463 /nfs/dbraw/zinc/29/24/63/1051292463.db2.gz SRPUEHICLHWENW-BORJPKMPSA-N 2 1 320.427 4.117 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129086 1051293237 /nfs/dbraw/zinc/29/32/37/1051293237.db2.gz WAOIOAKTFPBMCQ-ZSGPHXLJSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129086 1051293245 /nfs/dbraw/zinc/29/32/45/1051293245.db2.gz WAOIOAKTFPBMCQ-ZSGPHXLJSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172129086 1051293253 /nfs/dbraw/zinc/29/32/53/1051293253.db2.gz WAOIOAKTFPBMCQ-ZSGPHXLJSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172129086 1051293263 /nfs/dbraw/zinc/29/32/63/1051293263.db2.gz WAOIOAKTFPBMCQ-ZSGPHXLJSA-N 2 1 306.881 4.348 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105028 1051295028 /nfs/dbraw/zinc/29/50/28/1051295028.db2.gz HOLYEDMGYJRYSY-RDGPPVDQSA-N 2 1 300.490 4.379 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105028 1051295032 /nfs/dbraw/zinc/29/50/32/1051295032.db2.gz HOLYEDMGYJRYSY-RDGPPVDQSA-N 2 1 300.490 4.379 20 0 DIADMP CCC(CC)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001172108696 1051295062 /nfs/dbraw/zinc/29/50/62/1051295062.db2.gz YGVUTJWEFLZDFK-REPLKXPHSA-N 2 1 300.490 4.307 20 0 DIADMP CCC(CC)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001172108696 1051295072 /nfs/dbraw/zinc/29/50/72/1051295072.db2.gz YGVUTJWEFLZDFK-REPLKXPHSA-N 2 1 300.490 4.307 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104794 1051295390 /nfs/dbraw/zinc/29/53/90/1051295390.db2.gz CWZVOFCEXPGZIO-FCGDIQPGSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104794 1051295398 /nfs/dbraw/zinc/29/53/98/1051295398.db2.gz CWZVOFCEXPGZIO-FCGDIQPGSA-N 2 1 304.453 4.128 20 0 DIADMP CCC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104770 1051296308 /nfs/dbraw/zinc/29/63/08/1051296308.db2.gz CRCPVDJAYMXLFZ-RDGPPVDQSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104770 1051296318 /nfs/dbraw/zinc/29/63/18/1051296318.db2.gz CRCPVDJAYMXLFZ-RDGPPVDQSA-N 2 1 304.453 4.272 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103101 1051297525 /nfs/dbraw/zinc/29/75/25/1051297525.db2.gz RWQFEVKJUYBCNI-AHKXBBIQSA-N 2 1 316.533 4.196 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103101 1051297535 /nfs/dbraw/zinc/29/75/35/1051297535.db2.gz RWQFEVKJUYBCNI-AHKXBBIQSA-N 2 1 316.533 4.196 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105922 1051297638 /nfs/dbraw/zinc/29/76/38/1051297638.db2.gz LEYJMTPAZQVDFN-FCGDIQPGSA-N 2 1 318.892 4.396 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105922 1051297653 /nfs/dbraw/zinc/29/76/53/1051297653.db2.gz LEYJMTPAZQVDFN-FCGDIQPGSA-N 2 1 318.892 4.396 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001172106469 1051297730 /nfs/dbraw/zinc/29/77/30/1051297730.db2.gz PDAKIIOOGFGSFO-LDLYASANSA-N 2 1 308.469 4.253 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(F)cc(F)c1 ZINC001172109624 1051298954 /nfs/dbraw/zinc/29/89/54/1051298954.db2.gz IBYJJOAPXPIOEU-XMTFNYHQSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)cc(F)c1 ZINC001172109624 1051298966 /nfs/dbraw/zinc/29/89/66/1051298966.db2.gz IBYJJOAPXPIOEU-XMTFNYHQSA-N 2 1 308.416 4.021 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110833 1051300209 /nfs/dbraw/zinc/30/02/09/1051300209.db2.gz PTPHPDZBNUZCAO-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110833 1051300220 /nfs/dbraw/zinc/30/02/20/1051300220.db2.gz PTPHPDZBNUZCAO-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172113958 1051300503 /nfs/dbraw/zinc/30/05/03/1051300503.db2.gz KZOAJKZTRADMGO-GEALJGNFSA-N 2 1 300.490 4.476 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172113958 1051300509 /nfs/dbraw/zinc/30/05/09/1051300509.db2.gz KZOAJKZTRADMGO-GEALJGNFSA-N 2 1 300.490 4.476 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110084 1051301335 /nfs/dbraw/zinc/30/13/35/1051301335.db2.gz JSSHOBOMICYOJV-ZTENYAIWSA-N 2 1 318.892 4.322 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110084 1051301354 /nfs/dbraw/zinc/30/13/54/1051301354.db2.gz JSSHOBOMICYOJV-ZTENYAIWSA-N 2 1 318.892 4.322 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(C)cc(C)c1 ZINC001172111186 1051301398 /nfs/dbraw/zinc/30/13/98/1051301398.db2.gz TVXDAVBELMIYOJ-HAGHYFMRSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(C)cc(C)c1 ZINC001172111186 1051301413 /nfs/dbraw/zinc/30/14/13/1051301413.db2.gz TVXDAVBELMIYOJ-HAGHYFMRSA-N 2 1 300.490 4.359 20 0 DIADMP Cc1ccc(CC(C)(C)C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172110915 1051301442 /nfs/dbraw/zinc/30/14/42/1051301442.db2.gz LXDDEAKGQJFDTD-OWZKRDHZSA-N 2 1 314.517 4.169 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110834 1051301999 /nfs/dbraw/zinc/30/19/99/1051301999.db2.gz PTPHPDZBNUZCAO-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110834 1051302017 /nfs/dbraw/zinc/30/20/17/1051302017.db2.gz PTPHPDZBNUZCAO-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1Cl ZINC001172110795 1051302650 /nfs/dbraw/zinc/30/26/50/1051302650.db2.gz PHVUBAFBWNQMJY-QSPRXWTASA-N 2 1 306.881 4.314 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ccc1Cl ZINC001172110795 1051302656 /nfs/dbraw/zinc/30/26/56/1051302656.db2.gz PHVUBAFBWNQMJY-QSPRXWTASA-N 2 1 306.881 4.314 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120182 1051305029 /nfs/dbraw/zinc/30/50/29/1051305029.db2.gz ACOFIOWAGBQKSZ-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120182 1051305039 /nfs/dbraw/zinc/30/50/39/1051305039.db2.gz ACOFIOWAGBQKSZ-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120182 1051305047 /nfs/dbraw/zinc/30/50/47/1051305047.db2.gz ACOFIOWAGBQKSZ-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120182 1051305055 /nfs/dbraw/zinc/30/50/55/1051305055.db2.gz ACOFIOWAGBQKSZ-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP CC(C)C[N@H+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172117296 1051305991 /nfs/dbraw/zinc/30/59/91/1051305991.db2.gz GERWJPZQQQTFIE-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172117296 1051306005 /nfs/dbraw/zinc/30/60/05/1051306005.db2.gz GERWJPZQQQTFIE-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172117296 1051306013 /nfs/dbraw/zinc/30/60/13/1051306013.db2.gz GERWJPZQQQTFIE-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172117296 1051306017 /nfs/dbraw/zinc/30/60/17/1051306017.db2.gz GERWJPZQQQTFIE-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334219 1051358756 /nfs/dbraw/zinc/35/87/56/1051358756.db2.gz LUVRTLABZPNOJJ-MHORFTMASA-N 2 1 312.542 4.198 20 0 DIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334221 1051358967 /nfs/dbraw/zinc/35/89/67/1051358967.db2.gz LUVRTLABZPNOJJ-XSLAGTTESA-N 2 1 312.542 4.198 20 0 DIADMP CC(C)C([NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000381827229 1051375276 /nfs/dbraw/zinc/37/52/76/1051375276.db2.gz HROFUUAYODSIEQ-MJGOQNOKSA-N 2 1 302.506 4.167 20 0 DIADMP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390643891 1051405671 /nfs/dbraw/zinc/40/56/71/1051405671.db2.gz LRHNBDGNRFIDAA-ROUUACIJSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390643891 1051405675 /nfs/dbraw/zinc/40/56/75/1051405675.db2.gz LRHNBDGNRFIDAA-ROUUACIJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001170451064 1051412801 /nfs/dbraw/zinc/41/28/01/1051412801.db2.gz GYGPSIMOOSIHQT-UTKZUKDTSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001170451064 1051412806 /nfs/dbraw/zinc/41/28/06/1051412806.db2.gz GYGPSIMOOSIHQT-UTKZUKDTSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001170451064 1051412812 /nfs/dbraw/zinc/41/28/12/1051412812.db2.gz GYGPSIMOOSIHQT-UTKZUKDTSA-N 2 1 314.517 4.463 20 0 DIADMP C[NH+]1CCC2(CC[N@H+]([C@@H]3CCC[C@@H](c4ccccc4)C3)C2)CC1 ZINC001172551479 1051434543 /nfs/dbraw/zinc/43/45/43/1051434543.db2.gz HKZVCQCZOQWHGX-WOJBJXKFSA-N 2 1 312.501 4.131 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172555853 1051438292 /nfs/dbraw/zinc/43/82/92/1051438292.db2.gz JYNZQQZPJDJYBA-RLLQIKCJSA-N 2 1 300.490 4.164 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172557797 1051438674 /nfs/dbraw/zinc/43/86/74/1051438674.db2.gz QRMMUEGNTTYTOZ-XRXFAXGQSA-N 2 1 312.501 4.305 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172543733 1051455694 /nfs/dbraw/zinc/45/56/94/1051455694.db2.gz RWWGHSMMCPISLI-FYQPLNBISA-N 2 1 300.490 4.175 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169100673 1051510457 /nfs/dbraw/zinc/51/04/57/1051510457.db2.gz LFEXHVNDQYHAII-FJIDUMEYSA-N 2 1 304.865 4.006 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169100676 1051511393 /nfs/dbraw/zinc/51/13/93/1051511393.db2.gz LFEXHVNDQYHAII-ZJPYXAASSA-N 2 1 304.865 4.006 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccccc1-c1ccccc1)C2 ZINC001169081788 1051514072 /nfs/dbraw/zinc/51/40/72/1051514072.db2.gz WQLBJGSILTWDOF-OWZKRDHZSA-N 2 1 306.453 4.068 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](C2CCC(Cc3ccccc3)CC2)CC1 ZINC001172825032 1051517468 /nfs/dbraw/zinc/51/74/68/1051517468.db2.gz NMACQVVICYGSFU-UHFFFAOYSA-N 2 1 314.517 4.204 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116971 1051520345 /nfs/dbraw/zinc/52/03/45/1051520345.db2.gz VBPXXTLNPVUCRJ-AXVVYFOYSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116971 1051520351 /nfs/dbraw/zinc/52/03/51/1051520351.db2.gz VBPXXTLNPVUCRJ-AXVVYFOYSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124434 1051522314 /nfs/dbraw/zinc/52/23/14/1051522314.db2.gz CMXFUBPQDYQQMF-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124434 1051522323 /nfs/dbraw/zinc/52/23/23/1051522323.db2.gz CMXFUBPQDYQQMF-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124434 1051522333 /nfs/dbraw/zinc/52/23/33/1051522333.db2.gz CMXFUBPQDYQQMF-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124434 1051522342 /nfs/dbraw/zinc/52/23/42/1051522342.db2.gz CMXFUBPQDYQQMF-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169129596 1051525536 /nfs/dbraw/zinc/52/55/36/1051525536.db2.gz JZIQLOJVLVCQDA-BTTYYORXSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169129596 1051525548 /nfs/dbraw/zinc/52/55/48/1051525548.db2.gz JZIQLOJVLVCQDA-BTTYYORXSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169129596 1051525554 /nfs/dbraw/zinc/52/55/54/1051525554.db2.gz JZIQLOJVLVCQDA-BTTYYORXSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169129596 1051525562 /nfs/dbraw/zinc/52/55/62/1051525562.db2.gz JZIQLOJVLVCQDA-BTTYYORXSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3cccc(F)c3)CCCCC1)C2 ZINC001169106982 1051528799 /nfs/dbraw/zinc/52/87/99/1051528799.db2.gz CABXDNKTPJTQRF-REPLKXPHSA-N 2 1 316.464 4.200 20 0 DIADMP Cc1cc([NH2+][C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)ccc1N(C)C ZINC001169150086 1051535537 /nfs/dbraw/zinc/53/55/37/1051535537.db2.gz ASBVLQRZFUMLCW-APWZRJJASA-N 2 1 303.494 4.017 20 0 DIADMP Cc1cc[nH+]c2cc(N[C@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)ccc12 ZINC001169152424 1051537258 /nfs/dbraw/zinc/53/72/58/1051537258.db2.gz PRMBGPKCLBRDQG-OXJNMPFZSA-N 2 1 311.473 4.499 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160293 1051540695 /nfs/dbraw/zinc/54/06/95/1051540695.db2.gz CGAQEYJHOHFFJL-MUJYYYPQSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160293 1051540704 /nfs/dbraw/zinc/54/07/04/1051540704.db2.gz CGAQEYJHOHFFJL-MUJYYYPQSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169160293 1051540716 /nfs/dbraw/zinc/54/07/16/1051540716.db2.gz CGAQEYJHOHFFJL-MUJYYYPQSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169160293 1051540725 /nfs/dbraw/zinc/54/07/25/1051540725.db2.gz CGAQEYJHOHFFJL-MUJYYYPQSA-N 2 1 313.272 4.050 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172861917 1051547250 /nfs/dbraw/zinc/54/72/50/1051547250.db2.gz XFSVPRKKKBEITC-OSMBCOQSSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172861917 1051547263 /nfs/dbraw/zinc/54/72/63/1051547263.db2.gz XFSVPRKKKBEITC-OSMBCOQSSA-N 2 1 324.871 4.015 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@H]1CCC[C@H](C)C1 ZINC001169224305 1051556189 /nfs/dbraw/zinc/55/61/89/1051556189.db2.gz GQLBHUPSKPOMKZ-ZWKOTPCHSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@H]1CCC[C@H](C)C1 ZINC001169224305 1051556204 /nfs/dbraw/zinc/55/62/04/1051556204.db2.gz GQLBHUPSKPOMKZ-ZWKOTPCHSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@@H]1CCC[C@H](C)C1 ZINC001169224304 1051556625 /nfs/dbraw/zinc/55/66/25/1051556625.db2.gz GQLBHUPSKPOMKZ-ROUUACIJSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@@H]1CCC[C@H](C)C1 ZINC001169224304 1051556639 /nfs/dbraw/zinc/55/66/39/1051556639.db2.gz GQLBHUPSKPOMKZ-ROUUACIJSA-N 2 1 305.510 4.374 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001169241001 1051561941 /nfs/dbraw/zinc/56/19/41/1051561941.db2.gz ORFOWEOGQIZPFW-IBGZPJMESA-N 2 1 304.453 4.131 20 0 DIADMP CC[NH+]1CCC([NH+]2CCC(c3cccc(Cl)c3)CC2)CC1 ZINC001169246573 1051562950 /nfs/dbraw/zinc/56/29/50/1051562950.db2.gz SOVMJOLPGXVORV-UHFFFAOYSA-N 2 1 306.881 4.004 20 0 DIADMP CO[C@H]1CCC[C@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928448 1051574433 /nfs/dbraw/zinc/57/44/33/1051574433.db2.gz LDBAEWCSSDBUTD-MUGJNUQGSA-N 2 1 322.537 4.096 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001173110835 1051610296 /nfs/dbraw/zinc/61/02/96/1051610296.db2.gz ZEFSDSGHZSZTPZ-XEVCZEQESA-N 2 1 300.490 4.129 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(Cl)c1 ZINC000256049222 1051618433 /nfs/dbraw/zinc/61/84/33/1051618433.db2.gz YYCBATNHNWCKMI-RUZUBIRVSA-N 2 1 313.272 4.269 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(Cl)c1 ZINC000256049221 1051619016 /nfs/dbraw/zinc/61/90/16/1051619016.db2.gz YYCBATNHNWCKMI-DOERSZECSA-N 2 1 313.272 4.269 20 0 DIADMP CC(C)[NH+](CC[NH2+]C1CCC(Oc2ccccc2)CC1)C(C)C ZINC001173195384 1051628833 /nfs/dbraw/zinc/62/88/33/1051628833.db2.gz OQMFEGBVJKZMBK-UHFFFAOYSA-N 2 1 318.505 4.085 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@H]1CC[N@@H+](C)C1 ZINC001173204822 1051643305 /nfs/dbraw/zinc/64/33/05/1051643305.db2.gz LNZGAOCJABOCSR-RTBURBONSA-N 2 1 322.496 4.138 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@H]1C[NH3+] ZINC001173206879 1051644549 /nfs/dbraw/zinc/64/45/49/1051644549.db2.gz XXPSRFBMCHXQLC-PXNSSMCTSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]1C[NH3+] ZINC001173206879 1051644556 /nfs/dbraw/zinc/64/45/56/1051644556.db2.gz XXPSRFBMCHXQLC-PXNSSMCTSA-N 2 1 308.469 4.020 20 0 DIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCCC2CCCCC2)[C@@H](C)C1 ZINC001169557748 1051644961 /nfs/dbraw/zinc/64/49/61/1051644961.db2.gz ZHSCVWBUYHBWRV-AZUAARDMSA-N 2 1 324.553 4.074 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@H]1C[NH3+] ZINC001173206881 1051644983 /nfs/dbraw/zinc/64/49/83/1051644983.db2.gz XXPSRFBMCHXQLC-XLIONFOSSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]1C[NH3+] ZINC001173206881 1051644988 /nfs/dbraw/zinc/64/49/88/1051644988.db2.gz XXPSRFBMCHXQLC-XLIONFOSSA-N 2 1 308.469 4.020 20 0 DIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCCC2CCCCC2)[C@H](C)C1 ZINC001169557751 1051645202 /nfs/dbraw/zinc/64/52/02/1051645202.db2.gz ZHSCVWBUYHBWRV-UYAOXDASSA-N 2 1 324.553 4.074 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+](C)C[C@@H](C)C[NH3+] ZINC001173211534 1051649369 /nfs/dbraw/zinc/64/93/69/1051649369.db2.gz QZZKAPDCGXJQMO-ZWKOTPCHSA-N 2 1 310.485 4.124 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(Cl)c1Cl ZINC001206013102 1051650539 /nfs/dbraw/zinc/65/05/39/1051650539.db2.gz PFCBTCANWFVLAZ-STQMWFEESA-N 2 1 315.288 4.109 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173249218 1051653289 /nfs/dbraw/zinc/65/32/89/1051653289.db2.gz KHSJWBXTGVQBJR-VDGAXYAQSA-N 2 1 302.506 4.160 20 0 DIADMP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000493884567 1051663816 /nfs/dbraw/zinc/66/38/16/1051663816.db2.gz YSBKKHQLDGKDAF-NSHGMRRFSA-N 2 1 318.505 4.007 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001173270347 1051667336 /nfs/dbraw/zinc/66/73/36/1051667336.db2.gz NRFWOEPBLIWSMG-RHSMWYFYSA-N 2 1 306.881 4.169 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001173241668 1051672349 /nfs/dbraw/zinc/67/23/49/1051672349.db2.gz AFRKRARAEZYYES-SFHVURJKSA-N 2 1 316.533 4.232 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1cc[nH+]cc1C(F)(F)F ZINC001169695601 1051675394 /nfs/dbraw/zinc/67/53/94/1051675394.db2.gz HUSBEICIXVJERE-CQSZACIVSA-N 2 1 321.346 4.341 20 0 DIADMP CCSC[C@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173296097 1051677248 /nfs/dbraw/zinc/67/72/48/1051677248.db2.gz QNZGFASUXLJPPV-XIRDDKMYSA-N 2 1 324.509 4.039 20 0 DIADMP Cc1nc2ccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)cc2s1 ZINC000494080751 1051688356 /nfs/dbraw/zinc/68/83/56/1051688356.db2.gz VQKRBTKNFOHXJP-UHFFFAOYSA-N 2 1 319.518 4.203 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC2CCC3(CC3)CC2)CC1 ZINC001169779855 1051699911 /nfs/dbraw/zinc/69/99/11/1051699911.db2.gz FLQOJFDXHDBMTB-UHFFFAOYSA-N 2 1 314.473 4.204 20 0 DIADMP Cc1cc(C)c2[nH+]c(NCC34CC[NH+](CC3)CC4)cc(C)c2c1 ZINC001169794026 1051701253 /nfs/dbraw/zinc/70/12/53/1051701253.db2.gz CPTDECSTLBXIKR-UHFFFAOYSA-N 2 1 309.457 4.058 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000183188818 1051711627 /nfs/dbraw/zinc/71/16/27/1051711627.db2.gz OTJCAUJIKPCPJO-YQQAZPJKSA-N 2 1 304.453 4.129 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccs1 ZINC000183186870 1051712179 /nfs/dbraw/zinc/71/21/79/1051712179.db2.gz BOGHLGJOASQFFH-UXLLHSPISA-N 2 1 306.519 4.442 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000183700221 1051716990 /nfs/dbraw/zinc/71/69/90/1051716990.db2.gz FATXNJXERXPUPA-PCKAHOCUSA-N 2 1 320.443 4.065 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c1 ZINC001206211678 1051785922 /nfs/dbraw/zinc/78/59/22/1051785922.db2.gz OQOCJOPXISNIHC-DLBZAZTESA-N 2 1 312.498 4.132 20 0 DIADMP Cc1cc(C)c([N@@H+]2C=C(N)C(=[NH2+])C(c3cccc(F)c3)=C2)c(C)c1 ZINC001173843774 1051818699 /nfs/dbraw/zinc/81/86/99/1051818699.db2.gz PRPUOJLUMRHERN-UHFFFAOYSA-N 2 1 321.399 4.270 20 0 DIADMP Cc1cc(C)c([N@H+]2C=C(N)C(=[NH2+])C(c3cccc(F)c3)=C2)c(C)c1 ZINC001173843774 1051818710 /nfs/dbraw/zinc/81/87/10/1051818710.db2.gz PRPUOJLUMRHERN-UHFFFAOYSA-N 2 1 321.399 4.270 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)C1CCSCC1 ZINC000187000322 1051833129 /nfs/dbraw/zinc/83/31/29/1051833129.db2.gz SMGJHMNILBZBPN-MRXNPFEDSA-N 2 1 320.546 4.148 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2)cc1 ZINC000768175822 1051894498 /nfs/dbraw/zinc/89/44/98/1051894498.db2.gz XHFQVDATQZKGPS-UHFFFAOYSA-N 2 1 302.849 4.034 20 0 DIADMP C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)o1 ZINC000768215794 1051902773 /nfs/dbraw/zinc/90/27/73/1051902773.db2.gz YIPYLNKBCPJNJS-HNAYVOBHSA-N 2 1 312.457 4.097 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000764963383 1051946528 /nfs/dbraw/zinc/94/65/28/1051946528.db2.gz NXIIFSMXJFGZNY-CVEARBPZSA-N 2 1 300.556 4.151 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C3CC(C(F)F)C3)cc2)C1 ZINC000768678165 1051948017 /nfs/dbraw/zinc/94/80/17/1051948017.db2.gz LTOGKZZYCNZOFI-RWBZWWBESA-N 2 1 322.443 4.052 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CC(C(F)F)C2)cc1 ZINC000768680297 1051948907 /nfs/dbraw/zinc/94/89/07/1051948907.db2.gz XSGDKTDUUSYYED-NNGSBXSVSA-N 2 1 322.443 4.194 20 0 DIADMP Cc1c([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)cnn1C(C)C ZINC000191141332 1051962953 /nfs/dbraw/zinc/96/29/53/1051962953.db2.gz JOHWDFZVHSKKCJ-MRXNPFEDSA-N 2 1 320.525 4.078 20 0 DIADMP Cc1c([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cnn1C(C)C ZINC000191141332 1051962966 /nfs/dbraw/zinc/96/29/66/1051962966.db2.gz JOHWDFZVHSKKCJ-MRXNPFEDSA-N 2 1 320.525 4.078 20 0 DIADMP Cc1ccccc1[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000494919995 1052171885 /nfs/dbraw/zinc/17/18/85/1052171885.db2.gz FZKNFUPIUYJEAG-UTKZUKDTSA-N 2 1 312.501 4.300 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168474597 1052186529 /nfs/dbraw/zinc/18/65/29/1052186529.db2.gz SLJUNNRVXIXGSP-XFQXTVEOSA-N 2 1 318.480 4.271 20 0 DIADMP CCCCC[C@@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218224398 1052209866 /nfs/dbraw/zinc/20/98/66/1052209866.db2.gz XOIDVZXFDMGOBD-LJQANCHMSA-N 2 1 318.505 4.347 20 0 DIADMP CCC[C@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)[C@H](C)CC ZINC001218292776 1052217948 /nfs/dbraw/zinc/21/79/48/1052217948.db2.gz TVMMZRXCOLICAF-APWZRJJASA-N 2 1 318.505 4.203 20 0 DIADMP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309671832 1052231812 /nfs/dbraw/zinc/23/18/12/1052231812.db2.gz TWMYTTMJEQYOJB-YZGWKJHDSA-N 2 1 314.517 4.313 20 0 DIADMP CC(C)C(C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000309668932 1052231893 /nfs/dbraw/zinc/23/18/93/1052231893.db2.gz RJORFHAWBKIICW-HXUWFJFHSA-N 2 1 316.533 4.416 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309720346 1052235387 /nfs/dbraw/zinc/23/53/87/1052235387.db2.gz MCDYVACTNWIJOC-HLAWJBBLSA-N 2 1 314.517 4.457 20 0 DIADMP CC(C)CCC[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000309951689 1052252993 /nfs/dbraw/zinc/25/29/93/1052252993.db2.gz GMKMWPOOEAXKKM-HXUWFJFHSA-N 2 1 302.506 4.315 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000310069266 1052255780 /nfs/dbraw/zinc/25/57/80/1052255780.db2.gz CSGJBMAGWKRNMT-OAQYLSRUSA-N 2 1 322.496 4.224 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000310069264 1052256266 /nfs/dbraw/zinc/25/62/66/1052256266.db2.gz CSGJBMAGWKRNMT-NRFANRHFSA-N 2 1 322.496 4.224 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000495415048 1052341521 /nfs/dbraw/zinc/34/15/21/1052341521.db2.gz MENVEIZRWVZREY-XWYPRVOQSA-N 2 1 316.464 4.080 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CC(C)(C)Cc3oc(C)cc32)CC1 ZINC000236797177 1052431402 /nfs/dbraw/zinc/43/14/02/1052431402.db2.gz VNDOGBXZNHCCMR-KRWDZBQOSA-N 2 1 304.478 4.066 20 0 DIADMP CCc1oc2ccccc2c1C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000237088640 1052434504 /nfs/dbraw/zinc/43/45/04/1052434504.db2.gz GIQMBXWLWKVOCN-UHFFFAOYSA-N 2 1 314.473 4.348 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@@]2(C1)CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222141632 1052449399 /nfs/dbraw/zinc/44/93/99/1052449399.db2.gz PDQJWUXCFJIFPQ-UWJYYQICSA-N 2 1 308.469 4.019 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222148724 1052450618 /nfs/dbraw/zinc/45/06/18/1052450618.db2.gz RNILIYIIOMHBJY-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP c1oc2ccccc2c1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222166814 1052455137 /nfs/dbraw/zinc/45/51/37/1052455137.db2.gz CMBXYSYZNNZXBC-FQEVSTJZSA-N 2 1 312.457 4.179 20 0 DIADMP Cc1cc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc(F)c1F ZINC001222167251 1052455890 /nfs/dbraw/zinc/45/58/90/1052455890.db2.gz IXWXCRUHFUELIQ-LJQANCHMSA-N 2 1 322.443 4.019 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc(F)c1F ZINC001222167251 1052455893 /nfs/dbraw/zinc/45/58/93/1052455893.db2.gz IXWXCRUHFUELIQ-LJQANCHMSA-N 2 1 322.443 4.019 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)o1 ZINC001222171406 1052456344 /nfs/dbraw/zinc/45/63/44/1052456344.db2.gz BGSUPFOVLFUVDV-FQEVSTJZSA-N 2 1 312.457 4.179 20 0 DIADMP CCCCc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000316667334 1052471592 /nfs/dbraw/zinc/47/15/92/1052471592.db2.gz UTYKKBZLKLOJQE-DBVUQKKJSA-N 2 1 300.490 4.307 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CCC[C@]3(CC[NH2+]3)C2)CC1 ZINC001222277644 1052472821 /nfs/dbraw/zinc/47/28/21/1052472821.db2.gz QCOVHRHAELKHNQ-PMACEKPBSA-N 2 1 302.506 4.287 20 0 DIADMP Fc1ccc(C[NH+]2CCC3(CCCC[NH2+]3)CC2)c2ccccc12 ZINC001222293640 1052474741 /nfs/dbraw/zinc/47/47/41/1052474741.db2.gz ZZCRGFNADKALBG-UHFFFAOYSA-N 2 1 312.432 4.087 20 0 DIADMP c1cc2c(cccc2C[NH+]2CCC3(CCCC[NH2+]3)CC2)s1 ZINC001222297354 1052475934 /nfs/dbraw/zinc/47/59/34/1052475934.db2.gz FSWNLKLQKBYGFR-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP c1cc2ccc(C[NH+]3CCC4(CCCC[NH2+]4)CC3)cc2s1 ZINC001222297261 1052476095 /nfs/dbraw/zinc/47/60/95/1052476095.db2.gz AALVGWMGIURYCW-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001222309790 1052479167 /nfs/dbraw/zinc/47/91/67/1052479167.db2.gz SJGMJKUOFPKMBI-NEWSRXKRSA-N 2 1 318.892 4.052 20 0 DIADMP c1sc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1-c1ccccc1 ZINC000317107811 1052480148 /nfs/dbraw/zinc/48/01/48/1052480148.db2.gz BWDLMYCTEOWNAX-QZTJIDSGSA-N 2 1 312.482 4.132 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c2ccccc12 ZINC001222315636 1052480812 /nfs/dbraw/zinc/48/08/12/1052480812.db2.gz PCFGFIUCHRAZLT-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222355704 1052489548 /nfs/dbraw/zinc/48/95/48/1052489548.db2.gz TZZGFEISAPRKRT-OAQYLSRUSA-N 2 1 320.436 4.304 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222355704 1052489552 /nfs/dbraw/zinc/48/95/52/1052489552.db2.gz TZZGFEISAPRKRT-OAQYLSRUSA-N 2 1 320.436 4.304 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222389842 1052494939 /nfs/dbraw/zinc/49/49/39/1052494939.db2.gz HBIQMXGCYNQQQF-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222389842 1052494944 /nfs/dbraw/zinc/49/49/44/1052494944.db2.gz HBIQMXGCYNQQQF-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222395580 1052495282 /nfs/dbraw/zinc/49/52/82/1052495282.db2.gz LYCABASVHMQNSU-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222395580 1052495286 /nfs/dbraw/zinc/49/52/86/1052495286.db2.gz LYCABASVHMQNSU-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222391156 1052495331 /nfs/dbraw/zinc/49/53/31/1052495331.db2.gz YOWPWTCZYIFISC-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222391156 1052495334 /nfs/dbraw/zinc/49/53/34/1052495334.db2.gz YOWPWTCZYIFISC-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222389841 1052495409 /nfs/dbraw/zinc/49/54/09/1052495409.db2.gz HBIQMXGCYNQQQF-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222389841 1052495412 /nfs/dbraw/zinc/49/54/12/1052495412.db2.gz HBIQMXGCYNQQQF-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP C[C@H](C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421150 1052498525 /nfs/dbraw/zinc/49/85/25/1052498525.db2.gz JFTOWHWIHYOWSR-UTKZUKDTSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@H](C[N@H+]1CC[C@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421150 1052498528 /nfs/dbraw/zinc/49/85/28/1052498528.db2.gz JFTOWHWIHYOWSR-UTKZUKDTSA-N 2 1 308.469 4.161 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@]3(CCC[NH2+]3)C2)CC1 ZINC001222465568 1052502458 /nfs/dbraw/zinc/50/24/58/1052502458.db2.gz VGECNVGANXMAQF-PMACEKPBSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@]3(CCC[NH2+]3)C2)CC1 ZINC001222465572 1052502850 /nfs/dbraw/zinc/50/28/50/1052502850.db2.gz VGECNVGANXMAQF-WOJBJXKFSA-N 2 1 302.506 4.287 20 0 DIADMP c1ccc([C@H]2C[N@H+](CCCC3CCCCC3)CC23C[NH2+]C3)cc1 ZINC001222595852 1052515701 /nfs/dbraw/zinc/51/57/01/1052515701.db2.gz KMBHNAASPBZRJS-HXUWFJFHSA-N 2 1 312.501 4.036 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC001222624400 1052520780 /nfs/dbraw/zinc/52/07/80/1052520780.db2.gz ZLXKXHWYASYDCM-IYBDPMFKSA-N 2 1 320.436 4.017 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@@H]1CC1(C)C ZINC000397602564 1052529894 /nfs/dbraw/zinc/52/98/94/1052529894.db2.gz ALOWXFALOIXGGM-DKKFBQAASA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)[C@@H]1CC1(C)C ZINC000397602564 1052529903 /nfs/dbraw/zinc/52/99/03/1052529903.db2.gz ALOWXFALOIXGGM-DKKFBQAASA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398052606 1052564654 /nfs/dbraw/zinc/56/46/54/1052564654.db2.gz YJEFYBNNRCEKEY-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398052606 1052564660 /nfs/dbraw/zinc/56/46/60/1052564660.db2.gz YJEFYBNNRCEKEY-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccccc1)c1cc(C)ccc1C ZINC000326606683 1052565499 /nfs/dbraw/zinc/56/54/99/1052565499.db2.gz IDIFZHMEVUCRLT-OAQYLSRUSA-N 2 1 319.452 4.188 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000037149925 1052606094 /nfs/dbraw/zinc/60/60/94/1052606094.db2.gz VQYIPTHNTZQUEJ-UHFFFAOYSA-N 2 1 315.288 4.348 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649064 1052628044 /nfs/dbraw/zinc/62/80/44/1052628044.db2.gz XKWFXHLZDUYONE-RDTXWAMCSA-N 2 1 306.881 4.255 20 0 DIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1cccs1 ZINC000123931925 1052636677 /nfs/dbraw/zinc/63/66/77/1052636677.db2.gz SBVCPRHUWDTYLE-KRWDZBQOSA-N 2 1 302.487 4.441 20 0 DIADMP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1ccco1 ZINC000124712986 1052643432 /nfs/dbraw/zinc/64/34/32/1052643432.db2.gz OGZDSENAZYLQIY-ZACQAIPSSA-N 2 1 312.457 4.087 20 0 DIADMP CCCC[C@H](COC)[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000125143600 1052645338 /nfs/dbraw/zinc/64/53/38/1052645338.db2.gz VZVISMOMEDTHTH-YLJYHZDGSA-N 2 1 318.505 4.007 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2C)C[C@@H]1C ZINC000125523434 1052649774 /nfs/dbraw/zinc/64/97/74/1052649774.db2.gz MJMCVVVXVYOVON-PKOBYXMFSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2C)C[C@@H]1C ZINC000125523434 1052649776 /nfs/dbraw/zinc/64/97/76/1052649776.db2.gz MJMCVVVXVYOVON-PKOBYXMFSA-N 2 1 311.473 4.158 20 0 DIADMP COc1ccc(Cl)cc1C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000916834719 1052657857 /nfs/dbraw/zinc/65/78/57/1052657857.db2.gz VVMJNDVFNUHHGM-OAHLLOKOSA-N 2 1 324.896 4.093 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](CN[C@@H](C)c2cc3ccccc3o2)C1 ZINC000125980709 1052662298 /nfs/dbraw/zinc/66/22/98/1052662298.db2.gz GOIOSDBCAKYPQG-HOTGVXAUSA-N 2 1 300.446 4.204 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccccc3o2)C1 ZINC000125980709 1052662303 /nfs/dbraw/zinc/66/23/03/1052662303.db2.gz GOIOSDBCAKYPQG-HOTGVXAUSA-N 2 1 300.446 4.204 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccccc3o2)C1 ZINC000125980709 1052662306 /nfs/dbraw/zinc/66/23/06/1052662306.db2.gz GOIOSDBCAKYPQG-HOTGVXAUSA-N 2 1 300.446 4.204 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)cc2)c1 ZINC000065976595 1052683181 /nfs/dbraw/zinc/68/31/81/1052683181.db2.gz ZKGLUILSYNMWPW-UHFFFAOYSA-N 2 1 316.876 4.470 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cc1 ZINC000128230768 1052712626 /nfs/dbraw/zinc/71/26/26/1052712626.db2.gz KEAXOENIVGIVIN-QGZVFWFLSA-N 2 1 309.457 4.018 20 0 DIADMP c1ccc(-c2ccccc2C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000917395404 1052723639 /nfs/dbraw/zinc/72/36/39/1052723639.db2.gz MVNLZAANGPUTGH-PMACEKPBSA-N 2 1 306.453 4.070 20 0 DIADMP CC[C@H](C[NH2+]Cc1ccccc1-c1ccccc1)[NH+]1CCCC1 ZINC000917394954 1052723772 /nfs/dbraw/zinc/72/37/72/1052723772.db2.gz YCNUYKJVHRIURV-HXUWFJFHSA-N 2 1 308.469 4.318 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129456402 1052790131 /nfs/dbraw/zinc/79/01/31/1052790131.db2.gz YAHRNOVUEBQUGZ-DLBZAZTESA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129456402 1052790136 /nfs/dbraw/zinc/79/01/36/1052790136.db2.gz YAHRNOVUEBQUGZ-DLBZAZTESA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556062243 1052795578 /nfs/dbraw/zinc/79/55/78/1052795578.db2.gz RKWSUBMAWIOFFZ-HHUCQEJWSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556062243 1052795581 /nfs/dbraw/zinc/79/55/81/1052795581.db2.gz RKWSUBMAWIOFFZ-HHUCQEJWSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129624909 1052799078 /nfs/dbraw/zinc/79/90/78/1052799078.db2.gz NMYBCUXBSCIRSZ-MDZLAQPJSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129624909 1052799083 /nfs/dbraw/zinc/79/90/83/1052799083.db2.gz NMYBCUXBSCIRSZ-MDZLAQPJSA-N 2 1 301.261 4.127 20 0 DIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556118479 1052803382 /nfs/dbraw/zinc/80/33/82/1052803382.db2.gz DAIPHDPEWLCYTF-OALUTQOASA-N 2 1 320.546 4.191 20 0 DIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556118479 1052803387 /nfs/dbraw/zinc/80/33/87/1052803387.db2.gz DAIPHDPEWLCYTF-OALUTQOASA-N 2 1 320.546 4.191 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc3c(s2)CCCC3)CC1 ZINC000129794110 1052812212 /nfs/dbraw/zinc/81/22/12/1052812212.db2.gz OZXDLSYPMIJRHT-CQSZACIVSA-N 2 1 306.519 4.152 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]CCCn2cc[nH+]c2C)cc1 ZINC000556576653 1052866893 /nfs/dbraw/zinc/86/68/93/1052866893.db2.gz VKWPRALQSYXOMC-INIZCTEOSA-N 2 1 315.461 4.111 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC000920181435 1052925320 /nfs/dbraw/zinc/92/53/20/1052925320.db2.gz ZFRPPNTWOKJPJG-SFHVURJKSA-N 2 1 308.469 4.175 20 0 DIADMP c1cc(-c2cccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)c2)cs1 ZINC001226783010 1052931149 /nfs/dbraw/zinc/93/11/49/1052931149.db2.gz BWTZYKKHUOIEEX-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP Cc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000078402434 1052983846 /nfs/dbraw/zinc/98/38/46/1052983846.db2.gz XHLOEXZHYIYCQY-HXUWFJFHSA-N 2 1 300.490 4.083 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236449904 1053040709 /nfs/dbraw/zinc/04/07/09/1053040709.db2.gz DHXAMYPWYBYETD-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP c1cc(-c2csc(C[NH+]3CCC4(CCC[NH2+]4)CC3)c2)cs1 ZINC001228555748 1053134148 /nfs/dbraw/zinc/13/41/48/1053134148.db2.gz JCGFSMASSQKEIE-UHFFFAOYSA-N 2 1 318.511 4.195 20 0 DIADMP Cc1csc2sc(C[NH+]3CCC4(CCC[NH2+]4)CC3)c(C)c12 ZINC001228554900 1053134356 /nfs/dbraw/zinc/13/43/56/1053134356.db2.gz AWHIKRNJLLJXRH-UHFFFAOYSA-N 2 1 320.527 4.298 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000519435170 1053141989 /nfs/dbraw/zinc/14/19/89/1053141989.db2.gz JGIKZVRYRWPGSY-LNRXMEIDSA-N 2 1 320.480 4.215 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000519435170 1053141994 /nfs/dbraw/zinc/14/19/94/1053141994.db2.gz JGIKZVRYRWPGSY-LNRXMEIDSA-N 2 1 320.480 4.215 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2([NH+](C)C)CCCC2)C[C@@H](c2ccccc2)C1 ZINC000323645544 1053164541 /nfs/dbraw/zinc/16/45/41/1053164541.db2.gz UUKZWERFUUYURQ-IHPCNDPISA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC2([NH+](C)C)CCCC2)C1 ZINC000323645545 1053164864 /nfs/dbraw/zinc/16/48/64/1053164864.db2.gz UUKZWERFUUYURQ-SXLOBPIMSA-N 2 1 314.517 4.423 20 0 DIADMP CC[N@H+]1CCC[C@@H](CN[C@@H](C)c2cc(Cl)sc2Cl)C1 ZINC001319383068 1053239709 /nfs/dbraw/zinc/23/97/09/1053239709.db2.gz IZBZPEINSOWNCI-QWRGUYRKSA-N 2 1 321.317 4.437 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@H](C)CCSc2ccccc2)CC1 ZINC001319404105 1053241514 /nfs/dbraw/zinc/24/15/14/1053241514.db2.gz PNVZTLUOJCETCC-QGZVFWFLSA-N 2 1 320.546 4.364 20 0 DIADMP Fc1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000091284483 1053257998 /nfs/dbraw/zinc/25/79/98/1053257998.db2.gz MRZGQDZWUBVECD-FOIQADDNSA-N 2 1 316.464 4.131 20 0 DIADMP Fc1ccccc1[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000091268670 1053259219 /nfs/dbraw/zinc/25/92/19/1053259219.db2.gz PYEPIWJERVWMDE-FQEVSTJZSA-N 2 1 316.464 4.273 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC001319685172 1053263947 /nfs/dbraw/zinc/26/39/47/1053263947.db2.gz MSNZMHFDEXLAQF-KSSFIOAISA-N 2 1 306.881 4.039 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC001319756499 1053272483 /nfs/dbraw/zinc/27/24/83/1053272483.db2.gz XRFICXOHMJYUCX-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2ccccc2s1 ZINC000252703260 1053274086 /nfs/dbraw/zinc/27/40/86/1053274086.db2.gz NMZWOYLEEKHMDS-BPUTZDHNSA-N 2 1 300.471 4.179 20 0 DIADMP Cc1c[nH+]c2ccccc2c1N1CCC(C[N@H+](C)C(C)C)CC1 ZINC001319799395 1053275412 /nfs/dbraw/zinc/27/54/12/1053275412.db2.gz VIYUUFPSHDLINX-UHFFFAOYSA-N 2 1 311.473 4.100 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC001319935722 1053286236 /nfs/dbraw/zinc/28/62/36/1053286236.db2.gz XBAIRLYDMIBYGI-QFBILLFUSA-N 2 1 304.478 4.141 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001474744496 1053296969 /nfs/dbraw/zinc/29/69/69/1053296969.db2.gz IJAFCJTYGXJVJO-LSNMZSPYSA-N 2 1 314.517 4.311 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC001320599093 1053347395 /nfs/dbraw/zinc/34/73/95/1053347395.db2.gz VJHMTEKMODWKRF-KSSFIOAISA-N 2 1 306.881 4.113 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2[NH+](C)C)C1 ZINC001200089770 1053371393 /nfs/dbraw/zinc/37/13/93/1053371393.db2.gz XQMITNYCYHLMHB-OSTWSGHESA-N 2 1 314.517 4.421 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169719 1053398627 /nfs/dbraw/zinc/39/86/27/1053398627.db2.gz ICLGBMMUXAAJND-VXGBXAGGSA-N 2 1 301.261 4.115 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(C)sc2C)c1 ZINC001200243283 1053491513 /nfs/dbraw/zinc/49/15/13/1053491513.db2.gz GASTZNAZQMUMTI-UHFFFAOYSA-N 2 1 302.487 4.106 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](CNCc2cc(Cl)ccc2Cl)C1 ZINC001200243995 1053493898 /nfs/dbraw/zinc/49/38/98/1053493898.db2.gz OTUQFUUSTVSSQM-ZDUSSCGKSA-N 2 1 315.288 4.203 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000261918039 1053543866 /nfs/dbraw/zinc/54/38/66/1053543866.db2.gz RDPAFPMRYNBPCW-PNHOKKKMSA-N 2 1 310.441 4.269 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940222 1053613095 /nfs/dbraw/zinc/61/30/95/1053613095.db2.gz DRRRXPZZGJNKFE-XJKSGUPXSA-N 2 1 312.860 4.252 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940222 1053613110 /nfs/dbraw/zinc/61/31/10/1053613110.db2.gz DRRRXPZZGJNKFE-XJKSGUPXSA-N 2 1 312.860 4.252 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001324735563 1053675552 /nfs/dbraw/zinc/67/55/52/1053675552.db2.gz KRPVWLPIZPZZGY-INIZCTEOSA-N 2 1 300.490 4.043 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)C1 ZINC001324964005 1053691965 /nfs/dbraw/zinc/69/19/65/1053691965.db2.gz DOTDMLJJHWRRTN-JKSUJKDBSA-N 2 1 314.448 4.361 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270902 1053725092 /nfs/dbraw/zinc/72/50/92/1053725092.db2.gz QCFVFHQCTSVAMT-CWRNSKLLSA-N 2 1 314.395 4.000 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270902 1053725102 /nfs/dbraw/zinc/72/51/02/1053725102.db2.gz QCFVFHQCTSVAMT-CWRNSKLLSA-N 2 1 314.395 4.000 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccs1 ZINC000154476889 1053738655 /nfs/dbraw/zinc/73/86/55/1053738655.db2.gz DEAYZMXQFAVABY-BQFCYCMXSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccs1 ZINC000154476889 1053738660 /nfs/dbraw/zinc/73/86/60/1053738660.db2.gz DEAYZMXQFAVABY-BQFCYCMXSA-N 2 1 314.498 4.309 20 0 DIADMP CC1(C)CCCC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309762157 1053750843 /nfs/dbraw/zinc/75/08/43/1053750843.db2.gz YKDZFXCVMRZJTF-MOPGFXCFSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2ccccc21 ZINC000154852057 1053751468 /nfs/dbraw/zinc/75/14/68/1053751468.db2.gz QOOOGPOTGJLNLL-NRFANRHFSA-N 2 1 308.469 4.304 20 0 DIADMP CCc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)s1 ZINC001231502361 1053770464 /nfs/dbraw/zinc/77/04/64/1053770464.db2.gz ATPCJCZDCCHYOF-HOTGVXAUSA-N 2 1 306.519 4.149 20 0 DIADMP CCc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)s1 ZINC001231502361 1053770476 /nfs/dbraw/zinc/77/04/76/1053770476.db2.gz ATPCJCZDCCHYOF-HOTGVXAUSA-N 2 1 306.519 4.149 20 0 DIADMP CCc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)s1 ZINC001231502361 1053770489 /nfs/dbraw/zinc/77/04/89/1053770489.db2.gz ATPCJCZDCCHYOF-HOTGVXAUSA-N 2 1 306.519 4.149 20 0 DIADMP CCc1ccc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)s1 ZINC001231501778 1053771130 /nfs/dbraw/zinc/77/11/30/1053771130.db2.gz QJOIFRSOAJVMMN-MRXNPFEDSA-N 2 1 306.519 4.151 20 0 DIADMP CC[N@@H+](Cc1ccc(OC(C)C)c(Cl)c1)C1CCN(C)CC1 ZINC001231712837 1053836116 /nfs/dbraw/zinc/83/61/16/1053836116.db2.gz FVBYIUXPJLYQAD-UHFFFAOYSA-N 2 1 324.896 4.043 20 0 DIADMP CC(C)Oc1ccc(C[N@H+](C)CCC[NH+]2CCCC2)cc1Cl ZINC001231713147 1053837746 /nfs/dbraw/zinc/83/77/46/1053837746.db2.gz OPBCNHUROLVWIB-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP CC(C)Oc1ccc(C[N@@H+](C)CCC[NH+]2CCCC2)cc1Cl ZINC001231713147 1053837760 /nfs/dbraw/zinc/83/77/60/1053837760.db2.gz OPBCNHUROLVWIB-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000157230204 1053844739 /nfs/dbraw/zinc/84/47/39/1053844739.db2.gz WPCNGYSBTSEYCB-KTLDDFEXSA-N 2 1 300.490 4.033 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)s1 ZINC000157853282 1053870711 /nfs/dbraw/zinc/87/07/11/1053870711.db2.gz WWJKVJIXCKMAHL-GJZGRUSLSA-N 2 1 323.550 4.319 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001327723089 1053872147 /nfs/dbraw/zinc/87/21/47/1053872147.db2.gz RDXDCYAAEMNDFT-JPGZLTHCSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@H]1CC[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001327723092 1053874789 /nfs/dbraw/zinc/87/47/89/1053874789.db2.gz RDXDCYAAEMNDFT-XICAJGIJSA-N 2 1 312.501 4.350 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)C1 ZINC000163274688 1053894530 /nfs/dbraw/zinc/89/45/30/1053894530.db2.gz WHQIUPXPXOGERQ-JKSUJKDBSA-N 2 1 306.519 4.180 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)C(C)(C)c1ccccc1 ZINC001200702871 1053905142 /nfs/dbraw/zinc/90/51/42/1053905142.db2.gz HLFFCZJLXRADTJ-ROUUACIJSA-N 2 1 302.506 4.205 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)C(C)(C)c1ccccc1 ZINC001200702870 1053905683 /nfs/dbraw/zinc/90/56/83/1053905683.db2.gz HLFFCZJLXRADTJ-QZTJIDSGSA-N 2 1 302.506 4.205 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000158653692 1053913784 /nfs/dbraw/zinc/91/37/84/1053913784.db2.gz VDPUINRQUNTIGT-ROUUACIJSA-N 2 1 303.494 4.025 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232013744 1053939098 /nfs/dbraw/zinc/93/90/98/1053939098.db2.gz DOBHFDAYYZNYCW-IBGZPJMESA-N 2 1 309.388 4.429 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232013744 1053939109 /nfs/dbraw/zinc/93/91/09/1053939109.db2.gz DOBHFDAYYZNYCW-IBGZPJMESA-N 2 1 309.388 4.429 20 0 DIADMP c1c2c[nH+]ccc2[nH]c1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001232014355 1053941334 /nfs/dbraw/zinc/94/13/34/1053941334.db2.gz OHSOTLRKKBFEQB-KRWDZBQOSA-N 2 1 305.425 4.018 20 0 DIADMP Clc1cccc([C@H]2CC[N@@H+](Cc3cc4c[nH+]ccc4[nH]3)C2)c1 ZINC001232016120 1053943863 /nfs/dbraw/zinc/94/38/63/1053943863.db2.gz RDZOVJBQYZKHCW-AWEZNQCLSA-N 2 1 311.816 4.206 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@H]2c2ccccc2)c1 ZINC001232145782 1053973624 /nfs/dbraw/zinc/97/36/24/1053973624.db2.gz ASNYIUQLXOEOGF-FQEVSTJZSA-N 2 1 312.432 4.224 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000290287198 1054046610 /nfs/dbraw/zinc/04/66/10/1054046610.db2.gz XRCQPCCQJWGXCP-ICSRJNTNSA-N 2 1 323.484 4.035 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](Cc1ccc(C)cc1)C(C)C ZINC000164700438 1054062509 /nfs/dbraw/zinc/06/25/09/1054062509.db2.gz HMWBJOCXNCINDZ-HXUWFJFHSA-N 2 1 313.489 4.137 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(C3CC3)cc2)CC1 ZINC001232985952 1054166147 /nfs/dbraw/zinc/16/61/47/1054166147.db2.gz CWTDUUGXZRRAEZ-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC[N@@H+]1C ZINC000168479704 1054170447 /nfs/dbraw/zinc/17/04/47/1054170447.db2.gz BFMDRTGUCCLZMG-IDHHARJASA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC[N@H+]1C ZINC000168479704 1054170454 /nfs/dbraw/zinc/17/04/54/1054170454.db2.gz BFMDRTGUCCLZMG-IDHHARJASA-N 2 1 304.453 4.129 20 0 DIADMP CC1CC[NH+](c2ccc(N[C@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC001334890181 1054203740 /nfs/dbraw/zinc/20/37/40/1054203740.db2.gz HRYXPIOIWOYXBT-SFHVURJKSA-N 2 1 315.505 4.208 20 0 DIADMP CC1CC[NH+](c2ccc(N[C@H]3CC[N@@H+](C)C(C)(C)C3)cc2)CC1 ZINC001334890181 1054203743 /nfs/dbraw/zinc/20/37/43/1054203743.db2.gz HRYXPIOIWOYXBT-SFHVURJKSA-N 2 1 315.505 4.208 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)cc2)c1 ZINC001233225071 1054210075 /nfs/dbraw/zinc/21/00/75/1054210075.db2.gz JUHCYXNSMOZQLS-FGZHOGPDSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)cc2)c1 ZINC001233225071 1054210091 /nfs/dbraw/zinc/21/00/91/1054210091.db2.gz JUHCYXNSMOZQLS-FGZHOGPDSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC001337567710 1054274996 /nfs/dbraw/zinc/27/49/96/1054274996.db2.gz UKNINJWLOVFOJE-UHFFFAOYSA-N 2 1 323.484 4.056 20 0 DIADMP CC[C@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)cc1Cl ZINC000336839535 1054331747 /nfs/dbraw/zinc/33/17/47/1054331747.db2.gz OWGOHXPFOGJQLX-HNNXBMFYSA-N 2 1 312.244 4.239 20 0 DIADMP C[C@@H](CC[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000379849445 1054426405 /nfs/dbraw/zinc/42/64/05/1054426405.db2.gz GIVOUSLPMPYLOX-FPOVZHCZSA-N 2 1 322.496 4.292 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccccc1 ZINC000174450817 1054509194 /nfs/dbraw/zinc/50/91/94/1054509194.db2.gz RIPIJTIBTVUWPM-UHFFFAOYSA-N 2 1 320.436 4.201 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267225 1054561954 /nfs/dbraw/zinc/56/19/54/1054561954.db2.gz WGDUCIZWVNVASS-CVEARBPZSA-N 2 1 308.535 4.232 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267225 1054561973 /nfs/dbraw/zinc/56/19/73/1054561973.db2.gz WGDUCIZWVNVASS-CVEARBPZSA-N 2 1 308.535 4.232 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000623335744 1054562404 /nfs/dbraw/zinc/56/24/04/1054562404.db2.gz BTDFYVYUBVBPAQ-SWLSCSKDSA-N 2 1 314.395 4.229 20 0 DIADMP C[N@H+]1CC[C@H](N[C@@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344392 1054565208 /nfs/dbraw/zinc/56/52/08/1054565208.db2.gz KRTMMDCRRMCKDR-DZGCQCFKSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344392 1054565233 /nfs/dbraw/zinc/56/52/33/1054565233.db2.gz KRTMMDCRRMCKDR-DZGCQCFKSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344392 1054565247 /nfs/dbraw/zinc/56/52/47/1054565247.db2.gz KRTMMDCRRMCKDR-DZGCQCFKSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)C(C)(C)C ZINC000670267649 1054568078 /nfs/dbraw/zinc/56/80/78/1054568078.db2.gz NXTUHNZIAAKMAX-BFYDXBDKSA-N 2 1 308.535 4.403 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C(C)(C)C ZINC000670267649 1054568095 /nfs/dbraw/zinc/56/80/95/1054568095.db2.gz NXTUHNZIAAKMAX-BFYDXBDKSA-N 2 1 308.535 4.403 20 0 DIADMP CC[C@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419651 1054589530 /nfs/dbraw/zinc/58/95/30/1054589530.db2.gz RHPHDOAYGVHKDB-RYUDHWBXSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419651 1054589545 /nfs/dbraw/zinc/58/95/45/1054589545.db2.gz RHPHDOAYGVHKDB-RYUDHWBXSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419651 1054589558 /nfs/dbraw/zinc/58/95/58/1054589558.db2.gz RHPHDOAYGVHKDB-RYUDHWBXSA-N 2 1 300.899 4.315 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1(C)C ZINC000623487191 1054603495 /nfs/dbraw/zinc/60/34/95/1054603495.db2.gz WJXPVNUCCFCTOC-MOPGFXCFSA-N 2 1 316.464 4.224 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cccc2ccccc21 ZINC000177295271 1054618298 /nfs/dbraw/zinc/61/82/98/1054618298.db2.gz UQAQHYLJTDDMFJ-HOTGVXAUSA-N 2 1 307.441 4.332 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001234994360 1054637670 /nfs/dbraw/zinc/63/76/70/1054637670.db2.gz SHPCKCDJHGGUSR-NRFANRHFSA-N 2 1 320.436 4.162 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CCC[C@@]4(CC[NH2+]C4)C3)s2)c1 ZINC001234991508 1054637843 /nfs/dbraw/zinc/63/78/43/1054637843.db2.gz GIJMKXKIHQFMML-KRWDZBQOSA-N 2 1 318.511 4.052 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)s2)c1 ZINC001234991508 1054637848 /nfs/dbraw/zinc/63/78/48/1054637848.db2.gz GIJMKXKIHQFMML-KRWDZBQOSA-N 2 1 318.511 4.052 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001234995265 1054638642 /nfs/dbraw/zinc/63/86/42/1054638642.db2.gz VBJIRYNYPNXBSE-NQIIRXRSSA-N 2 1 314.517 4.064 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001234994817 1054638981 /nfs/dbraw/zinc/63/89/81/1054638981.db2.gz WGLFYNIMSVCIIZ-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001234994817 1054638986 /nfs/dbraw/zinc/63/89/86/1054638986.db2.gz WGLFYNIMSVCIIZ-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001235003007 1054640829 /nfs/dbraw/zinc/64/08/29/1054640829.db2.gz YZYWCKZATZYLDW-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)CC1 ZINC001235030946 1054644358 /nfs/dbraw/zinc/64/43/58/1054644358.db2.gz JFHGXEUQQDECHL-UXHICEINSA-N 2 1 302.506 4.145 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc(C)c1Cl ZINC001235036777 1054644522 /nfs/dbraw/zinc/64/45/22/1054644522.db2.gz BKVHXYQYJNTDAY-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc(C)c1Cl ZINC001235036777 1054644528 /nfs/dbraw/zinc/64/45/28/1054644528.db2.gz BKVHXYQYJNTDAY-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1c(Cl)ccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c1C ZINC001235036742 1054644790 /nfs/dbraw/zinc/64/47/90/1054644790.db2.gz BAPBPAZEURSKBE-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c1C ZINC001235036742 1054644798 /nfs/dbraw/zinc/64/47/98/1054644798.db2.gz BAPBPAZEURSKBE-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235042364 1054646335 /nfs/dbraw/zinc/64/63/35/1054646335.db2.gz AXRRFFNACRVEND-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)cc2)cc1 ZINC001235040695 1054646645 /nfs/dbraw/zinc/64/66/45/1054646645.db2.gz MYJNNSAQWHVCIN-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235046544 1054647209 /nfs/dbraw/zinc/64/72/09/1054647209.db2.gz RAUASZYWDDWCEQ-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235041705 1054647606 /nfs/dbraw/zinc/64/76/06/1054647606.db2.gz RWVPATXWLUXCQV-AZUAARDMSA-N 2 1 324.553 4.216 20 0 DIADMP Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000178302287 1054649165 /nfs/dbraw/zinc/64/91/65/1054649165.db2.gz MFLLNONTVNWBNM-AYBZRNKSSA-N 2 1 312.457 4.292 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)o1 ZINC000178302287 1054649171 /nfs/dbraw/zinc/64/91/71/1054649171.db2.gz MFLLNONTVNWBNM-AYBZRNKSSA-N 2 1 312.457 4.292 20 0 DIADMP CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001235086128 1054653872 /nfs/dbraw/zinc/65/38/72/1054653872.db2.gz AFERTYJIZNMXMY-DLBZAZTESA-N 2 1 314.464 4.080 20 0 DIADMP CC(C)c1cc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)ccc1Cl ZINC001235094423 1054653955 /nfs/dbraw/zinc/65/39/55/1054653955.db2.gz WWXWBDCCPOQJFH-UHFFFAOYSA-N 2 1 306.881 4.039 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)cc2)cc1 ZINC001235093951 1054654117 /nfs/dbraw/zinc/65/41/17/1054654117.db2.gz UBJIXANLGDYAAL-UHFFFAOYSA-N 2 1 320.480 4.238 20 0 DIADMP CC(C)=CCC[C@@H](C)CC[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001235086144 1054654183 /nfs/dbraw/zinc/65/41/83/1054654183.db2.gz AFERTYJIZNMXMY-IAGOWNOFSA-N 2 1 314.464 4.080 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CCCC34CC[NH2+]CC4)c2)cc1 ZINC001235139758 1054664293 /nfs/dbraw/zinc/66/42/93/1054664293.db2.gz CXZVSKFVOYQWRN-UHFFFAOYSA-N 2 1 322.452 4.197 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCCC23CC[NH2+]CC3)cc1 ZINC001235143976 1054664914 /nfs/dbraw/zinc/66/49/14/1054664914.db2.gz HGMPOGODHXMPQY-UHFFFAOYSA-N 2 1 306.453 4.072 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235152688 1054666726 /nfs/dbraw/zinc/66/67/26/1054666726.db2.gz AHKDAKKSXVZOSK-SFHVURJKSA-N 2 1 324.871 4.142 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235152602 1054667532 /nfs/dbraw/zinc/66/75/32/1054667532.db2.gz HPMNTYSROSACAD-NRFANRHFSA-N 2 1 308.469 4.194 20 0 DIADMP Cc1c(F)ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1Cl ZINC001235158663 1054667569 /nfs/dbraw/zinc/66/75/69/1054667569.db2.gz VBUQSRHMSDLNIW-QGZVFWFLSA-N 2 1 324.871 4.142 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1 ZINC001235158715 1054669775 /nfs/dbraw/zinc/66/97/75/1054669775.db2.gz VJUXKMXEXOMSCU-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP c1ccc(C2(C[N@H+]3CCCC[C@@]34CCC[NH2+]C4)CCCC2)cc1 ZINC001235171416 1054673753 /nfs/dbraw/zinc/67/37/53/1054673753.db2.gz JPXJTXGLPBXRFG-NRFANRHFSA-N 2 1 312.501 4.107 20 0 DIADMP C[N@H+](Cc1cc(-c2ccsc2)cs1)CC1CC[NH+](C)CC1 ZINC001235187614 1054678753 /nfs/dbraw/zinc/67/87/53/1054678753.db2.gz YJJPNTQKMMCBIP-UHFFFAOYSA-N 2 1 320.527 4.250 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCCCC23CC[NH2+]CC3)s1 ZINC001235190539 1054680256 /nfs/dbraw/zinc/68/02/56/1054680256.db2.gz VKXJOOYYIYXXBS-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235191137 1054680384 /nfs/dbraw/zinc/68/03/84/1054680384.db2.gz PTRLSADHMCLEHO-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001235192186 1054681535 /nfs/dbraw/zinc/68/15/35/1054681535.db2.gz YNDORWZQJJNHCL-UHFFFAOYSA-N 2 1 324.921 4.170 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235192186 1054681541 /nfs/dbraw/zinc/68/15/41/1054681541.db2.gz YNDORWZQJJNHCL-UHFFFAOYSA-N 2 1 324.921 4.170 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)CC1 ZINC001235247242 1054691832 /nfs/dbraw/zinc/69/18/32/1054691832.db2.gz BQBPPVUIGRFQCF-FVTFTPSCSA-N 2 1 324.512 4.200 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235260698 1054695754 /nfs/dbraw/zinc/69/57/54/1054695754.db2.gz HFBDPBWEHHNRFZ-SJLPKXTDSA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235260698 1054695762 /nfs/dbraw/zinc/69/57/62/1054695762.db2.gz HFBDPBWEHHNRFZ-SJLPKXTDSA-N 2 1 306.519 4.055 20 0 DIADMP Cc1ccc(-c2cccc(C[NH+]3CC[C@]4(CC[N@H+](C)C4)C3)c2)cc1 ZINC001235316003 1054699594 /nfs/dbraw/zinc/69/95/94/1054699594.db2.gz PYWFYJZVVUCQHN-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CC[C@]4(CC[NH+](C)C4)C3)c2)cc1 ZINC001235316003 1054699599 /nfs/dbraw/zinc/69/95/99/1054699599.db2.gz PYWFYJZVVUCQHN-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3CC[C@]4(CC[NH+](C)C4)C3)c2)cc1 ZINC001235316003 1054699606 /nfs/dbraw/zinc/69/96/06/1054699606.db2.gz PYWFYJZVVUCQHN-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235424626 1054715587 /nfs/dbraw/zinc/71/55/87/1054715587.db2.gz HUHILFXELIGRBA-MSOLQXFVSA-N 2 1 300.490 4.022 20 0 DIADMP c1cc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c2cccccc1-2 ZINC001235430866 1054718772 /nfs/dbraw/zinc/71/87/72/1054718772.db2.gz YINPHJNRZBEILU-OALUTQOASA-N 2 1 308.469 4.003 20 0 DIADMP c1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c2cccccc1-2 ZINC001235430871 1054718928 /nfs/dbraw/zinc/71/89/28/1054718928.db2.gz YINPHJNRZBEILU-RTBURBONSA-N 2 1 308.469 4.003 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+](C)CC3CC[NH2+]CC3)cc2)c1 ZINC001235433822 1054719193 /nfs/dbraw/zinc/71/91/93/1054719193.db2.gz RSJKMWSRJUZGOT-UHFFFAOYSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1C ZINC001235427786 1054719517 /nfs/dbraw/zinc/71/95/17/1054719517.db2.gz OEMCENPMYFGDAL-WMZOPIPTSA-N 2 1 320.908 4.168 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)CC1CC[NH2+]CC1 ZINC001235433782 1054719821 /nfs/dbraw/zinc/71/98/21/1054719821.db2.gz QDHMNSKQKAUDEA-UHFFFAOYSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@@H+](Cc1ccc2sc3ccccc3c2c1)C1CC[NH2+]CC1 ZINC001235465418 1054727807 /nfs/dbraw/zinc/72/78/07/1054727807.db2.gz JKZLWKFIIANQAR-UHFFFAOYSA-N 2 1 310.466 4.238 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2CC2CC3(C2)CC[NH2+]CC3)cc1 ZINC001235674762 1054771993 /nfs/dbraw/zinc/77/19/93/1054771993.db2.gz ODIYLMCFWTVILS-GOSISDBHSA-N 2 1 318.892 4.257 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc3c(s2)CC[NH2+]C3)cc1 ZINC001235680573 1054774709 /nfs/dbraw/zinc/77/47/09/1054774709.db2.gz UFUQJDHMORXYRH-SFHVURJKSA-N 2 1 312.482 4.039 20 0 DIADMP Cc1cc(C[N@@H+](C)CCC2CC[NH2+]CC2)c(Cl)cc1Cl ZINC001235718303 1054787563 /nfs/dbraw/zinc/78/75/63/1054787563.db2.gz XCFXIULQWOBBEE-UHFFFAOYSA-N 2 1 315.288 4.123 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001235716963 1054790118 /nfs/dbraw/zinc/79/01/18/1054790118.db2.gz PFPGJEZNPUAGHQ-UHFFFAOYSA-N 2 1 322.496 4.484 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc2c(c1)Cc1ccccc1-2 ZINC001235717415 1054790310 /nfs/dbraw/zinc/79/03/10/1054790310.db2.gz UXTVVAJXUMQDPZ-UHFFFAOYSA-N 2 1 320.480 4.079 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2cccc(-c3ccc(C)cc3)c2)CC1 ZINC001235727495 1054791392 /nfs/dbraw/zinc/79/13/92/1054791392.db2.gz YDHSUNPAPOOZMX-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP CCCCCCc1csc(C[N@@H+](CC)C2CC[NH2+]CC2)c1 ZINC001235764824 1054799744 /nfs/dbraw/zinc/79/97/44/1054799744.db2.gz KDSKOGISQNAFDY-UHFFFAOYSA-N 2 1 308.535 4.445 20 0 DIADMP CC[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)C1CC[NH2+]CC1 ZINC001235760640 1054801376 /nfs/dbraw/zinc/80/13/76/1054801376.db2.gz HBBLSIMFDBTITA-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP CC[N@@H+](C[C@H](C)Cc1ccc(C(C)(C)C)cc1)C1CC[NH2+]CC1 ZINC001235762149 1054801750 /nfs/dbraw/zinc/80/17/50/1054801750.db2.gz VIUHSFLDCSAWMU-QGZVFWFLSA-N 2 1 316.533 4.237 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH3+])C2 ZINC001235808319 1054808887 /nfs/dbraw/zinc/80/88/87/1054808887.db2.gz ASVWCUMDKTYFDV-REPLKXPHSA-N 2 1 306.453 4.116 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2Cl)cc1)C[C@H]1CC[NH2+]C1 ZINC001235843148 1054822988 /nfs/dbraw/zinc/82/29/88/1054822988.db2.gz WLFNYSFLCVBBCE-INIZCTEOSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908540 1054844866 /nfs/dbraw/zinc/84/48/66/1054844866.db2.gz YFSBDJZRIJWFLJ-NVXWUHKLSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908540 1054844872 /nfs/dbraw/zinc/84/48/72/1054844872.db2.gz YFSBDJZRIJWFLJ-NVXWUHKLSA-N 2 1 319.452 4.147 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)sc1C ZINC000623995767 1054848455 /nfs/dbraw/zinc/84/84/55/1054848455.db2.gz ILVBBCQCADOVPF-YCXXCVGLSA-N 2 1 306.519 4.421 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2)cc1Cl ZINC001235925374 1054849404 /nfs/dbraw/zinc/84/94/04/1054849404.db2.gz JZGBRHFONUWVTJ-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@@H+]3C[C@H]4C[NH2+]CC[C@@H]4C3)cc12 ZINC001235940334 1054858722 /nfs/dbraw/zinc/85/87/22/1054858722.db2.gz SJOQTZHQCWGDEL-HZPDHXFCSA-N 2 1 322.477 4.096 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1C[C@@H]2CC[NH2+]C[C@H]2C1 ZINC001235940895 1054860556 /nfs/dbraw/zinc/86/05/56/1054860556.db2.gz TYPQANPNRWRQGW-HOCLYGCPSA-N 2 1 322.477 4.096 20 0 DIADMP Clc1cccc([C@H]2CC[N@H+](CCC[NH2+]C3CCCCC3)C2)c1 ZINC001235949569 1054867014 /nfs/dbraw/zinc/86/70/14/1054867014.db2.gz BWHGRMWDCACIOJ-KRWDZBQOSA-N 2 1 320.908 4.442 20 0 DIADMP Clc1cccc([C@H]2CC[N@@H+](CCC[NH2+]C3CCCCC3)C2)c1 ZINC001235949569 1054867019 /nfs/dbraw/zinc/86/70/19/1054867019.db2.gz BWHGRMWDCACIOJ-KRWDZBQOSA-N 2 1 320.908 4.442 20 0 DIADMP C[N@@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccc(Oc2ccccc2)cc1 ZINC001235950158 1054867142 /nfs/dbraw/zinc/86/71/42/1054867142.db2.gz SJHYCDMUIHSXMU-SFHVURJKSA-N 2 1 324.468 4.300 20 0 DIADMP Cc1cc(C[N@@H+](C)C[C@H]2CCC[NH2+]C2)ccc1Oc1ccccc1 ZINC001235959474 1054869455 /nfs/dbraw/zinc/86/94/55/1054869455.db2.gz QCUWVJTYXIYYBB-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)C[C@@H]3CCC[NH2+]C3)cc2)cc1 ZINC001235957785 1054869938 /nfs/dbraw/zinc/86/99/38/1054869938.db2.gz UGMMTWKFPARHOG-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+](C)C[C@H]3CCC[NH2+]C3)c2)cc1 ZINC001235957682 1054870437 /nfs/dbraw/zinc/87/04/37/1054870437.db2.gz SANKBUMNMUSLRN-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)C[C@@H]3CCC[NH2+]C3)c(C)c12 ZINC001235956275 1054870673 /nfs/dbraw/zinc/87/06/73/1054870673.db2.gz BSFWSFRFRQYIJY-CYBMUJFWSA-N 2 1 308.516 4.011 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989022 1054882639 /nfs/dbraw/zinc/88/26/39/1054882639.db2.gz BOAPPUYQQFHZBC-RXVVDRJESA-N 2 1 324.443 4.033 20 0 DIADMP Cc1cc(C[N@H+]2C[C@@H]3CC[C@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989022 1054882645 /nfs/dbraw/zinc/88/26/45/1054882645.db2.gz BOAPPUYQQFHZBC-RXVVDRJESA-N 2 1 324.443 4.033 20 0 DIADMP Cc1ccc2cc([C@H](C)NC[C@@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123927 1054884643 /nfs/dbraw/zinc/88/46/43/1054884643.db2.gz TZSRRHSOQXNNAD-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]C[C@@H]3CCCC[N@H+](C)C3)oc2c1 ZINC000624123927 1054884650 /nfs/dbraw/zinc/88/46/50/1054884650.db2.gz TZSRRHSOQXNNAD-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123927 1054884658 /nfs/dbraw/zinc/88/46/58/1054884658.db2.gz TZSRRHSOQXNNAD-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP C[C@H]1C[NH2+]CC(F)(F)[C@@H]1C[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009837 1054895030 /nfs/dbraw/zinc/89/50/30/1054895030.db2.gz XYBDWBSPJMDMNJ-SLTXQBBLSA-N 2 1 316.480 4.014 20 0 DIADMP C[C@H]1C[NH2+]CC(F)(F)[C@@H]1C[N@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009837 1054895027 /nfs/dbraw/zinc/89/50/27/1054895027.db2.gz XYBDWBSPJMDMNJ-SLTXQBBLSA-N 2 1 316.480 4.014 20 0 DIADMP C[N@@H+](Cc1ccc2c(c1)C[NH2+]C2)C1CCC(C(C)(C)C)CC1 ZINC001236008371 1054895126 /nfs/dbraw/zinc/89/51/26/1054895126.db2.gz JTFURCOYMPPUEK-UHFFFAOYSA-N 2 1 300.490 4.327 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000181164550 1054905387 /nfs/dbraw/zinc/90/53/87/1054905387.db2.gz SNCNOLURGMAZDJ-SASKPELWSA-N 2 1 306.881 4.109 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000181164550 1054905399 /nfs/dbraw/zinc/90/53/99/1054905399.db2.gz SNCNOLURGMAZDJ-SASKPELWSA-N 2 1 306.881 4.109 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051342 1054916411 /nfs/dbraw/zinc/91/64/11/1054916411.db2.gz WAXMOXSRLCARTO-KBXCAEBGSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051342 1054916424 /nfs/dbraw/zinc/91/64/24/1054916424.db2.gz WAXMOXSRLCARTO-KBXCAEBGSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051348 1054917158 /nfs/dbraw/zinc/91/71/58/1054917158.db2.gz WAXMOXSRLCARTO-RDTXWAMCSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051348 1054917169 /nfs/dbraw/zinc/91/71/69/1054917169.db2.gz WAXMOXSRLCARTO-RDTXWAMCSA-N 2 1 314.860 4.176 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000181809469 1054938767 /nfs/dbraw/zinc/93/87/67/1054938767.db2.gz BNVMQHKKXWGSNM-FQEVSTJZSA-N 2 1 311.473 4.493 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1CC[C@@H]1CCCC[NH2+]1 ZINC001236108070 1054951845 /nfs/dbraw/zinc/95/18/45/1054951845.db2.gz IGLMHMRJCSCBAD-DOTOQJQBSA-N 2 1 304.503 4.078 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(C[NH3+])cc1 ZINC001236107709 1054952453 /nfs/dbraw/zinc/95/24/53/1054952453.db2.gz ARPPWHIRXZYQDC-SFHVURJKSA-N 2 1 312.482 4.204 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1CC[C@@H]1CCCC[NH2+]1 ZINC001236108072 1054952574 /nfs/dbraw/zinc/95/25/74/1054952574.db2.gz IGLMHMRJCSCBAD-RDJZCZTQSA-N 2 1 304.503 4.078 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccccc1Oc1cccc(Cl)c1 ZINC001236141564 1054967953 /nfs/dbraw/zinc/96/79/53/1054967953.db2.gz JLBGXKCWVDPMFR-UHFFFAOYSA-N 2 1 318.848 4.303 20 0 DIADMP CCC[N@@H+](Cc1ccc(-c2cccs2)s1)C1CC[NH2+]CC1 ZINC001236182686 1054982021 /nfs/dbraw/zinc/98/20/21/1054982021.db2.gz SWVBLKYPPKRCPP-UHFFFAOYSA-N 2 1 320.527 4.441 20 0 DIADMP CCC[N@@H+](Cc1cccc(-c2ccsc2)c1)C1CC[NH2+]CC1 ZINC001236182343 1054982079 /nfs/dbraw/zinc/98/20/79/1054982079.db2.gz LTHARVQFZKHNBE-UHFFFAOYSA-N 2 1 314.498 4.379 20 0 DIADMP CCC[N@@H+](C[C@H](C)c1cccc2ccccc21)C1CC[NH2+]CC1 ZINC001236181203 1054982718 /nfs/dbraw/zinc/98/27/18/1054982718.db2.gz XEDJVYBMOOFTIY-KRWDZBQOSA-N 2 1 310.485 4.407 20 0 DIADMP CCC[N@@H+](Cc1ccc(Cl)c(C(C)C)c1)C1CC[NH2+]CC1 ZINC001236184984 1054984752 /nfs/dbraw/zinc/98/47/52/1054984752.db2.gz QCSDVLQVARPYEO-UHFFFAOYSA-N 2 1 308.897 4.427 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@@H]2c2c[nH]c3ccccc23)CC1 ZINC001236190523 1054988426 /nfs/dbraw/zinc/98/84/26/1054988426.db2.gz GRCZEYRSZRLRFR-LJQANCHMSA-N 2 1 311.473 4.037 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC1 ZINC001236212650 1055002374 /nfs/dbraw/zinc/00/23/74/1055002374.db2.gz KOBBPQBXAXBASI-UHFFFAOYSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236214679 1055002702 /nfs/dbraw/zinc/00/27/02/1055002702.db2.gz DNCSBCPFSRQDJS-ZWKOTPCHSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1ccc2oc3ccccc3c2c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236214679 1055002712 /nfs/dbraw/zinc/00/27/12/1055002712.db2.gz DNCSBCPFSRQDJS-ZWKOTPCHSA-N 2 1 308.425 4.288 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)CC1 ZINC001236215501 1055005412 /nfs/dbraw/zinc/00/54/12/1055005412.db2.gz OEYQZYSFYYPTHT-UHFFFAOYSA-N 2 1 324.896 4.090 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236216580 1055006368 /nfs/dbraw/zinc/00/63/68/1055006368.db2.gz KLOKHJGJWXTOSC-UXHICEINSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236216580 1055006380 /nfs/dbraw/zinc/00/63/80/1055006380.db2.gz KLOKHJGJWXTOSC-UXHICEINSA-N 2 1 312.432 4.194 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)[C@H]1CCCC[C@H]1[NH3+] ZINC001236218488 1055009258 /nfs/dbraw/zinc/00/92/58/1055009258.db2.gz SGNDGOCHEXMAOC-RTWAWAEBSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@H]1CCCC[C@H]1[NH3+] ZINC001236219107 1055009672 /nfs/dbraw/zinc/00/96/72/1055009672.db2.gz ULTHBRUYULGZTL-AEFFLSMTSA-N 2 1 313.489 4.167 20 0 DIADMP C[N@@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@H]1CCCC[C@H]1[NH3+] ZINC001236219107 1055009692 /nfs/dbraw/zinc/00/96/92/1055009692.db2.gz ULTHBRUYULGZTL-AEFFLSMTSA-N 2 1 313.489 4.167 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236218769 1055010174 /nfs/dbraw/zinc/01/01/74/1055010174.db2.gz UBMUKUBMDRLYAO-QZTJIDSGSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222610 1055013475 /nfs/dbraw/zinc/01/34/75/1055013475.db2.gz JJMBETSUUUTIIT-IYARVYRRSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C1(C)CC[NH2+]CC1 ZINC001236221641 1055013531 /nfs/dbraw/zinc/01/35/31/1055013531.db2.gz DESRLUYATCBQON-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+](C)[C@H]3CC[C@H]([NH3+])CC3)cc2)c1 ZINC001236223784 1055014235 /nfs/dbraw/zinc/01/42/35/1055014235.db2.gz PBLBKKDPYNURCE-MEMLXQNLSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccsc2)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223977 1055015064 /nfs/dbraw/zinc/01/50/64/1055015064.db2.gz RROHMQJHTJKPCS-IYARVYRRSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccs2)s1)C1(C)CC[NH2+]CC1 ZINC001236226125 1055017344 /nfs/dbraw/zinc/01/73/44/1055017344.db2.gz JKFWRUJQGZENHW-UHFFFAOYSA-N 2 1 306.500 4.051 20 0 DIADMP CCCCCCc1ccc(C[N@@H+](C)C2(C)CC[NH2+]CC2)s1 ZINC001236227301 1055017928 /nfs/dbraw/zinc/01/79/28/1055017928.db2.gz BPAPIQYNSRLPAB-UHFFFAOYSA-N 2 1 308.535 4.445 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(F)cc2)cc1)C1(C)CC[NH2+]CC1 ZINC001236225672 1055018275 /nfs/dbraw/zinc/01/82/75/1055018275.db2.gz BBXIMTZFULCMBN-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP Cc1cc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)oc1C ZINC001236228164 1055019675 /nfs/dbraw/zinc/01/96/75/1055019675.db2.gz QQYXMOLLIZSVIC-UHFFFAOYSA-N 2 1 312.457 4.169 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2CC[C@@H]2CCC[NH2+]C2)cc1C ZINC001236244672 1055030372 /nfs/dbraw/zinc/03/03/72/1055030372.db2.gz NBOPWIZCYUBWCH-ICSRJNTNSA-N 2 1 300.490 4.220 20 0 DIADMP CC[N@@H+](CCCCCC[NH3+])Cc1ccc(Cl)cc1Cl ZINC001236266266 1055045470 /nfs/dbraw/zinc/04/54/70/1055045470.db2.gz ORVQTPBMYWOVQI-UHFFFAOYSA-N 2 1 303.277 4.334 20 0 DIADMP CC[N@@H+](CCCCCC[NH3+])Cc1cccc(C(F)(F)F)c1 ZINC001236285154 1055046794 /nfs/dbraw/zinc/04/67/94/1055046794.db2.gz BTBLYQFKNGKCIH-UHFFFAOYSA-N 2 1 302.384 4.046 20 0 DIADMP CCc1ccccc1C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236300225 1055050974 /nfs/dbraw/zinc/05/09/74/1055050974.db2.gz OCUJSDFHDVBYEH-UHFFFAOYSA-N 2 1 308.469 4.003 20 0 DIADMP c1ccc(CCCC[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236369745 1055076477 /nfs/dbraw/zinc/07/64/77/1055076477.db2.gz CTDKNPRGABGIDN-FQEVSTJZSA-N 2 1 314.517 4.254 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000184502000 1055077551 /nfs/dbraw/zinc/07/75/51/1055077551.db2.gz FMUMPKIJQFLEHV-CYBMUJFWSA-N 2 1 320.506 4.077 20 0 DIADMP C[C@@H](C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1)c1ccccc1 ZINC001236373500 1055078610 /nfs/dbraw/zinc/07/86/10/1055078610.db2.gz XUROYHKHQKMTQV-ROUUACIJSA-N 2 1 300.490 4.034 20 0 DIADMP FC(F)c1ccccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236372148 1055079686 /nfs/dbraw/zinc/07/96/86/1055079686.db2.gz AYZCPSPJKAADAB-OAHLLOKOSA-N 2 1 322.443 4.368 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1C ZINC001236375453 1055081345 /nfs/dbraw/zinc/08/13/45/1055081345.db2.gz XYIHUXDDBGXDEB-LJQANCHMSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1c(F)cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1F ZINC001236375375 1055082177 /nfs/dbraw/zinc/08/21/77/1055082177.db2.gz JTQJOISHDNMZNI-HNNXBMFYSA-N 2 1 322.443 4.017 20 0 DIADMP Cc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)sc1C ZINC001236375210 1055082387 /nfs/dbraw/zinc/08/23/87/1055082387.db2.gz JGRIGBZCJBDCQE-INIZCTEOSA-N 2 1 306.519 4.109 20 0 DIADMP CSc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236377097 1055082637 /nfs/dbraw/zinc/08/26/37/1055082637.db2.gz XOYSECFLNCAGCH-CQSZACIVSA-N 2 1 324.559 4.214 20 0 DIADMP Cc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(F)cc1F ZINC001236376225 1055082771 /nfs/dbraw/zinc/08/27/71/1055082771.db2.gz PHYNKGNVSFNGTF-HNNXBMFYSA-N 2 1 322.443 4.017 20 0 DIADMP Clc1csc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374594 1055083055 /nfs/dbraw/zinc/08/30/55/1055083055.db2.gz FNBMOORFAVGGEO-ZDUSSCGKSA-N 2 1 312.910 4.146 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375972 1055083924 /nfs/dbraw/zinc/08/39/24/1055083924.db2.gz OLGZTXHZZBMHKH-KRWDZBQOSA-N 2 1 318.480 4.187 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374897 1055084016 /nfs/dbraw/zinc/08/40/16/1055084016.db2.gz GFZLYKIPJLNLIZ-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP CC[N@@H+](C[C@@H](C)Cc1ccc(C(C)(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236409182 1055100846 /nfs/dbraw/zinc/10/08/46/1055100846.db2.gz YGOFHOVYRFRADS-PKOBYXMFSA-N 2 1 316.533 4.094 20 0 DIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000193206557 1055101043 /nfs/dbraw/zinc/10/10/43/1055101043.db2.gz SNOSBJQQHLHXSP-QWHCGFSZSA-N 2 1 312.910 4.144 20 0 DIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206557 1055101049 /nfs/dbraw/zinc/10/10/49/1055101049.db2.gz SNOSBJQQHLHXSP-QWHCGFSZSA-N 2 1 312.910 4.144 20 0 DIADMP CC[N@@H+](C[C@H]1CC[NH2+]C1)C[C@@H]1CC=C(CCC=C(C)C)CC1 ZINC001236409095 1055100873 /nfs/dbraw/zinc/10/08/73/1055100873.db2.gz XDFIWRGPKWZOGS-UXHICEINSA-N 2 1 304.522 4.391 20 0 DIADMP CCCCCCc1csc(C[N@@H+](CC)C[C@H]2CC[NH2+]C2)c1 ZINC001236412637 1055103810 /nfs/dbraw/zinc/10/38/10/1055103810.db2.gz WXNOAPVWJBUFLH-KRWDZBQOSA-N 2 1 308.535 4.302 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420831 1055104723 /nfs/dbraw/zinc/10/47/23/1055104723.db2.gz OMXFALRXIHPQNU-AUUYWEPGSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420831 1055104726 /nfs/dbraw/zinc/10/47/26/1055104726.db2.gz OMXFALRXIHPQNU-AUUYWEPGSA-N 2 1 314.860 4.319 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@@H]([NH3+])[C@H]2C)c1 ZINC001236423011 1055107825 /nfs/dbraw/zinc/10/78/25/1055107825.db2.gz ZDRQBAOSIUMKIL-YLJYHZDGSA-N 2 1 308.469 4.282 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[C@@H]([NH3+])[C@H]2C)c1 ZINC001236423011 1055107833 /nfs/dbraw/zinc/10/78/33/1055107833.db2.gz ZDRQBAOSIUMKIL-YLJYHZDGSA-N 2 1 308.469 4.282 20 0 DIADMP CC(C)=CCC[C@@H](C)C[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001236448285 1055117690 /nfs/dbraw/zinc/11/76/90/1055117690.db2.gz SNWFHLOJHORKID-GOSISDBHSA-N 2 1 315.505 4.018 20 0 DIADMP C[C@H](CC[N@H+](Cc1ccccn1)C1CC[NH2+]CC1)CC(C)(C)C ZINC001236448662 1055119044 /nfs/dbraw/zinc/11/90/44/1055119044.db2.gz WSMZKLPKDYDZPJ-QGZVFWFLSA-N 2 1 317.521 4.098 20 0 DIADMP C[C@H](CC[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1)CC(C)(C)C ZINC001236448662 1055119050 /nfs/dbraw/zinc/11/90/50/1055119050.db2.gz WSMZKLPKDYDZPJ-QGZVFWFLSA-N 2 1 317.521 4.098 20 0 DIADMP Clc1ccccc1C[N@H+](CCC1CCCC1)C1CC[NH2+]CC1 ZINC001236450874 1055120835 /nfs/dbraw/zinc/12/08/35/1055120835.db2.gz KZYCMNYSWFLHBZ-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP Clc1ccccc1C[N@@H+](CCC1CCCC1)C1CC[NH2+]CC1 ZINC001236450874 1055120845 /nfs/dbraw/zinc/12/08/45/1055120845.db2.gz KZYCMNYSWFLHBZ-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP CC(C)(C)C[N@H+](Cc1ccc(F)cc1Cl)C1CC[NH2+]CC1 ZINC001236457735 1055123875 /nfs/dbraw/zinc/12/38/75/1055123875.db2.gz NLCVOXYSKJOXDZ-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(F)cc1Cl)C1CC[NH2+]CC1 ZINC001236457735 1055123881 /nfs/dbraw/zinc/12/38/81/1055123881.db2.gz NLCVOXYSKJOXDZ-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP CC(C)Oc1cccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236456269 1055124364 /nfs/dbraw/zinc/12/43/64/1055124364.db2.gz AVPBRYAOVYHJAS-UHFFFAOYSA-N 2 1 318.505 4.074 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1coc2ccc(F)cc12)C1CC[NH2+]CC1 ZINC001236456652 1055125457 /nfs/dbraw/zinc/12/54/57/1055125457.db2.gz BWQXNVNFZXZCOI-UHFFFAOYSA-N 2 1 318.436 4.172 20 0 DIADMP CC(C)(C)C[N@@H+](CCC(C)(C)c1ccccc1)C1CC[NH2+]CC1 ZINC001236458618 1055126459 /nfs/dbraw/zinc/12/64/59/1055126459.db2.gz UHQZZNGCBFYULA-UHFFFAOYSA-N 2 1 316.533 4.454 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236459741 1055126504 /nfs/dbraw/zinc/12/65/04/1055126504.db2.gz YCVOBJDJTNMSIY-UHFFFAOYSA-N 2 1 302.506 4.158 20 0 DIADMP [NH3+]CCc1ccc(C2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001236475730 1055134885 /nfs/dbraw/zinc/13/48/85/1055134885.db2.gz OOLWZSFLEYSDLE-YADHBBJMSA-N 2 1 318.464 4.008 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380908914 1055136767 /nfs/dbraw/zinc/13/67/67/1055136767.db2.gz JOJVBLZFPFALGC-MISYRCLQSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@H](C4CC4)C3)C2)cc1 ZINC000380958117 1055140800 /nfs/dbraw/zinc/14/08/00/1055140800.db2.gz VMQMTJIKALGLIG-GIVPXCGWSA-N 2 1 312.501 4.067 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001236517592 1055158518 /nfs/dbraw/zinc/15/85/18/1055158518.db2.gz LRBUKRILHGPNFU-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP CC(C)[N@H+](Cc1cccc2c3ccccc3oc21)[C@H]1CC[NH2+]C1 ZINC001236525675 1055161620 /nfs/dbraw/zinc/16/16/20/1055161620.db2.gz AUIRMHJNKLZSAW-INIZCTEOSA-N 2 1 308.425 4.158 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2c3ccccc3oc21)[C@H]1CC[NH2+]C1 ZINC001236525675 1055161624 /nfs/dbraw/zinc/16/16/24/1055161624.db2.gz AUIRMHJNKLZSAW-INIZCTEOSA-N 2 1 308.425 4.158 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2F)C[C@H]2CC=CCC2)CC1 ZINC001236534223 1055165181 /nfs/dbraw/zinc/16/51/81/1055165181.db2.gz SLBHJDYDWJIYAD-WDSOQIARSA-N 2 1 316.464 4.254 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2F)CC2CCCC2)CC1 ZINC001236534182 1055165442 /nfs/dbraw/zinc/16/54/42/1055165442.db2.gz QVVDSGQYARMKOP-IYARVYRRSA-N 2 1 304.453 4.088 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)cc1F ZINC001236542172 1055170134 /nfs/dbraw/zinc/17/01/34/1055170134.db2.gz YNKFESDNHAMYKF-QAQDUYKDSA-N 2 1 322.443 4.145 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc(Cl)cs2)CC2CCC2)CC1 ZINC001236542122 1055170298 /nfs/dbraw/zinc/17/02/98/1055170298.db2.gz XOVHXTWCTBAYMI-SHTZXODSSA-N 2 1 312.910 4.274 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccc(F)cc2)CC2CCC2)CC1 ZINC001236541943 1055171092 /nfs/dbraw/zinc/17/10/92/1055171092.db2.gz QJKYTNJVDBPQFU-MXVIHJGJSA-N 2 1 318.480 4.130 20 0 DIADMP CSc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236541761 1055171104 /nfs/dbraw/zinc/17/11/04/1055171104.db2.gz KIUDEBKKERGPQZ-SHTZXODSSA-N 2 1 324.559 4.342 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc3ccccc3[nH]2)CC2CCC2)CC1 ZINC001236541961 1055171113 /nfs/dbraw/zinc/17/11/13/1055171113.db2.gz KZDQEOOIZAJBCK-UAPYVXQJSA-N 2 1 311.473 4.040 20 0 DIADMP CCc1ccccc1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236542041 1055171126 /nfs/dbraw/zinc/17/11/26/1055171126.db2.gz MKKREWWSYOFXPY-MXVIHJGJSA-N 2 1 300.490 4.121 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236541995 1055171263 /nfs/dbraw/zinc/17/12/63/1055171263.db2.gz RUKYKZPFNVJXMU-MXVIHJGJSA-N 2 1 300.490 4.175 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc(F)ccc2Cl)CC2CCC2)CC1 ZINC001236540778 1055171287 /nfs/dbraw/zinc/17/12/87/1055171287.db2.gz BINQZCUSIQJJKT-QAQDUYKDSA-N 2 1 324.871 4.351 20 0 DIADMP CCCCCC[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236542300 1055173006 /nfs/dbraw/zinc/17/30/06/1055173006.db2.gz DIOOLDIWXFKBTH-WGSAOQKQSA-N 2 1 318.505 4.347 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236543437 1055173082 /nfs/dbraw/zinc/17/30/82/1055173082.db2.gz SFLGRCFEGVCZAT-OJTDBYKOSA-N 2 1 316.489 4.123 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(Cl)c2F)CC2CCC2)CC1 ZINC001236542458 1055173118 /nfs/dbraw/zinc/17/31/18/1055173118.db2.gz QWGICPWVRLIRMR-WKILWMFISA-N 2 1 324.871 4.351 20 0 DIADMP CC(C)C[N@@H+](Cc1nc2ccccc2s1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550744 1055178487 /nfs/dbraw/zinc/17/84/87/1055178487.db2.gz MMFQQZBNBNWSGE-SHTZXODSSA-N 2 1 317.502 4.024 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3ccsc3c2)CC2CC2)CC1 ZINC001236552122 1055179606 /nfs/dbraw/zinc/17/96/06/1055179606.db2.gz IGSOVWJNXLATAL-IYARVYRRSA-N 2 1 314.498 4.383 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3ccccc32)CC2CC2)CC1 ZINC001236551789 1055179679 /nfs/dbraw/zinc/17/96/79/1055179679.db2.gz NPXSBGQZRIKDDX-MXVIHJGJSA-N 2 1 308.469 4.322 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCC2CCCCC2)C2CCOCC2)CC1 ZINC001236552427 1055179963 /nfs/dbraw/zinc/17/99/63/1055179963.db2.gz GGPMONLNAXDBLQ-WGSAOQKQSA-N 2 1 322.537 4.098 20 0 DIADMP CCCc1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236552108 1055180002 /nfs/dbraw/zinc/18/00/02/1055180002.db2.gz IAZNSEGYMORTKR-MXVIHJGJSA-N 2 1 300.490 4.121 20 0 DIADMP COc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)c1 ZINC001236551885 1055180145 /nfs/dbraw/zinc/18/01/45/1055180145.db2.gz NLJYVNVPMANHSU-WKILWMFISA-N 2 1 324.896 4.077 20 0 DIADMP Cc1ccc2[nH]cc(C[N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)c2c1 ZINC001236552678 1055180267 /nfs/dbraw/zinc/18/02/67/1055180267.db2.gz ZCASTXYQDCVTDJ-IYARVYRRSA-N 2 1 313.489 4.204 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3cc(O)ccc3c2)CC2CC2)CC1 ZINC001236552449 1055180361 /nfs/dbraw/zinc/18/03/61/1055180361.db2.gz KNXMVAZPYWFTGV-MXVIHJGJSA-N 2 1 324.468 4.027 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552150 1055180461 /nfs/dbraw/zinc/18/04/61/1055180461.db2.gz RZWPMENTTHRLHG-WKILWMFISA-N 2 1 324.871 4.269 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3c2CCCC3)CC2CC2)CC1 ZINC001236553515 1055181732 /nfs/dbraw/zinc/18/17/32/1055181732.db2.gz QAZXBAJIPRPQHE-MXVIHJGJSA-N 2 1 312.501 4.047 20 0 DIADMP CC1=CC[C@H](CC[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)C1(C)C ZINC001236553514 1055182151 /nfs/dbraw/zinc/18/21/51/1055182151.db2.gz YWJWJUARWULGKM-GUDVDZBRSA-N 2 1 304.522 4.351 20 0 DIADMP Cc1ccccc1C[N@@H+](C[C@@H]1C[C@H]2C=C[C@@H]1C2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554837 1055183503 /nfs/dbraw/zinc/18/35/03/1055183503.db2.gz XTHBNFGWHYYQIT-ITEKTMBMSA-N 2 1 324.512 4.279 20 0 DIADMP CCCC[C@@H](CC)C[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236561214 1055184586 /nfs/dbraw/zinc/18/45/86/1055184586.db2.gz OZKMFIDXBWPUQD-MISYRCLQSA-N 2 1 317.521 4.370 20 0 DIADMP C[C@@H](C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236566095 1055185735 /nfs/dbraw/zinc/18/57/35/1055185735.db2.gz BPLPDJORGUDBFC-QRFRQXIXSA-N 2 1 300.490 4.305 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1F ZINC001236566981 1055187697 /nfs/dbraw/zinc/18/76/97/1055187697.db2.gz PXOHEFHIMTWFPD-SAABIXHNSA-N 2 1 304.453 4.149 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236567116 1055187771 /nfs/dbraw/zinc/18/77/71/1055187771.db2.gz TXAUHSCJIAXCLV-KESTWPANSA-N 2 1 300.490 4.318 20 0 DIADMP Cc1nc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)sc1C ZINC001236567005 1055187874 /nfs/dbraw/zinc/18/78/74/1055187874.db2.gz HDGSXHUNJUFTLO-JCNLHEQBSA-N 2 1 321.534 4.165 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccc(Cl)cc2)C2CCCC2)CC1 ZINC001236567421 1055188239 /nfs/dbraw/zinc/18/82/39/1055188239.db2.gz VKFWPJDMCRDSGV-UAPYVXQJSA-N 2 1 320.908 4.397 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1F ZINC001236566514 1055188664 /nfs/dbraw/zinc/18/86/64/1055188664.db2.gz JTVZKCUISGBBLU-SAABIXHNSA-N 2 1 304.453 4.149 20 0 DIADMP CC1(C)CC[C@@H]1[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381886823 1055190253 /nfs/dbraw/zinc/19/02/53/1055190253.db2.gz CAUCDGPDRONEDD-MOPGFXCFSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236570798 1055191485 /nfs/dbraw/zinc/19/14/85/1055191485.db2.gz BQGDHGRTFMNVOH-UAPYVXQJSA-N 2 1 304.453 4.149 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(O)cc2Cl)C2CCCC2)CC1 ZINC001236572013 1055193152 /nfs/dbraw/zinc/19/31/52/1055193152.db2.gz PWAIKFREGWLZGQ-KOMQPUFPSA-N 2 1 322.880 4.060 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCCc2ccccc2)C2CCC2)CC1 ZINC001236571867 1055193207 /nfs/dbraw/zinc/19/32/07/1055193207.db2.gz IQJDUXPMJMGQHJ-KESTWPANSA-N 2 1 300.490 4.134 20 0 DIADMP Cc1cc(O)cc(C)c1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571877 1055193637 /nfs/dbraw/zinc/19/36/37/1055193637.db2.gz LOGKWNFPJUUICR-SAABIXHNSA-N 2 1 316.489 4.024 20 0 DIADMP Cc1ccc2nc(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)ccc2c1 ZINC001236571816 1055193730 /nfs/dbraw/zinc/19/37/30/1055193730.db2.gz HRQDOSCWCZXCGY-IRJFHVNHSA-N 2 1 323.484 4.168 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381982997 1055194548 /nfs/dbraw/zinc/19/45/48/1055194548.db2.gz NJURHLPIJIILJH-YZGWKJHDSA-N 2 1 300.490 4.067 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2coc3ccc(F)cc23)C2CCC2)CC1 ZINC001236572992 1055195073 /nfs/dbraw/zinc/19/50/73/1055195073.db2.gz SINDXPAATAEZOO-JCNLHEQBSA-N 2 1 316.420 4.196 20 0 DIADMP CCOc1cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1C ZINC001236577693 1055196819 /nfs/dbraw/zinc/19/68/19/1055196819.db2.gz ZDKJGMAEIDJZRG-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236576063 1055197187 /nfs/dbraw/zinc/19/71/87/1055197187.db2.gz AGIYMACPCIEIEJ-JCNLHEQBSA-N 2 1 324.871 4.412 20 0 DIADMP Cc1ccc2c(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)cccc2n1 ZINC001236577664 1055197708 /nfs/dbraw/zinc/19/77/08/1055197708.db2.gz XNUDFHZWNAEZRK-UAPYVXQJSA-N 2 1 323.484 4.168 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236598153 1055200920 /nfs/dbraw/zinc/20/09/20/1055200920.db2.gz HNELFMOFDSOGDF-QGZVFWFLSA-N 2 1 308.469 4.112 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000382142346 1055202596 /nfs/dbraw/zinc/20/25/96/1055202596.db2.gz QVSISDUYHBQHOC-IBGZPJMESA-N 2 1 314.498 4.453 20 0 DIADMP Clc1ccc(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)cc1Cl ZINC001236632941 1055207912 /nfs/dbraw/zinc/20/79/12/1055207912.db2.gz DEJSGPNYZSVRKJ-UHFFFAOYSA-N 2 1 313.272 4.100 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001236637115 1055208019 /nfs/dbraw/zinc/20/80/19/1055208019.db2.gz MRDIASYPCQKGCB-UHFFFAOYSA-N 2 1 306.881 4.063 20 0 DIADMP c1cc2ccc(C[N@@H+](C3CCC3)C3CC[NH2+]CC3)cc2s1 ZINC001236636213 1055208285 /nfs/dbraw/zinc/20/82/85/1055208285.db2.gz BHGAFVYJXXGNNM-UHFFFAOYSA-N 2 1 300.471 4.008 20 0 DIADMP CCCCc1ccc(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)s1 ZINC001236634709 1055209191 /nfs/dbraw/zinc/20/91/91/1055209191.db2.gz VULUCFRPIHYWRB-UHFFFAOYSA-N 2 1 306.519 4.197 20 0 DIADMP c1c2ccccc2sc1C[N@H+]([C@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236650404 1055212389 /nfs/dbraw/zinc/21/23/89/1055212389.db2.gz CADCMQZQSLJXRL-KRWDZBQOSA-N 2 1 314.498 4.398 20 0 DIADMP c1c2ccccc2sc1C[N@@H+]([C@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236650404 1055212401 /nfs/dbraw/zinc/21/24/01/1055212401.db2.gz CADCMQZQSLJXRL-KRWDZBQOSA-N 2 1 314.498 4.398 20 0 DIADMP Cc1sccc1C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236693361 1055233591 /nfs/dbraw/zinc/23/35/91/1055233591.db2.gz COZCJWUXXYPMJB-WGSAOQKQSA-N 2 1 314.498 4.329 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@@H]2CC=CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236727102 1055243153 /nfs/dbraw/zinc/24/31/53/1055243153.db2.gz SNUSVEXMJSSDHH-HMXCVIKNSA-N 2 1 312.501 4.423 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@H]2CC=CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236727103 1055245183 /nfs/dbraw/zinc/24/51/83/1055245183.db2.gz SNUSVEXMJSSDHH-JBACZVJFSA-N 2 1 312.501 4.423 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccsc2)Cc2ccc(F)cc2)CC1 ZINC001236741695 1055248457 /nfs/dbraw/zinc/24/84/57/1055248457.db2.gz IKQQVAJESVDCEJ-IYARVYRRSA-N 2 1 318.461 4.159 20 0 DIADMP c1cc2c(cccc2C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)o1 ZINC001236742422 1055249284 /nfs/dbraw/zinc/24/92/84/1055249284.db2.gz DFEMBOCEGVIDMJ-GOSISDBHSA-N 2 1 312.457 4.273 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)ns1 ZINC001236767563 1055250395 /nfs/dbraw/zinc/25/03/95/1055250395.db2.gz JRKQNQUNOHRQCS-SAABIXHNSA-N 2 1 321.534 4.104 20 0 DIADMP Cc1cccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236767488 1055250665 /nfs/dbraw/zinc/25/06/65/1055250665.db2.gz MYNVASZFUSSCSK-QAQDUYKDSA-N 2 1 306.469 4.252 20 0 DIADMP Cc1cnc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236758472 1055251662 /nfs/dbraw/zinc/25/16/62/1055251662.db2.gz IGEJMJRXMGPNHR-QAQDUYKDSA-N 2 1 321.534 4.104 20 0 DIADMP Cc1cc(C)c(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)[nH]1 ZINC001236755894 1055251913 /nfs/dbraw/zinc/25/19/13/1055251913.db2.gz RZPBSLSMPQVQSV-WGSAOQKQSA-N 2 1 317.521 4.284 20 0 DIADMP Cc1cnsc1C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236759311 1055252233 /nfs/dbraw/zinc/25/22/33/1055252233.db2.gz SNCPOCZBDXTXMX-QAQDUYKDSA-N 2 1 321.534 4.104 20 0 DIADMP CC(C)c1nc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cs1 ZINC001236766082 1055252757 /nfs/dbraw/zinc/25/27/57/1055252757.db2.gz DGWAJCWFCKMSTF-KOMQPUFPSA-N 2 1 323.550 4.385 20 0 DIADMP CCc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236766857 1055253068 /nfs/dbraw/zinc/25/30/68/1055253068.db2.gz DKIHNKRPECRJFQ-WGSAOQKQSA-N 2 1 302.506 4.367 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(OC)cc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781153 1055253896 /nfs/dbraw/zinc/25/38/96/1055253896.db2.gz AUMMNBNPFZGUQY-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP Cc1cnc(Cl)c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236768844 1055254005 /nfs/dbraw/zinc/25/40/05/1055254005.db2.gz XQNXOSLWNULOOQ-WKILWMFISA-N 2 1 323.912 4.161 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(C)c(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781692 1055254981 /nfs/dbraw/zinc/25/49/81/1055254981.db2.gz HNQYUBUTXZZIMZ-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768837 1055255187 /nfs/dbraw/zinc/25/51/87/1055255187.db2.gz RAKDZMCCMLRPIM-QAQDUYKDSA-N 2 1 308.897 4.458 20 0 DIADMP CC(C)(C)C[N@@H+](CCCc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768788 1055255405 /nfs/dbraw/zinc/25/54/05/1055255405.db2.gz PNVHVTYLJBRXFZ-WGSAOQKQSA-N 2 1 320.496 4.376 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(O)cc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768745 1055255440 /nfs/dbraw/zinc/25/54/40/1055255440.db2.gz VQSWHDKRYVWNKW-WKILWMFISA-N 2 1 324.896 4.164 20 0 DIADMP CCC(CC)[N@@H+](Cc1cnc(Cl)c(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781176 1055256439 /nfs/dbraw/zinc/25/64/39/1055256439.db2.gz BQBRXNRHEMKRJP-JCNLHEQBSA-N 2 1 323.912 4.304 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(OC)c(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783727 1055257429 /nfs/dbraw/zinc/25/74/29/1055257429.db2.gz YOCMEVGUXVYJSO-JCNLHEQBSA-N 2 1 322.468 4.095 20 0 DIADMP COc1c(C)cccc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781891 1055258551 /nfs/dbraw/zinc/25/85/51/1055258551.db2.gz AQLHWNYMWQJFAD-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)cnc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782595 1055259152 /nfs/dbraw/zinc/25/91/52/1055259152.db2.gz VFDVTBHRWQXPFV-JCNLHEQBSA-N 2 1 323.912 4.304 20 0 DIADMP CCC(CC)[N@@H+](CCc1c(F)cccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783318 1055259384 /nfs/dbraw/zinc/25/93/84/1055259384.db2.gz SKCLTDJZSNIDGT-KOMQPUFPSA-N 2 1 324.459 4.268 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(C)c1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236797313 1055262544 /nfs/dbraw/zinc/26/25/44/1055262544.db2.gz DUBPOPIVGOYCMM-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(OC)ccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236799877 1055267230 /nfs/dbraw/zinc/26/72/30/1055267230.db2.gz UNWQHMFLCVOVEF-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc2c1CCC2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236798319 1055268036 /nfs/dbraw/zinc/26/80/36/1055268036.db2.gz KFTMEMPQEKMVMA-KESTWPANSA-N 2 1 314.517 4.436 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383436557 1055276446 /nfs/dbraw/zinc/27/64/46/1055276446.db2.gz FKLQRLCYCSHUAD-KNQAVFIVSA-N 2 1 322.496 4.119 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(/C=C/c4ccccc4)cc3)C[C@@H]12 ZINC001236826274 1055279980 /nfs/dbraw/zinc/27/99/80/1055279980.db2.gz BFHYOMCWFPLQDH-YEKHMCODSA-N 2 1 318.464 4.026 20 0 DIADMP CCC[N@@H+](CC(c1ccccc1)c1ccccc1)C[C@H]1CC[NH2+]C1 ZINC001236828439 1055280056 /nfs/dbraw/zinc/28/00/56/1055280056.db2.gz IWZNIICTGDEXHV-IBGZPJMESA-N 2 1 322.496 4.140 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)s1 ZINC001236828984 1055280514 /nfs/dbraw/zinc/28/05/14/1055280514.db2.gz JTWNWSUQFPLHLA-BMGDILEWSA-N 2 1 306.519 4.040 20 0 DIADMP CCC[N@H+](Cc1ccc(Oc2ccccc2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236836880 1055284064 /nfs/dbraw/zinc/28/40/64/1055284064.db2.gz YXRYWWCHAQDJDI-IBGZPJMESA-N 2 1 324.468 4.300 20 0 DIADMP CCC[N@H+](Cc1ccccc1-c1cccs1)C[C@H]1CC[NH2+]C1 ZINC001236834013 1055284888 /nfs/dbraw/zinc/28/48/88/1055284888.db2.gz DZLJSLOGPLPZRY-INIZCTEOSA-N 2 1 314.498 4.237 20 0 DIADMP CCC[N@H+](Cc1cc(Cl)c(Cl)cc1C)C[C@@H]1CC[NH2+]C1 ZINC001236843449 1055288940 /nfs/dbraw/zinc/28/89/40/1055288940.db2.gz OIXZFWBSAQISDB-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP CC(C)[N@@H+](CC1CC2(C1)CC[NH2+]CC2)[C@@H](C)c1ccccc1 ZINC001236858649 1055297292 /nfs/dbraw/zinc/29/72/92/1055297292.db2.gz FDLIFNIUUPPYSO-KRWDZBQOSA-N 2 1 300.490 4.238 20 0 DIADMP CC[C@H]([NH3+])C[N@H+](C)Cc1c2ccccc2n(C)c1-c1ccccc1 ZINC001236868693 1055297918 /nfs/dbraw/zinc/29/79/18/1055297918.db2.gz GAXSAVSOGKNVSS-KRWDZBQOSA-N 2 1 321.468 4.014 20 0 DIADMP CC[C@H]([NH3+])C[N@@H+](C)Cc1c2ccccc2n(C)c1-c1ccccc1 ZINC001236868693 1055297926 /nfs/dbraw/zinc/29/79/26/1055297926.db2.gz GAXSAVSOGKNVSS-KRWDZBQOSA-N 2 1 321.468 4.014 20 0 DIADMP C[C@@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000764963388 1055306915 /nfs/dbraw/zinc/30/69/15/1055306915.db2.gz NXIIFSMXJFGZNY-JKSUJKDBSA-N 2 1 300.556 4.151 20 0 DIADMP C[C@@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000764966018 1055307778 /nfs/dbraw/zinc/30/77/78/1055307778.db2.gz XOZLYVHCDGNAEL-HOTGVXAUSA-N 2 1 300.556 4.008 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(-n3ccnc3)c(Cl)c2)C1 ZINC001236911148 1055310592 /nfs/dbraw/zinc/31/05/92/1055310592.db2.gz IQXILUHQVNHAJB-OKILXGFUSA-N 2 1 303.837 4.004 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236907258 1055310964 /nfs/dbraw/zinc/31/09/64/1055310964.db2.gz AUMAMTFHTQBAKM-MRXNPFEDSA-N 2 1 303.837 4.146 20 0 DIADMP Clc1cc(C[N@H+]2CCC23CCCC3)ccc1-n1ccnc1 ZINC001236906815 1055311428 /nfs/dbraw/zinc/31/14/28/1055311428.db2.gz NLCRKJQHAPPORR-UHFFFAOYSA-N 2 1 301.821 4.044 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(-n3ccnc3)c(Cl)c2)CC1 ZINC001236909872 1055312716 /nfs/dbraw/zinc/31/27/16/1055312716.db2.gz YWFKTFNYRKMKHC-CQSZACIVSA-N 2 1 303.837 4.148 20 0 DIADMP C[N@H+](Cc1ccc(-n2ccnc2)c(Cl)c1)CC1CCCC1 ZINC001236911402 1055313529 /nfs/dbraw/zinc/31/35/29/1055313529.db2.gz JFKDSZQEFAWULX-UHFFFAOYSA-N 2 1 303.837 4.148 20 0 DIADMP [NH3+]CCCCC[N@H+]1CCC[C@@H]1c1cc(C(F)(F)F)ccc1F ZINC001237057025 1055352869 /nfs/dbraw/zinc/35/28/69/1055352869.db2.gz FWGSYGMJVCFNRG-OAHLLOKOSA-N 2 1 318.358 4.110 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@](C)(C[NH3+])C2)cc1 ZINC001237057844 1055354547 /nfs/dbraw/zinc/35/45/47/1055354547.db2.gz NUNXBEGMUIKUKV-XLIONFOSSA-N 2 1 302.506 4.049 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001237055254 1055356818 /nfs/dbraw/zinc/35/68/18/1055356818.db2.gz BXHYTNDGYCOHMQ-FQEVSTJZSA-N 2 1 308.425 4.147 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+](Cc2sccc2Oc2ccccc2)C1 ZINC001237059740 1055359839 /nfs/dbraw/zinc/35/98/39/1055359839.db2.gz VAXSCMGJONEVNA-GOSISDBHSA-N 2 1 316.470 4.101 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2sccc2Oc2ccccc2)C1 ZINC001237059740 1055359858 /nfs/dbraw/zinc/35/98/58/1055359858.db2.gz VAXSCMGJONEVNA-GOSISDBHSA-N 2 1 316.470 4.101 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@](C)(C[NH3+])C3)c(C)c12 ZINC001237082377 1055362278 /nfs/dbraw/zinc/36/22/78/1055362278.db2.gz PJTYXPXVGPTLMA-MRXNPFEDSA-N 2 1 308.516 4.140 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(-c2ccsc2)cs1 ZINC001237081449 1055363617 /nfs/dbraw/zinc/36/36/17/1055363617.db2.gz HXLJFHCVEUOHEZ-SFESLNEESA-N 2 1 318.511 4.178 20 0 DIADMP Fc1ccc(C[N@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)c2ccccc12 ZINC001237154146 1055387311 /nfs/dbraw/zinc/38/73/11/1055387311.db2.gz KBDDDAZXVCSJDW-QGZVFWFLSA-N 2 1 312.432 4.085 20 0 DIADMP Fc1ccc(C[N@@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)c2ccccc12 ZINC001237154146 1055387328 /nfs/dbraw/zinc/38/73/28/1055387328.db2.gz KBDDDAZXVCSJDW-QGZVFWFLSA-N 2 1 312.432 4.085 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)C1CCCCC1 ZINC000386015958 1055403180 /nfs/dbraw/zinc/40/31/80/1055403180.db2.gz GSLRCAAMJXXRDJ-GJZGRUSLSA-N 2 1 320.443 4.352 20 0 DIADMP CC(C)(C)Oc1ccc([C@H]2CC[N@@H+](CCCCCC[NH3+])C2)cc1 ZINC001237262962 1055409912 /nfs/dbraw/zinc/40/99/12/1055409912.db2.gz AAPRFPMYFUZSNP-SFHVURJKSA-N 2 1 318.505 4.172 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cc3ccccc3o2)CC1 ZINC000386080401 1055413578 /nfs/dbraw/zinc/41/35/78/1055413578.db2.gz DDEKLMAZEPWDNV-HNNXBMFYSA-N 2 1 300.446 4.348 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)CC1 ZINC001237274974 1055413599 /nfs/dbraw/zinc/41/35/99/1055413599.db2.gz IIVRWHYAKHBRHX-QUCCMNQESA-N 2 1 324.512 4.116 20 0 DIADMP CC1=CC[C@@H](CC[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)C1(C)C ZINC001237300965 1055421041 /nfs/dbraw/zinc/42/10/41/1055421041.db2.gz RWGKIESPAYYHQB-IBGZPJMESA-N 2 1 324.512 4.463 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001237327785 1055428832 /nfs/dbraw/zinc/42/88/32/1055428832.db2.gz TUFRMBURDJQRTQ-UHFFFAOYSA-N 2 1 302.506 4.110 20 0 DIADMP c1ccc(CCCC[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)cc1 ZINC001237360242 1055439077 /nfs/dbraw/zinc/43/90/77/1055439077.db2.gz WAQKOFSBEAZYEO-UHFFFAOYSA-N 2 1 320.480 4.104 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC1 ZINC001237359458 1055439592 /nfs/dbraw/zinc/43/95/92/1055439592.db2.gz OPGZRXYLSQWIMB-MJGOQNOKSA-N 2 1 310.485 4.073 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC1 ZINC001237359455 1055439817 /nfs/dbraw/zinc/43/98/17/1055439817.db2.gz OPGZRXYLSQWIMB-IEBWSBKVSA-N 2 1 310.485 4.073 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237380816 1055444761 /nfs/dbraw/zinc/44/47/61/1055444761.db2.gz HOPGWVBPCUSUNT-JRGCBEDISA-N 2 1 314.517 4.063 20 0 DIADMP Cc1c(C[N@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cccc1-c1ccccc1 ZINC001237410944 1055451323 /nfs/dbraw/zinc/45/13/23/1055451323.db2.gz DYGIPLRZTZVKAN-IFMALSPDSA-N 2 1 320.480 4.236 20 0 DIADMP C[C@@H]1CCC[C@H]1C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001620913109 1055538001 /nfs/dbraw/zinc/53/80/01/1055538001.db2.gz UMGHPOFFBZRWBY-MJGOQNOKSA-N 2 1 302.506 4.170 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001620924807 1055545131 /nfs/dbraw/zinc/54/51/31/1055545131.db2.gz NGGKGPRUHFGFJR-RLLQIKCJSA-N 2 1 302.506 4.423 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+](C)CCc3ccccc3)cc21 ZINC001237881813 1055546230 /nfs/dbraw/zinc/54/62/30/1055546230.db2.gz VMCBSTMFIHOWOC-UHFFFAOYSA-N 2 1 320.480 4.362 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCc4ccccc4C3)cc21 ZINC001237881851 1055546799 /nfs/dbraw/zinc/54/67/99/1055546799.db2.gz WWAYAAQRIQLNTD-UHFFFAOYSA-N 2 1 318.464 4.246 20 0 DIADMP Cc1ncccc1C[N@@H+](C)Cc1ccc2c(c1)C(C(C)C)=[NH+]CC2 ZINC001237888775 1055550323 /nfs/dbraw/zinc/55/03/23/1055550323.db2.gz DSAVOBSMCMZBTD-UHFFFAOYSA-N 2 1 321.468 4.023 20 0 DIADMP Cc1ncccc1C[N@H+](C)Cc1ccc2c(c1)C(C(C)C)=[NH+]CC2 ZINC001237888775 1055550329 /nfs/dbraw/zinc/55/03/29/1055550329.db2.gz DSAVOBSMCMZBTD-UHFFFAOYSA-N 2 1 321.468 4.023 20 0 DIADMP CC[N@@H+](Cc1cc(Cl)c(Cl)cc1C)C1CCN(C)CC1 ZINC001238260858 1055631791 /nfs/dbraw/zinc/63/17/91/1055631791.db2.gz WCSKHNHHVOZCLC-UHFFFAOYSA-N 2 1 315.288 4.218 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+](C)C1CCN(C)CC1 ZINC001238054790 1055594702 /nfs/dbraw/zinc/59/47/02/1055594702.db2.gz ATPUDWQAYNLUFW-UHFFFAOYSA-N 2 1 324.468 4.313 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1CN(C)C1CC[NH+](C)CC1 ZINC001238054790 1055594711 /nfs/dbraw/zinc/59/47/11/1055594711.db2.gz ATPUDWQAYNLUFW-UHFFFAOYSA-N 2 1 324.468 4.313 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+](C)C1CC[NH+](C)CC1 ZINC001238054790 1055594721 /nfs/dbraw/zinc/59/47/21/1055594721.db2.gz ATPUDWQAYNLUFW-UHFFFAOYSA-N 2 1 324.468 4.313 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+](C)C1CC[NH+](C)CC1 ZINC001238054790 1055594729 /nfs/dbraw/zinc/59/47/29/1055594729.db2.gz ATPUDWQAYNLUFW-UHFFFAOYSA-N 2 1 324.468 4.313 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH2+]CCCC[N@H+](C)C2CC2)c(C)c1 ZINC001620960531 1055606795 /nfs/dbraw/zinc/60/67/95/1055606795.db2.gz OEIYULLIIIBQNR-FPLPWBNLSA-N 2 1 300.490 4.089 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)c(Cl)cc1C ZINC001238266860 1055634203 /nfs/dbraw/zinc/63/42/03/1055634203.db2.gz KKKDICWCQNJVIN-UHFFFAOYSA-N 2 1 303.277 4.075 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2cc(C)c(OC(C)C)c(C)c2)CC1 ZINC001238752402 1055741349 /nfs/dbraw/zinc/74/13/49/1055741349.db2.gz WVPHJMUSDFQSAQ-UHFFFAOYSA-N 2 1 318.505 4.007 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2cc(C)c(OC(C)C)c(C)c2)CC1 ZINC001238752402 1055741360 /nfs/dbraw/zinc/74/13/60/1055741360.db2.gz WVPHJMUSDFQSAQ-UHFFFAOYSA-N 2 1 318.505 4.007 20 0 DIADMP c1csc(CC[NH+]2CCC3(CC[N@H+](C4CCCC4)C3)CC2)c1 ZINC001278280213 1055750725 /nfs/dbraw/zinc/75/07/25/1055750725.db2.gz DLZJCSGHNZHLHQ-UHFFFAOYSA-N 2 1 318.530 4.021 20 0 DIADMP c1csc(CC[N@H+]2CCC[C@@]3(CC[NH+](C4CCCC4)C3)C2)c1 ZINC001278280337 1055751177 /nfs/dbraw/zinc/75/11/77/1055751177.db2.gz IVAANUKLIGDFAB-LJQANCHMSA-N 2 1 318.530 4.021 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)cs2)C1 ZINC000058061212 1055794993 /nfs/dbraw/zinc/79/49/93/1055794993.db2.gz UGZHTVKVZLXZCC-INIZCTEOSA-N 2 1 314.498 4.235 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1(C)C ZINC001620974592 1055817114 /nfs/dbraw/zinc/81/71/14/1055817114.db2.gz RGLJCZFIFWVWQA-NJAFHUGGSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccccc1C(F)(F)F ZINC000061029062 1055859068 /nfs/dbraw/zinc/85/90/68/1055859068.db2.gz OBFICUCUMRMSNU-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccccc1C(F)(F)F ZINC000061029062 1055859074 /nfs/dbraw/zinc/85/90/74/1055859074.db2.gz OBFICUCUMRMSNU-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+]2CC2CCCCC2)C[C@@H]1C ZINC001620770664 1055940413 /nfs/dbraw/zinc/94/04/13/1055940413.db2.gz ZDNONKCJPPWIND-LCLWPZTBSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+]2CC2CCCCC2)C[C@H]1C ZINC001620770663 1055941298 /nfs/dbraw/zinc/94/12/98/1055941298.db2.gz ZDNONKCJPPWIND-JYBIWHBTSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@@H]3[C@H](CC[NH+]3C)C2)c(C(C)C)c1 ZINC001620506730 1055961679 /nfs/dbraw/zinc/96/16/79/1055961679.db2.gz MPGOIKMXGXJCDL-TZIWHRDSSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)c(C(C)C)c1 ZINC001620506730 1055961687 /nfs/dbraw/zinc/96/16/87/1055961687.db2.gz MPGOIKMXGXJCDL-TZIWHRDSSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c(C(C)C)c1 ZINC001620506730 1055961698 /nfs/dbraw/zinc/96/16/98/1055961698.db2.gz MPGOIKMXGXJCDL-TZIWHRDSSA-N 2 1 314.517 4.459 20 0 DIADMP CCNc1ccccc1CNCCC[N@@H+](CC)C1CCCCC1 ZINC001620997185 1055965322 /nfs/dbraw/zinc/96/53/22/1055965322.db2.gz ZOFDHDRMYKNLKY-UHFFFAOYSA-N 2 1 317.521 4.253 20 0 DIADMP CCNc1ccccc1C[NH2+]CCC[N@H+](CC)C1CCCCC1 ZINC001620997185 1055965333 /nfs/dbraw/zinc/96/53/33/1055965333.db2.gz ZOFDHDRMYKNLKY-UHFFFAOYSA-N 2 1 317.521 4.253 20 0 DIADMP CCNc1ccccc1C[NH2+]CCC[N@@H+](CC)C1CCCCC1 ZINC001620997185 1055965342 /nfs/dbraw/zinc/96/53/42/1055965342.db2.gz ZOFDHDRMYKNLKY-UHFFFAOYSA-N 2 1 317.521 4.253 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H]1CCC[C@@H](SC)C1)C1CCCCC1 ZINC001620997131 1055966383 /nfs/dbraw/zinc/96/63/83/1055966383.db2.gz XTDDAXJZKVSDOA-SJLPKXTDSA-N 2 1 312.567 4.295 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@H](SC)C2)C1 ZINC001620791724 1055969295 /nfs/dbraw/zinc/96/92/95/1055969295.db2.gz WFKWGGPHXNQKBK-ZACQAIPSSA-N 2 1 312.567 4.151 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@H](SC)C2)C1 ZINC001620791724 1055969298 /nfs/dbraw/zinc/96/92/98/1055969298.db2.gz WFKWGGPHXNQKBK-ZACQAIPSSA-N 2 1 312.567 4.151 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)CC[N@@H+]1Cc1ccccc1 ZINC001621007643 1055975148 /nfs/dbraw/zinc/97/51/48/1055975148.db2.gz ICTXILJOLKYGHB-OBJCFNGXSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)CC[N@H+]1Cc1ccccc1 ZINC001621007643 1055975157 /nfs/dbraw/zinc/97/51/57/1055975157.db2.gz ICTXILJOLKYGHB-OBJCFNGXSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]CC(C)(C)c2ccccc2)C1 ZINC001620724633 1055986352 /nfs/dbraw/zinc/98/63/52/1055986352.db2.gz FZZAPVQTTSQUIP-GOSISDBHSA-N 2 1 302.506 4.066 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621021021 1055987415 /nfs/dbraw/zinc/98/74/15/1055987415.db2.gz YDHOTIGPQGDRTI-CTNGQTDRSA-N 2 1 314.517 4.138 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621021023 1055987526 /nfs/dbraw/zinc/98/75/26/1055987526.db2.gz YDHOTIGPQGDRTI-PZJWPPBQSA-N 2 1 314.517 4.138 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001620746666 1055990996 /nfs/dbraw/zinc/99/09/96/1055990996.db2.gz WDPDNEHBCPBXAB-IPJUCJBFSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001620746666 1055991009 /nfs/dbraw/zinc/99/10/09/1055991009.db2.gz WDPDNEHBCPBXAB-IPJUCJBFSA-N 2 1 306.538 4.445 20 0 DIADMP CCc1cccc(C[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC001621030282 1055992150 /nfs/dbraw/zinc/99/21/50/1055992150.db2.gz AITSXASXXYXHEG-PGRDOPGGSA-N 2 1 322.496 4.107 20 0 DIADMP c1cc2cnccc2c(C[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001621036827 1055997674 /nfs/dbraw/zinc/99/76/74/1055997674.db2.gz QBFQRYXQWWDRAM-HXUWFJFHSA-N 2 1 323.484 4.122 20 0 DIADMP c1cc2cnccc2c(C[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001621036827 1055997684 /nfs/dbraw/zinc/99/76/84/1055997684.db2.gz QBFQRYXQWWDRAM-HXUWFJFHSA-N 2 1 323.484 4.122 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(-c2ccccc2C[NH+](C)C)nc1 ZINC001239681458 1056022601 /nfs/dbraw/zinc/02/26/01/1056022601.db2.gz HHDMHGNYGJIDNO-NRFANRHFSA-N 2 1 323.484 4.357 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(C)ccc32)c1 ZINC000765775745 1056067038 /nfs/dbraw/zinc/06/70/38/1056067038.db2.gz NCJUSWISAMGIGB-OAQYLSRUSA-N 2 1 308.469 4.224 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000166387255 1056185735 /nfs/dbraw/zinc/18/57/35/1056185735.db2.gz FUXXEUVFRXXHAN-RTBURBONSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166387255 1056185746 /nfs/dbraw/zinc/18/57/46/1056185746.db2.gz FUXXEUVFRXXHAN-RTBURBONSA-N 2 1 322.452 4.195 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2sc(C(C)(C)C)nc2C)C1 ZINC001116288078 1056196854 /nfs/dbraw/zinc/19/68/54/1056196854.db2.gz BZSAMJHBICTFRA-ZFWWWQNUSA-N 2 1 323.550 4.132 20 0 DIADMP CC[C@@H](C)[N@@H+](C)CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614455 1056329951 /nfs/dbraw/zinc/32/99/51/1056329951.db2.gz SJOKGMKAWPRXGJ-LMRVLLHPSA-N 2 1 308.432 4.064 20 0 DIADMP CC[C@@H](C)[N@H+](C)CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614455 1056329938 /nfs/dbraw/zinc/32/99/38/1056329938.db2.gz SJOKGMKAWPRXGJ-LMRVLLHPSA-N 2 1 308.432 4.064 20 0 DIADMP C[N@H+]1CCc2cc(-c3cccc(C[NH+]4CCCCC4)c3)ccc2C1 ZINC001240173882 1056361925 /nfs/dbraw/zinc/36/19/25/1056361925.db2.gz HUTMQVUOQUICTM-UHFFFAOYSA-N 2 1 320.480 4.327 20 0 DIADMP Cc1[nH+]c(C2=CCC[N@H+](Cc3ccccc3)C2)cc2[nH]ccc21 ZINC001240386076 1056467082 /nfs/dbraw/zinc/46/70/82/1056467082.db2.gz YRTRUAXBJLUUCC-UHFFFAOYSA-N 2 1 303.409 4.161 20 0 DIADMP Cc1[nH+]c(C2=CCC[N@@H+](Cc3ccccc3)C2)cc2[nH]ccc21 ZINC001240386076 1056467090 /nfs/dbraw/zinc/46/70/90/1056467090.db2.gz YRTRUAXBJLUUCC-UHFFFAOYSA-N 2 1 303.409 4.161 20 0 DIADMP c1ccc(C[N@@H+]2CCC=C(c3ccc(C[NH+]4CCC4)cc3)C2)cc1 ZINC001240386473 1056469572 /nfs/dbraw/zinc/46/95/72/1056469572.db2.gz DNYSJXPHRGXBIO-UHFFFAOYSA-N 2 1 318.464 4.182 20 0 DIADMP C[NH+](C)Cc1cc(C2=CCC[N@@H+](Cc3ccccc3)C2)ccc1F ZINC001240388926 1056474072 /nfs/dbraw/zinc/47/40/72/1056474072.db2.gz PVMKFELMQGMEAY-UHFFFAOYSA-N 2 1 324.443 4.177 20 0 DIADMP CC(C)[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)C1CC1 ZINC001615346478 1056497500 /nfs/dbraw/zinc/49/75/00/1056497500.db2.gz HLNIGCDOPHAXMY-UHFFFAOYSA-N 2 1 314.517 4.204 20 0 DIADMP C[C@@H]1SCC[N@H+](CCC[NH+]2CCCCC2)[C@@H]1c1ccccc1 ZINC001615522875 1056526830 /nfs/dbraw/zinc/52/68/30/1056526830.db2.gz BORZGJHYRLYUKK-HKUYNNGSSA-N 2 1 318.530 4.041 20 0 DIADMP C[C@@H]1SCC[N@@H+](CCC[NH+]2CCCCC2)[C@@H]1c1ccccc1 ZINC001615522875 1056526838 /nfs/dbraw/zinc/52/68/38/1056526838.db2.gz BORZGJHYRLYUKK-HKUYNNGSSA-N 2 1 318.530 4.041 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001615540637 1056532667 /nfs/dbraw/zinc/53/26/67/1056532667.db2.gz ZLKJFJZWCAREST-MSOLQXFVSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001615540637 1056532670 /nfs/dbraw/zinc/53/26/70/1056532670.db2.gz ZLKJFJZWCAREST-MSOLQXFVSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001615540637 1056532683 /nfs/dbraw/zinc/53/26/83/1056532683.db2.gz ZLKJFJZWCAREST-MSOLQXFVSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001615540637 1056532692 /nfs/dbraw/zinc/53/26/92/1056532692.db2.gz ZLKJFJZWCAREST-MSOLQXFVSA-N 2 1 318.480 4.221 20 0 DIADMP C[C@H]1CC(CC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)C[C@H](C)C1 ZINC001615577640 1056541074 /nfs/dbraw/zinc/54/10/74/1056541074.db2.gz JMRAUKQJYIBVEL-QWFCFKBJSA-N 2 1 306.538 4.399 20 0 DIADMP COc1ccccc1[C@@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001620831098 1056651042 /nfs/dbraw/zinc/65/10/42/1056651042.db2.gz JGGLKKHSPXLHFM-FUHWJXTLSA-N 2 1 318.505 4.245 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)c2ccccc21 ZINC000672806859 1056778409 /nfs/dbraw/zinc/77/84/09/1056778409.db2.gz AYIGFGPXILJGBP-JYJNAYRXSA-N 2 1 312.432 4.256 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC001617197883 1056791889 /nfs/dbraw/zinc/79/18/89/1056791889.db2.gz FXGPYKUDKGFUHX-APWZRJJASA-N 2 1 302.506 4.461 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CCCC3CC3)C2)s1 ZINC001617784386 1056882878 /nfs/dbraw/zinc/88/28/78/1056882878.db2.gz TWSXJGRGXKGBKO-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CCCC3CC3)C2)s1 ZINC001617784386 1056882890 /nfs/dbraw/zinc/88/28/90/1056882890.db2.gz TWSXJGRGXKGBKO-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCCC3CC3)C2)s1 ZINC001617784386 1056882898 /nfs/dbraw/zinc/88/28/98/1056882898.db2.gz TWSXJGRGXKGBKO-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccccc1[C@H](C)[N@H+](CC[C@H]1CCC[NH+]1C)CC(C)C ZINC001617888632 1056898184 /nfs/dbraw/zinc/89/81/84/1056898184.db2.gz UTMLCPFRZNFBCA-RBUKOAKNSA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@H](C)[NH+](CC[C@H]1CCC[N@@H+]1C)CC(C)C ZINC001617888632 1056898189 /nfs/dbraw/zinc/89/81/89/1056898189.db2.gz UTMLCPFRZNFBCA-RBUKOAKNSA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@H](C)[NH+](CC[C@H]1CCC[N@H+]1C)CC(C)C ZINC001617888632 1056898195 /nfs/dbraw/zinc/89/81/95/1056898195.db2.gz UTMLCPFRZNFBCA-RBUKOAKNSA-N 2 1 302.506 4.498 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001618048272 1056918390 /nfs/dbraw/zinc/91/83/90/1056918390.db2.gz KROQCOCRWXVEPE-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001618048272 1056918399 /nfs/dbraw/zinc/91/83/99/1056918399.db2.gz KROQCOCRWXVEPE-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001618048272 1056918406 /nfs/dbraw/zinc/91/84/06/1056918406.db2.gz KROQCOCRWXVEPE-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001618048272 1056918415 /nfs/dbraw/zinc/91/84/15/1056918415.db2.gz KROQCOCRWXVEPE-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC(C)(C[NH2+][C@H]1CCSc2c(F)cccc21)C[NH+]1CCCC1 ZINC000357874985 1056970194 /nfs/dbraw/zinc/97/01/94/1056970194.db2.gz LTEQZYQFMJXFBV-INIZCTEOSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000480630534 1057009912 /nfs/dbraw/zinc/00/99/12/1057009912.db2.gz JWSLNBFWCNOOJP-KXBFYZLASA-N 2 1 304.453 4.057 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCSc3c(Cl)cccc32)C1 ZINC000360233013 1057020079 /nfs/dbraw/zinc/02/00/79/1057020079.db2.gz DQJBUDXPXIWTJX-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCSc3c(Cl)cccc32)C1 ZINC000360233014 1057020186 /nfs/dbraw/zinc/02/01/86/1057020186.db2.gz DQJBUDXPXIWTJX-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP c1ccc(C[N@@H+]2CC=C(c3ccc([C@H]4CCC[NH2+]4)cc3)CC2)cc1 ZINC001241504631 1057074505 /nfs/dbraw/zinc/07/45/05/1057074505.db2.gz XESSAMRMMJUACT-JOCHJYFZSA-N 2 1 318.464 4.400 20 0 DIADMP C[NH+](C)Cc1ccc(C2=CC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001241504356 1057075387 /nfs/dbraw/zinc/07/53/87/1057075387.db2.gz FQHSCCUIWSIVHU-UHFFFAOYSA-N 2 1 306.453 4.038 20 0 DIADMP Nc1cc[nH+]c2cc(C3=CC[N@@H+](Cc4ccccc4)CC3)ccc12 ZINC001241506704 1057076300 /nfs/dbraw/zinc/07/63/00/1057076300.db2.gz KARUWTMCBLOQMW-UHFFFAOYSA-N 2 1 315.420 4.106 20 0 DIADMP [NH3+]Cc1ccc(-c2cccc3c2C[N@@H+](Cc2ccccc2)C3)cc1 ZINC001241913900 1057209203 /nfs/dbraw/zinc/20/92/03/1057209203.db2.gz TWGAYLPOFLTBRJ-UHFFFAOYSA-N 2 1 314.432 4.328 20 0 DIADMP CCOC(=[NH2+])c1ccc(-c2cccc(C[NH+]3CCCC3)c2)cc1 ZINC001242122058 1057269750 /nfs/dbraw/zinc/26/97/50/1057269750.db2.gz IAINOARERRUVPR-UHFFFAOYSA-N 2 1 308.425 4.311 20 0 DIADMP C[C@H](c1ccncc1)[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000675641659 1057391213 /nfs/dbraw/zinc/39/12/13/1057391213.db2.gz RDJZYEAINAYOGW-QZTJIDSGSA-N 2 1 315.505 4.119 20 0 DIADMP Cc1nc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(C)s1 ZINC000676490320 1057479539 /nfs/dbraw/zinc/47/95/39/1057479539.db2.gz NINLMLZSHSVGBE-KBPBESRZSA-N 2 1 309.523 4.065 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366761 1057502428 /nfs/dbraw/zinc/50/24/28/1057502428.db2.gz XHIJNPBGYAODJH-RDJZCZTQSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366761 1057502434 /nfs/dbraw/zinc/50/24/34/1057502434.db2.gz XHIJNPBGYAODJH-RDJZCZTQSA-N 2 1 324.459 4.168 20 0 DIADMP C[NH+](C)Cc1cnc(C[N@@H+]2CCC[C@@H]2CCC2CCCC2)s1 ZINC000347912640 1057530423 /nfs/dbraw/zinc/53/04/23/1057530423.db2.gz MEMQDMXLDKRGLD-MRXNPFEDSA-N 2 1 321.534 4.140 20 0 DIADMP C[NH+](C)Cc1cnc(C[N@H+]2CCC[C@@H]2CCC2CCCC2)s1 ZINC000347912640 1057530426 /nfs/dbraw/zinc/53/04/26/1057530426.db2.gz MEMQDMXLDKRGLD-MRXNPFEDSA-N 2 1 321.534 4.140 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166462 1057533933 /nfs/dbraw/zinc/53/39/33/1057533933.db2.gz SDGHZGBKDONIHY-MBNYWOFBSA-N 2 1 314.445 4.135 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166462 1057533935 /nfs/dbraw/zinc/53/39/35/1057533935.db2.gz SDGHZGBKDONIHY-MBNYWOFBSA-N 2 1 314.445 4.135 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](CC)c2ccc(Cl)s2)CC1 ZINC000161650946 1057599069 /nfs/dbraw/zinc/59/90/69/1057599069.db2.gz VUUWCRAHOBIHEP-ZDUSSCGKSA-N 2 1 300.899 4.317 20 0 DIADMP CC[NH+](CC)Cc1ccccc1-c1ccc(C[N@@H+](C)C2CC2)cn1 ZINC001243336551 1057650654 /nfs/dbraw/zinc/65/06/54/1057650654.db2.gz WXCQOEXPDRPCMW-UHFFFAOYSA-N 2 1 323.484 4.185 20 0 DIADMP CCCCCCOc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000731041781 1057733463 /nfs/dbraw/zinc/73/34/63/1057733463.db2.gz VWPWOLFHVLITCM-LJQANCHMSA-N 2 1 318.505 4.077 20 0 DIADMP CCCC[C@@H](CC)C[N@@H+]1CCO[C@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391378 1058065077 /nfs/dbraw/zinc/06/50/77/1058065077.db2.gz QARQGPWLDPGMMZ-UXHICEINSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCO[C@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391378 1058065079 /nfs/dbraw/zinc/06/50/79/1058065079.db2.gz QARQGPWLDPGMMZ-UXHICEINSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCO[C@]2(CCC[N@H+](CC(C)C)C2)C1 ZINC001278391378 1058065082 /nfs/dbraw/zinc/06/50/82/1058065082.db2.gz QARQGPWLDPGMMZ-UXHICEINSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCO[C@]2(CCC[N@@H+](CC(C)C)C2)C1 ZINC001278391378 1058065083 /nfs/dbraw/zinc/06/50/83/1058065083.db2.gz QARQGPWLDPGMMZ-UXHICEINSA-N 2 1 324.553 4.026 20 0 DIADMP c1[nH+]c(C2C[NH2+]C2)c2ccc(-c3cccc(C4CCCC4)c3)cn12 ZINC001244988722 1058087320 /nfs/dbraw/zinc/08/73/20/1058087320.db2.gz MFLPGSPPFFUADU-UHFFFAOYSA-N 2 1 317.436 4.346 20 0 DIADMP C[N@H+]1CC[C@H](c2ccc(-c3ccc(C4CC[NH2+]CC4)cc3)cc2)C1 ZINC001245525412 1058199603 /nfs/dbraw/zinc/19/96/03/1058199603.db2.gz DOOJBHDJAGUXOA-QFIPXVFZSA-N 2 1 320.480 4.240 20 0 DIADMP Cc1cccc2c1CCC[C@@H]2[NH2+][C@H]1CC[C@@H](c2[nH+]ccn2C)C1 ZINC001550520308 1058341320 /nfs/dbraw/zinc/34/13/20/1058341320.db2.gz NJGZAPAZUUDBDO-GJYPPUQNSA-N 2 1 309.457 4.032 20 0 DIADMP Fc1ccccc1C1CC([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001552080692 1058426898 /nfs/dbraw/zinc/42/68/98/1058426898.db2.gz HWJYIHOQJRMMTB-RAVMWGBXSA-N 2 1 324.443 4.155 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001552219490 1058430580 /nfs/dbraw/zinc/43/05/80/1058430580.db2.gz QINIKEMZXAPTOE-ANULTFPQSA-N 2 1 306.453 4.016 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246063176 1058660419 /nfs/dbraw/zinc/66/04/19/1058660419.db2.gz AVEQQSJIVRYDMA-AZFSHXRASA-N 2 1 304.453 4.096 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)cc1 ZINC001246073491 1058662654 /nfs/dbraw/zinc/66/26/54/1058662654.db2.gz ZISXJXQZPKZISZ-AZUAARDMSA-N 2 1 312.432 4.025 20 0 DIADMP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246073450 1058663067 /nfs/dbraw/zinc/66/30/67/1058663067.db2.gz YFJBUQDCUNSJTB-UYAOXDASSA-N 2 1 312.432 4.025 20 0 DIADMP Cc1cccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)c1 ZINC001246071192 1058663731 /nfs/dbraw/zinc/66/37/31/1058663731.db2.gz ITBDBOSIZMLSMH-QUCCMNQESA-N 2 1 312.432 4.025 20 0 DIADMP Cc1ccccc1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246073447 1058664351 /nfs/dbraw/zinc/66/43/51/1058664351.db2.gz YFJBUQDCUNSJTB-AZUAARDMSA-N 2 1 312.432 4.025 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246076328 1058667573 /nfs/dbraw/zinc/66/75/73/1058667573.db2.gz NIKANTKHPDHPJV-RBOXIYTFSA-N 2 1 315.288 4.421 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)s1 ZINC001246085126 1058670752 /nfs/dbraw/zinc/67/07/52/1058670752.db2.gz NHZHEDDKTXQIBS-YJBOKZPZSA-N 2 1 318.461 4.087 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246083724 1058671110 /nfs/dbraw/zinc/67/11/10/1058671110.db2.gz IUPDYIMDDCDFJD-NVXWUHKLSA-N 2 1 318.461 4.087 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CC[C@H](C)[NH2+]C1 ZINC001246086866 1058671227 /nfs/dbraw/zinc/67/12/27/1058671227.db2.gz WIRQAFIXSOCDTD-SCRDCRAPSA-N 2 1 315.288 4.045 20 0 DIADMP CC[C@@H]1CC([NH2+]C2(c3ccc(Cl)cc3)CC2)C[C@@H](CC)[NH2+]1 ZINC001246078876 1058671793 /nfs/dbraw/zinc/67/17/93/1058671793.db2.gz XRSRVRNPETVOOE-HZPDHXFCSA-N 2 1 306.881 4.228 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CC[C@H](C)[NH2+]C1 ZINC001246086864 1058672111 /nfs/dbraw/zinc/67/21/11/1058672111.db2.gz WIRQAFIXSOCDTD-OBJOEFQTSA-N 2 1 315.288 4.045 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@H](C)c2cccc(Cl)c2F)CC[NH2+]1 ZINC001246104443 1058678286 /nfs/dbraw/zinc/67/82/86/1058678286.db2.gz JRNHYSYUSMAQLV-HZSPNIEDSA-N 2 1 312.860 4.441 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)ccc1Cl ZINC001246113487 1058683866 /nfs/dbraw/zinc/68/38/66/1058683866.db2.gz BJMNWQDLIHZRFP-RUZUBIRVSA-N 2 1 313.272 4.317 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246155209 1058701270 /nfs/dbraw/zinc/70/12/70/1058701270.db2.gz VSZPBEVLAXDWDO-LSDHHAIUSA-N 2 1 315.288 4.250 20 0 DIADMP CC(C)c1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246163124 1058707580 /nfs/dbraw/zinc/70/75/80/1058707580.db2.gz VUSKCOTUAZVGJD-SFTDATJTSA-N 2 1 308.469 4.393 20 0 DIADMP Clc1ccc(C2CCC([NH2+]C[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC001246170990 1058715383 /nfs/dbraw/zinc/71/53/83/1058715383.db2.gz VGYPELHPYSXIRW-VJFUWPCTSA-N 2 1 306.881 4.098 20 0 DIADMP CCC1CCC([NH2+][C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CC1 ZINC001246171211 1058716932 /nfs/dbraw/zinc/71/69/32/1058716932.db2.gz KXOAEXHTLJFKPM-CCWWBTDTSA-N 2 1 318.480 4.486 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246173571 1058717187 /nfs/dbraw/zinc/71/71/87/1058717187.db2.gz BDMNVDUKPBWMHB-QUCCMNQESA-N 2 1 324.443 4.206 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]CC34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246174493 1058720238 /nfs/dbraw/zinc/72/02/38/1058720238.db2.gz XDOOJQIGMTYEDF-DAYNZGEJSA-N 2 1 324.512 4.286 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CCC2CCCCC2)CC[NH2+]1 ZINC001246177287 1058722612 /nfs/dbraw/zinc/72/26/12/1058722612.db2.gz IKPCGCRWMAFYAC-UYAOXDASSA-N 2 1 318.480 4.487 20 0 DIADMP CC[C@H]1CC([NH2+]Cc2ccc(Cl)cc2Cl)C[C@H](CC)[NH2+]1 ZINC001246179205 1058723451 /nfs/dbraw/zinc/72/34/51/1058723451.db2.gz DHAYKIQSIGMMGF-KBPBESRZSA-N 2 1 315.288 4.392 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]Cc3ccccc3C3CC3)CC[NH2+]2)cc1 ZINC001246186984 1058729693 /nfs/dbraw/zinc/72/96/93/1058729693.db2.gz DXFDWVBBDQRLAM-FPOVZHCZSA-N 2 1 306.453 4.147 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246190277 1058730662 /nfs/dbraw/zinc/73/06/62/1058730662.db2.gz GINANHNIWUXFFF-MSOLQXFVSA-N 2 1 310.441 4.099 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]Cc3ccccc3C3CC3)CC[NH2+]2)cc1 ZINC001246186988 1058731744 /nfs/dbraw/zinc/73/17/44/1058731744.db2.gz DXFDWVBBDQRLAM-PZJWPPBQSA-N 2 1 306.453 4.147 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@]1(C)CCC[NH2+]C1 ZINC001246191669 1058733242 /nfs/dbraw/zinc/73/32/42/1058733242.db2.gz WXJFMIIJJPRJFE-LRDDRELGSA-N 2 1 315.288 4.046 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@]1(C)CCC[NH2+]C1 ZINC001246190760 1058733352 /nfs/dbraw/zinc/73/33/52/1058733352.db2.gz SEWUUSPNKPRLEO-GCJKJVERSA-N 2 1 322.496 4.329 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2c3ccccc3-c3ccccc32)CC[NH2+]1 ZINC001246201446 1058742403 /nfs/dbraw/zinc/74/24/03/1058742403.db2.gz UZUYRNJDBFESKV-QRWLVFNGSA-N 2 1 306.453 4.123 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccc(F)c(Cl)c1 ZINC001246212870 1058744515 /nfs/dbraw/zinc/74/45/15/1058744515.db2.gz OLNFOYFYMXCYKS-PVXIVEMSSA-N 2 1 312.860 4.296 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]C[C@@]2(C)CC[NH2+]CC2(F)F)CC1 ZINC001246220998 1058746591 /nfs/dbraw/zinc/74/65/91/1058746591.db2.gz MMMWWLYNWXTCGB-VMBOVVBDSA-N 2 1 316.480 4.206 20 0 DIADMP C[C@]1(C[NH2+][C@@H]2CCCC3(CCCCC3)C2)CC[NH2+]CC1(F)F ZINC001246224098 1058751389 /nfs/dbraw/zinc/75/13/89/1058751389.db2.gz ZDFOTVAFSPADQP-HZPDHXFCSA-N 2 1 314.464 4.104 20 0 DIADMP CCCc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246229822 1058753065 /nfs/dbraw/zinc/75/30/65/1058753065.db2.gz LSOYGQMYXISTMA-SFTDATJTSA-N 2 1 308.469 4.222 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCC3CCCCCC3)CC[NH2+]2)cc1 ZINC001246230465 1058754096 /nfs/dbraw/zinc/75/40/96/1058754096.db2.gz BLBQCVZBGVOGGL-PMACEKPBSA-N 2 1 300.490 4.430 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246235524 1058756555 /nfs/dbraw/zinc/75/65/55/1058756555.db2.gz HTIKGSQYXWFMOF-DLBZAZTESA-N 2 1 306.881 4.230 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001246266783 1058781915 /nfs/dbraw/zinc/78/19/15/1058781915.db2.gz YCGNSVVEBPPSAE-CXAGYDPISA-N 2 1 308.416 4.070 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cc(F)ccc1F ZINC001246271666 1058788890 /nfs/dbraw/zinc/78/88/90/1058788890.db2.gz WTMCIEVZLOYKRH-RRQGHBQHSA-N 2 1 310.432 4.172 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2F)C(C)C)C[C@H](CC)[NH2+]1 ZINC001246275455 1058792693 /nfs/dbraw/zinc/79/26/93/1058792693.db2.gz UPJQWSBPVLUMEI-RCJHGTSTSA-N 2 1 306.469 4.422 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246282261 1058799857 /nfs/dbraw/zinc/79/98/57/1058799857.db2.gz UUVBSJCUIIGJIJ-MNEFBYGVSA-N 2 1 304.453 4.033 20 0 DIADMP CCOc1cccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246294718 1058805771 /nfs/dbraw/zinc/80/57/71/1058805771.db2.gz HOMRITRQNVHFAO-PBEJRMEISA-N 2 1 324.468 4.229 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246309255 1058814851 /nfs/dbraw/zinc/81/48/51/1058814851.db2.gz JEBUKQNABJUZPB-HUUCEWRRSA-N 2 1 308.897 4.476 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)cc1 ZINC001246313100 1058820459 /nfs/dbraw/zinc/82/04/59/1058820459.db2.gz IUOMOKRXZVODLP-QHAWAJNXSA-N 2 1 324.443 4.360 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](CC)c2ccc(F)cc2F)CC[NH2+]1 ZINC001246316508 1058825765 /nfs/dbraw/zinc/82/57/65/1058825765.db2.gz GXNIKYLUZNHJJS-RVKKMQEKSA-N 2 1 310.432 4.316 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1ccc(F)cc1F ZINC001246317324 1058828684 /nfs/dbraw/zinc/82/86/84/1058828684.db2.gz MPSHBDDHVOYUKX-LDDOYCOJSA-N 2 1 310.432 4.315 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246318076 1058829578 /nfs/dbraw/zinc/82/95/78/1058829578.db2.gz PTRMZUBPWMEJFK-AQNXPRMDSA-N 2 1 312.432 4.360 20 0 DIADMP c1cc2c(cccc2C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC001246318902 1058829699 /nfs/dbraw/zinc/82/96/99/1058829699.db2.gz TTZBFSCRCVVDBB-MJGOQNOKSA-N 2 1 322.477 4.484 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H](CC)[NH2+][C@@H](CC)C1)c1ccc(F)cc1F ZINC001246317325 1058831274 /nfs/dbraw/zinc/83/12/74/1058831274.db2.gz MPSHBDDHVOYUKX-SUNYJGFJSA-N 2 1 310.432 4.315 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]CCCC3CCCCC3)CC[NH2+]2)cc1 ZINC001246329094 1058839595 /nfs/dbraw/zinc/83/95/95/1058839595.db2.gz OMEMHPCHFBHFFB-UXHICEINSA-N 2 1 300.490 4.430 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]CCCC3CCCCC3)CC[NH2+]2)cc1 ZINC001246329095 1058840053 /nfs/dbraw/zinc/84/00/53/1058840053.db2.gz OMEMHPCHFBHFFB-VQTJNVASSA-N 2 1 300.490 4.430 20 0 DIADMP CCCC1CCC([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246331776 1058841539 /nfs/dbraw/zinc/84/15/39/1058841539.db2.gz CGNVCSBBGWSWLK-HFPIOELMSA-N 2 1 300.490 4.428 20 0 DIADMP CCCCCC[C@H](CCC)[NH2+][C@H]1CC[NH2+]C[C@H]1C(F)(F)F ZINC001246344434 1058858997 /nfs/dbraw/zinc/85/89/97/1058858997.db2.gz ZCFSDDXEBBUATB-ZNMIVQPWSA-N 2 1 308.432 4.256 20 0 DIADMP COc1cccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246363684 1058869343 /nfs/dbraw/zinc/86/93/43/1058869343.db2.gz SNOJEIMCFPOXFR-ICSRJNTNSA-N 2 1 324.468 4.013 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@H]2CC[C@@H](C)CC2)CC[NH2+]1 ZINC001246363643 1058869858 /nfs/dbraw/zinc/86/98/58/1058869858.db2.gz QYOLWRVKKXHAFU-WITVHBPWSA-N 2 1 304.453 4.096 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+]C2(c3ccccc3F)CCC2)CC[NH2+]1 ZINC001246362610 1058871335 /nfs/dbraw/zinc/87/13/35/1058871335.db2.gz BIARBGDQODBXQV-JKSUJKDBSA-N 2 1 304.453 4.105 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]C2(c3ccccc3F)CCC2)C[C@H](CC)[NH2+]1 ZINC001246368991 1058874785 /nfs/dbraw/zinc/87/47/85/1058874785.db2.gz URPBEKQNQFBSRA-ZSHCYNCHSA-N 2 1 304.453 4.104 20 0 DIADMP CCCCC[C@@H](C)[NH2+]C1(c2ccccc2Cl)CC[NH2+]CC1 ZINC001246376625 1058882686 /nfs/dbraw/zinc/88/26/86/1058882686.db2.gz WMBGXJSQFJGYNP-OAHLLOKOSA-N 2 1 308.897 4.477 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C[C@@H]1C ZINC001246378888 1058882875 /nfs/dbraw/zinc/88/28/75/1058882875.db2.gz VEWZDUMVMZRVMI-OWCLPIDISA-N 2 1 320.908 4.333 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)CC1CCC1 ZINC001246387506 1058891744 /nfs/dbraw/zinc/89/17/44/1058891744.db2.gz GDLPLHJXQSDEIG-RTBURBONSA-N 2 1 300.490 4.286 20 0 DIADMP CCCC1([NH2+][C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CCC1 ZINC001246386804 1058894742 /nfs/dbraw/zinc/89/47/42/1058894742.db2.gz PJXPDDCPUKSBJQ-SJLPKXTDSA-N 2 1 304.453 4.240 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](c2ccncc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246391762 1058895552 /nfs/dbraw/zinc/89/55/52/1058895552.db2.gz GUXGMHUEFVHTRM-BORJPKMPSA-N 2 1 321.896 4.085 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccncc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246391758 1058897892 /nfs/dbraw/zinc/89/78/92/1058897892.db2.gz GUXGMHUEFVHTRM-BASYENTBSA-N 2 1 321.896 4.085 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](c2ccncc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246391779 1058898914 /nfs/dbraw/zinc/89/89/14/1058898914.db2.gz GUXGMHUEFVHTRM-LDDOYCOJSA-N 2 1 321.896 4.085 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)CC[NH2+]1 ZINC001246396568 1058900167 /nfs/dbraw/zinc/90/01/67/1058900167.db2.gz CDRCDYXLVVGVHH-FGTMMUONSA-N 2 1 321.896 4.087 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)c1 ZINC001246399172 1058902158 /nfs/dbraw/zinc/90/21/58/1058902158.db2.gz GGOXSOXUGMTYQS-QHAWAJNXSA-N 2 1 324.443 4.360 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](c2cncc(Cl)c2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246401009 1058903580 /nfs/dbraw/zinc/90/35/80/1058903580.db2.gz QUBFULLMNXGRMA-MHORFTMASA-N 2 1 321.896 4.085 20 0 DIADMP CCC(CC)[N@H+](C1C[C@@H](CC)[NH2+][C@H](CC)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246404312 1058903759 /nfs/dbraw/zinc/90/37/59/1058903759.db2.gz NEVHLTFZUAQLDJ-YWTNHNAXSA-N 3 1 323.569 4.056 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246401013 1058904447 /nfs/dbraw/zinc/90/44/47/1058904447.db2.gz QUBFULLMNXGRMA-XMTFNYHQSA-N 2 1 321.896 4.085 20 0 DIADMP CCC(CC)[N@H+](C1C[C@H](CC)[NH2+][C@@H](CC)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246404310 1058905336 /nfs/dbraw/zinc/90/53/36/1058905336.db2.gz NEVHLTFZUAQLDJ-DWRORGKVSA-N 3 1 323.569 4.056 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)CC[NH2+]1 ZINC001246403482 1058905823 /nfs/dbraw/zinc/90/58/23/1058905823.db2.gz MUHBWKIHDRHXQW-LFGUQSLTSA-N 3 1 323.569 4.058 20 0 DIADMP Fc1ccccc1[C@@H](CC1CCC1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246408670 1058910480 /nfs/dbraw/zinc/91/04/80/1058910480.db2.gz VSBUOPSCWFAENM-QFBILLFUSA-N 2 1 316.464 4.321 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)C[C@H](C)[NH2+]1 ZINC001246410239 1058910662 /nfs/dbraw/zinc/91/06/62/1058910662.db2.gz ZJQGKXUMWOXSCZ-QHHYFVSCSA-N 2 1 304.453 4.176 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C(C)(C)CC2CCC2)CC[NH2+]1 ZINC001246411801 1058914205 /nfs/dbraw/zinc/91/42/05/1058914205.db2.gz VZDSKHQBFSDIHO-MJGOQNOKSA-N 2 1 318.480 4.486 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246433221 1058926635 /nfs/dbraw/zinc/92/66/35/1058926635.db2.gz QZFLZSSPEXQICG-IEBWSBKVSA-N 2 1 316.464 4.097 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246437851 1058930659 /nfs/dbraw/zinc/93/06/59/1058930659.db2.gz WFDVKGNMUQVNKZ-SUMDDJOVSA-N 2 1 318.480 4.343 20 0 DIADMP C[NH2+]CC[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001246445757 1058936835 /nfs/dbraw/zinc/93/68/35/1058936835.db2.gz ZFSPMGQUGQAHBX-RDTXWAMCSA-N 2 1 302.849 4.017 20 0 DIADMP CC[C@@]1(C[NH2+][C@@H](C)Cc2ccc(Cl)cc2Cl)CCC[NH2+]1 ZINC001246454200 1058941068 /nfs/dbraw/zinc/94/10/68/1058941068.db2.gz APIBYTZLDHTEII-LRDDRELGSA-N 2 1 315.288 4.046 20 0 DIADMP CCC[C@@]1(C[NH2+][C@H](C)Cc2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246457329 1058947062 /nfs/dbraw/zinc/94/70/62/1058947062.db2.gz SIDVSYGUZFVIED-WBMJQRKESA-N 2 1 315.288 4.046 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](c2ccc(Cl)cn2)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246462483 1058949286 /nfs/dbraw/zinc/94/92/86/1058949286.db2.gz ZKWDLZLRYIXWDO-IIDMSEBBSA-N 2 1 321.896 4.085 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](CC)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246463420 1058949736 /nfs/dbraw/zinc/94/97/36/1058949736.db2.gz RTLZXYYCMZXLTN-FGTMMUONSA-N 2 1 310.432 4.316 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]CC[C@@H]1CC[NH2+]CC1(F)F ZINC001246483105 1058964152 /nfs/dbraw/zinc/96/41/52/1058964152.db2.gz RHGUOBJVADRYPL-ZWKOTPCHSA-N 2 1 324.459 4.012 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1C[NH2+]C[C@H](C)C1 ZINC001246489948 1058965744 /nfs/dbraw/zinc/96/57/44/1058965744.db2.gz BZWWDFUTPPNAAB-LQWHRVPQSA-N 2 1 322.496 4.185 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H]1CCc2c(Cl)cccc2C1 ZINC001246494124 1058971282 /nfs/dbraw/zinc/97/12/82/1058971282.db2.gz DRHHHGDIVABPHU-HNNXBMFYSA-N 2 1 308.897 4.085 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H]2CCOc3ccc(Cl)cc32)CC[NH2+]1 ZINC001246508254 1058977082 /nfs/dbraw/zinc/97/70/82/1058977082.db2.gz BQOPBQOOJGBVFZ-HLLBOEOZSA-N 2 1 322.880 4.064 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246521256 1058980242 /nfs/dbraw/zinc/98/02/42/1058980242.db2.gz NPQDDMQDXYCIKN-FCHUYYIVSA-N 2 1 322.496 4.260 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246518201 1058980394 /nfs/dbraw/zinc/98/03/94/1058980394.db2.gz FLYYQQIJBPEZJU-SFHVURJKSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCCC23CCC3)CC[NH2+]1 ZINC001246521529 1058984097 /nfs/dbraw/zinc/98/40/97/1058984097.db2.gz BPDJNVWRMGQIFJ-NZSAHSFTSA-N 2 1 316.464 4.240 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC23CCC3)CC[NH2+]1 ZINC001246521534 1058984376 /nfs/dbraw/zinc/98/43/76/1058984376.db2.gz BPDJNVWRMGQIFJ-YTQUADARSA-N 2 1 316.464 4.240 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246526416 1058988947 /nfs/dbraw/zinc/98/89/47/1058988947.db2.gz WSPRQWXNSUMFNF-AERCQKQUSA-N 2 1 320.480 4.381 20 0 DIADMP Clc1ccc(C2=CC[N@H+]([C@@H]3CC[NH2+]C4(CCC4)C3)CC2)cc1 ZINC001246536603 1058990369 /nfs/dbraw/zinc/99/03/69/1058990369.db2.gz RQKYLHRJKRFGMY-GOSISDBHSA-N 2 1 316.876 4.104 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534846 1058990906 /nfs/dbraw/zinc/99/09/06/1058990906.db2.gz ZPKXMRJJRHDMDN-IEBWSBKVSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534846 1058990927 /nfs/dbraw/zinc/99/09/27/1058990927.db2.gz ZPKXMRJJRHDMDN-IEBWSBKVSA-N 2 1 304.453 4.192 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@](C)([NH3+])C1 ZINC001246540169 1058991686 /nfs/dbraw/zinc/99/16/86/1058991686.db2.gz LGYMPQCFYLWNAE-LRDDRELGSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@](C)([NH3+])C1 ZINC001246540169 1058991710 /nfs/dbraw/zinc/99/17/10/1058991710.db2.gz LGYMPQCFYLWNAE-LRDDRELGSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246541027 1058994797 /nfs/dbraw/zinc/99/47/97/1058994797.db2.gz LKVWGRJSOSFWEJ-GHTZIAJQSA-N 2 1 322.496 4.410 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H]([NH3+])CC1 ZINC001246542517 1058995722 /nfs/dbraw/zinc/99/57/22/1058995722.db2.gz PUPASPDXWBKVIT-JSGCOSHPSA-N 2 1 315.288 4.128 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246550994 1058996339 /nfs/dbraw/zinc/99/63/39/1058996339.db2.gz RUMZSTRGWZKHKO-OTWHNJEPSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246558250 1058999548 /nfs/dbraw/zinc/99/95/48/1058999548.db2.gz KCAFCWUOKZVUBY-IBGZPJMESA-N 2 1 300.490 4.067 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001246556944 1058999942 /nfs/dbraw/zinc/99/99/42/1058999942.db2.gz IOOVIEKXBRKZEZ-YZGWKJHDSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246547327 1059000290 /nfs/dbraw/zinc/00/02/90/1059000290.db2.gz CKVQAABPRCCTQN-CRAIPNDOSA-N 2 1 324.534 4.273 20 0 DIADMP CCCCCC(CCCCC)[N@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246555885 1059000989 /nfs/dbraw/zinc/00/09/89/1059000989.db2.gz IJXQGZTVQRKOBT-OAHLLOKOSA-N 2 1 304.469 4.432 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246561164 1059002091 /nfs/dbraw/zinc/00/20/91/1059002091.db2.gz IPYLFBWKECJKEY-IBGZPJMESA-N 2 1 316.464 4.275 20 0 DIADMP C[C@H]1CC[N@H+](C2CCC(Cc3ccccc3)CC2)CC[C@H]1C[NH3+] ZINC001246561429 1059002482 /nfs/dbraw/zinc/00/24/82/1059002482.db2.gz SNPRLJSNRPUSEK-AFVILVPDSA-N 2 1 314.517 4.095 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC001246561412 1059002850 /nfs/dbraw/zinc/00/28/50/1059002850.db2.gz SKSXVXSDEOKJQE-LJHODMEESA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC001246561412 1059002876 /nfs/dbraw/zinc/00/28/76/1059002876.db2.gz SKSXVXSDEOKJQE-LJHODMEESA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246573531 1059003289 /nfs/dbraw/zinc/00/32/89/1059003289.db2.gz RSYWSAIAWIDVRJ-HNAWSFBYSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246573531 1059003313 /nfs/dbraw/zinc/00/33/13/1059003313.db2.gz RSYWSAIAWIDVRJ-HNAWSFBYSA-N 2 1 316.464 4.049 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CCC[C@H](c3ccccc3)C2)CCC[C@H]1C[NH3+] ZINC001246566960 1059003783 /nfs/dbraw/zinc/00/37/83/1059003783.db2.gz KFWMZLXNSOOJHZ-BTHPGYMESA-N 2 1 300.490 4.020 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2ccc(F)cc2)C[C@@H](CC)[NH2+]1 ZINC001246565032 1059007945 /nfs/dbraw/zinc/00/79/45/1059007945.db2.gz ZZEDGMQKQAEKGU-LMMKCTJWSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001246581145 1059008556 /nfs/dbraw/zinc/00/85/56/1059008556.db2.gz XYNIRYAMOLRCKW-UXHICEINSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246582564 1059008864 /nfs/dbraw/zinc/00/88/64/1059008864.db2.gz NTSIWTNZXNFYOT-HZPDHXFCSA-N 2 1 324.534 4.131 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001246586201 1059013081 /nfs/dbraw/zinc/01/30/81/1059013081.db2.gz RNUWTWZPCWQCPF-VAMGGRTRSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1ccccc1Cl)[C@H]1CCC[NH2+]CC1 ZINC001246589758 1059015540 /nfs/dbraw/zinc/01/55/40/1059015540.db2.gz FNRUSXPBHTYBJB-RDJZCZTQSA-N 2 1 308.897 4.124 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001246593426 1059018359 /nfs/dbraw/zinc/01/83/59/1059018359.db2.gz MUVZXMZIOLRUAK-WOJBJXKFSA-N 2 1 302.506 4.250 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246589421 1059019276 /nfs/dbraw/zinc/01/92/76/1059019276.db2.gz DZTDEQNLCQOXTJ-KRIWPVKQSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246589423 1059020022 /nfs/dbraw/zinc/02/00/22/1059020022.db2.gz DZTDEQNLCQOXTJ-VKUSLMQGSA-N 2 1 320.908 4.425 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614383 1059025379 /nfs/dbraw/zinc/02/53/79/1059025379.db2.gz NYYCFXTYBDWNKZ-MJGOQNOKSA-N 2 1 316.464 4.336 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614383 1059025403 /nfs/dbraw/zinc/02/54/03/1059025403.db2.gz NYYCFXTYBDWNKZ-MJGOQNOKSA-N 2 1 316.464 4.336 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246612331 1059027488 /nfs/dbraw/zinc/02/74/88/1059027488.db2.gz VPFGORKOLUPMEO-YLJYHZDGSA-N 2 1 318.480 4.003 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CCC[C@@]34CCC[NH2+]C4)CC2)cc1 ZINC001246610050 1059028152 /nfs/dbraw/zinc/02/81/52/1059028152.db2.gz NSFOFLAZPPPLQQ-XVAXZDLZSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CC[C@]4(C3)CCCC[NH2+]4)CC2)cc1 ZINC001246619953 1059032334 /nfs/dbraw/zinc/03/23/34/1059032334.db2.gz JMQROVLVKOTYIG-CBNMVNINSA-N 2 1 312.501 4.006 20 0 DIADMP FC(F)(F)CCN1CCC[C@@]2(CCC[N@H+](C3CCCC3)C2)C1 ZINC001278458341 1059032438 /nfs/dbraw/zinc/03/24/38/1059032438.db2.gz GARXKJCBZUBUEF-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@@]4(CCC[NH2+]4)C3)CC2)cc1 ZINC001246614585 1059033287 /nfs/dbraw/zinc/03/32/87/1059033287.db2.gz OUQJKAPXTHGCDD-KVZIAJEVSA-N 2 1 318.892 4.194 20 0 DIADMP c1ccc(C2CCC([N@H+]3CCC[C@@]4(CCCC[NH2+]4)C3)CC2)cc1 ZINC001246617081 1059034571 /nfs/dbraw/zinc/03/45/71/1059034571.db2.gz XPMBUHQWERUNGU-CBNMVNINSA-N 2 1 312.501 4.321 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001246616287 1059035326 /nfs/dbraw/zinc/03/53/26/1059035326.db2.gz GXMZNHMFKVINSE-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246633875 1059036380 /nfs/dbraw/zinc/03/63/80/1059036380.db2.gz MZQJXOKEEGHACU-KSSFIOAISA-N 2 1 324.871 4.018 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246633875 1059036396 /nfs/dbraw/zinc/03/63/96/1059036396.db2.gz MZQJXOKEEGHACU-KSSFIOAISA-N 2 1 324.871 4.018 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001246625778 1059038555 /nfs/dbraw/zinc/03/85/55/1059038555.db2.gz UNJZHPVCMJRUAS-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001246628652 1059038720 /nfs/dbraw/zinc/03/87/20/1059038720.db2.gz BXTQUYZCOJCCTI-PKOBYXMFSA-N 2 1 318.530 4.084 20 0 DIADMP CCCCCC[C@@H](CC)[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001246638559 1059044142 /nfs/dbraw/zinc/04/41/42/1059044142.db2.gz MOOQKUGUJPSXKH-CVEARBPZSA-N 2 1 302.453 4.056 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)C2)cc1 ZINC001246636668 1059044981 /nfs/dbraw/zinc/04/49/81/1059044981.db2.gz VYHAOHGAUAPMBY-NJDAHSKKSA-N 2 1 312.501 4.321 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246642924 1059047251 /nfs/dbraw/zinc/04/72/51/1059047251.db2.gz FQODWZSOKNQIOW-RTWAWAEBSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246643922 1059050071 /nfs/dbraw/zinc/05/00/71/1059050071.db2.gz IAHPRZHFUHXJSB-BEFAXECRSA-N 2 1 320.908 4.125 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@@H+]2CCCC[C@]23CCC[NH2+]C3)cc1 ZINC001246649546 1059053322 /nfs/dbraw/zinc/05/33/22/1059053322.db2.gz CQCDNMBLDLNIJR-PKOBYXMFSA-N 2 1 318.530 4.084 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCCC[C@]23CCC[NH2+]C3)cc1 ZINC001246649546 1059053346 /nfs/dbraw/zinc/05/33/46/1059053346.db2.gz CQCDNMBLDLNIJR-PKOBYXMFSA-N 2 1 318.530 4.084 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@@H+]3CCCC[C@]34CCC[NH2+]C4)C2)cc1 ZINC001246651517 1059055085 /nfs/dbraw/zinc/05/50/85/1059055085.db2.gz LXRGHEIKRGFHFP-QHAWAJNXSA-N 2 1 312.501 4.321 20 0 DIADMP CCC1CCC([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)CC1 ZINC001246669863 1059057710 /nfs/dbraw/zinc/05/77/10/1059057710.db2.gz CCOQVXGPZKSDTI-CGNZLSCGSA-N 2 1 312.501 4.177 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246675846 1059058149 /nfs/dbraw/zinc/05/81/49/1059058149.db2.gz YJWKRLPFTVUKQG-CTNGQTDRSA-N 2 1 314.517 4.208 20 0 DIADMP C1CCC2(C1)CCC([N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1)CC2 ZINC001246659233 1059060068 /nfs/dbraw/zinc/06/00/68/1059060068.db2.gz RATIISBIYAEMPM-LJQANCHMSA-N 2 1 304.522 4.344 20 0 DIADMP C1CCC2(C1)CCC([N@H+]1CCC[C@@H]([C@@H]3CCC[NH2+]C3)C1)CC2 ZINC001246679636 1059061026 /nfs/dbraw/zinc/06/10/26/1059061026.db2.gz XCKQXXBUNWGIEL-QZTJIDSGSA-N 2 1 304.522 4.201 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246677141 1059062452 /nfs/dbraw/zinc/06/24/52/1059062452.db2.gz BWAGXIOUXDVFRO-RXVVDRJESA-N 2 1 320.480 4.392 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246682338 1059062817 /nfs/dbraw/zinc/06/28/17/1059062817.db2.gz BQWODRXYFVZAID-WJMWBRGCSA-N 2 1 314.517 4.280 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H](c3ccccc3)C2)C[C@@H](CC)[NH2+]1 ZINC001246774588 1059072053 /nfs/dbraw/zinc/07/20/53/1059072053.db2.gz FXWKBBBQMFSXAZ-IPMKNSEASA-N 2 1 300.490 4.175 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246775581 1059072642 /nfs/dbraw/zinc/07/26/42/1059072642.db2.gz IXRVZEILBJHBDC-QUCCMNQESA-N 2 1 310.485 4.438 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@H+]3CCC[C@@H](c4ccccc4)C3)CC[NH2+]2)cc1 ZINC001246773332 1059073994 /nfs/dbraw/zinc/07/39/94/1059073994.db2.gz AVFPPWWSSZDIEM-BHIFYINESA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@@H+]3CCC[C@@H](c4ccccc4)C3)CC[NH2+]2)cc1 ZINC001246773332 1059074018 /nfs/dbraw/zinc/07/40/18/1059074018.db2.gz AVFPPWWSSZDIEM-BHIFYINESA-N 2 1 320.480 4.359 20 0 DIADMP C[N@H+](CCCc1ccccc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246773652 1059074919 /nfs/dbraw/zinc/07/49/19/1059074919.db2.gz CBILMWRGLKMILF-RTWAWAEBSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@@H+](CCCc1ccccc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246773652 1059074937 /nfs/dbraw/zinc/07/49/37/1059074937.db2.gz CBILMWRGLKMILF-RTWAWAEBSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@@H+](C1CCC2(CC[NH2+]CC2)CC1)C12CC3CC(CC(C3)C1)C2 ZINC001246783180 1059077190 /nfs/dbraw/zinc/07/71/90/1059077190.db2.gz NVODJDZZQXDFGB-UHFFFAOYSA-N 2 1 316.533 4.199 20 0 DIADMP CCCC1CC[NH+]([C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CC1 ZINC001246777755 1059077888 /nfs/dbraw/zinc/07/78/88/1059077888.db2.gz UFNOCZFQLAQAOC-UYAOXDASSA-N 2 1 318.480 4.439 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2ccc(C)cc2)C[C@@H](CC)[NH2+]1 ZINC001246781004 1059079962 /nfs/dbraw/zinc/07/99/62/1059079962.db2.gz MPWSRLMATHRPMD-QWFCFKBJSA-N 2 1 300.490 4.441 20 0 DIADMP C[N@@H+](C1CCC2(CCC[NH2+]C2)CC1)C12CC3CC(CC(C3)C1)C2 ZINC001246781536 1059081186 /nfs/dbraw/zinc/08/11/86/1059081186.db2.gz GTXYTXVNNMLBFJ-UHFFFAOYSA-N 2 1 316.533 4.199 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246778516 1059082302 /nfs/dbraw/zinc/08/23/02/1059082302.db2.gz PNOHOFYDPJYPTR-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP c1csc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246786607 1059083953 /nfs/dbraw/zinc/08/39/53/1059083953.db2.gz MDLYHASMVKBCFM-HOTGVXAUSA-N 2 1 304.503 4.340 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246784698 1059084809 /nfs/dbraw/zinc/08/48/09/1059084809.db2.gz IKGAKRLWTSTPLT-UXPWSPDFSA-N 2 1 316.464 4.275 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCCC[C@H]2c2ccccc2F)CC[NH2+]1 ZINC001246785597 1059085304 /nfs/dbraw/zinc/08/53/04/1059085304.db2.gz KMGPCVSZJTXMCG-MNEFBYGVSA-N 2 1 304.453 4.129 20 0 DIADMP c1ccc(C[C@@H]2C[C@H]([N@H+]3CCC[C@H]3c3ccccc3)CC[NH2+]2)cc1 ZINC001246784130 1059085419 /nfs/dbraw/zinc/08/54/19/1059085419.db2.gz FBOGUIHOMKJARI-VSKRKVRLSA-N 2 1 320.480 4.187 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCCC[C@H]2c2ccccc2F)CC[NH2+]1 ZINC001246785601 1059086415 /nfs/dbraw/zinc/08/64/15/1059086415.db2.gz KMGPCVSZJTXMCG-SNRMKQJTSA-N 2 1 304.453 4.129 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(OC)cc2)CC[NH2+]1 ZINC001246788340 1059086573 /nfs/dbraw/zinc/08/65/73/1059086573.db2.gz RDOOVNNCMDODHC-WSTZPKSXSA-N 2 1 316.489 4.143 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783858 1059086898 /nfs/dbraw/zinc/08/68/98/1059086898.db2.gz QILIASOQZSTOOE-QAPCUYQASA-N 2 1 318.461 4.121 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783858 1059086920 /nfs/dbraw/zinc/08/69/20/1059086920.db2.gz QILIASOQZSTOOE-QAPCUYQASA-N 2 1 318.461 4.121 20 0 DIADMP c1csc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785710 1059087387 /nfs/dbraw/zinc/08/73/87/1059087387.db2.gz KWNUWCUSRXCYIU-OKZBNKHCSA-N 2 1 312.482 4.378 20 0 DIADMP c1csc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785710 1059087408 /nfs/dbraw/zinc/08/74/08/1059087408.db2.gz KWNUWCUSRXCYIU-OKZBNKHCSA-N 2 1 312.482 4.378 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787539 1059087781 /nfs/dbraw/zinc/08/77/81/1059087781.db2.gz QIMHNFIIKHCDPP-PCCBWWKXSA-N 2 1 306.453 4.317 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787539 1059087802 /nfs/dbraw/zinc/08/78/02/1059087802.db2.gz QIMHNFIIKHCDPP-PCCBWWKXSA-N 2 1 306.453 4.317 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246791902 1059089229 /nfs/dbraw/zinc/08/92/29/1059089229.db2.gz PQSADZBDCTWFTO-MAUKXSAKSA-N 2 1 318.892 4.399 20 0 DIADMP Fc1ccc(F)c([C@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246792138 1059092617 /nfs/dbraw/zinc/09/26/17/1059092617.db2.gz NPKAIGXILJVJCM-CRAIPNDOSA-N 2 1 320.427 4.024 20 0 DIADMP c1ccc(C[C@H]2CC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246791533 1059093069 /nfs/dbraw/zinc/09/30/69/1059093069.db2.gz LBDKVMGXRNMWLZ-WOJBJXKFSA-N 2 1 312.501 4.006 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001246793248 1059094931 /nfs/dbraw/zinc/09/49/31/1059094931.db2.gz BXZPPAZGGIOKHX-FQEVSTJZSA-N 2 1 302.506 4.109 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793662 1059095422 /nfs/dbraw/zinc/09/54/22/1059095422.db2.gz WAILJPZQLDHZQL-QGTPRVQTSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793662 1059095445 /nfs/dbraw/zinc/09/54/45/1059095445.db2.gz WAILJPZQLDHZQL-QGTPRVQTSA-N 2 1 322.443 4.268 20 0 DIADMP Clc1ccc(CCC2CC[NH+]([C@H]3CCCC[NH2+]C3)CC2)cc1 ZINC001246792386 1059096893 /nfs/dbraw/zinc/09/68/93/1059096893.db2.gz VIUGMSUDYMQWHT-IBGZPJMESA-N 2 1 320.908 4.127 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246795954 1059098999 /nfs/dbraw/zinc/09/89/99/1059098999.db2.gz JQZOHQQGELBZEZ-UXHICEINSA-N 2 1 300.490 4.034 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2OC)C[C@H](CC)[NH2+]1 ZINC001246792526 1059099238 /nfs/dbraw/zinc/09/92/38/1059099238.db2.gz QLXBIEUVPPTQFA-SFNKJDCFSA-N 2 1 316.489 4.141 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246799924 1059101169 /nfs/dbraw/zinc/10/11/69/1059101169.db2.gz PJWHGMTXCBGECW-RTBURBONSA-N 2 1 316.464 4.418 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+]([C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC001246809012 1059104961 /nfs/dbraw/zinc/10/49/61/1059104961.db2.gz FYIKHPLZIASQKT-GPMSIDNRSA-N 2 1 318.892 4.052 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@H+]([C@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246809475 1059105581 /nfs/dbraw/zinc/10/55/81/1059105581.db2.gz WRLYTOJCAZYCRV-SJORKVTESA-N 2 1 316.464 4.070 20 0 DIADMP CC[C@@H]1CC([N@H+]2CC[C@H](c3ccccc3Cl)C2)C[C@@H](CC)[NH2+]1 ZINC001246809659 1059105848 /nfs/dbraw/zinc/10/58/48/1059105848.db2.gz KXRVRYPDTDLWRG-ARFHVFGLSA-N 2 1 320.908 4.439 20 0 DIADMP C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246814250 1059107716 /nfs/dbraw/zinc/10/77/16/1059107716.db2.gz POFGGIKDWLSOMN-REPLKXPHSA-N 2 1 316.565 4.039 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)s1 ZINC001246822559 1059108859 /nfs/dbraw/zinc/10/88/59/1059108859.db2.gz LMHODICGTFFNGD-JKIFEVAISA-N 2 1 324.921 4.461 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826349 1059110146 /nfs/dbraw/zinc/11/01/46/1059110146.db2.gz WVOKABUWORYFSU-RDBSUJKOSA-N 2 1 312.910 4.315 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826349 1059110154 /nfs/dbraw/zinc/11/01/54/1059110154.db2.gz WVOKABUWORYFSU-RDBSUJKOSA-N 2 1 312.910 4.315 20 0 DIADMP CC[C@@H]1CC([N@@H+](C)CCc2cccc(Cl)c2)C[C@@H](CC)[NH2+]1 ZINC001246822375 1059111034 /nfs/dbraw/zinc/11/10/34/1059111034.db2.gz KPDFZRJWUQHENC-IAGOWNOFSA-N 2 1 308.897 4.124 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+](C)CCc2cccc(Cl)c2)CC[NH2+]1 ZINC001246822591 1059111259 /nfs/dbraw/zinc/11/12/59/1059111259.db2.gz LZJUUBCUWJUSEC-ROUUACIJSA-N 2 1 308.897 4.125 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)s1 ZINC001246826879 1059115474 /nfs/dbraw/zinc/11/54/74/1059115474.db2.gz YZVQCRUTOGNURC-UONOGXRCSA-N 2 1 324.921 4.461 20 0 DIADMP Fc1cccc([C@@H]2CC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)c1 ZINC001246833541 1059115962 /nfs/dbraw/zinc/11/59/62/1059115962.db2.gz LSCZYJSCTJCRMS-IEBWSBKVSA-N 2 1 316.464 4.070 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCc3c(Cl)cccc3C2)C[C@H](CC)[NH2+]1 ZINC001246839375 1059118564 /nfs/dbraw/zinc/11/85/64/1059118564.db2.gz AHGVDXLNXAAAHV-ZSHCYNCHSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCc3c(Cl)cccc3C2)C[C@H](CC)[NH2+]1 ZINC001246839375 1059118580 /nfs/dbraw/zinc/11/85/80/1059118580.db2.gz AHGVDXLNXAAAHV-ZSHCYNCHSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC[NH2+]1 ZINC001246838897 1059120070 /nfs/dbraw/zinc/12/00/70/1059120070.db2.gz KDIGYYMCLXMUHC-FGZHOGPDSA-N 2 1 322.496 4.262 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246845035 1059122661 /nfs/dbraw/zinc/12/26/61/1059122661.db2.gz KLYUVNGMXUGAPN-LMMKCTJWSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246845035 1059122669 /nfs/dbraw/zinc/12/26/69/1059122669.db2.gz KLYUVNGMXUGAPN-LMMKCTJWSA-N 2 1 304.453 4.192 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246844666 1059123404 /nfs/dbraw/zinc/12/34/04/1059123404.db2.gz KCEDJMSHZRLEAR-AABGKKOBSA-N 2 1 314.517 4.423 20 0 DIADMP C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246843201 1059123558 /nfs/dbraw/zinc/12/35/58/1059123558.db2.gz UVBVOSCMERPVBW-DMKPSLHHSA-N 2 1 320.908 4.298 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@H]3CCC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001246845758 1059124842 /nfs/dbraw/zinc/12/48/42/1059124842.db2.gz NTBKJOLNQQCLDD-PMACEKPBSA-N 2 1 312.501 4.178 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246843923 1059125105 /nfs/dbraw/zinc/12/51/05/1059125105.db2.gz GQAWDRDWDDNEKH-LJQANCHMSA-N 2 1 300.490 4.382 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246847206 1059127159 /nfs/dbraw/zinc/12/71/59/1059127159.db2.gz JWVCKYOUAXMANF-GIVPXCGWSA-N 2 1 324.443 4.374 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246847206 1059127171 /nfs/dbraw/zinc/12/71/71/1059127171.db2.gz JWVCKYOUAXMANF-GIVPXCGWSA-N 2 1 324.443 4.374 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+]([C@@H]3CCC[C@]4(CC[NH2+]C4)C3)C2)c1 ZINC001246848762 1059127946 /nfs/dbraw/zinc/12/79/46/1059127946.db2.gz DNBYKDDFLUJEBP-QRQLOZEOSA-N 2 1 318.892 4.052 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(OC)c2)CC[NH2+]1 ZINC001246846410 1059128478 /nfs/dbraw/zinc/12/84/78/1059128478.db2.gz GWDQRSMPOKSTDU-WSTZPKSXSA-N 2 1 316.489 4.143 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)[C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246853636 1059132126 /nfs/dbraw/zinc/13/21/26/1059132126.db2.gz RWXWVKJISNFBDZ-FUHWJXTLSA-N 2 1 316.489 4.143 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852151 1059132222 /nfs/dbraw/zinc/13/22/22/1059132222.db2.gz NFEJXGNWYQNTGI-BHIYHBOVSA-N 2 1 320.908 4.440 20 0 DIADMP COc1ccc([C@@H](C)[N@@H+](C)[C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246853637 1059132372 /nfs/dbraw/zinc/13/23/72/1059132372.db2.gz RWXWVKJISNFBDZ-SJLPKXTDSA-N 2 1 316.489 4.143 20 0 DIADMP C[N@@H+](C1CCC(C(C)(C)C)CC1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246856173 1059132466 /nfs/dbraw/zinc/13/24/66/1059132466.db2.gz ZBLRLHRDSYFGDI-SMRJSYMMSA-N 2 1 306.538 4.445 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246854507 1059133178 /nfs/dbraw/zinc/13/31/78/1059133178.db2.gz VETXEIAKIQCLKJ-DFNIBXOVSA-N 2 1 322.452 4.194 20 0 DIADMP C1C[N@H+](C2CCC3(CC[NH2+]CC3)CC2)C[C@H]1C1CCCCC1 ZINC001246850670 1059133275 /nfs/dbraw/zinc/13/32/75/1059133275.db2.gz VOEBUMFNYNIVJI-SFHVURJKSA-N 2 1 304.522 4.201 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246852340 1059133379 /nfs/dbraw/zinc/13/33/79/1059133379.db2.gz OUSSKJXVLWGLPT-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@@H+](C1CCC(C(C)(C)C)CC1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246856175 1059133570 /nfs/dbraw/zinc/13/35/70/1059133570.db2.gz ZBLRLHRDSYFGDI-ZZVGESKWSA-N 2 1 306.538 4.445 20 0 DIADMP C1C[C@H](C2CCCCC2)[N@H+](C2CCC3(CC[NH2+]CC3)CC2)C1 ZINC001246866911 1059136494 /nfs/dbraw/zinc/13/64/94/1059136494.db2.gz VBNXXWWLFGIOGK-LJQANCHMSA-N 2 1 304.522 4.344 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1C1CCC2(CC[NH2+]CC2)CC1 ZINC001246867676 1059140728 /nfs/dbraw/zinc/14/07/28/1059140728.db2.gz PZVOYXPVWPVDAS-HXUWFJFHSA-N 2 1 312.501 4.308 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2Cc3ccccc3C(C)(C)C2)C[C@H](CC)[NH2+]1 ZINC001246869522 1059141168 /nfs/dbraw/zinc/14/11/68/1059141168.db2.gz IBDAWFQCBSGXGT-PIIMJCKOSA-N 2 1 300.490 4.089 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246867430 1059142329 /nfs/dbraw/zinc/14/23/29/1059142329.db2.gz XLKOZQJZYCQDHU-GOSISDBHSA-N 2 1 304.453 4.103 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246879878 1059145684 /nfs/dbraw/zinc/14/56/84/1059145684.db2.gz PXOFYWJCBKOVKG-KDOFPFPSSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2CC3CCC(CC3)C2)CC[NH2+]1 ZINC001246882876 1059147868 /nfs/dbraw/zinc/14/78/68/1059147868.db2.gz OWDZYXSGUYQWCE-JQGZUDLISA-N 2 1 316.464 4.049 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886427 1059148048 /nfs/dbraw/zinc/14/80/48/1059148048.db2.gz KPXHCDNHQIEFJL-OLMNPRSZSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886427 1059148054 /nfs/dbraw/zinc/14/80/54/1059148054.db2.gz KPXHCDNHQIEFJL-OLMNPRSZSA-N 2 1 322.443 4.268 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c(F)c1 ZINC001246884389 1059149878 /nfs/dbraw/zinc/14/98/78/1059149878.db2.gz AOFJZXVKLXRBCH-MNEFBYGVSA-N 2 1 320.427 4.024 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2C2CCC3(C[NH2+]C3)CC2)c1 ZINC001246887341 1059153199 /nfs/dbraw/zinc/15/31/99/1059153199.db2.gz KZWYAWQEOMIVJG-QGZVFWFLSA-N 2 1 304.865 4.009 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)c1 ZINC001246888025 1059153688 /nfs/dbraw/zinc/15/36/88/1059153688.db2.gz QFQDCSWGSFEUDW-MHORFTMASA-N 2 1 304.865 4.150 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246889553 1059155773 /nfs/dbraw/zinc/15/57/73/1059155773.db2.gz QXWPFAPEQMYUNG-DFGXFYAUSA-N 2 1 316.514 4.219 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2C2CCC3(C[NH2+]C3)CC2)c1 ZINC001246887340 1059156335 /nfs/dbraw/zinc/15/63/35/1059156335.db2.gz KZWYAWQEOMIVJG-KRWDZBQOSA-N 2 1 304.865 4.009 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c(F)c1 ZINC001246886857 1059156841 /nfs/dbraw/zinc/15/68/41/1059156841.db2.gz LVAOUTQMQWVVOU-ZCDLSOSASA-N 2 1 320.427 4.024 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246896714 1059158978 /nfs/dbraw/zinc/15/89/78/1059158978.db2.gz ZSZVJMZWFKDXPQ-NHCUHLMSSA-N 2 1 308.469 4.194 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2c[nH]c3ccccc23)CC1 ZINC001246898133 1059159703 /nfs/dbraw/zinc/15/97/03/1059159703.db2.gz AHOBKFFKDVCPBO-HXUWFJFHSA-N 2 1 311.473 4.179 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H]2c2c[nH]c3ccccc23)CC1 ZINC001246898133 1059159717 /nfs/dbraw/zinc/15/97/17/1059159717.db2.gz AHOBKFFKDVCPBO-HXUWFJFHSA-N 2 1 311.473 4.179 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@H](C(C)(C)C)C1)C(C)(C)Cc1ccccc1 ZINC001246895773 1059160716 /nfs/dbraw/zinc/16/07/16/1059160716.db2.gz YANVJHZBEJENOJ-ROUUACIJSA-N 2 1 302.506 4.106 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246896713 1059160735 /nfs/dbraw/zinc/16/07/35/1059160735.db2.gz ZSZVJMZWFKDXPQ-LEWJYISDSA-N 2 1 308.469 4.194 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246903013 1059162769 /nfs/dbraw/zinc/16/27/69/1059162769.db2.gz HIIACMCBBLFICQ-ROUUACIJSA-N 2 1 306.881 4.084 20 0 DIADMP Fc1cccc(F)c1[C@@H]1CCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246901335 1059163292 /nfs/dbraw/zinc/16/32/92/1059163292.db2.gz MCQQWPCDWLMAST-PBHICJAKSA-N 2 1 320.427 4.024 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246906659 1059166684 /nfs/dbraw/zinc/16/66/84/1059166684.db2.gz FUTJEJDBTCTZDC-LJQANCHMSA-N 2 1 300.490 4.272 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246907712 1059167342 /nfs/dbraw/zinc/16/73/42/1059167342.db2.gz UMQGKOQBCYNSBW-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1Cl)[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246905791 1059167931 /nfs/dbraw/zinc/16/79/31/1059167931.db2.gz GUYVQIMJZCYDIB-CQDKDKBSSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905957 1059168468 /nfs/dbraw/zinc/16/84/68/1059168468.db2.gz PCMOJTXDMHVNGQ-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905957 1059168482 /nfs/dbraw/zinc/16/84/82/1059168482.db2.gz PCMOJTXDMHVNGQ-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246910986 1059172180 /nfs/dbraw/zinc/17/21/80/1059172180.db2.gz OSDDWADHKFHWSY-SGZDXZSOSA-N 2 1 300.490 4.337 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246912144 1059174582 /nfs/dbraw/zinc/17/45/82/1059174582.db2.gz DMGSUFYTPGPOJY-OAQYLSRUSA-N 2 1 322.496 4.262 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)[C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001246921733 1059175561 /nfs/dbraw/zinc/17/55/61/1059175561.db2.gz RQLCQDNQXZLASL-OAHAVBBTSA-N 2 1 300.490 4.175 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246916428 1059175820 /nfs/dbraw/zinc/17/58/20/1059175820.db2.gz SWDXAIOGOFSUAN-GOSISDBHSA-N 2 1 300.490 4.376 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@H]([NH3+])[C@H]1C ZINC001246937969 1059182699 /nfs/dbraw/zinc/18/26/99/1059182699.db2.gz KSCXNKAGXSDCGD-HSMVNMDESA-N 2 1 315.288 4.126 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H]([NH3+])[C@H]1C ZINC001246937969 1059182721 /nfs/dbraw/zinc/18/27/21/1059182721.db2.gz KSCXNKAGXSDCGD-HSMVNMDESA-N 2 1 315.288 4.126 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C[C@H]1C ZINC001246936617 1059183820 /nfs/dbraw/zinc/18/38/20/1059183820.db2.gz WTNRNNIAWJDFMV-MDZRGWNJSA-N 2 1 318.480 4.204 20 0 DIADMP Fc1ccccc1C[N@@H+](C1CC[NH2+]CC1)C1CCC2(CC2)CC1 ZINC001246934675 1059185287 /nfs/dbraw/zinc/18/52/87/1059185287.db2.gz OYQBCRKHUWOJFS-UHFFFAOYSA-N 2 1 316.464 4.103 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246936713 1059185337 /nfs/dbraw/zinc/18/53/37/1059185337.db2.gz YCZGLPSTPDRZRF-QGZVFWFLSA-N 2 1 306.469 4.204 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246938323 1059185447 /nfs/dbraw/zinc/18/54/47/1059185447.db2.gz OZUQMIQQNNSEHT-WOJBJXKFSA-N 2 1 314.517 4.252 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246937182 1059185564 /nfs/dbraw/zinc/18/55/64/1059185564.db2.gz ZVBCTIPQQANCAC-KRWDZBQOSA-N 2 1 306.469 4.349 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@H]([NH3+])[C@H](C(F)(F)F)C2)CC1 ZINC001246942987 1059188193 /nfs/dbraw/zinc/18/81/93/1059188193.db2.gz YSCZDMGRRDYHAS-CVSAEHQPSA-N 2 1 320.443 4.193 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246944453 1059189165 /nfs/dbraw/zinc/18/91/65/1059189165.db2.gz CDOHABAVAYOCPA-QAPCUYQASA-N 2 1 320.908 4.473 20 0 DIADMP C[C@H]1CCC[C@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246941891 1059189291 /nfs/dbraw/zinc/18/92/91/1059189291.db2.gz IWOVEMWOWNNFKH-JXFKEZNVSA-N 2 1 318.480 4.206 20 0 DIADMP CCC[C@@H](CC)[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001246941883 1059190468 /nfs/dbraw/zinc/19/04/68/1059190468.db2.gz IUOWBVNTENXIPH-LJQANCHMSA-N 2 1 306.469 4.206 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246946246 1059191367 /nfs/dbraw/zinc/19/13/67/1059191367.db2.gz KEHAXTHGYVVHTA-AWEZNQCLSA-N 2 1 300.556 4.007 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246948012 1059193227 /nfs/dbraw/zinc/19/32/27/1059193227.db2.gz ZNNUERXMRCLWMG-HNNXBMFYSA-N 2 1 322.924 4.371 20 0 DIADMP Fc1ccc(F)c([C@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246947978 1059195045 /nfs/dbraw/zinc/19/50/45/1059195045.db2.gz OMLOESRTDQSSKW-LZQZEXGQSA-N 2 1 320.427 4.024 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246948003 1059195814 /nfs/dbraw/zinc/19/58/14/1059195814.db2.gz ZIJVJLHDEZHUFR-GOSISDBHSA-N 2 1 320.908 4.473 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246947259 1059196227 /nfs/dbraw/zinc/19/62/27/1059196227.db2.gz SPZPGWNMOGCIRE-HNAYVOBHSA-N 2 1 320.908 4.473 20 0 DIADMP CCCC[C@@H](C)[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246955833 1059199244 /nfs/dbraw/zinc/19/92/44/1059199244.db2.gz UDBRZTVZOUSULY-OAHLLOKOSA-N 2 1 308.897 4.473 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246955833 1059199252 /nfs/dbraw/zinc/19/92/52/1059199252.db2.gz UDBRZTVZOUSULY-OAHLLOKOSA-N 2 1 308.897 4.473 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246955941 1059200086 /nfs/dbraw/zinc/20/00/86/1059200086.db2.gz ODGUSVWDMIDOCO-MRXNPFEDSA-N 2 1 324.459 4.488 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccc(C)cc2F)C2CC[NH2+]CC2)C1 ZINC001246954223 1059200488 /nfs/dbraw/zinc/20/04/88/1059200488.db2.gz FPNMMNJIQLEVAH-LPHOPBHVSA-N 2 1 318.480 4.267 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956174 1059200779 /nfs/dbraw/zinc/20/07/79/1059200779.db2.gz QPRPPPSAFGGNPB-KDOFPFPSSA-N 2 1 322.443 4.098 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956174 1059200806 /nfs/dbraw/zinc/20/08/06/1059200806.db2.gz QPRPPPSAFGGNPB-KDOFPFPSSA-N 2 1 322.443 4.098 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246954889 1059201030 /nfs/dbraw/zinc/20/10/30/1059201030.db2.gz JKTORGADKHBPGS-OAHLLOKOSA-N 2 1 310.432 4.098 20 0 DIADMP c1ccc(C[N@@H+](C2CCC2)C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246958878 1059203974 /nfs/dbraw/zinc/20/39/74/1059203974.db2.gz DVLZWLAYOBJVHS-UHFFFAOYSA-N 2 1 312.501 4.354 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246962329 1059204023 /nfs/dbraw/zinc/20/40/23/1059204023.db2.gz CDKZSPCQKGPXCW-NJDAHSKKSA-N 2 1 314.517 4.380 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCC2)C[C@H](CC)[NH2+]1 ZINC001246959199 1059207293 /nfs/dbraw/zinc/20/72/93/1059207293.db2.gz FRROBWJPQQFZGJ-OPVJXMOQSA-N 2 1 300.490 4.350 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246956723 1059208004 /nfs/dbraw/zinc/20/80/04/1059208004.db2.gz ZYZKMVVSGUSMHO-KRWDZBQOSA-N 2 1 320.908 4.473 20 0 DIADMP c1ccc(C[N@@H+](C2CCC2)[C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246965928 1059210363 /nfs/dbraw/zinc/21/03/63/1059210363.db2.gz QZMLUJNHSNFEPR-HXUWFJFHSA-N 2 1 312.501 4.496 20 0 DIADMP Cc1cccc(C[N@H+]([C@H]2CC[C@@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001246974839 1059215426 /nfs/dbraw/zinc/21/54/26/1059215426.db2.gz SGOQUQNNLWTQDP-AFYVEPGGSA-N 2 1 300.490 4.256 20 0 DIADMP Cc1cccc(C[N@H+]([C@H]2CC[C@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001246974844 1059215796 /nfs/dbraw/zinc/21/57/96/1059215796.db2.gz SGOQUQNNLWTQDP-LEAZDLGRSA-N 2 1 300.490 4.256 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001246971528 1059216296 /nfs/dbraw/zinc/21/62/96/1059216296.db2.gz HCOWBNBHOINWIP-TZIWHRDSSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246970886 1059218346 /nfs/dbraw/zinc/21/83/46/1059218346.db2.gz SHFFOHQRTKHSJU-SNRMKQJTSA-N 2 1 318.480 4.129 20 0 DIADMP CCC[N@@H+](C[C@@H]1CC[NH2+]C1)[C@H]1CCC[C@H](c2ccccc2)C1 ZINC001246971963 1059218480 /nfs/dbraw/zinc/21/84/80/1059218480.db2.gz CECCWWYTTAMZET-HOJAQTOUSA-N 2 1 300.490 4.034 20 0 DIADMP CCC(CC)[N@@H+]([C@H](C)c1ccccc1)[C@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246974886 1059218934 /nfs/dbraw/zinc/21/89/34/1059218934.db2.gz SEBHIGQLJVQNFM-PHXBYCTMSA-N 2 1 300.490 4.236 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246974426 1059219384 /nfs/dbraw/zinc/21/93/84/1059219384.db2.gz ALLVMAXWPFJUAQ-PMACEKPBSA-N 2 1 314.517 4.252 20 0 DIADMP c1ccc(CC[C@@H]2CCC[N@H+]([C@H]3C[C@H]4CCC[C@@H](C3)[NH2+]4)C2)cc1 ZINC001246981454 1059222517 /nfs/dbraw/zinc/22/25/17/1059222517.db2.gz WMEQOJVOLLOKPE-UWHLTILDSA-N 2 1 312.501 4.004 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246979174 1059223489 /nfs/dbraw/zinc/22/34/89/1059223489.db2.gz XBSZUZHKASFYJS-NRFANRHFSA-N 2 1 314.517 4.394 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246978866 1059224124 /nfs/dbraw/zinc/22/41/24/1059224124.db2.gz NBFOANZQTREMJM-WOZUAGRISA-N 2 1 314.517 4.393 20 0 DIADMP Fc1cc(F)cc([C@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001247000316 1059226499 /nfs/dbraw/zinc/22/64/99/1059226499.db2.gz HKUSWEKOTXUGLA-QRVBRYPASA-N 2 1 320.427 4.024 20 0 DIADMP C[N@H+]([C@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246998857 1059228021 /nfs/dbraw/zinc/22/80/21/1059228021.db2.gz HDZNYLKDHMLLQE-NRSPTQNISA-N 2 1 306.453 4.099 20 0 DIADMP C[N@@H+]([C@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246998857 1059228041 /nfs/dbraw/zinc/22/80/41/1059228041.db2.gz HDZNYLKDHMLLQE-NRSPTQNISA-N 2 1 306.453 4.099 20 0 DIADMP CC[C@H]1CC([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001247006673 1059234213 /nfs/dbraw/zinc/23/42/13/1059234213.db2.gz XPNJLKGTBGVGOT-JENIJYKNSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@H]1CC([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001247006673 1059234228 /nfs/dbraw/zinc/23/42/28/1059234228.db2.gz XPNJLKGTBGVGOT-JENIJYKNSA-N 2 1 322.443 4.411 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001247005237 1059235384 /nfs/dbraw/zinc/23/53/84/1059235384.db2.gz VJKYXEAJCUMUNM-KVZIAJEVSA-N 2 1 320.908 4.427 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006383 1059236017 /nfs/dbraw/zinc/23/60/17/1059236017.db2.gz WRRQLNHKFVGAIX-ZESCBINXSA-N 2 1 318.480 4.438 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006383 1059236034 /nfs/dbraw/zinc/23/60/34/1059236034.db2.gz WRRQLNHKFVGAIX-ZESCBINXSA-N 2 1 318.480 4.438 20 0 DIADMP CCCCCC[C@@H](C)[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001247012317 1059242476 /nfs/dbraw/zinc/24/24/76/1059242476.db2.gz VRYKMRHOVWOQAK-QGZVFWFLSA-N 2 1 300.490 4.440 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247015285 1059243445 /nfs/dbraw/zinc/24/34/45/1059243445.db2.gz OBIBUYOZVYAWOR-AEFFLSMTSA-N 2 1 300.490 4.296 20 0 DIADMP Clc1ccc(/C=C/C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547493 1059355142 /nfs/dbraw/zinc/35/51/42/1059355142.db2.gz XFRFLVPTIYDFRU-WRFKIARRSA-N 2 1 318.892 4.161 20 0 DIADMP Clc1ccc(/C=C/C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547493 1059355157 /nfs/dbraw/zinc/35/51/57/1059355157.db2.gz XFRFLVPTIYDFRU-WRFKIARRSA-N 2 1 318.892 4.161 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[N@H+](CC)CCCn1cc[nH+]c1C ZINC001559560379 1059380444 /nfs/dbraw/zinc/38/04/44/1059380444.db2.gz KFYOOGRHJPNQNL-HXUWFJFHSA-N 2 1 313.489 4.233 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)CCCn1cc[nH+]c1C ZINC001559560379 1059380461 /nfs/dbraw/zinc/38/04/61/1059380461.db2.gz KFYOOGRHJPNQNL-HXUWFJFHSA-N 2 1 313.489 4.233 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2F)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573239 1059404020 /nfs/dbraw/zinc/40/40/20/1059404020.db2.gz ADPAISJPGJESIU-VQIMIIECSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573239 1059404024 /nfs/dbraw/zinc/40/40/24/1059404024.db2.gz ADPAISJPGJESIU-VQIMIIECSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573236 1059404980 /nfs/dbraw/zinc/40/49/80/1059404980.db2.gz ADPAISJPGJESIU-APWZRJJASA-N 2 1 304.453 4.085 20 0 DIADMP C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573236 1059404997 /nfs/dbraw/zinc/40/49/97/1059404997.db2.gz ADPAISJPGJESIU-APWZRJJASA-N 2 1 304.453 4.085 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC001559584262 1059414201 /nfs/dbraw/zinc/41/42/01/1059414201.db2.gz GTZHKZWJPCZCEG-KBAYOESNSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC001559584262 1059414207 /nfs/dbraw/zinc/41/42/07/1059414207.db2.gz GTZHKZWJPCZCEG-KBAYOESNSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC001559584262 1059414217 /nfs/dbraw/zinc/41/42/17/1059414217.db2.gz GTZHKZWJPCZCEG-KBAYOESNSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC001559584262 1059414223 /nfs/dbraw/zinc/41/42/23/1059414223.db2.gz GTZHKZWJPCZCEG-KBAYOESNSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC001559584262 1059414230 /nfs/dbraw/zinc/41/42/30/1059414230.db2.gz GTZHKZWJPCZCEG-KBAYOESNSA-N 2 1 320.546 4.138 20 0 DIADMP CC[C@@H]1C[C@H]1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594329 1059426837 /nfs/dbraw/zinc/42/68/37/1059426837.db2.gz MZVBUROPSTWRHI-MXEMCNAFSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594329 1059426843 /nfs/dbraw/zinc/42/68/43/1059426843.db2.gz MZVBUROPSTWRHI-MXEMCNAFSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594329 1059426857 /nfs/dbraw/zinc/42/68/57/1059426857.db2.gz MZVBUROPSTWRHI-MXEMCNAFSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594326 1059427231 /nfs/dbraw/zinc/42/72/31/1059427231.db2.gz MZVBUROPSTWRHI-ANULTFPQSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594326 1059427241 /nfs/dbraw/zinc/42/72/41/1059427241.db2.gz MZVBUROPSTWRHI-ANULTFPQSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594326 1059427249 /nfs/dbraw/zinc/42/72/49/1059427249.db2.gz MZVBUROPSTWRHI-ANULTFPQSA-N 2 1 312.501 4.019 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC001559594115 1059428349 /nfs/dbraw/zinc/42/83/49/1059428349.db2.gz JKNMWNGOGKIIGM-DENIHFKCSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC001559594115 1059428368 /nfs/dbraw/zinc/42/83/68/1059428368.db2.gz JKNMWNGOGKIIGM-DENIHFKCSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC001559594115 1059428374 /nfs/dbraw/zinc/42/83/74/1059428374.db2.gz JKNMWNGOGKIIGM-DENIHFKCSA-N 2 1 322.496 4.318 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CCC4CCC4)CC[C@H]32)cc1 ZINC001559594555 1059429826 /nfs/dbraw/zinc/42/98/26/1059429826.db2.gz QWSWEJJBQHCTPL-NHCUHLMSSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CCC4CCC4)CC[C@H]32)cc1 ZINC001559594555 1059429839 /nfs/dbraw/zinc/42/98/39/1059429839.db2.gz QWSWEJJBQHCTPL-NHCUHLMSSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CCC4CCC4)CC[C@H]32)cc1 ZINC001559594555 1059429857 /nfs/dbraw/zinc/42/98/57/1059429857.db2.gz QWSWEJJBQHCTPL-NHCUHLMSSA-N 2 1 312.501 4.163 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC23CCC(CC2)C3)CC1)CC1CC1 ZINC001559675539 1059503718 /nfs/dbraw/zinc/50/37/18/1059503718.db2.gz LAYSPFJTVJOLAV-UHFFFAOYSA-N 2 1 318.549 4.401 20 0 DIADMP CCC[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)C1CC1 ZINC001559677376 1059504881 /nfs/dbraw/zinc/50/48/81/1059504881.db2.gz FMOUYTLHCVPLOU-UHFFFAOYSA-N 2 1 314.517 4.206 20 0 DIADMP C[N@@H+](CCCC(C)(C)C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001559711648 1059539012 /nfs/dbraw/zinc/53/90/12/1059539012.db2.gz PFFQZWKPXLAQDR-UHFFFAOYSA-N 2 1 317.521 4.446 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001559726516 1059558898 /nfs/dbraw/zinc/55/88/98/1059558898.db2.gz SNMOUYZFIISWCY-CTAFRAEOSA-N 2 1 316.533 4.415 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C1CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737910 1059568943 /nfs/dbraw/zinc/56/89/43/1059568943.db2.gz QIPNTJZMFKXSPG-QFBILLFUSA-N 2 1 312.501 4.307 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C1CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737909 1059571815 /nfs/dbraw/zinc/57/18/15/1059571815.db2.gz QIPNTJZMFKXSPG-LPHOPBHVSA-N 2 1 312.501 4.307 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH2+]C(C)(C)C[NH+]2CCCC2)c1 ZINC001559917579 1059731995 /nfs/dbraw/zinc/73/19/95/1059731995.db2.gz ISZVGRFAGRSGNF-UHFFFAOYSA-N 2 1 310.485 4.421 20 0 DIADMP Cc1ccc(C[N@@H+](CCC[NH+]2CCCCC2)C(C)(C)C)cc1 ZINC001560018149 1059831665 /nfs/dbraw/zinc/83/16/65/1059831665.db2.gz HERNULMJUIXCGJ-UHFFFAOYSA-N 2 1 302.506 4.472 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001560043366 1059854832 /nfs/dbraw/zinc/85/48/32/1059854832.db2.gz WZODPSHMDBSQCQ-HSALFYBXSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001560068677 1059882376 /nfs/dbraw/zinc/88/23/76/1059882376.db2.gz FUOVLNGUHFHKGC-XLIONFOSSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001560068677 1059882403 /nfs/dbraw/zinc/88/24/03/1059882403.db2.gz FUOVLNGUHFHKGC-XLIONFOSSA-N 2 1 318.480 4.473 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)[C@@H]1CCc2ccc(F)cc21 ZINC001560100376 1059907502 /nfs/dbraw/zinc/90/75/02/1059907502.db2.gz JXWODTNTNXSCDB-LJQANCHMSA-N 2 1 304.453 4.011 20 0 DIADMP C[C@H]1CC(CC[N@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)C[C@H](C)C1 ZINC001560109183 1059914416 /nfs/dbraw/zinc/91/44/16/1059914416.db2.gz VQZBYKQQUQNVBT-KURKYZTESA-N 2 1 315.505 4.055 20 0 DIADMP Cc1cccc([C@H](C)[NH+]2CCC(C)([NH+]3CCCCC3)CC2)c1 ZINC001560126253 1059928896 /nfs/dbraw/zinc/92/88/96/1059928896.db2.gz DQOSKZSFJGKWKG-SFHVURJKSA-N 2 1 300.490 4.396 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC(C)(C)[C@@H](c2ccccc2)C1 ZINC001560181251 1059969234 /nfs/dbraw/zinc/96/92/34/1059969234.db2.gz MKSRGCJYTIFXKD-LJQANCHMSA-N 2 1 302.506 4.234 20 0 DIADMP Cc1cc2cc(C[NH2+]CCC[NH+]3CCC(C)CC3)oc2cc1C ZINC001560251419 1060018919 /nfs/dbraw/zinc/01/89/19/1060018919.db2.gz PTMZWKVOBGSZRY-UHFFFAOYSA-N 2 1 314.473 4.261 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccccc2C2CC2)C1 ZINC001560269871 1060043691 /nfs/dbraw/zinc/04/36/91/1060043691.db2.gz WSIMYHIBSQCUCT-CALCHBBNSA-N 2 1 300.490 4.022 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560270416 1060046620 /nfs/dbraw/zinc/04/66/20/1060046620.db2.gz SSJYSAZUQFNVJM-AQNXPRMDSA-N 2 1 316.533 4.213 20 0 DIADMP Cc1cc2cc(C[NH2+]C[C@@H](C)C[NH+]3CCCCC3)oc2cc1C ZINC001560282978 1060059878 /nfs/dbraw/zinc/05/98/78/1060059878.db2.gz QATSCXANPJTYBH-OAHLLOKOSA-N 2 1 314.473 4.261 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+]C[C@H](CC)c1ccccc1 ZINC001560320746 1060106339 /nfs/dbraw/zinc/10/63/39/1060106339.db2.gz NAYIDYXDJUFQHJ-ICSRJNTNSA-N 2 1 302.506 4.424 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+]C[C@H](CC)c1ccccc1 ZINC001560320746 1060106354 /nfs/dbraw/zinc/10/63/54/1060106354.db2.gz NAYIDYXDJUFQHJ-ICSRJNTNSA-N 2 1 302.506 4.424 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CC[N@@H+](CC3CCCC3)C2)CC(C)(C)C1 ZINC001560360049 1060146437 /nfs/dbraw/zinc/14/64/37/1060146437.db2.gz AEYCUCJJSMGQDE-QGZVFWFLSA-N 2 1 306.538 4.445 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CC[N@H+](CC3CCCC3)C2)CC(C)(C)C1 ZINC001560360049 1060146427 /nfs/dbraw/zinc/14/64/27/1060146427.db2.gz AEYCUCJJSMGQDE-QGZVFWFLSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1cccc(OC(C)(C)C)c1)C(C)C ZINC001560366762 1060152769 /nfs/dbraw/zinc/15/27/69/1060152769.db2.gz OWQGTTXHDPJRFS-UHFFFAOYSA-N 2 1 320.521 4.462 20 0 DIADMP CC1CCC(C)(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001560461181 1060252429 /nfs/dbraw/zinc/25/24/29/1060252429.db2.gz KGQYOOBFGNDYBY-UHFFFAOYSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1)C[C@H]1CCC[NH2+]C1 ZINC000469883338 1060259552 /nfs/dbraw/zinc/25/95/52/1060259552.db2.gz XHSUXWGADWFIBZ-ICSRJNTNSA-N 2 1 308.469 4.249 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc3oc4ccccc4c3c2)C1 ZINC001560500628 1060296194 /nfs/dbraw/zinc/29/61/94/1060296194.db2.gz WTOBZKRFQPTFEW-INIZCTEOSA-N 2 1 322.452 4.408 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1ccc2cc[nH]c2c1)C1CCCCC1 ZINC001560524394 1060323647 /nfs/dbraw/zinc/32/36/47/1060323647.db2.gz JTODYGYOSPTEEW-UHFFFAOYSA-N 2 1 313.489 4.302 20 0 DIADMP Fc1ccccc1CN1CCC[C@@]2(CC[N@H+](C3CCCC3)C2)C1 ZINC001278524259 1060344868 /nfs/dbraw/zinc/34/48/68/1060344868.db2.gz AXOBYCVCXSJCRP-HXUWFJFHSA-N 2 1 316.464 4.056 20 0 DIADMP CC1(C)C[C@@]1(C)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572894 1060383868 /nfs/dbraw/zinc/38/38/68/1060383868.db2.gz HOYZAFSASFWSAJ-ICSRJNTNSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[C@@]1(C)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572894 1060383883 /nfs/dbraw/zinc/38/38/83/1060383883.db2.gz HOYZAFSASFWSAJ-ICSRJNTNSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[C@@]1(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572895 1060384713 /nfs/dbraw/zinc/38/47/13/1060384713.db2.gz HOYZAFSASFWSAJ-QUCCMNQESA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[C@@]1(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572895 1060384718 /nfs/dbraw/zinc/38/47/18/1060384718.db2.gz HOYZAFSASFWSAJ-QUCCMNQESA-N 2 1 312.501 4.209 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)CC1 ZINC001560632907 1060445483 /nfs/dbraw/zinc/44/54/83/1060445483.db2.gz ZZIXWLFORKFRLF-NHCUHLMSSA-N 2 1 314.517 4.295 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC001560640482 1060459924 /nfs/dbraw/zinc/45/99/24/1060459924.db2.gz RCPLMDNTDTXPCE-XSNSTOHYSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC001560640482 1060459931 /nfs/dbraw/zinc/45/99/31/1060459931.db2.gz RCPLMDNTDTXPCE-XSNSTOHYSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC001560640482 1060459937 /nfs/dbraw/zinc/45/99/37/1060459937.db2.gz RCPLMDNTDTXPCE-XSNSTOHYSA-N 2 1 318.549 4.398 20 0 DIADMP CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560644096 1060464034 /nfs/dbraw/zinc/46/40/34/1060464034.db2.gz HTCKFMRCHZILTO-CGXNFDGLSA-N 2 1 312.501 4.055 20 0 DIADMP CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CC2CC[NH+](CC)CC2)o1 ZINC001560647248 1060469418 /nfs/dbraw/zinc/46/94/18/1060469418.db2.gz SXCAXAYZXXNQDE-VQIMIIECSA-N 2 1 318.505 4.347 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC001560653561 1060476421 /nfs/dbraw/zinc/47/64/21/1060476421.db2.gz WKMRQFXKAMIWGV-IBGZPJMESA-N 2 1 322.496 4.436 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC001560653561 1060476434 /nfs/dbraw/zinc/47/64/34/1060476434.db2.gz WKMRQFXKAMIWGV-IBGZPJMESA-N 2 1 322.496 4.436 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC001560653561 1060476444 /nfs/dbraw/zinc/47/64/44/1060476444.db2.gz WKMRQFXKAMIWGV-IBGZPJMESA-N 2 1 322.496 4.436 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001560704052 1060561757 /nfs/dbraw/zinc/56/17/57/1060561757.db2.gz WFPCYNMBBPOMEU-BVJIBDCISA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@H](C[N@@H+](CC)CC1CC[NH+](CC)CC1)c1ccccc1 ZINC001560771647 1060636574 /nfs/dbraw/zinc/63/65/74/1060636574.db2.gz BYVXPLRJWLGLEP-LJQANCHMSA-N 2 1 302.506 4.234 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@H]1Cc1ccc(Cl)cc1 ZINC001560803612 1060663391 /nfs/dbraw/zinc/66/33/91/1060663391.db2.gz BBVUXKAHZUTXLL-HHXXYDBFSA-N 2 1 322.924 4.371 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C=C/c1cccc(F)c1 ZINC001560812407 1060671239 /nfs/dbraw/zinc/67/12/39/1060671239.db2.gz RBPDYLVLFCPBEE-VMPITWQZSA-N 2 1 315.436 4.010 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C=C/c1cccc(F)c1 ZINC001560812407 1060671248 /nfs/dbraw/zinc/67/12/48/1060671248.db2.gz RBPDYLVLFCPBEE-VMPITWQZSA-N 2 1 315.436 4.010 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@](C)(c3ccccc3)CC2)CC1 ZINC001560825209 1060685033 /nfs/dbraw/zinc/68/50/33/1060685033.db2.gz FSLIMLGSKWWHLE-OAQYLSRUSA-N 2 1 314.517 4.162 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001560834676 1060691290 /nfs/dbraw/zinc/69/12/90/1060691290.db2.gz ABZGNDVBJQZUTA-IZZBFERCSA-N 2 1 312.501 4.236 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001560834676 1060691295 /nfs/dbraw/zinc/69/12/95/1060691295.db2.gz ABZGNDVBJQZUTA-IZZBFERCSA-N 2 1 312.501 4.236 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC001560869581 1060731150 /nfs/dbraw/zinc/73/11/50/1060731150.db2.gz LCMLLZUWCUTYSK-ROUUACIJSA-N 2 1 304.522 4.453 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC001560869581 1060731165 /nfs/dbraw/zinc/73/11/65/1060731165.db2.gz LCMLLZUWCUTYSK-ROUUACIJSA-N 2 1 304.522 4.453 20 0 DIADMP CC(C)CCC[C@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560900541 1060762793 /nfs/dbraw/zinc/76/27/93/1060762793.db2.gz DVUAWHMRUXDWRU-SXLOBPIMSA-N 2 1 302.506 4.136 20 0 DIADMP C[C@H]1CCC(C)(C)C[C@@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901255 1060765010 /nfs/dbraw/zinc/76/50/10/1060765010.db2.gz OMTRDJHCEPGJRW-RNQOJCNYSA-N 2 1 314.517 4.136 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CCC(C)C)CC1)c1ccccc1F ZINC001560914192 1060773550 /nfs/dbraw/zinc/77/35/50/1060773550.db2.gz CLENBHZTHMVZLY-IBGZPJMESA-N 2 1 306.469 4.377 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001560916584 1060776034 /nfs/dbraw/zinc/77/60/34/1060776034.db2.gz RFCWJMHYOUEHFO-AWEZNQCLSA-N 2 1 316.942 4.290 20 0 DIADMP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1C[C@@H](C)c1cccc(Cl)c1 ZINC001560948292 1060812411 /nfs/dbraw/zinc/81/24/11/1060812411.db2.gz SSHSTDNUBPMAMZ-MDZRGWNJSA-N 2 1 322.924 4.496 20 0 DIADMP C([NH2+][C@H]1CCC[C@@H](C2CC2)C1)[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001560973522 1060837532 /nfs/dbraw/zinc/83/75/32/1060837532.db2.gz WSWTUDMNDWSASX-WSTZPKSXSA-N 2 1 304.522 4.342 20 0 DIADMP C([NH2+][C@H]1CCC[C@@H](C2CC2)C1)[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001560973522 1060837537 /nfs/dbraw/zinc/83/75/37/1060837537.db2.gz WSWTUDMNDWSASX-WSTZPKSXSA-N 2 1 304.522 4.342 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972960 1060838419 /nfs/dbraw/zinc/83/84/19/1060838419.db2.gz DOWCHRWFLZFXIF-JXFKEZNVSA-N 2 1 318.480 4.316 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972960 1060838424 /nfs/dbraw/zinc/83/84/24/1060838424.db2.gz DOWCHRWFLZFXIF-JXFKEZNVSA-N 2 1 318.480 4.316 20 0 DIADMP Cc1ccccc1C[N@@H+]1C[C@@H]2CC[NH+](C3CCCC3)CC[C@@H]2C1 ZINC001278574052 1060851122 /nfs/dbraw/zinc/85/11/22/1060851122.db2.gz MRZYYQWDHXXTKC-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP Cc1ccccc1C[NH+]1C[C@@H]2CC[N@H+](C3CCCC3)CC[C@@H]2C1 ZINC001278574052 1060851146 /nfs/dbraw/zinc/85/11/46/1060851146.db2.gz MRZYYQWDHXXTKC-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP Cc1ccccc1C[NH+]1C[C@@H]2CC[N@@H+](C3CCCC3)CC[C@@H]2C1 ZINC001278574052 1060851160 /nfs/dbraw/zinc/85/11/60/1060851160.db2.gz MRZYYQWDHXXTKC-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP CC[C@H](C)C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473204016 1060970037 /nfs/dbraw/zinc/97/00/37/1060970037.db2.gz WYKLMEUGDTVMLG-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473204016 1060970058 /nfs/dbraw/zinc/97/00/58/1060970058.db2.gz WYKLMEUGDTVMLG-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473204016 1060970083 /nfs/dbraw/zinc/97/00/83/1060970083.db2.gz WYKLMEUGDTVMLG-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[C@@H](C)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203072 1060970707 /nfs/dbraw/zinc/97/07/07/1060970707.db2.gz HMWPDPBYYRPDQZ-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203072 1060970735 /nfs/dbraw/zinc/97/07/35/1060970735.db2.gz HMWPDPBYYRPDQZ-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203072 1060970762 /nfs/dbraw/zinc/97/07/62/1060970762.db2.gz HMWPDPBYYRPDQZ-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203072 1060970789 /nfs/dbraw/zinc/97/07/89/1060970789.db2.gz HMWPDPBYYRPDQZ-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213107 1060987031 /nfs/dbraw/zinc/98/70/31/1060987031.db2.gz QWXUADBTTKCHCH-LJQANCHMSA-N 2 1 314.517 4.148 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213107 1060987055 /nfs/dbraw/zinc/98/70/55/1060987055.db2.gz QWXUADBTTKCHCH-LJQANCHMSA-N 2 1 314.517 4.148 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213107 1060987073 /nfs/dbraw/zinc/98/70/73/1060987073.db2.gz QWXUADBTTKCHCH-LJQANCHMSA-N 2 1 314.517 4.148 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213107 1060987091 /nfs/dbraw/zinc/98/70/91/1060987091.db2.gz QWXUADBTTKCHCH-LJQANCHMSA-N 2 1 314.517 4.148 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC001473219443 1060996308 /nfs/dbraw/zinc/99/63/08/1060996308.db2.gz HHFFIBDZTBYHTG-PWIZWCRZSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC001473219443 1060996320 /nfs/dbraw/zinc/99/63/20/1060996320.db2.gz HHFFIBDZTBYHTG-PWIZWCRZSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC001473219443 1060996332 /nfs/dbraw/zinc/99/63/32/1060996332.db2.gz HHFFIBDZTBYHTG-PWIZWCRZSA-N 2 1 300.490 4.287 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001473229628 1061008327 /nfs/dbraw/zinc/00/83/27/1061008327.db2.gz CPYGJXRHOSKXNZ-UXHICEINSA-N 2 1 300.490 4.120 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462215795 1061033117 /nfs/dbraw/zinc/03/31/17/1061033117.db2.gz BPJAJHWCEALMOF-XUVXKRRUSA-N 2 1 300.490 4.095 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462215795 1061033127 /nfs/dbraw/zinc/03/31/27/1061033127.db2.gz BPJAJHWCEALMOF-XUVXKRRUSA-N 2 1 300.490 4.095 20 0 DIADMP CC(C)SCC[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462222890 1061039009 /nfs/dbraw/zinc/03/90/09/1061039009.db2.gz XJMWQQQFTJYUAN-PKOBYXMFSA-N 2 1 318.530 4.086 20 0 DIADMP CC(C)SCC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462222890 1061039021 /nfs/dbraw/zinc/03/90/21/1061039021.db2.gz XJMWQQQFTJYUAN-PKOBYXMFSA-N 2 1 318.530 4.086 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280348 1061074268 /nfs/dbraw/zinc/07/42/68/1061074268.db2.gz ROHZOOIHXXQFOZ-JLJPHGGASA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280348 1061074280 /nfs/dbraw/zinc/07/42/80/1061074280.db2.gz ROHZOOIHXXQFOZ-JLJPHGGASA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c2ccsc2S1 ZINC001462280348 1061074291 /nfs/dbraw/zinc/07/42/91/1061074291.db2.gz ROHZOOIHXXQFOZ-JLJPHGGASA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c2ccsc2S1 ZINC001462280348 1061074302 /nfs/dbraw/zinc/07/43/02/1061074302.db2.gz ROHZOOIHXXQFOZ-JLJPHGGASA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280361 1061074610 /nfs/dbraw/zinc/07/46/10/1061074610.db2.gz ROHZOOIHXXQFOZ-YSVLISHTSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280361 1061074623 /nfs/dbraw/zinc/07/46/23/1061074623.db2.gz ROHZOOIHXXQFOZ-YSVLISHTSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c2ccsc2S1 ZINC001462280361 1061074636 /nfs/dbraw/zinc/07/46/36/1061074636.db2.gz ROHZOOIHXXQFOZ-YSVLISHTSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c2ccsc2S1 ZINC001462280361 1061074654 /nfs/dbraw/zinc/07/46/54/1061074654.db2.gz ROHZOOIHXXQFOZ-YSVLISHTSA-N 2 1 322.543 4.091 20 0 DIADMP CCC[NH+](CCC)c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001462397821 1061148351 /nfs/dbraw/zinc/14/83/51/1061148351.db2.gz BVYGUSKZHFMMEF-CTXDPNEZSA-N 2 1 315.505 4.350 20 0 DIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1ccc(C2CCCC2)cc1 ZINC001473425333 1061154719 /nfs/dbraw/zinc/15/47/19/1061154719.db2.gz HRAIYKGUQRPVSA-UHFFFAOYSA-N 2 1 300.490 4.262 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(C2CCCC2)cc1 ZINC001473425333 1061154732 /nfs/dbraw/zinc/15/47/32/1061154732.db2.gz HRAIYKGUQRPVSA-UHFFFAOYSA-N 2 1 300.490 4.262 20 0 DIADMP CCC(C)(C)[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001462430426 1061169741 /nfs/dbraw/zinc/16/97/41/1061169741.db2.gz TVPDLXZQWUAYCK-AOIWGVFYSA-N 2 1 302.506 4.311 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)C1 ZINC001462437871 1061174143 /nfs/dbraw/zinc/17/41/43/1061174143.db2.gz NMFAYMAKYXCDQD-SUMDDJOVSA-N 2 1 320.908 4.298 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC001473501640 1061196705 /nfs/dbraw/zinc/19/67/05/1061196705.db2.gz LTIODYWTKQIUJX-JOCHJYFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC001473501640 1061196715 /nfs/dbraw/zinc/19/67/15/1061196715.db2.gz LTIODYWTKQIUJX-JOCHJYFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC001473501640 1061196729 /nfs/dbraw/zinc/19/67/29/1061196729.db2.gz LTIODYWTKQIUJX-JOCHJYFZSA-N 2 1 322.496 4.320 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC001462484422 1061205806 /nfs/dbraw/zinc/20/58/06/1061205806.db2.gz XBEDDEKBVUCDLN-RTWAWAEBSA-N 2 1 324.512 4.377 20 0 DIADMP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001462521220 1061228229 /nfs/dbraw/zinc/22/82/29/1061228229.db2.gz YVFKQLKGRMKOMC-QFBILLFUSA-N 2 1 320.546 4.456 20 0 DIADMP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001462521220 1061228252 /nfs/dbraw/zinc/22/82/52/1061228252.db2.gz YVFKQLKGRMKOMC-QFBILLFUSA-N 2 1 320.546 4.456 20 0 DIADMP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001462521217 1061228381 /nfs/dbraw/zinc/22/83/81/1061228381.db2.gz YVFKQLKGRMKOMC-LPHOPBHVSA-N 2 1 320.546 4.456 20 0 DIADMP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001462521217 1061228395 /nfs/dbraw/zinc/22/83/95/1061228395.db2.gz YVFKQLKGRMKOMC-LPHOPBHVSA-N 2 1 320.546 4.456 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@@H](CC[NH+](C)C)c1cccnc1 ZINC001462587150 1061278396 /nfs/dbraw/zinc/27/83/96/1061278396.db2.gz FNDSTBMQNRDZTC-SCTDSRPQSA-N 2 1 305.510 4.125 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC001473665598 1061329584 /nfs/dbraw/zinc/32/95/84/1061329584.db2.gz CFTRXEVWZGHKKR-UHFFFAOYSA-N 2 1 317.304 4.246 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC001473665598 1061329603 /nfs/dbraw/zinc/32/96/03/1061329603.db2.gz CFTRXEVWZGHKKR-UHFFFAOYSA-N 2 1 317.304 4.246 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@H](C)[C@@H]1CC1(F)F)c1ccccc1 ZINC001462673056 1061331622 /nfs/dbraw/zinc/33/16/22/1061331622.db2.gz HTLQQRWDCHUDSD-PVAVHDDUSA-N 2 1 310.432 4.093 20 0 DIADMP CCCC[N@@H+](CCC1CCOCC1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001473683126 1061339941 /nfs/dbraw/zinc/33/99/41/1061339941.db2.gz JSFCFCDTFUKAPQ-UHFFFAOYSA-N 2 1 324.553 4.214 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)CC1CC2(CCC2)C1 ZINC001473691540 1061348750 /nfs/dbraw/zinc/34/87/50/1061348750.db2.gz XAAWKRYRCGUQCY-UHFFFAOYSA-N 2 1 300.490 4.150 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC001473689954 1061352197 /nfs/dbraw/zinc/35/21/97/1061352197.db2.gz SWUKMZKCIFFIJA-ORYQWCPZSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001473689954 1061352213 /nfs/dbraw/zinc/35/22/13/1061352213.db2.gz SWUKMZKCIFFIJA-ORYQWCPZSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001473689954 1061352233 /nfs/dbraw/zinc/35/22/33/1061352233.db2.gz SWUKMZKCIFFIJA-ORYQWCPZSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1C[C@@]2(C)C[N@H+](C)C[C@@]2(C)C1 ZINC001473689954 1061352250 /nfs/dbraw/zinc/35/22/50/1061352250.db2.gz SWUKMZKCIFFIJA-ORYQWCPZSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1C[C@@]2(C)C[N@@H+](C)C[C@@]2(C)C1 ZINC001473689954 1061352269 /nfs/dbraw/zinc/35/22/69/1061352269.db2.gz SWUKMZKCIFFIJA-ORYQWCPZSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1C[C@@]2(C)C[NH+](C)C[C@]2(C)C1 ZINC001473689953 1061352420 /nfs/dbraw/zinc/35/24/20/1061352420.db2.gz SWUKMZKCIFFIJA-MAODMQOUSA-N 2 1 308.469 4.174 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2)CC1 ZINC001473717682 1061367690 /nfs/dbraw/zinc/36/76/90/1061367690.db2.gz ZIQYQXWNQRSXPO-LJQANCHMSA-N 2 1 320.908 4.426 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2Cc2ccc(Cl)cc2)CC1 ZINC001473717682 1061367705 /nfs/dbraw/zinc/36/77/05/1061367705.db2.gz ZIQYQXWNQRSXPO-LJQANCHMSA-N 2 1 320.908 4.426 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C(C)(C)C1 ZINC001473756716 1061393875 /nfs/dbraw/zinc/39/38/75/1061393875.db2.gz HWRRZDVCMIZXCZ-KRWDZBQOSA-N 2 1 300.490 4.293 20 0 DIADMP CC[C@H](C[NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC001473917635 1061465721 /nfs/dbraw/zinc/46/57/21/1061465721.db2.gz JQBLNAFRHREWFO-HXUWFJFHSA-N 2 1 310.485 4.292 20 0 DIADMP CCCCOc1ccccc1C[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC001473925206 1061472379 /nfs/dbraw/zinc/47/23/79/1061472379.db2.gz WFRFAVHBOSBEEF-UHFFFAOYSA-N 2 1 318.505 4.076 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC001473933778 1061479217 /nfs/dbraw/zinc/47/92/17/1061479217.db2.gz QPBYCCUOQGAQNY-WIRSXHRWSA-N 2 1 314.517 4.443 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC001473957224 1061499248 /nfs/dbraw/zinc/49/92/48/1061499248.db2.gz MZHMHMOZAJPPTJ-NRSPTQNISA-N 2 1 314.517 4.424 20 0 DIADMP CC(C)[C@@H](C[NH2+]CC[N@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962670 1061504901 /nfs/dbraw/zinc/50/49/01/1061504901.db2.gz QGUAFYACBMYPLO-HXUWFJFHSA-N 2 1 302.506 4.280 20 0 DIADMP CC(C)[C@@H](C[NH2+]CC[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962670 1061504916 /nfs/dbraw/zinc/50/49/16/1061504916.db2.gz QGUAFYACBMYPLO-HXUWFJFHSA-N 2 1 302.506 4.280 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)CC1(C)C ZINC001473969400 1061511528 /nfs/dbraw/zinc/51/15/28/1061511528.db2.gz UGLOLDCEBBMIKT-IRXDYDNUSA-N 2 1 306.469 4.375 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+]2CC2CCCCC2)C1 ZINC001473980700 1061524159 /nfs/dbraw/zinc/52/41/59/1061524159.db2.gz YQFORXNCYSADNN-IPMKNSEASA-N 2 1 324.578 4.295 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001474027220 1061566585 /nfs/dbraw/zinc/56/65/85/1061566585.db2.gz CQGSXEBVGUBJRP-CABCVRRESA-N 2 1 316.420 4.048 20 0 DIADMP Cc1cc(F)ccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC001474033572 1061577906 /nfs/dbraw/zinc/57/79/06/1061577906.db2.gz RUSYFMCCFDVLNL-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(C(F)F)c(F)c1)[NH+]1CCCCC1 ZINC001474109000 1061659315 /nfs/dbraw/zinc/65/93/15/1061659315.db2.gz MUKTXRHDSWPGCQ-ZDUSSCGKSA-N 2 1 314.395 4.117 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH2+]CCCC[N@H+](C)C2CC2)cc1C ZINC001474170097 1061714861 /nfs/dbraw/zinc/71/48/61/1061714861.db2.gz GYVUIUULVWOAML-BQYQJAHWSA-N 2 1 300.490 4.089 20 0 DIADMP CC[N@@H+](CCCNCc1cc(C)ccc1F)C1CCCCC1 ZINC001474200891 1061754183 /nfs/dbraw/zinc/75/41/83/1061754183.db2.gz JGQIOYXCKJVUOK-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270089 1061838032 /nfs/dbraw/zinc/83/80/32/1061838032.db2.gz SGCIAVSTXMXBGT-MJGOQNOKSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270089 1061838047 /nfs/dbraw/zinc/83/80/47/1061838047.db2.gz SGCIAVSTXMXBGT-MJGOQNOKSA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)CCC1 ZINC001474294780 1061864994 /nfs/dbraw/zinc/86/49/94/1061864994.db2.gz UHOAIWYVILXAAE-HSALFYBXSA-N 2 1 312.501 4.067 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+]CC1(OC)CCCC1)c1ccccc1 ZINC001474300157 1061869250 /nfs/dbraw/zinc/86/92/50/1061869250.db2.gz DTAVPUAAZOOQSU-IBGZPJMESA-N 2 1 318.505 4.008 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC001474304316 1061874211 /nfs/dbraw/zinc/87/42/11/1061874211.db2.gz OGWCVPPBAFNABI-INIZCTEOSA-N 2 1 300.446 4.157 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001474314231 1061888511 /nfs/dbraw/zinc/88/85/11/1061888511.db2.gz KHERKUQAKUHYBF-KRWDZBQOSA-N 2 1 320.908 4.265 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001474314231 1061888526 /nfs/dbraw/zinc/88/85/26/1061888526.db2.gz KHERKUQAKUHYBF-KRWDZBQOSA-N 2 1 320.908 4.265 20 0 DIADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](C[C@@H](C)CC2CCCCC2)C1 ZINC001474348450 1061958542 /nfs/dbraw/zinc/95/85/42/1061958542.db2.gz IKAHSKNJBDUVJR-ICSRJNTNSA-N 2 1 324.553 4.026 20 0 DIADMP CCCc1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC001474359650 1061981862 /nfs/dbraw/zinc/98/18/62/1061981862.db2.gz AXLJKZUJXPNEAM-HXUWFJFHSA-N 2 1 300.490 4.089 20 0 DIADMP C[C@H]1CC[N@@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001474380724 1062022879 /nfs/dbraw/zinc/02/28/79/1062022879.db2.gz AALLARJSTYTKJT-GHTZIAJQSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001474380724 1062022883 /nfs/dbraw/zinc/02/28/83/1062022883.db2.gz AALLARJSTYTKJT-GHTZIAJQSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001474380724 1062022903 /nfs/dbraw/zinc/02/29/03/1062022903.db2.gz AALLARJSTYTKJT-GHTZIAJQSA-N 2 1 314.517 4.267 20 0 DIADMP c1ccc(C[N@H+]2C[C@H]3CC[NH+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254449368 1062110702 /nfs/dbraw/zinc/11/07/02/1062110702.db2.gz MMWYWRYJKWQUBS-UXHICEINSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3CC[N@@H+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254449368 1062110703 /nfs/dbraw/zinc/11/07/03/1062110703.db2.gz MMWYWRYJKWQUBS-UXHICEINSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3CC[N@H+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254449368 1062110707 /nfs/dbraw/zinc/11/07/07/1062110707.db2.gz MMWYWRYJKWQUBS-UXHICEINSA-N 2 1 324.512 4.163 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)C2CCc3ccccc3CC2)CC1 ZINC001254454352 1062114344 /nfs/dbraw/zinc/11/43/44/1062114344.db2.gz QNQMHTHCXRHQBQ-XGAFWQRZSA-N 2 1 312.501 4.058 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001254486629 1062128687 /nfs/dbraw/zinc/12/86/87/1062128687.db2.gz FITCZHWNGVJUKC-XSDIEEQYSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001254486629 1062128698 /nfs/dbraw/zinc/12/86/98/1062128698.db2.gz FITCZHWNGVJUKC-XSDIEEQYSA-N 2 1 314.517 4.393 20 0 DIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC001459430795 1062141364 /nfs/dbraw/zinc/14/13/64/1062141364.db2.gz YHERAMBAOWBIBU-OAQYLSRUSA-N 2 1 312.501 4.437 20 0 DIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CCC[C@H]1C1CCC1 ZINC001459430790 1062142096 /nfs/dbraw/zinc/14/20/96/1062142096.db2.gz YHERAMBAOWBIBU-NRFANRHFSA-N 2 1 312.501 4.437 20 0 DIADMP C([C@@H]1CC[C@@H]2C[C@@H]2C1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001459442011 1062145505 /nfs/dbraw/zinc/14/55/05/1062145505.db2.gz ZFMMVHCQCVLSMO-WCIQWLHISA-N 2 1 304.522 4.011 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]CC(C)(c2ccccc2)c2ccccc2)CC1 ZINC001254501564 1062145869 /nfs/dbraw/zinc/14/58/69/1062145869.db2.gz VNPVOAPKGQDHDF-OAQYLSRUSA-N 2 1 322.496 4.067 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]CC(C)(c2ccccc2)c2ccccc2)CC1 ZINC001254501562 1062146912 /nfs/dbraw/zinc/14/69/12/1062146912.db2.gz VNPVOAPKGQDHDF-NRFANRHFSA-N 2 1 322.496 4.067 20 0 DIADMP Cc1ccc(C[C@H]([NH2+][C@@H]2CCC[N@H+](C)CC2)c2ccccc2)cc1 ZINC001254510204 1062148885 /nfs/dbraw/zinc/14/88/85/1062148885.db2.gz SWLPZSPPNNQUTM-YADHBBJMSA-N 2 1 322.496 4.353 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001254509966 1062149770 /nfs/dbraw/zinc/14/97/70/1062149770.db2.gz KSVWVYLXWFYKJX-OALUTQOASA-N 2 1 304.453 4.131 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CCC[NH+](C)CC1 ZINC001254529144 1062160298 /nfs/dbraw/zinc/16/02/98/1062160298.db2.gz KILIHRSFDJFWJB-RDJZCZTQSA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@H]1CCC[N@H+](C)CC1 ZINC001254529144 1062160307 /nfs/dbraw/zinc/16/03/07/1062160307.db2.gz KILIHRSFDJFWJB-RDJZCZTQSA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@H]1CCC[N@@H+](C)CC1 ZINC001254529144 1062160316 /nfs/dbraw/zinc/16/03/16/1062160316.db2.gz KILIHRSFDJFWJB-RDJZCZTQSA-N 2 1 304.503 4.030 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001254526717 1062160738 /nfs/dbraw/zinc/16/07/38/1062160738.db2.gz TZBRUKBRPIBEGA-UNMCSNQZSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@H]([N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001254526717 1062160751 /nfs/dbraw/zinc/16/07/51/1062160751.db2.gz TZBRUKBRPIBEGA-UNMCSNQZSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001254526717 1062160760 /nfs/dbraw/zinc/16/07/60/1062160760.db2.gz TZBRUKBRPIBEGA-UNMCSNQZSA-N 2 1 320.480 4.118 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+]2CCC(c3ccccc3Cl)CC2)CC1 ZINC001254530593 1062163660 /nfs/dbraw/zinc/16/36/60/1062163660.db2.gz ZDGJMLPNSKLEGM-MRXNPFEDSA-N 2 1 306.881 4.004 20 0 DIADMP Cc1ccc([C@@H]2CCCC[NH+]2[C@H]2CCC[N@H+](C)CC2)cc1C ZINC001254532374 1062164329 /nfs/dbraw/zinc/16/43/29/1062164329.db2.gz RXLVNWMLOVBGBS-PMACEKPBSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2[C@H]2CCC[NH+](C)CC2)cc1C ZINC001254532374 1062164355 /nfs/dbraw/zinc/16/43/55/1062164355.db2.gz RXLVNWMLOVBGBS-PMACEKPBSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2[C@H]2CCC[NH+](C)CC2)cc1C ZINC001254532374 1062164365 /nfs/dbraw/zinc/16/43/65/1062164365.db2.gz RXLVNWMLOVBGBS-PMACEKPBSA-N 2 1 300.490 4.315 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc2c1CCC2 ZINC001474500876 1062180317 /nfs/dbraw/zinc/18/03/17/1062180317.db2.gz QGRGLZRGMHQLLT-UHFFFAOYSA-N 2 1 322.496 4.259 20 0 DIADMP CC[C@H](C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC001474500732 1062180950 /nfs/dbraw/zinc/18/09/50/1062180950.db2.gz POYXVORJFNTIMW-HXUWFJFHSA-N 2 1 310.485 4.374 20 0 DIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC001459527059 1062185230 /nfs/dbraw/zinc/18/52/30/1062185230.db2.gz RFBKYNCQWFWMFL-SFTDATJTSA-N 2 1 312.501 4.437 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001459552409 1062204488 /nfs/dbraw/zinc/20/44/88/1062204488.db2.gz VKELHOGYPCUCNB-FQEVSTJZSA-N 2 1 300.490 4.293 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](CCSc2ccc(C)c(C)c2)C1 ZINC001459567546 1062214828 /nfs/dbraw/zinc/21/48/28/1062214828.db2.gz FAPCQERNYPUXCC-GOSISDBHSA-N 2 1 320.546 4.059 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCSc2ccc(C)c(C)c2)C1 ZINC001459567546 1062214847 /nfs/dbraw/zinc/21/48/47/1062214847.db2.gz FAPCQERNYPUXCC-GOSISDBHSA-N 2 1 320.546 4.059 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(C)ccc3ccccc32)C[C@@H]1C ZINC001459614641 1062248289 /nfs/dbraw/zinc/24/82/89/1062248289.db2.gz QLYQVRJDTPEIIB-PKOBYXMFSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(C)ccc3ccccc32)C[C@@H]1C ZINC001459614641 1062248309 /nfs/dbraw/zinc/24/83/09/1062248309.db2.gz QLYQVRJDTPEIIB-PKOBYXMFSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(C)ccc3ccccc32)C[C@@H]1C ZINC001459614641 1062248330 /nfs/dbraw/zinc/24/83/30/1062248330.db2.gz QLYQVRJDTPEIIB-PKOBYXMFSA-N 2 1 310.485 4.453 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474559914 1062265890 /nfs/dbraw/zinc/26/58/90/1062265890.db2.gz FUMRCGFUNCSZKI-ZIAGYGMSSA-N 2 1 316.411 4.127 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474559914 1062265910 /nfs/dbraw/zinc/26/59/10/1062265910.db2.gz FUMRCGFUNCSZKI-ZIAGYGMSSA-N 2 1 316.411 4.127 20 0 DIADMP C[C@@H]([N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1)C1(C)CC1 ZINC001459632407 1062267172 /nfs/dbraw/zinc/26/71/72/1062267172.db2.gz YNYOWOHVZBTVBZ-QGZVFWFLSA-N 2 1 300.490 4.293 20 0 DIADMP F[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255122214 1062323507 /nfs/dbraw/zinc/32/35/07/1062323507.db2.gz MWYMWCVOXLVURE-KJFMYELZSA-N 2 1 316.464 4.052 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136148 1062325070 /nfs/dbraw/zinc/32/50/70/1062325070.db2.gz HKEFGAARJJDOSU-UJZAFDIWSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136148 1062325092 /nfs/dbraw/zinc/32/50/92/1062325092.db2.gz HKEFGAARJJDOSU-UJZAFDIWSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136148 1062325115 /nfs/dbraw/zinc/32/51/15/1062325115.db2.gz HKEFGAARJJDOSU-UJZAFDIWSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136148 1062325134 /nfs/dbraw/zinc/32/51/34/1062325134.db2.gz HKEFGAARJJDOSU-UJZAFDIWSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255136974 1062325339 /nfs/dbraw/zinc/32/53/39/1062325339.db2.gz OOZIILOUIUACIM-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255136974 1062325356 /nfs/dbraw/zinc/32/53/56/1062325356.db2.gz OOZIILOUIUACIM-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255136974 1062325378 /nfs/dbraw/zinc/32/53/78/1062325378.db2.gz OOZIILOUIUACIM-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@]1(F)CCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137439 1062325747 /nfs/dbraw/zinc/32/57/47/1062325747.db2.gz RVBHBZSFBCSNFC-YRPNKDGESA-N 2 1 316.464 4.006 20 0 DIADMP C[C@]1(F)CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137439 1062325761 /nfs/dbraw/zinc/32/57/61/1062325761.db2.gz RVBHBZSFBCSNFC-YRPNKDGESA-N 2 1 316.464 4.006 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137439 1062325789 /nfs/dbraw/zinc/32/57/89/1062325789.db2.gz RVBHBZSFBCSNFC-YRPNKDGESA-N 2 1 316.464 4.006 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137439 1062325815 /nfs/dbraw/zinc/32/58/15/1062325815.db2.gz RVBHBZSFBCSNFC-YRPNKDGESA-N 2 1 316.464 4.006 20 0 DIADMP CCC[NH+](CCC)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255137730 1062326644 /nfs/dbraw/zinc/32/66/44/1062326644.db2.gz WQUPLPXECLAFGB-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP F[C@@H]1CCCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137741 1062327119 /nfs/dbraw/zinc/32/71/19/1062327119.db2.gz WRVICBPYVIVBRS-YSTOQKLRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137741 1062327138 /nfs/dbraw/zinc/32/71/38/1062327138.db2.gz WRVICBPYVIVBRS-YSTOQKLRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137741 1062327159 /nfs/dbraw/zinc/32/71/59/1062327159.db2.gz WRVICBPYVIVBRS-YSTOQKLRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137741 1062327180 /nfs/dbraw/zinc/32/71/80/1062327180.db2.gz WRVICBPYVIVBRS-YSTOQKLRSA-N 2 1 316.464 4.006 20 0 DIADMP C[N@@H+](C[C@H]1CC1(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146261 1062332846 /nfs/dbraw/zinc/33/28/46/1062332846.db2.gz FEKVYBGWKGRFQI-YSTOQKLRSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146261 1062332872 /nfs/dbraw/zinc/33/28/72/1062332872.db2.gz FEKVYBGWKGRFQI-YSTOQKLRSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146261 1062332898 /nfs/dbraw/zinc/33/28/98/1062332898.db2.gz FEKVYBGWKGRFQI-YSTOQKLRSA-N 2 1 312.501 4.160 20 0 DIADMP C[N@@H+](CC1CCCC1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146829 1062332997 /nfs/dbraw/zinc/33/29/97/1062332997.db2.gz JZXYDDCXTLZLHE-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCCC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146829 1062333026 /nfs/dbraw/zinc/33/30/26/1062333026.db2.gz JZXYDDCXTLZLHE-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCCC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146829 1062333049 /nfs/dbraw/zinc/33/30/49/1062333049.db2.gz JZXYDDCXTLZLHE-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001255141928 1062333355 /nfs/dbraw/zinc/33/33/55/1062333355.db2.gz ORORQTJRBOWPBJ-MLBCHFTJSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CC[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001255141928 1062333376 /nfs/dbraw/zinc/33/33/76/1062333376.db2.gz ORORQTJRBOWPBJ-MLBCHFTJSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CC[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001255141928 1062333401 /nfs/dbraw/zinc/33/34/01/1062333401.db2.gz ORORQTJRBOWPBJ-MLBCHFTJSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC24CCCC4)C3)cc1 ZINC001255142119 1062336103 /nfs/dbraw/zinc/33/61/03/1062336103.db2.gz PLZUYQWOJLXHAX-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC24CCCC4)C3)cc1 ZINC001255142119 1062336124 /nfs/dbraw/zinc/33/61/24/1062336124.db2.gz PLZUYQWOJLXHAX-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCC24CCCC4)C3)cc1 ZINC001255142119 1062336147 /nfs/dbraw/zinc/33/61/47/1062336147.db2.gz PLZUYQWOJLXHAX-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCC24CCCC4)C3)cc1 ZINC001255142119 1062336168 /nfs/dbraw/zinc/33/61/68/1062336168.db2.gz PLZUYQWOJLXHAX-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP CC[N@@H+](CCC[NH2+]C1C[C@H]2CC[C@@H](C1)S2)C1CCCCC1 ZINC001474615285 1062336693 /nfs/dbraw/zinc/33/66/93/1062336693.db2.gz UENJERDIYSNSEG-ZNXRZULTSA-N 2 1 310.551 4.047 20 0 DIADMP CC(C)[C@H]1CCC[N@@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145329 1062338711 /nfs/dbraw/zinc/33/87/11/1062338711.db2.gz AXDTXEZYJOFRPM-IVAOSVALSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145329 1062338734 /nfs/dbraw/zinc/33/87/34/1062338734.db2.gz AXDTXEZYJOFRPM-IVAOSVALSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145329 1062338751 /nfs/dbraw/zinc/33/87/51/1062338751.db2.gz AXDTXEZYJOFRPM-IVAOSVALSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145329 1062338777 /nfs/dbraw/zinc/33/87/77/1062338777.db2.gz AXDTXEZYJOFRPM-IVAOSVALSA-N 2 1 312.501 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC[C@H]4CCC[C@H]4C2)C3)cc1 ZINC001255141932 1062342549 /nfs/dbraw/zinc/34/25/49/1062342549.db2.gz ORORQTJRBOWPBJ-TWGBQZSLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CC[C@H]4CCC[C@H]4C2)C3)cc1 ZINC001255141932 1062342572 /nfs/dbraw/zinc/34/25/72/1062342572.db2.gz ORORQTJRBOWPBJ-TWGBQZSLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CC[C@H]4CCC[C@H]4C2)C3)cc1 ZINC001255141932 1062342591 /nfs/dbraw/zinc/34/25/91/1062342591.db2.gz ORORQTJRBOWPBJ-TWGBQZSLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCCC4(CCC4)C2)C3)cc1 ZINC001255151337 1062343432 /nfs/dbraw/zinc/34/34/32/1062343432.db2.gz WXMJOLGLNMNWBW-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+]2CCCC4(CCC4)C2)C3)cc1 ZINC001255151337 1062343456 /nfs/dbraw/zinc/34/34/56/1062343456.db2.gz WXMJOLGLNMNWBW-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+]2CCCC4(CCC4)C2)C3)cc1 ZINC001255151337 1062343477 /nfs/dbraw/zinc/34/34/77/1062343477.db2.gz WXMJOLGLNMNWBW-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP C[C@H]1C[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150148 1062345699 /nfs/dbraw/zinc/34/56/99/1062345699.db2.gz MFUOHKUPEIKHPS-LMCOJAPRSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@H]1C[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150148 1062345722 /nfs/dbraw/zinc/34/57/22/1062345722.db2.gz MFUOHKUPEIKHPS-LMCOJAPRSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150148 1062345744 /nfs/dbraw/zinc/34/57/44/1062345744.db2.gz MFUOHKUPEIKHPS-LMCOJAPRSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150148 1062345762 /nfs/dbraw/zinc/34/57/62/1062345762.db2.gz MFUOHKUPEIKHPS-LMCOJAPRSA-N 2 1 310.485 4.056 20 0 DIADMP CC(C)c1cccc(C[N@@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)c1 ZINC001474646495 1062369895 /nfs/dbraw/zinc/36/98/95/1062369895.db2.gz FCSDZBFJXCISHA-PXNSSMCTSA-N 2 1 302.506 4.362 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@H+]1CCCC[C@H]1[C@H](C)C[NH+](C)C ZINC001474647167 1062373741 /nfs/dbraw/zinc/37/37/41/1062373741.db2.gz IEQBISBEOCZNGB-QAPCUYQASA-N 2 1 320.521 4.438 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCCC[C@H]1[C@H](C)C[NH+](C)C ZINC001474647167 1062373761 /nfs/dbraw/zinc/37/37/61/1062373761.db2.gz IEQBISBEOCZNGB-QAPCUYQASA-N 2 1 320.521 4.438 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255320330 1062398689 /nfs/dbraw/zinc/39/86/89/1062398689.db2.gz NTTYZTAUJDVOHU-ATZDWAIDSA-N 2 1 306.469 4.476 20 0 DIADMP C([NH2+]C1CCC2(CSC2)CC1)[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001474671622 1062403511 /nfs/dbraw/zinc/40/35/11/1062403511.db2.gz VYGOBEHGLTVLKQ-GOSISDBHSA-N 2 1 322.562 4.049 20 0 DIADMP C([NH2+]C1CCC2(CSC2)CC1)[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001474671622 1062403513 /nfs/dbraw/zinc/40/35/13/1062403513.db2.gz VYGOBEHGLTVLKQ-GOSISDBHSA-N 2 1 322.562 4.049 20 0 DIADMP CCCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001255331931 1062405296 /nfs/dbraw/zinc/40/52/96/1062405296.db2.gz FJKRAHAMXCPVGA-INIZCTEOSA-N 2 1 306.469 4.301 20 0 DIADMP CCCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001255331931 1062405303 /nfs/dbraw/zinc/40/53/03/1062405303.db2.gz FJKRAHAMXCPVGA-INIZCTEOSA-N 2 1 306.469 4.301 20 0 DIADMP CCCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001255332246 1062406330 /nfs/dbraw/zinc/40/63/30/1062406330.db2.gz LKPQKIOCXSDICB-MRXNPFEDSA-N 2 1 306.469 4.301 20 0 DIADMP CCCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001255332246 1062406342 /nfs/dbraw/zinc/40/63/42/1062406342.db2.gz LKPQKIOCXSDICB-MRXNPFEDSA-N 2 1 306.469 4.301 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255375131 1062419127 /nfs/dbraw/zinc/41/91/27/1062419127.db2.gz DCEGGBFSFBKLRQ-NRFANRHFSA-N 2 1 308.469 4.139 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccc1 ZINC001255380490 1062422483 /nfs/dbraw/zinc/42/24/83/1062422483.db2.gz KQCSBKAMQKBYOW-UGKGYDQZSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1cccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255379917 1062423222 /nfs/dbraw/zinc/42/32/22/1062423222.db2.gz YMJGKAABWRCFIR-OAQYLSRUSA-N 2 1 308.469 4.139 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccc(O)c1 ZINC001255383961 1062424868 /nfs/dbraw/zinc/42/48/68/1062424868.db2.gz QJSTVSBOEDIUGD-YLJYHZDGSA-N 2 1 324.468 4.098 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@H]3CC[C@@H]4CCC[C@@H]43)CC2)cc1 ZINC001255390367 1062426811 /nfs/dbraw/zinc/42/68/11/1062426811.db2.gz BMRFVLRHENTNJW-WOZUAGRISA-N 2 1 312.501 4.209 20 0 DIADMP CC[C@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccncc1 ZINC001255392496 1062427025 /nfs/dbraw/zinc/42/70/25/1062427025.db2.gz FMRABEGNBSRIAD-SFTDATJTSA-N 2 1 323.484 4.177 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@H]3CC34CCCCC4)CC2)cc1 ZINC001255391966 1062427163 /nfs/dbraw/zinc/42/71/63/1062427163.db2.gz WLSBTHVQYNAQNQ-PMACEKPBSA-N 2 1 312.501 4.354 20 0 DIADMP CC(C)C([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)C(C)C ZINC001255390509 1062427777 /nfs/dbraw/zinc/42/77/77/1062427777.db2.gz CDRYOKLBZCMMHS-IBGZPJMESA-N 2 1 302.506 4.311 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@H]3C[C@@H]3c3ccccc3)CC2)cc1 ZINC001255385518 1062428907 /nfs/dbraw/zinc/42/89/07/1062428907.db2.gz IFOOQAYJNADVCQ-VSKRKVRLSA-N 2 1 320.480 4.187 20 0 DIADMP CC1(C)CCC[C@@H]1[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386763 1062429284 /nfs/dbraw/zinc/42/92/84/1062429284.db2.gz BKEWVWFXNRFHQU-MOPGFXCFSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC(F)(F)C1 ZINC001255386419 1062429935 /nfs/dbraw/zinc/42/99/35/1062429935.db2.gz MPAIFLWFSMLOCR-KRWDZBQOSA-N 2 1 322.443 4.066 20 0 DIADMP C[C@@H]1CCCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398225 1062433989 /nfs/dbraw/zinc/43/39/89/1062433989.db2.gz ISVCFFODAZWABX-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398225 1062433996 /nfs/dbraw/zinc/43/39/96/1062433996.db2.gz ISVCFFODAZWABX-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398225 1062434002 /nfs/dbraw/zinc/43/40/02/1062434002.db2.gz ISVCFFODAZWABX-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCC1CC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255398595 1062435335 /nfs/dbraw/zinc/43/53/35/1062435335.db2.gz KYGFUUYTIYQVQR-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398666 1062436016 /nfs/dbraw/zinc/43/60/16/1062436016.db2.gz LXKFRRBIYLIZPC-SJLPKXTDSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398666 1062436021 /nfs/dbraw/zinc/43/60/21/1062436021.db2.gz LXKFRRBIYLIZPC-SJLPKXTDSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398666 1062436025 /nfs/dbraw/zinc/43/60/25/1062436025.db2.gz LXKFRRBIYLIZPC-SJLPKXTDSA-N 2 1 322.443 4.018 20 0 DIADMP c1coc(C[N@H+](C2CC2)[C@@H]2CCC[NH+](Cc3ccccc3)CC2)c1 ZINC001255409371 1062437795 /nfs/dbraw/zinc/43/77/95/1062437795.db2.gz WNVVMBZRMNFFSR-LJQANCHMSA-N 2 1 324.468 4.299 20 0 DIADMP c1coc(C[N@@H+](C2CC2)[C@@H]2CCC[NH+](Cc3ccccc3)CC2)c1 ZINC001255409371 1062437801 /nfs/dbraw/zinc/43/78/01/1062437801.db2.gz WNVVMBZRMNFFSR-LJQANCHMSA-N 2 1 324.468 4.299 20 0 DIADMP c1coc(C[NH+](C2CC2)[C@@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255409371 1062437809 /nfs/dbraw/zinc/43/78/09/1062437809.db2.gz WNVVMBZRMNFFSR-LJQANCHMSA-N 2 1 324.468 4.299 20 0 DIADMP c1coc(C[NH+](C2CC2)[C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255409371 1062437814 /nfs/dbraw/zinc/43/78/14/1062437814.db2.gz WNVVMBZRMNFFSR-LJQANCHMSA-N 2 1 324.468 4.299 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCCCCC3)CC2)cc1 ZINC001255402791 1062438243 /nfs/dbraw/zinc/43/82/43/1062438243.db2.gz ASLWORYESHUJAY-HXUWFJFHSA-N 2 1 300.490 4.307 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CC(c4ccccc4)C3)CC2)cc1 ZINC001255408516 1062439971 /nfs/dbraw/zinc/43/99/71/1062439971.db2.gz MYPFYADVJXFCOJ-JOCHJYFZSA-N 2 1 320.480 4.141 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255402660 1062441679 /nfs/dbraw/zinc/44/16/79/1062441679.db2.gz LEGNVBHUQAOBOP-UYAOXDASSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255402660 1062441680 /nfs/dbraw/zinc/44/16/80/1062441680.db2.gz LEGNVBHUQAOBOP-UYAOXDASSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255402660 1062441681 /nfs/dbraw/zinc/44/16/81/1062441681.db2.gz LEGNVBHUQAOBOP-UYAOXDASSA-N 2 1 300.490 4.306 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCC[C@@H]4CCC[C@H]43)CC2)cc1 ZINC001255406428 1062442403 /nfs/dbraw/zinc/44/24/03/1062442403.db2.gz SECADTOPSXUCLP-PCCBWWKXSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCC[C@@H]4CCC[C@H]43)CC2)cc1 ZINC001255406428 1062442411 /nfs/dbraw/zinc/44/24/11/1062442411.db2.gz SECADTOPSXUCLP-PCCBWWKXSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCC[C@@H]4CCC[C@H]43)CC2)cc1 ZINC001255406428 1062442418 /nfs/dbraw/zinc/44/24/18/1062442418.db2.gz SECADTOPSXUCLP-PCCBWWKXSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCC[C@@H]4CCC[C@H]43)CC2)cc1 ZINC001255406428 1062442419 /nfs/dbraw/zinc/44/24/19/1062442419.db2.gz SECADTOPSXUCLP-PCCBWWKXSA-N 2 1 312.501 4.306 20 0 DIADMP CC(C)(C)C1CCC([NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)CC1 ZINC001255503774 1062463663 /nfs/dbraw/zinc/46/36/63/1062463663.db2.gz YJYXHRPUEFJCIU-UHFFFAOYSA-N 2 1 304.522 4.009 20 0 DIADMP CC(C)(C)C1CCC([NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)CC1 ZINC001255503774 1062463677 /nfs/dbraw/zinc/46/36/77/1062463677.db2.gz YJYXHRPUEFJCIU-UHFFFAOYSA-N 2 1 304.522 4.009 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](C2CCC(C(F)(F)F)CC2)CC1 ZINC001255522419 1062473410 /nfs/dbraw/zinc/47/34/10/1062473410.db2.gz PBXQRWVCLQVPKD-UHFFFAOYSA-N 2 1 318.427 4.058 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)C2CCC(C(F)(F)F)CC2)CC1 ZINC001255522744 1062473919 /nfs/dbraw/zinc/47/39/19/1062473919.db2.gz VKKXQSUQIOOEQY-UHFFFAOYSA-N 2 1 320.443 4.304 20 0 DIADMP CCCC[C@@H](CC)COCCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255667535 1062505907 /nfs/dbraw/zinc/50/59/07/1062505907.db2.gz LCTVGHSSRIERHH-XUBOLADHSA-N 2 1 324.553 4.214 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001255670364 1062511351 /nfs/dbraw/zinc/51/13/51/1062511351.db2.gz QKRZEFKLZPIEJJ-IPQPSQTFSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001255670364 1062511371 /nfs/dbraw/zinc/51/13/71/1062511371.db2.gz QKRZEFKLZPIEJJ-IPQPSQTFSA-N 2 1 304.453 4.272 20 0 DIADMP FC(F)(F)[C@H]1CCC[C@@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001255710145 1062533001 /nfs/dbraw/zinc/53/30/01/1062533001.db2.gz SZZFNQBLEIKZST-GOEBONIOSA-N 2 1 318.427 4.058 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001255710144 1062534384 /nfs/dbraw/zinc/53/43/84/1062534384.db2.gz SZZFNQBLEIKZST-GDBMZVCRSA-N 2 1 318.427 4.058 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255711968 1062534444 /nfs/dbraw/zinc/53/44/44/1062534444.db2.gz GJGCMGZYVQYMOM-HZPDHXFCSA-N 2 1 320.443 4.160 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC001460020986 1062575211 /nfs/dbraw/zinc/57/52/11/1062575211.db2.gz TUYDRYVINNUJQS-UHFFFAOYSA-N 2 1 322.496 4.456 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255784742 1062606115 /nfs/dbraw/zinc/60/61/15/1062606115.db2.gz VVWJNEQEJRJUFP-YVWKXTFCSA-N 2 1 300.490 4.050 20 0 DIADMP Cc1ccc(C[C@H](C)[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001255793633 1062608382 /nfs/dbraw/zinc/60/83/82/1062608382.db2.gz NSMOFWHAGZLMDA-PZJWPPBQSA-N 2 1 314.517 4.266 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001255793634 1062609312 /nfs/dbraw/zinc/60/93/12/1062609312.db2.gz NSMOFWHAGZLMDA-TZIWHRDSSA-N 2 1 314.517 4.266 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@H](C)CC(C)C)C2)s1 ZINC001460073697 1062617059 /nfs/dbraw/zinc/61/70/59/1062617059.db2.gz PILGGVAEXCRNPB-AEFFLSMTSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@H](C)CC(C)C)C2)s1 ZINC001460073697 1062617068 /nfs/dbraw/zinc/61/70/68/1062617068.db2.gz PILGGVAEXCRNPB-AEFFLSMTSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C[C@H](C)CC(C)C)C2)s1 ZINC001460073697 1062617078 /nfs/dbraw/zinc/61/70/78/1062617078.db2.gz PILGGVAEXCRNPB-AEFFLSMTSA-N 2 1 322.562 4.492 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]C(c1ccccc1)c1ccccc1 ZINC001255940322 1062664815 /nfs/dbraw/zinc/66/48/15/1062664815.db2.gz XGMVJVQWDIDSSQ-SFHVURJKSA-N 2 1 310.485 4.486 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH+]1CCC(c2ccccc2F)CC1 ZINC001255959794 1062669056 /nfs/dbraw/zinc/66/90/56/1062669056.db2.gz AHWDMAYFRMMZGM-INIZCTEOSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](c1ccccc1F)C1CCC1 ZINC001255948657 1062670984 /nfs/dbraw/zinc/67/09/84/1062670984.db2.gz PLBLZWAQUNQRLW-HNAYVOBHSA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001255962222 1062672387 /nfs/dbraw/zinc/67/23/87/1062672387.db2.gz SCHHDCOHMBGMTB-VQIMIIECSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001255962222 1062672403 /nfs/dbraw/zinc/67/24/03/1062672403.db2.gz SCHHDCOHMBGMTB-VQIMIIECSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001255968329 1062674763 /nfs/dbraw/zinc/67/47/63/1062674763.db2.gz XVIJETAKHCBRIV-DOTOQJQBSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001255968329 1062674772 /nfs/dbraw/zinc/67/47/72/1062674772.db2.gz XVIJETAKHCBRIV-DOTOQJQBSA-N 2 1 308.897 4.250 20 0 DIADMP Fc1ccccc1[C@@H](CC1CCC1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001256072003 1062695108 /nfs/dbraw/zinc/69/51/08/1062695108.db2.gz UROCUMCHYPNCBA-HXUWFJFHSA-N 2 1 316.464 4.273 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(F)c1 ZINC001256069680 1062695946 /nfs/dbraw/zinc/69/59/46/1062695946.db2.gz MCZIQGFAMXRCFL-LJQANCHMSA-N 2 1 304.453 4.129 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@@H+]1C1CC[NH+](C2CC2)CC1 ZINC001256080827 1062698483 /nfs/dbraw/zinc/69/84/83/1062698483.db2.gz DAFUNEDZGZQJHY-SFHVURJKSA-N 2 1 316.514 4.172 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1CC[NH+](C2CC2)CC1 ZINC001256080827 1062698492 /nfs/dbraw/zinc/69/84/92/1062698492.db2.gz DAFUNEDZGZQJHY-SFHVURJKSA-N 2 1 316.514 4.172 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+](C)C1CC[NH+](C2CC2)CC1 ZINC001256082296 1062699234 /nfs/dbraw/zinc/69/92/34/1062699234.db2.gz VLUUEQGDXOAKDH-MRXNPFEDSA-N 2 1 308.469 4.459 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)C1CC[NH+](C2CC2)CC1 ZINC001256082296 1062699246 /nfs/dbraw/zinc/69/92/46/1062699246.db2.gz VLUUEQGDXOAKDH-MRXNPFEDSA-N 2 1 308.469 4.459 20 0 DIADMP C[C@H]1CCC(C)(C)[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001460231294 1062714731 /nfs/dbraw/zinc/71/47/31/1062714731.db2.gz OEBIJAPWZIWPIY-KRWDZBQOSA-N 2 1 300.490 4.435 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC001256114020 1062717039 /nfs/dbraw/zinc/71/70/39/1062717039.db2.gz SWLXRLQXTNNHKD-PMXSJFBMSA-N 2 1 314.517 4.421 20 0 DIADMP C[N@H+](CCC(c1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC001256210964 1062749920 /nfs/dbraw/zinc/74/99/20/1062749920.db2.gz OPFHZFWRGBVUFY-UHFFFAOYSA-N 2 1 322.496 4.235 20 0 DIADMP C[N@@H+](CCC(c1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC001256210964 1062749932 /nfs/dbraw/zinc/74/99/32/1062749932.db2.gz OPFHZFWRGBVUFY-UHFFFAOYSA-N 2 1 322.496 4.235 20 0 DIADMP CC(C)CC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001256367968 1062791481 /nfs/dbraw/zinc/79/14/81/1062791481.db2.gz KQGNZMPNQNISLF-GOSISDBHSA-N 2 1 302.506 4.408 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC001256520668 1062843539 /nfs/dbraw/zinc/84/35/39/1062843539.db2.gz RZXMJMFELKSXIP-JQVVWYNYSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC001256520668 1062843564 /nfs/dbraw/zinc/84/35/64/1062843564.db2.gz RZXMJMFELKSXIP-JQVVWYNYSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256527219 1062848790 /nfs/dbraw/zinc/84/87/90/1062848790.db2.gz QSQINPWCTBTCKY-JPLJXNOCSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256527219 1062848809 /nfs/dbraw/zinc/84/88/09/1062848809.db2.gz QSQINPWCTBTCKY-JPLJXNOCSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256533365 1062850781 /nfs/dbraw/zinc/85/07/81/1062850781.db2.gz NEWSUKRZJHMKOW-VQIMIIECSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256533365 1062850796 /nfs/dbraw/zinc/85/07/96/1062850796.db2.gz NEWSUKRZJHMKOW-VQIMIIECSA-N 2 1 300.490 4.208 20 0 DIADMP CCCC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC001256535200 1062851634 /nfs/dbraw/zinc/85/16/34/1062851634.db2.gz XOHFSUCQOSRBSS-PKOBYXMFSA-N 2 1 300.490 4.352 20 0 DIADMP CCCC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC001256535200 1062851655 /nfs/dbraw/zinc/85/16/55/1062851655.db2.gz XOHFSUCQOSRBSS-PKOBYXMFSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2[C@H](C)CCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256535761 1062853664 /nfs/dbraw/zinc/85/36/64/1062853664.db2.gz CWHAGEIYKLKWSM-AJYBTWMASA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2[C@H](C)CCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256535761 1062853673 /nfs/dbraw/zinc/85/36/73/1062853673.db2.gz CWHAGEIYKLKWSM-AJYBTWMASA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256535761 1062853686 /nfs/dbraw/zinc/85/36/86/1062853686.db2.gz CWHAGEIYKLKWSM-AJYBTWMASA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256535761 1062853697 /nfs/dbraw/zinc/85/36/97/1062853697.db2.gz CWHAGEIYKLKWSM-AJYBTWMASA-N 2 1 300.490 4.302 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256540526 1062859189 /nfs/dbraw/zinc/85/91/89/1062859189.db2.gz IQPPZNZCIJCXHX-WMZOPIPTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256540526 1062859215 /nfs/dbraw/zinc/85/92/15/1062859215.db2.gz IQPPZNZCIJCXHX-WMZOPIPTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540526 1062859236 /nfs/dbraw/zinc/85/92/36/1062859236.db2.gz IQPPZNZCIJCXHX-WMZOPIPTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540526 1062859259 /nfs/dbraw/zinc/85/92/59/1062859259.db2.gz IQPPZNZCIJCXHX-WMZOPIPTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256540521 1062862992 /nfs/dbraw/zinc/86/29/92/1062862992.db2.gz IQPPZNZCIJCXHX-FUHWJXTLSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256540521 1062863010 /nfs/dbraw/zinc/86/30/10/1062863010.db2.gz IQPPZNZCIJCXHX-FUHWJXTLSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540521 1062863028 /nfs/dbraw/zinc/86/30/28/1062863028.db2.gz IQPPZNZCIJCXHX-FUHWJXTLSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540521 1062863048 /nfs/dbraw/zinc/86/30/48/1062863048.db2.gz IQPPZNZCIJCXHX-FUHWJXTLSA-N 2 1 322.443 4.161 20 0 DIADMP CCC[N@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537810 1062864133 /nfs/dbraw/zinc/86/41/33/1062864133.db2.gz OTVCENOWPGIFTL-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537810 1062864158 /nfs/dbraw/zinc/86/41/58/1062864158.db2.gz OTVCENOWPGIFTL-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537810 1062864176 /nfs/dbraw/zinc/86/41/76/1062864176.db2.gz OTVCENOWPGIFTL-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537810 1062864197 /nfs/dbraw/zinc/86/41/97/1062864197.db2.gz OTVCENOWPGIFTL-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@H]1C ZINC001256549504 1062869739 /nfs/dbraw/zinc/86/97/39/1062869739.db2.gz HTCVIANLOTYUBY-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@H]1C ZINC001256549504 1062869763 /nfs/dbraw/zinc/86/97/63/1062869763.db2.gz HTCVIANLOTYUBY-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[C@H]1C ZINC001256549504 1062869791 /nfs/dbraw/zinc/86/97/91/1062869791.db2.gz HTCVIANLOTYUBY-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)[C@H]1C ZINC001256549504 1062869818 /nfs/dbraw/zinc/86/98/18/1062869818.db2.gz HTCVIANLOTYUBY-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC[C@@H](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256543949 1062870143 /nfs/dbraw/zinc/87/01/43/1062870143.db2.gz WAPBXEWJLSDUHC-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC[C@@H](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256543949 1062870163 /nfs/dbraw/zinc/87/01/63/1062870163.db2.gz WAPBXEWJLSDUHC-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543949 1062870188 /nfs/dbraw/zinc/87/01/88/1062870188.db2.gz WAPBXEWJLSDUHC-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543949 1062870207 /nfs/dbraw/zinc/87/02/07/1062870207.db2.gz WAPBXEWJLSDUHC-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256551507 1062870658 /nfs/dbraw/zinc/87/06/58/1062870658.db2.gz SMANHHYRUXJBDA-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256551507 1062870681 /nfs/dbraw/zinc/87/06/81/1062870681.db2.gz SMANHHYRUXJBDA-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256554136 1062874516 /nfs/dbraw/zinc/87/45/16/1062874516.db2.gz NTXSPXCRYBWPAC-MISYRCLQSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256554136 1062874533 /nfs/dbraw/zinc/87/45/33/1062874533.db2.gz NTXSPXCRYBWPAC-MISYRCLQSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256554136 1062874547 /nfs/dbraw/zinc/87/45/47/1062874547.db2.gz NTXSPXCRYBWPAC-MISYRCLQSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256554136 1062874567 /nfs/dbraw/zinc/87/45/67/1062874567.db2.gz NTXSPXCRYBWPAC-MISYRCLQSA-N 2 1 300.490 4.304 20 0 DIADMP CC(C)[N@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551685 1062875930 /nfs/dbraw/zinc/87/59/30/1062875930.db2.gz UHHXAKYTOLAJHZ-PXNSSMCTSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551685 1062875937 /nfs/dbraw/zinc/87/59/37/1062875937.db2.gz UHHXAKYTOLAJHZ-PXNSSMCTSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551685 1062875938 /nfs/dbraw/zinc/87/59/38/1062875938.db2.gz UHHXAKYTOLAJHZ-PXNSSMCTSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551685 1062875940 /nfs/dbraw/zinc/87/59/40/1062875940.db2.gz UHHXAKYTOLAJHZ-PXNSSMCTSA-N 2 1 300.490 4.160 20 0 DIADMP CCC[N@H+](CC(C)C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256556772 1062883419 /nfs/dbraw/zinc/88/34/19/1062883419.db2.gz GOGRIMFGWIJFDF-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256556772 1062883431 /nfs/dbraw/zinc/88/34/31/1062883431.db2.gz GOGRIMFGWIJFDF-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[NH+](CC(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256556772 1062883437 /nfs/dbraw/zinc/88/34/37/1062883437.db2.gz GOGRIMFGWIJFDF-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[NH+](CC(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256556772 1062883454 /nfs/dbraw/zinc/88/34/54/1062883454.db2.gz GOGRIMFGWIJFDF-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256559261 1062883856 /nfs/dbraw/zinc/88/38/56/1062883856.db2.gz KCYRFVIECUPHQN-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256559261 1062883869 /nfs/dbraw/zinc/88/38/69/1062883869.db2.gz KCYRFVIECUPHQN-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559261 1062883893 /nfs/dbraw/zinc/88/38/93/1062883893.db2.gz KCYRFVIECUPHQN-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559261 1062883917 /nfs/dbraw/zinc/88/39/17/1062883917.db2.gz KCYRFVIECUPHQN-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256557398 1062886768 /nfs/dbraw/zinc/88/67/68/1062886768.db2.gz IVQSMSCRENJNHO-ZIBCJSCZSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256557398 1062886796 /nfs/dbraw/zinc/88/67/96/1062886796.db2.gz IVQSMSCRENJNHO-ZIBCJSCZSA-N 2 1 312.501 4.162 20 0 DIADMP CCC(CC)[N@H+](C1CCN(C(C)(C)C)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001256567381 1062890498 /nfs/dbraw/zinc/89/04/98/1062890498.db2.gz WAQPKWBNEWZWDU-SAABIXHNSA-N 2 1 323.569 4.010 20 0 DIADMP CCC(CC)[N@@H+](C1CC[NH+](C(C)(C)C)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001256567381 1062890509 /nfs/dbraw/zinc/89/05/09/1062890509.db2.gz WAQPKWBNEWZWDU-SAABIXHNSA-N 3 1 323.569 4.010 20 0 DIADMP CCC(CC)[N@H+](C1CC[NH+](C(C)(C)C)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001256567381 1062890528 /nfs/dbraw/zinc/89/05/28/1062890528.db2.gz WAQPKWBNEWZWDU-SAABIXHNSA-N 3 1 323.569 4.010 20 0 DIADMP C[N@@H+](CCc1ccc(Cl)cc1)C1CC[NH+](C(C)(C)C)CC1 ZINC001256574026 1062898028 /nfs/dbraw/zinc/89/80/28/1062898028.db2.gz SBTDYABNHDCYLI-UHFFFAOYSA-N 2 1 308.897 4.077 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001256574212 1062900315 /nfs/dbraw/zinc/90/03/15/1062900315.db2.gz WPCYFDFNYODQJW-HNNXBMFYSA-N 2 1 320.908 4.392 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001256574212 1062900341 /nfs/dbraw/zinc/90/03/41/1062900341.db2.gz WPCYFDFNYODQJW-HNNXBMFYSA-N 2 1 320.908 4.392 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C34CC5CC(CC(C5)C3)C4)CC2)cc1 ZINC001256598356 1062911104 /nfs/dbraw/zinc/91/11/04/1062911104.db2.gz VEMFCRSQVSSDNY-UHFFFAOYSA-N 2 1 324.512 4.209 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)cc(C)c1 ZINC001460572229 1062917700 /nfs/dbraw/zinc/91/77/00/1062917700.db2.gz XICOMWLOXRJTFI-UHFFFAOYSA-N 2 1 310.485 4.387 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CCC[C@H]4CCCC[C@@H]43)CC2)cc1 ZINC001256611709 1062918396 /nfs/dbraw/zinc/91/83/96/1062918396.db2.gz ULYGJOXMERUVQB-CTNGQTDRSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CCC[C@H]4CCCC[C@@H]43)CC2)cc1 ZINC001256611709 1062918410 /nfs/dbraw/zinc/91/84/10/1062918410.db2.gz ULYGJOXMERUVQB-CTNGQTDRSA-N 2 1 312.501 4.306 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256629847 1062922116 /nfs/dbraw/zinc/92/21/16/1062922116.db2.gz UDCOQLOMXPTCAR-IXEWLPCDSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001256629847 1062922136 /nfs/dbraw/zinc/92/21/36/1062922136.db2.gz UDCOQLOMXPTCAR-IXEWLPCDSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001256629847 1062922156 /nfs/dbraw/zinc/92/21/56/1062922156.db2.gz UDCOQLOMXPTCAR-IXEWLPCDSA-N 2 1 316.514 4.171 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC(Cc2ccc(Cl)cc2)CC1 ZINC001460647280 1062958251 /nfs/dbraw/zinc/95/82/51/1062958251.db2.gz BIOIXLSNRZXQMQ-IBGZPJMESA-N 2 1 320.908 4.079 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)c(C)s1 ZINC001460672676 1062977180 /nfs/dbraw/zinc/97/71/80/1062977180.db2.gz ULAGLSBHOCKPOJ-UHFFFAOYSA-N 2 1 308.535 4.165 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cc(Cl)ccc1F ZINC001460691645 1062993519 /nfs/dbraw/zinc/99/35/19/1062993519.db2.gz NIMKGWQADGFIHD-UHFFFAOYSA-N 2 1 312.860 4.177 20 0 DIADMP C[N@@H+](C1CCN(c2cc[nH+]cc2)CC1)C(C)(C)Cc1ccccc1 ZINC001256862598 1063019033 /nfs/dbraw/zinc/01/90/33/1063019033.db2.gz OULGHVYDAZOYQO-UHFFFAOYSA-N 2 1 323.484 4.004 20 0 DIADMP c1ccc([C@H]2CCCC[N@H+]2C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC001256855362 1063019708 /nfs/dbraw/zinc/01/97/08/1063019708.db2.gz JYBDBAGQEZSOCH-OAQYLSRUSA-N 2 1 321.468 4.278 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256895324 1063031762 /nfs/dbraw/zinc/03/17/62/1063031762.db2.gz AVBYZWNXSPMTIV-IEBWSBKVSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256895324 1063031784 /nfs/dbraw/zinc/03/17/84/1063031784.db2.gz AVBYZWNXSPMTIV-IEBWSBKVSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@]12C[NH+](CC3CCCCC3)C[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001460744859 1063032425 /nfs/dbraw/zinc/03/24/25/1063032425.db2.gz DFZZPIXKLRJBHG-RTWAWAEBSA-N 2 1 312.501 4.021 20 0 DIADMP Clc1ccc(CCC[NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC001256899963 1063032976 /nfs/dbraw/zinc/03/29/76/1063032976.db2.gz YCZSSALYLOHALW-SFHVURJKSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1ccc(CCC[NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC001256899963 1063032997 /nfs/dbraw/zinc/03/29/97/1063032997.db2.gz YCZSSALYLOHALW-SFHVURJKSA-N 2 1 320.908 4.269 20 0 DIADMP CC(C)(Cc1ccc(F)cc1)[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256896907 1063033391 /nfs/dbraw/zinc/03/33/91/1063033391.db2.gz FTCATIWTDZKOFN-SFHVURJKSA-N 2 1 318.480 4.143 20 0 DIADMP CC(C)(Cc1ccc(F)cc1)[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256896907 1063033409 /nfs/dbraw/zinc/03/34/09/1063033409.db2.gz FTCATIWTDZKOFN-SFHVURJKSA-N 2 1 318.480 4.143 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)CC1 ZINC001256896901 1063036087 /nfs/dbraw/zinc/03/60/87/1063036087.db2.gz FRCCHYIWCNCSBQ-YMAMQOFZSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)CC1 ZINC001256896901 1063036105 /nfs/dbraw/zinc/03/61/05/1063036105.db2.gz FRCCHYIWCNCSBQ-YMAMQOFZSA-N 2 1 318.427 4.104 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+]([C@H]2CCCc3ccc(F)cc32)CC1 ZINC001460794533 1063064161 /nfs/dbraw/zinc/06/41/61/1063064161.db2.gz NJXZGELAXVGLPB-IBGZPJMESA-N 2 1 316.464 4.153 20 0 DIADMP C[C@H]1CC([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@H](C)O1 ZINC001257079680 1063105727 /nfs/dbraw/zinc/10/57/27/1063105727.db2.gz GMDFXYLXSPIGTB-CAMMJAKZSA-N 2 1 322.537 4.095 20 0 DIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(c2cc(C)ccc2C)CC1 ZINC001460895532 1063120110 /nfs/dbraw/zinc/12/01/10/1063120110.db2.gz JYVVZKAGGBCXEP-UHFFFAOYSA-N 2 1 311.473 4.078 20 0 DIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccccc2Oc2ccccc2)CC1 ZINC001257205318 1063137745 /nfs/dbraw/zinc/13/77/45/1063137745.db2.gz JBNITWGJMXKLDY-UHFFFAOYSA-N 2 1 324.468 4.441 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC001257222270 1063147076 /nfs/dbraw/zinc/14/70/76/1063147076.db2.gz ZVZYVHJIBUIUHY-LJQANCHMSA-N 2 1 300.490 4.129 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1cccc(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257252718 1063158726 /nfs/dbraw/zinc/15/87/26/1063158726.db2.gz GGZIBLZVKYSPAX-GUDVDZBRSA-N 2 1 318.505 4.346 20 0 DIADMP CCC[C@H](CC)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001257265500 1063170322 /nfs/dbraw/zinc/17/03/22/1063170322.db2.gz FQJRHDQOEHEFFR-FQEVSTJZSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[C@H](CC)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001257271806 1063172558 /nfs/dbraw/zinc/17/25/58/1063172558.db2.gz TVFTWNWFHRSRJZ-UFYCRDLUSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@@H](CC)[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001257271822 1063172690 /nfs/dbraw/zinc/17/26/90/1063172690.db2.gz TZZDPCIANWCYFV-GOSISDBHSA-N 2 1 306.469 4.301 20 0 DIADMP CCC[C@@H](CC)[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001257271822 1063172702 /nfs/dbraw/zinc/17/27/02/1063172702.db2.gz TZZDPCIANWCYFV-GOSISDBHSA-N 2 1 306.469 4.301 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC001257292894 1063184137 /nfs/dbraw/zinc/18/41/37/1063184137.db2.gz XRBSBRDGQGUJCM-ZWKOTPCHSA-N 2 1 318.505 4.248 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035747 1063205988 /nfs/dbraw/zinc/20/59/88/1063205988.db2.gz CVLPZEFKQSSLSP-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035747 1063206000 /nfs/dbraw/zinc/20/60/00/1063206000.db2.gz CVLPZEFKQSSLSP-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001461039603 1063208401 /nfs/dbraw/zinc/20/84/01/1063208401.db2.gz JTSUFQIFZIIZMG-UHFFFAOYSA-N 2 1 322.802 4.179 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001461039603 1063208421 /nfs/dbraw/zinc/20/84/21/1063208421.db2.gz JTSUFQIFZIIZMG-UHFFFAOYSA-N 2 1 322.802 4.179 20 0 DIADMP CCCC(CCC)[N@@H+]1C[C@H]2CN(Cc3cccs3)C[C@H]2C1 ZINC001257338454 1063218466 /nfs/dbraw/zinc/21/84/66/1063218466.db2.gz WOLISDCRXSGUOJ-IYBDPMFKSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC(CCC)[N@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257338454 1063218485 /nfs/dbraw/zinc/21/84/85/1063218485.db2.gz WOLISDCRXSGUOJ-IYBDPMFKSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC(CCC)[N@@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257338454 1063218501 /nfs/dbraw/zinc/21/85/01/1063218501.db2.gz WOLISDCRXSGUOJ-IYBDPMFKSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC(CCC)[NH+]1C[C@H]2C[N@@H+](Cc3cccs3)C[C@H]2C1 ZINC001257338454 1063218519 /nfs/dbraw/zinc/21/85/19/1063218519.db2.gz WOLISDCRXSGUOJ-IYBDPMFKSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC(CCC)[NH+]1C[C@H]2C[N@H+](Cc3cccs3)C[C@H]2C1 ZINC001257338454 1063218539 /nfs/dbraw/zinc/21/85/39/1063218539.db2.gz WOLISDCRXSGUOJ-IYBDPMFKSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001257356821 1063223841 /nfs/dbraw/zinc/22/38/41/1063223841.db2.gz BBGSAMJKXSMCDI-QGZVFWFLSA-N 2 1 318.505 4.304 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCC[C@@H](C)CC2)cc1F ZINC001461097031 1063250591 /nfs/dbraw/zinc/25/05/91/1063250591.db2.gz ADKFSPFNSPRHCM-RHSMWYFYSA-N 2 1 315.436 4.378 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001461120782 1063271220 /nfs/dbraw/zinc/27/12/20/1063271220.db2.gz LCIYNWLFCLEEEA-SFHVURJKSA-N 2 1 300.490 4.166 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C2CCCCC2)C3)cc1 ZINC001257461197 1063286017 /nfs/dbraw/zinc/28/60/17/1063286017.db2.gz LZHQJUPPEKBZFA-OAQYLSRUSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C2CCCCC2)C3)cc1 ZINC001257461197 1063286034 /nfs/dbraw/zinc/28/60/34/1063286034.db2.gz LZHQJUPPEKBZFA-OAQYLSRUSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C2CCCCC2)C3)cc1 ZINC001257461197 1063286052 /nfs/dbraw/zinc/28/60/52/1063286052.db2.gz LZHQJUPPEKBZFA-OAQYLSRUSA-N 2 1 312.501 4.307 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001461372324 1063455487 /nfs/dbraw/zinc/45/54/87/1063455487.db2.gz CNEMZIZYJIGOJZ-SFHVURJKSA-N 2 1 306.538 4.447 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@@H+]1C1CC[NH+](CC(C)C)CC1 ZINC001258013615 1063462396 /nfs/dbraw/zinc/46/23/96/1063462396.db2.gz UMVWWQMDGIKTLA-FQEVSTJZSA-N 2 1 300.490 4.252 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2cc(F)cc(Cl)c2)CC1 ZINC001258009400 1063463336 /nfs/dbraw/zinc/46/33/36/1063463336.db2.gz VQBSSSYDIWDIGZ-CYBMUJFWSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](c2ccccc2F)C2CCC2)CC1 ZINC001258007216 1063463360 /nfs/dbraw/zinc/46/33/60/1063463360.db2.gz RIHDPANKISAGGQ-HXUWFJFHSA-N 2 1 318.480 4.377 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccc(F)cc2)CC1 ZINC001258011420 1063463393 /nfs/dbraw/zinc/46/33/93/1063463393.db2.gz MUELXIWRIIANLJ-IBGZPJMESA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@H]2c2ccc(F)cc2)CC1 ZINC001258011420 1063463408 /nfs/dbraw/zinc/46/34/08/1063463408.db2.gz MUELXIWRIIANLJ-IBGZPJMESA-N 2 1 304.453 4.083 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@@H+]1C1CC[NH+](CC(C)C)CC1 ZINC001258013616 1063463809 /nfs/dbraw/zinc/46/38/09/1063463809.db2.gz UMVWWQMDGIKTLA-HXUWFJFHSA-N 2 1 300.490 4.252 20 0 DIADMP Cc1cccc([C@H]2CCC[N@@H+]2C2CC[NH+](CC(C)C)CC2)c1 ZINC001258011272 1063463878 /nfs/dbraw/zinc/46/38/78/1063463878.db2.gz IXKMYXVJFAPLHI-HXUWFJFHSA-N 2 1 300.490 4.252 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccc(F)cc2)CC1 ZINC001258011423 1063464424 /nfs/dbraw/zinc/46/44/24/1063464424.db2.gz MUELXIWRIIANLJ-LJQANCHMSA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccc(F)cc2)CC1 ZINC001258011423 1063464435 /nfs/dbraw/zinc/46/44/35/1063464435.db2.gz MUELXIWRIIANLJ-LJQANCHMSA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](C)C(C)(C)Cc2ccccc2)CC1 ZINC001258017484 1063466334 /nfs/dbraw/zinc/46/63/34/1063466334.db2.gz IILBNTKMMMPHCA-UHFFFAOYSA-N 2 1 302.506 4.060 20 0 DIADMP CC[C@H]1c2ccccc2CC[N@H+]1C1CC[NH+](CC(C)C)CC1 ZINC001258017362 1063466453 /nfs/dbraw/zinc/46/64/53/1063466453.db2.gz FZKDZDRXPBLJMI-FQEVSTJZSA-N 2 1 300.490 4.116 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)C1CC[NH+](CC(C)C)CC1 ZINC001258014599 1063467789 /nfs/dbraw/zinc/46/77/89/1063467789.db2.gz OMPRSFMSIJWOIA-UHFFFAOYSA-N 2 1 302.506 4.409 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258062912 1063489733 /nfs/dbraw/zinc/48/97/33/1063489733.db2.gz QRSDBKTXZYYHQP-VJANTYMQSA-N 2 1 324.553 4.198 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461440693 1063509080 /nfs/dbraw/zinc/50/90/80/1063509080.db2.gz LUCLEWHWVZLWRT-GOSISDBHSA-N 2 1 300.490 4.209 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461440693 1063509084 /nfs/dbraw/zinc/50/90/84/1063509084.db2.gz LUCLEWHWVZLWRT-GOSISDBHSA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)=CCC[C@H](C)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258093617 1063512589 /nfs/dbraw/zinc/51/25/89/1063512589.db2.gz SIEQYLXFCLTKGP-ROUUACIJSA-N 2 1 322.537 4.133 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH+]3CCCCCCCC3)CC2)cc1 ZINC001258148788 1063530903 /nfs/dbraw/zinc/53/09/03/1063530903.db2.gz SMSUXAUCZLLZLG-UHFFFAOYSA-N 2 1 314.517 4.350 20 0 DIADMP CC[N@H+](C1CCCCC1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258140807 1063533733 /nfs/dbraw/zinc/53/37/33/1063533733.db2.gz JNWNYUFHCZCQHD-UHFFFAOYSA-N 2 1 314.517 4.348 20 0 DIADMP CC[N@@H+](C1CCCCC1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258140807 1063533748 /nfs/dbraw/zinc/53/37/48/1063533748.db2.gz JNWNYUFHCZCQHD-UHFFFAOYSA-N 2 1 314.517 4.348 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@@H](C)C1 ZINC001258160126 1063536398 /nfs/dbraw/zinc/53/63/98/1063536398.db2.gz JSLBAOUUGIWPGA-RUYXUALKSA-N 2 1 314.517 4.455 20 0 DIADMP CSCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001258209928 1063563905 /nfs/dbraw/zinc/56/39/05/1063563905.db2.gz XAMSGIVKZUYFPZ-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP CSCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001258209928 1063563920 /nfs/dbraw/zinc/56/39/20/1063563920.db2.gz XAMSGIVKZUYFPZ-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@@H](CC(C)(C)C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001461554250 1063577501 /nfs/dbraw/zinc/57/75/01/1063577501.db2.gz TXUFDXXCBIISTD-INIZCTEOSA-N 2 1 320.496 4.247 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)CC(C)(C)SCc2ccco2)CC1 ZINC001258295898 1063592974 /nfs/dbraw/zinc/59/29/74/1063592974.db2.gz SCIMJBYCNOPEEJ-HNNXBMFYSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC001258293988 1063593461 /nfs/dbraw/zinc/59/34/61/1063593461.db2.gz FLNICGACZFEULP-HOTGVXAUSA-N 2 1 324.534 4.001 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001258302840 1063597205 /nfs/dbraw/zinc/59/72/05/1063597205.db2.gz PKWJHHCUEFKWGK-FHERZECASA-N 2 1 324.534 4.272 20 0 DIADMP CCOc1ccc(C[NH2+]CCC[N@H+](CC)C2CCCCC2)cc1 ZINC001461616892 1063615332 /nfs/dbraw/zinc/61/53/32/1063615332.db2.gz UKSDXMVOVYCSMN-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CCOc1ccc(C[NH2+]CCC[N@@H+](CC)C2CCCCC2)cc1 ZINC001461616892 1063615340 /nfs/dbraw/zinc/61/53/40/1063615340.db2.gz UKSDXMVOVYCSMN-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CCCCC[C@H](CC)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258440335 1063654854 /nfs/dbraw/zinc/65/48/54/1063654854.db2.gz PIOLCOUWGMYZOD-ZWKOTPCHSA-N 2 1 324.553 4.357 20 0 DIADMP Cc1ccccc1C[N@H+]([C@H](C)CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258457599 1063663302 /nfs/dbraw/zinc/66/33/02/1063663302.db2.gz ZRQQEAPCMZDASS-NSISKUIASA-N 2 1 300.490 4.256 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+]([C@@H](C)CC3CC3)C[C@@H]21 ZINC001258463546 1063665364 /nfs/dbraw/zinc/66/53/64/1063665364.db2.gz OWAJOGVUXJUBLB-ZEWNOJEFSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+]([C@@H](C)CC3CC3)C[C@@H]21 ZINC001258463546 1063665372 /nfs/dbraw/zinc/66/53/72/1063665372.db2.gz OWAJOGVUXJUBLB-ZEWNOJEFSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+]([C@@H](C)CC3CC3)C[C@@H]21 ZINC001258463546 1063665375 /nfs/dbraw/zinc/66/53/75/1063665375.db2.gz OWAJOGVUXJUBLB-ZEWNOJEFSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@H](CC1CC1)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001258471270 1063668913 /nfs/dbraw/zinc/66/89/13/1063668913.db2.gz XNZRTBTUFYXCAX-WIYYLYMNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258471270 1063668922 /nfs/dbraw/zinc/66/89/22/1063668922.db2.gz XNZRTBTUFYXCAX-WIYYLYMNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258471270 1063668926 /nfs/dbraw/zinc/66/89/26/1063668926.db2.gz XNZRTBTUFYXCAX-WIYYLYMNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H](CC1CC1)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001258471758 1063669273 /nfs/dbraw/zinc/66/92/73/1063669273.db2.gz FBGWALMFGZWBTD-UIFIKXQLSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001258471758 1063669278 /nfs/dbraw/zinc/66/92/78/1063669278.db2.gz FBGWALMFGZWBTD-UIFIKXQLSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001258471758 1063669289 /nfs/dbraw/zinc/66/92/89/1063669289.db2.gz FBGWALMFGZWBTD-UIFIKXQLSA-N 2 1 312.501 4.019 20 0 DIADMP CC1(C)CC[C@@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258604927 1063703838 /nfs/dbraw/zinc/70/38/38/1063703838.db2.gz MHQLTEQCKAJWAU-CTNGQTDRSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604927 1063703846 /nfs/dbraw/zinc/70/38/46/1063703846.db2.gz MHQLTEQCKAJWAU-CTNGQTDRSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604927 1063703854 /nfs/dbraw/zinc/70/38/54/1063703854.db2.gz MHQLTEQCKAJWAU-CTNGQTDRSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258608665 1063707317 /nfs/dbraw/zinc/70/73/17/1063707317.db2.gz MUJXHBZHMKWBNH-ZCNNSNEGSA-N 2 1 312.501 4.019 20 0 DIADMP CCC1CCC(C2CCC([NH2+]C3CC[NH+](C)CC3)CC2)CC1 ZINC001258633405 1063719724 /nfs/dbraw/zinc/71/97/24/1063719724.db2.gz SSKPAHASLMKCHS-UHFFFAOYSA-N 2 1 306.538 4.445 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258652442 1063724283 /nfs/dbraw/zinc/72/42/83/1063724283.db2.gz VXPCSYHXPQHBOB-HAGHYFMRSA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258652442 1063724294 /nfs/dbraw/zinc/72/42/94/1063724294.db2.gz VXPCSYHXPQHBOB-HAGHYFMRSA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258652444 1063726068 /nfs/dbraw/zinc/72/60/68/1063726068.db2.gz VXPCSYHXPQHBOB-WTGUMLROSA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258652444 1063726081 /nfs/dbraw/zinc/72/60/81/1063726081.db2.gz VXPCSYHXPQHBOB-WTGUMLROSA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001258654173 1063728540 /nfs/dbraw/zinc/72/85/40/1063728540.db2.gz ITKVCOSILDJXRF-MISYRCLQSA-N 2 1 302.506 4.106 20 0 DIADMP CC[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1(C(C)C)CC1 ZINC001461863390 1063756070 /nfs/dbraw/zinc/75/60/70/1063756070.db2.gz FKOGMECJNIUULH-HXUWFJFHSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC(C)(C)C1 ZINC001258691689 1063756078 /nfs/dbraw/zinc/75/60/78/1063756078.db2.gz HFMBENMWRCCZRV-CVEARBPZSA-N 2 1 318.480 4.290 20 0 DIADMP CC[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1(C(C)C)CC1 ZINC001461863390 1063756077 /nfs/dbraw/zinc/75/60/77/1063756077.db2.gz FKOGMECJNIUULH-HXUWFJFHSA-N 2 1 314.517 4.267 20 0 DIADMP CC[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(C(C)C)CC1 ZINC001461863390 1063756088 /nfs/dbraw/zinc/75/60/88/1063756088.db2.gz FKOGMECJNIUULH-HXUWFJFHSA-N 2 1 314.517 4.267 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC001461864104 1063757108 /nfs/dbraw/zinc/75/71/08/1063757108.db2.gz KAWOSKHUIWHSFQ-FXAWDEMLSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC001461864104 1063757115 /nfs/dbraw/zinc/75/71/15/1063757115.db2.gz KAWOSKHUIWHSFQ-FXAWDEMLSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC001461864104 1063757126 /nfs/dbraw/zinc/75/71/26/1063757126.db2.gz KAWOSKHUIWHSFQ-FXAWDEMLSA-N 2 1 302.506 4.015 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258706305 1063764319 /nfs/dbraw/zinc/76/43/19/1063764319.db2.gz QGIQMIYEVLBPFP-MXEMCNAFSA-N 2 1 314.517 4.393 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258706305 1063764334 /nfs/dbraw/zinc/76/43/34/1063764334.db2.gz QGIQMIYEVLBPFP-MXEMCNAFSA-N 2 1 314.517 4.393 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001258710970 1063768050 /nfs/dbraw/zinc/76/80/50/1063768050.db2.gz ASUOFRNXAUPTAR-HXUWFJFHSA-N 2 1 302.506 4.062 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH+]1CCC([N@@H+](C)CC)CC1 ZINC001258711382 1063768310 /nfs/dbraw/zinc/76/83/10/1063768310.db2.gz AELHKMWFHVKQJX-HXUWFJFHSA-N 2 1 302.506 4.204 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001258710969 1063768502 /nfs/dbraw/zinc/76/85/02/1063768502.db2.gz ASUOFRNXAUPTAR-FQEVSTJZSA-N 2 1 302.506 4.062 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258741604 1063791400 /nfs/dbraw/zinc/79/14/00/1063791400.db2.gz MSNGGYFFFDMIAM-LSBZLQRGSA-N 2 1 320.908 4.395 20 0 DIADMP CCCC[C@H](CCC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258755332 1063800025 /nfs/dbraw/zinc/80/00/25/1063800025.db2.gz LIICFTKCOJGJGV-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001461921454 1063804232 /nfs/dbraw/zinc/80/42/32/1063804232.db2.gz OTHUZALDSIHHEE-FUHWJXTLSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001461921454 1063804246 /nfs/dbraw/zinc/80/42/46/1063804246.db2.gz OTHUZALDSIHHEE-FUHWJXTLSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC001461921454 1063804260 /nfs/dbraw/zinc/80/42/60/1063804260.db2.gz OTHUZALDSIHHEE-FUHWJXTLSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC001461921454 1063804275 /nfs/dbraw/zinc/80/42/75/1063804275.db2.gz OTHUZALDSIHHEE-FUHWJXTLSA-N 2 1 311.473 4.102 20 0 DIADMP CCCC[C@@H](CCC)N(c1cc(C)[nH+]c(C)n1)C1CC[NH2+]CC1 ZINC001258763824 1063810031 /nfs/dbraw/zinc/81/00/31/1063810031.db2.gz DRWGSUQLXDXRSX-QGZVFWFLSA-N 2 1 318.509 4.011 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C/c2ccc(F)cc2)CC1 ZINC001461926939 1063810369 /nfs/dbraw/zinc/81/03/69/1063810369.db2.gz LKGUMUXIQQXIJM-AATRIKPKSA-N 2 1 318.480 4.283 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2csc(C)c2C)CC1 ZINC001461928086 1063815165 /nfs/dbraw/zinc/81/51/65/1063815165.db2.gz PEPYWYXHLCGXME-UHFFFAOYSA-N 2 1 308.535 4.309 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001258774258 1063817543 /nfs/dbraw/zinc/81/75/43/1063817543.db2.gz LKHSODCZPSOWOX-GOSISDBHSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001258774258 1063817556 /nfs/dbraw/zinc/81/75/56/1063817556.db2.gz LKHSODCZPSOWOX-GOSISDBHSA-N 2 1 306.881 4.351 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258782281 1063820158 /nfs/dbraw/zinc/82/01/58/1063820158.db2.gz NRYPCOKCEWFCST-WBVHZDCISA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258786153 1063824374 /nfs/dbraw/zinc/82/43/74/1063824374.db2.gz KTTWKYSVBFZGOM-CVEARBPZSA-N 2 1 306.469 4.290 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786141 1063824406 /nfs/dbraw/zinc/82/44/06/1063824406.db2.gz KPYAZFUIQRELCU-HNBVOPMISA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258791517 1063828513 /nfs/dbraw/zinc/82/85/13/1063828513.db2.gz SKRLGNPNDINTJT-RCCFBDPRSA-N 2 1 324.553 4.213 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258791515 1063828703 /nfs/dbraw/zinc/82/87/03/1063828703.db2.gz SKRLGNPNDINTJT-OKZBNKHCSA-N 2 1 324.553 4.213 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+]C2CCC(C(C)C)CC2)CC1 ZINC001258799508 1063833776 /nfs/dbraw/zinc/83/37/76/1063833776.db2.gz WXSBJTXSHWTSJD-UHFFFAOYSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001258810952 1063840662 /nfs/dbraw/zinc/84/06/62/1063840662.db2.gz SSQNDJQVROLEAC-DARKYYSBSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001258810953 1063840913 /nfs/dbraw/zinc/84/09/13/1063840913.db2.gz SSQNDJQVROLEAC-RKFFNLMFSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813189 1063842811 /nfs/dbraw/zinc/84/28/11/1063842811.db2.gz PMFHFHMSEQFIQI-HUYLIWGRSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001258812852 1063843254 /nfs/dbraw/zinc/84/32/54/1063843254.db2.gz NAKYAJGEMQTZJG-GJZGRUSLSA-N 2 1 306.881 4.169 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001258814512 1063845258 /nfs/dbraw/zinc/84/52/58/1063845258.db2.gz PMJMWYPENNUMEJ-RHSMWYFYSA-N 2 1 306.881 4.169 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828600 1063854183 /nfs/dbraw/zinc/85/41/83/1063854183.db2.gz OJGHNYHYQMYZJR-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828600 1063854187 /nfs/dbraw/zinc/85/41/87/1063854187.db2.gz OJGHNYHYQMYZJR-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+](C(CC(C)C)CC(C)C)CC1 ZINC001258834999 1063857915 /nfs/dbraw/zinc/85/79/15/1063857915.db2.gz KDNQLZLPUOCGNO-LJQANCHMSA-N 2 1 324.553 4.022 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[NH2+]CCP(C(C)C)C(C)C ZINC001258905643 1063878433 /nfs/dbraw/zinc/87/84/33/1063878433.db2.gz VINSAPJFMYCJAB-QGZVFWFLSA-N 2 1 302.487 4.385 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001258907910 1063880172 /nfs/dbraw/zinc/88/01/72/1063880172.db2.gz OCHAGTIKFIMJEL-HNNXBMFYSA-N 2 1 308.897 4.209 20 0 DIADMP CCCCCC[C@@H]1CCC[C@@H]1[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC001462099557 1063929726 /nfs/dbraw/zinc/92/97/26/1063929726.db2.gz QAOLNSMOCNXWTM-AQNXPRMDSA-N 2 1 324.553 4.216 20 0 DIADMP CCCCCC[C@@H]1CCC[C@@H]1[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC001462099557 1063929739 /nfs/dbraw/zinc/92/97/39/1063929739.db2.gz QAOLNSMOCNXWTM-AQNXPRMDSA-N 2 1 324.553 4.216 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H](C)C1 ZINC000379632388 1063984246 /nfs/dbraw/zinc/98/42/46/1063984246.db2.gz NQKVKYIFRKAUTL-ARXXEPJESA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H](C)C1 ZINC000379632388 1063984254 /nfs/dbraw/zinc/98/42/54/1063984254.db2.gz NQKVKYIFRKAUTL-ARXXEPJESA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(O)cc1 ZINC000379632713 1063984748 /nfs/dbraw/zinc/98/47/48/1063984748.db2.gz NXWSTYVOOKDHRQ-UWVAXJGDSA-N 2 1 324.468 4.096 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(O)cc1 ZINC000379632713 1063984757 /nfs/dbraw/zinc/98/47/57/1063984757.db2.gz NXWSTYVOOKDHRQ-UWVAXJGDSA-N 2 1 324.468 4.096 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c(C)c1 ZINC000379637581 1063985770 /nfs/dbraw/zinc/98/57/70/1063985770.db2.gz SMXOWCWZQJJGMJ-SIKLNZKXSA-N 2 1 322.496 4.446 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[C@@H](C)C1 ZINC000379632762 1063985999 /nfs/dbraw/zinc/98/59/99/1063985999.db2.gz SSGNZPKEECAQPT-QIYLELGZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)[C@@H](C)C1 ZINC000379632762 1063986007 /nfs/dbraw/zinc/98/60/07/1063986007.db2.gz SSGNZPKEECAQPT-QIYLELGZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379637607 1063986338 /nfs/dbraw/zinc/98/63/38/1063986338.db2.gz SPAFRROPEFXBAH-QIYLELGZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379637607 1063986348 /nfs/dbraw/zinc/98/63/48/1063986348.db2.gz SPAFRROPEFXBAH-QIYLELGZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380944336 1063989774 /nfs/dbraw/zinc/98/97/74/1063989774.db2.gz NYQMSHRAMSSRNW-JYRKZWEQSA-N 2 1 314.517 4.313 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC000381310635 1063991694 /nfs/dbraw/zinc/99/16/94/1063991694.db2.gz NROZXSNYZUWQOG-IYWMVGAKSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)C1 ZINC000381810947 1063994045 /nfs/dbraw/zinc/99/40/45/1063994045.db2.gz ZSOFQPQFINGWNB-QNDFHXLGSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390669539 1064165994 /nfs/dbraw/zinc/16/59/94/1064165994.db2.gz NMTVMYNBURENDX-RTBURBONSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390669539 1064166001 /nfs/dbraw/zinc/16/60/01/1064166001.db2.gz NMTVMYNBURENDX-RTBURBONSA-N 2 1 302.506 4.455 20 0 DIADMP CCCc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)s1 ZINC001279583284 1064359931 /nfs/dbraw/zinc/35/99/31/1064359931.db2.gz UXVMHSPIEGKDAN-GOSISDBHSA-N 2 1 306.519 4.008 20 0 DIADMP CCCc1ccc(C[NH+]2CCC[C@@]3(CCC[N@H+](C)C3)C2)s1 ZINC001279583284 1064359942 /nfs/dbraw/zinc/35/99/42/1064359942.db2.gz UXVMHSPIEGKDAN-GOSISDBHSA-N 2 1 306.519 4.008 20 0 DIADMP CCCc1ccc(C[NH+]2CCC[C@@]3(CCC[N@@H+](C)C3)C2)s1 ZINC001279583284 1064359952 /nfs/dbraw/zinc/35/99/52/1064359952.db2.gz UXVMHSPIEGKDAN-GOSISDBHSA-N 2 1 306.519 4.008 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC2(C1)CCC[N@@H+](CC(C)(C)OC)C2 ZINC001280056224 1064379205 /nfs/dbraw/zinc/37/92/05/1064379205.db2.gz LQQPJZPYGGQYDG-SFHVURJKSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC2(C1)CCC[N@@H+](CCOC(C)C)C2 ZINC001280081504 1064380508 /nfs/dbraw/zinc/38/05/08/1064380508.db2.gz SKKNNTFINURTPH-IBGZPJMESA-N 2 1 324.553 4.026 20 0 DIADMP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(C(C)C)nc3Cl)(C1)CCC2 ZINC001280184072 1064384048 /nfs/dbraw/zinc/38/40/48/1064384048.db2.gz KUKUJAJTOBMCFD-ZWKOTPCHSA-N 2 1 321.896 4.013 20 0 DIADMP c1ccc(CCCC[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000643458364 1064413596 /nfs/dbraw/zinc/41/35/96/1064413596.db2.gz QVVAOWFAMZOOPO-LEWJYISDSA-N 2 1 308.469 4.092 20 0 DIADMP Fc1cccc(C2([NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)CCC2)c1 ZINC000647802327 1064415057 /nfs/dbraw/zinc/41/50/57/1064415057.db2.gz JCQPTIPZJYUCTM-VQTJNVASSA-N 2 1 324.443 4.288 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCC3=CCCCC3)C2)CC1 ZINC001307439896 1065399012 /nfs/dbraw/zinc/39/90/12/1065399012.db2.gz CEAIFGPMYYIRTD-FQEVSTJZSA-N 2 1 304.522 4.321 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001307440436 1065402449 /nfs/dbraw/zinc/40/24/49/1065402449.db2.gz MMVWIPQEEKDCAR-SFHVURJKSA-N 2 1 300.490 4.295 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CCc1ccccc1)C1CCCC1 ZINC001307458027 1065412495 /nfs/dbraw/zinc/41/24/95/1065412495.db2.gz MWFOOQCICMQWSN-UHFFFAOYSA-N 2 1 302.506 4.206 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)C1CCC1 ZINC001307488873 1065432329 /nfs/dbraw/zinc/43/23/29/1065432329.db2.gz YFLMFNHKWBKQCN-UHFFFAOYSA-N 2 1 314.517 4.206 20 0 DIADMP CC(C)C[C@H](C)C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001307496412 1065439616 /nfs/dbraw/zinc/43/96/16/1065439616.db2.gz LMQVIDDPLUUGSA-AZUAARDMSA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@H](C)C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001307496412 1065439625 /nfs/dbraw/zinc/43/96/25/1065439625.db2.gz LMQVIDDPLUUGSA-AZUAARDMSA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@H](C)C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001307496412 1065439631 /nfs/dbraw/zinc/43/96/31/1065439631.db2.gz LMQVIDDPLUUGSA-AZUAARDMSA-N 2 1 302.506 4.123 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c3ccccc23)CC1 ZINC001307515202 1065455894 /nfs/dbraw/zinc/45/58/94/1065455894.db2.gz IQQGVBBQMVRACY-UHFFFAOYSA-N 2 1 316.876 4.409 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c3ccccc23)CC1 ZINC001307515202 1065455900 /nfs/dbraw/zinc/45/59/00/1065455900.db2.gz IQQGVBBQMVRACY-UHFFFAOYSA-N 2 1 316.876 4.409 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c(C)c1 ZINC001307524794 1065462995 /nfs/dbraw/zinc/46/29/95/1065462995.db2.gz ZUJFNALSTLCEBI-OTWHNJEPSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001307524794 1065463006 /nfs/dbraw/zinc/46/30/06/1065463006.db2.gz ZUJFNALSTLCEBI-OTWHNJEPSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c(C)c1 ZINC001307524794 1065463012 /nfs/dbraw/zinc/46/30/12/1065463012.db2.gz ZUJFNALSTLCEBI-OTWHNJEPSA-N 2 1 300.490 4.089 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CC/C=C/c2ccccc2)cc1 ZINC001307644794 1065538591 /nfs/dbraw/zinc/53/85/91/1065538591.db2.gz SUPIKVOEYVNHJN-YRNVUSSQSA-N 2 1 308.469 4.284 20 0 DIADMP C[C@@H]([NH2+]CC1CCC2(CC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001307670760 1065553006 /nfs/dbraw/zinc/55/30/06/1065553006.db2.gz SYQCNGBCJFUODY-SJLPKXTDSA-N 2 1 304.522 4.199 20 0 DIADMP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670205 1065554617 /nfs/dbraw/zinc/55/46/17/1065554617.db2.gz QKMJEUAGTWHYLI-DOTOQJQBSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670205 1065554624 /nfs/dbraw/zinc/55/46/24/1065554624.db2.gz QKMJEUAGTWHYLI-DOTOQJQBSA-N 2 1 320.908 4.391 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC001307725123 1065589742 /nfs/dbraw/zinc/58/97/42/1065589742.db2.gz LOCIQVJSSOPYSS-UHFFFAOYSA-N 2 1 300.490 4.118 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001307785569 1065619385 /nfs/dbraw/zinc/61/93/85/1065619385.db2.gz NCDAQEXJZCVDFA-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001307785569 1065619394 /nfs/dbraw/zinc/61/93/94/1065619394.db2.gz NCDAQEXJZCVDFA-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001307785569 1065619401 /nfs/dbraw/zinc/61/94/01/1065619401.db2.gz NCDAQEXJZCVDFA-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP CC[N@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001307825355 1065640258 /nfs/dbraw/zinc/64/02/58/1065640258.db2.gz HWXQSTBRVXJIBU-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CC[C@@H](C2CCC2)C1 ZINC001307845825 1065650017 /nfs/dbraw/zinc/65/00/17/1065650017.db2.gz UQQYINCUFQDLLY-OAQYLSRUSA-N 2 1 312.501 4.295 20 0 DIADMP FCC[C@@H]1CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001307932188 1065686424 /nfs/dbraw/zinc/68/64/24/1065686424.db2.gz VOIAGGMWFAYUCY-SFHVURJKSA-N 2 1 318.480 4.244 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2cccc3ncccc23)CC1 ZINC001308057563 1065745724 /nfs/dbraw/zinc/74/57/24/1065745724.db2.gz ZYQCJGDHPNPBNJ-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC001308198795 1065806960 /nfs/dbraw/zinc/80/69/60/1065806960.db2.gz CMICIKVXHSYGPS-FUHIMQAGSA-N 2 1 300.490 4.197 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc3occc3c2)C1 ZINC001308203503 1065811542 /nfs/dbraw/zinc/81/15/42/1065811542.db2.gz FOGJRIGYVQWTSH-CALCHBBNSA-N 2 1 314.473 4.281 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]C2CCC3(CCC3)CC2)C1 ZINC001308203547 1065812008 /nfs/dbraw/zinc/81/20/08/1065812008.db2.gz GVZQBQNPHLCQIH-HDICACEKSA-N 2 1 306.538 4.447 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1cccc(F)c1 ZINC001308203149 1065812089 /nfs/dbraw/zinc/81/20/89/1065812089.db2.gz LZLUALMKAIGBIZ-PYUISTEWSA-N 2 1 304.453 4.083 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1cccc(F)c1 ZINC001308203148 1065812848 /nfs/dbraw/zinc/81/28/48/1065812848.db2.gz LZLUALMKAIGBIZ-JEZWAEDTSA-N 2 1 304.453 4.083 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)CC1 ZINC001308206398 1065815377 /nfs/dbraw/zinc/81/53/77/1065815377.db2.gz XYXNUFLIQSNGFR-HGHGUNKESA-N 2 1 314.517 4.374 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2C[C@H](c3ccccc3)C[C@H](C)C2)C1 ZINC001308225220 1065831873 /nfs/dbraw/zinc/83/18/73/1065831873.db2.gz OHOVEAMLBNWPSN-UYWIDEMCSA-N 2 1 314.517 4.280 20 0 DIADMP Cc1coc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC001308255241 1065859692 /nfs/dbraw/zinc/85/96/92/1065859692.db2.gz XAOGNYNHZLJTJQ-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP C[NH+](C)CC1(C[NH2+]Cc2ccc(Cl)c(Cl)c2)CCCC1 ZINC001308365482 1065943664 /nfs/dbraw/zinc/94/36/64/1065943664.db2.gz DZCBUBPEBKCWNS-UHFFFAOYSA-N 2 1 315.288 4.205 20 0 DIADMP CC(C)C[N@@H+](C)CCCNCc1ccc(F)c(Cl)c1Cl ZINC001308458747 1066002433 /nfs/dbraw/zinc/00/24/33/1066002433.db2.gz YDUSUQFRVJJDDD-UHFFFAOYSA-N 2 1 321.267 4.200 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1 ZINC001308484405 1066021604 /nfs/dbraw/zinc/02/16/04/1066021604.db2.gz CIMMEBUHSPNUPA-CEQLMSFQSA-N 2 1 314.517 4.170 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC2(C)CCCC2)CC1 ZINC001308590736 1066102706 /nfs/dbraw/zinc/10/27/06/1066102706.db2.gz CJYPGVJNZVBKRV-UHFFFAOYSA-N 2 1 314.517 4.411 20 0 DIADMP CC[C@H](C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1)c1ccccc1 ZINC001308612624 1066118131 /nfs/dbraw/zinc/11/81/31/1066118131.db2.gz PORPEBYZXNYEIP-LJQANCHMSA-N 2 1 302.506 4.232 20 0 DIADMP CC1=CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC001308636140 1066130518 /nfs/dbraw/zinc/13/05/18/1066130518.db2.gz UGQHBTQYYXCXFM-FNAHDJPLSA-N 2 1 324.512 4.376 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cccc(CC3CCC3)c2)CC1 ZINC001308661402 1066142333 /nfs/dbraw/zinc/14/23/33/1066142333.db2.gz YIDCULYCZSXTFC-UHFFFAOYSA-N 2 1 314.517 4.334 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001308725045 1066200098 /nfs/dbraw/zinc/20/00/98/1066200098.db2.gz MYQHYPQWIJBYRA-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H](C)CC12CC3CC(CC(C3)C1)C2 ZINC001308737086 1066210965 /nfs/dbraw/zinc/21/09/65/1066210965.db2.gz XQSRWUIGILOROI-HZCWPMTASA-N 2 1 306.538 4.301 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)C[C@H](C)c1cc(F)cc(F)c1 ZINC001308745187 1066219100 /nfs/dbraw/zinc/21/91/00/1066219100.db2.gz RDHTXKHATPXFLO-HNNXBMFYSA-N 2 1 312.448 4.122 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)Cc1ccccc1SCC ZINC001308750275 1066224932 /nfs/dbraw/zinc/22/49/32/1066224932.db2.gz KBDABHKWKRRENH-AEFFLSMTSA-N 2 1 320.546 4.194 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)Cc1ccccc1SCC ZINC001308750275 1066224951 /nfs/dbraw/zinc/22/49/51/1066224951.db2.gz KBDABHKWKRRENH-AEFFLSMTSA-N 2 1 320.546 4.194 20 0 DIADMP CC/C=C/C[NH2+]C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001308782451 1066254351 /nfs/dbraw/zinc/25/43/51/1066254351.db2.gz NYQMHSHHLIXBOZ-VMLCMGRWSA-N 2 1 314.517 4.481 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC001308794560 1066270596 /nfs/dbraw/zinc/27/05/96/1066270596.db2.gz XTBFGZIOLQBJEG-DLBZAZTESA-N 2 1 315.505 4.199 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC001308794560 1066270607 /nfs/dbraw/zinc/27/06/07/1066270607.db2.gz XTBFGZIOLQBJEG-DLBZAZTESA-N 2 1 315.505 4.199 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H](C)CC12CC3CC(CC(C3)C1)C2 ZINC001308802844 1066277663 /nfs/dbraw/zinc/27/76/63/1066277663.db2.gz OVNJDQCXSAQJSR-HZCWPMTASA-N 2 1 306.538 4.300 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H](C)CC12CC3CC(CC(C3)C1)C2 ZINC001308802844 1066277674 /nfs/dbraw/zinc/27/76/74/1066277674.db2.gz OVNJDQCXSAQJSR-HZCWPMTASA-N 2 1 306.538 4.300 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001308801904 1066278231 /nfs/dbraw/zinc/27/82/31/1066278231.db2.gz QHIFZKKEZDNEAL-KGLIPLIRSA-N 2 1 316.942 4.433 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001308801904 1066278244 /nfs/dbraw/zinc/27/82/44/1066278244.db2.gz QHIFZKKEZDNEAL-KGLIPLIRSA-N 2 1 316.942 4.433 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@@H]3CC[C@H]3C3CC3)C2)cc1 ZINC001308803496 1066279292 /nfs/dbraw/zinc/27/92/92/1066279292.db2.gz VXMJHOJVYDNSKX-HLAWJBBLSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1ccc([C@H]2CCC[C@@H]2[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001308816006 1066290773 /nfs/dbraw/zinc/29/07/73/1066290773.db2.gz UBKOJTIVXSQMFK-MOPGFXCFSA-N 2 1 300.490 4.095 20 0 DIADMP Cc1ccc([C@H]2CCC[C@@H]2[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001308816006 1066290776 /nfs/dbraw/zinc/29/07/76/1066290776.db2.gz UBKOJTIVXSQMFK-MOPGFXCFSA-N 2 1 300.490 4.095 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2ccc(F)cc2C)CC1 ZINC001308817536 1066292946 /nfs/dbraw/zinc/29/29/46/1066292946.db2.gz FVLQNOMSPWEOEB-IBGZPJMESA-N 2 1 304.453 4.003 20 0 DIADMP Clc1cccc(CC[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001308906085 1066384533 /nfs/dbraw/zinc/38/45/33/1066384533.db2.gz PRMIPXPVEKNHNW-IBGZPJMESA-N 2 1 320.908 4.269 20 0 DIADMP Clc1cccc(CC[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001308906085 1066384544 /nfs/dbraw/zinc/38/45/44/1066384544.db2.gz PRMIPXPVEKNHNW-IBGZPJMESA-N 2 1 320.908 4.269 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1coc2ccccc12 ZINC001308914074 1066392011 /nfs/dbraw/zinc/39/20/11/1066392011.db2.gz KIDLXCNVFCDWRK-UHFFFAOYSA-N 2 1 300.446 4.131 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C3CCC=CCC3)CC[N@H+]2C2CC2)cc1 ZINC001308944232 1066411234 /nfs/dbraw/zinc/41/12/34/1066411234.db2.gz RETGQVOMVPOJMO-FPOVZHCZSA-N 2 1 310.485 4.443 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C3CCC=CCC3)CC[N@@H+]2C2CC2)cc1 ZINC001308944232 1066411242 /nfs/dbraw/zinc/41/12/42/1066411242.db2.gz RETGQVOMVPOJMO-FPOVZHCZSA-N 2 1 310.485 4.443 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000152382595 335043512 /nfs/dbraw/zinc/04/35/12/335043512.db2.gz FRQWAPDAIXZARS-UONOGXRCSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000152382595 335043514 /nfs/dbraw/zinc/04/35/14/335043514.db2.gz FRQWAPDAIXZARS-UONOGXRCSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000152382595 335043515 /nfs/dbraw/zinc/04/35/15/335043515.db2.gz FRQWAPDAIXZARS-UONOGXRCSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000152382595 335043517 /nfs/dbraw/zinc/04/35/17/335043517.db2.gz FRQWAPDAIXZARS-UONOGXRCSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442716069 335048516 /nfs/dbraw/zinc/04/85/16/335048516.db2.gz LXYMVVGGCGHBMU-RYTJFDOTSA-N 2 1 316.480 4.158 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)c1 ZINC000284133193 131051583 /nfs/dbraw/zinc/05/15/83/131051583.db2.gz OHXYDCNDRRUELU-OAQYLSRUSA-N 2 1 324.468 4.011 20 0 DIADMP Cc1ccnc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000285846357 131205206 /nfs/dbraw/zinc/20/52/06/131205206.db2.gz XQDPHWGNXOCBNE-KRWDZBQOSA-N 2 1 311.473 4.081 20 0 DIADMP CN(Cc1c(Cl)oc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000289220237 131367083 /nfs/dbraw/zinc/36/70/83/131367083.db2.gz CKHRHZUJSKAGNA-PBWFPOADSA-N 2 1 318.848 4.143 20 0 DIADMP Cc1ccc([C@H](CNc2cc[nH+]c3ccsc32)[NH+](C)C)cc1 ZINC000462376395 332868442 /nfs/dbraw/zinc/86/84/42/332868442.db2.gz QOXHAQWAPSDRIL-KRWDZBQOSA-N 2 1 311.454 4.320 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000530914641 331635166 /nfs/dbraw/zinc/63/51/66/331635166.db2.gz CLBXGQWWIRAXLM-IRXDYDNUSA-N 2 1 316.420 4.048 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000530914640 331635184 /nfs/dbraw/zinc/63/51/84/331635184.db2.gz CLBXGQWWIRAXLM-IAGOWNOFSA-N 2 1 316.420 4.048 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)[C@H](C)C1 ZINC000426290782 332033167 /nfs/dbraw/zinc/03/31/67/332033167.db2.gz KJLOYXVEPBDNDQ-XBFCOCLRSA-N 2 1 312.910 4.099 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)[C@H](C)C1 ZINC000426290782 332033169 /nfs/dbraw/zinc/03/31/69/332033169.db2.gz KJLOYXVEPBDNDQ-XBFCOCLRSA-N 2 1 312.910 4.099 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(-c3ccncc3)c2)CC1 ZINC000092165649 332114142 /nfs/dbraw/zinc/11/41/42/332114142.db2.gz SMCHDIDGXIRDHD-UHFFFAOYSA-N 2 1 323.484 4.055 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CCC2 ZINC000569522986 332123869 /nfs/dbraw/zinc/12/38/69/332123869.db2.gz FFSAXFOKXJCCPF-FAFZWHIHSA-N 2 1 318.892 4.324 20 0 DIADMP c1csc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000564655648 332132417 /nfs/dbraw/zinc/13/24/17/332132417.db2.gz NZLXXVSMWNYJBV-KRWDZBQOSA-N 2 1 312.482 4.035 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]Cc1nc2c(s1)C[N@@H+](C(C)C)CC2 ZINC000449443805 332198444 /nfs/dbraw/zinc/19/84/44/332198444.db2.gz VZAMLJYZDGRZTD-OAHLLOKOSA-N 2 1 321.534 4.134 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]Cc1nc2c(s1)C[N@H+](C(C)C)CC2 ZINC000449443805 332198445 /nfs/dbraw/zinc/19/84/45/332198445.db2.gz VZAMLJYZDGRZTD-OAHLLOKOSA-N 2 1 321.534 4.134 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(F)c2ccccc21 ZINC000559740336 332278322 /nfs/dbraw/zinc/27/83/22/332278322.db2.gz OJEBHKTWBDNSEI-CABCVRRESA-N 2 1 312.432 4.114 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000559767082 332280256 /nfs/dbraw/zinc/28/02/56/332280256.db2.gz PBECISNODSINGW-INDMIFKZSA-N 2 1 318.530 4.086 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000559767082 332280257 /nfs/dbraw/zinc/28/02/57/332280257.db2.gz PBECISNODSINGW-INDMIFKZSA-N 2 1 318.530 4.086 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559845827 332284965 /nfs/dbraw/zinc/28/49/65/332284965.db2.gz VMJKZLVBLWFWJN-GTAWCEEGSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559845827 332284967 /nfs/dbraw/zinc/28/49/67/332284967.db2.gz VMJKZLVBLWFWJN-GTAWCEEGSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CC[C@@H](C)c2ccccc2)CC1 ZINC000560007520 332300722 /nfs/dbraw/zinc/30/07/22/332300722.db2.gz HMOOUTICGDCHCA-GOSISDBHSA-N 2 1 302.506 4.232 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCC2(C)C)C[N@H+]1Cc1ccccc1 ZINC000560244835 332322741 /nfs/dbraw/zinc/32/27/41/332322741.db2.gz OYSKWAIXCGXWGP-NEWSRXKRSA-N 2 1 300.490 4.065 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000560484138 332345054 /nfs/dbraw/zinc/34/50/54/332345054.db2.gz BBRJWUMULJQQTC-RYRKJORJSA-N 2 1 304.503 4.219 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000560484138 332345055 /nfs/dbraw/zinc/34/50/55/332345055.db2.gz BBRJWUMULJQQTC-RYRKJORJSA-N 2 1 304.503 4.219 20 0 DIADMP [NH3+]C[C@@H]1C[N@@H+](Cc2cccc3ccccc32)C[C@H]1c1ccccc1 ZINC000261799329 332379301 /nfs/dbraw/zinc/37/93/01/332379301.db2.gz QTWRPERMFHWDEB-IRLDBZIGSA-N 2 1 316.448 4.014 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)c2)cc1 ZINC000378905044 333062442 /nfs/dbraw/zinc/06/24/42/333062442.db2.gz YQOWHYFYFKIZEU-MOPGFXCFSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)c2)cc1 ZINC000378905044 333062443 /nfs/dbraw/zinc/06/24/43/333062443.db2.gz YQOWHYFYFKIZEU-MOPGFXCFSA-N 2 1 322.452 4.195 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000379037408 333098483 /nfs/dbraw/zinc/09/84/83/333098483.db2.gz DDDUOQBLCXTERI-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccsc2)c1 ZINC000177979695 333133976 /nfs/dbraw/zinc/13/39/76/333133976.db2.gz WEHAUUOVBDJBRS-OAHLLOKOSA-N 2 1 302.487 4.439 20 0 DIADMP c1cn2c(cccc2C[N@H+]2C[C@@H](c3ccccc3)[C@@H]3CCC[C@H]32)n1 ZINC000582089598 333208917 /nfs/dbraw/zinc/20/89/17/333208917.db2.gz MYLDSCWEMCKJSK-SLFFLAALSA-N 2 1 317.436 4.102 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000500645294 333251745 /nfs/dbraw/zinc/25/17/45/333251745.db2.gz CLWFLRPPHCXRJA-OTWHNJEPSA-N 2 1 317.521 4.271 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000497850380 333301029 /nfs/dbraw/zinc/30/10/29/333301029.db2.gz ZDQDBMKTIKRGCS-APWZRJJASA-N 2 1 321.484 4.162 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525787121 333313455 /nfs/dbraw/zinc/31/34/55/333313455.db2.gz OJVACZQPIQVZBV-MSOLQXFVSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697164 333315642 /nfs/dbraw/zinc/31/56/42/333315642.db2.gz RYJWPSVBBFUWJL-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697164 333315643 /nfs/dbraw/zinc/31/56/43/333315643.db2.gz RYJWPSVBBFUWJL-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[N@@H+](C)CCCN[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000221920607 333379870 /nfs/dbraw/zinc/37/98/70/333379870.db2.gz IDRKKDXBPJPBDL-ZDUSSCGKSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000221920607 333379871 /nfs/dbraw/zinc/37/98/71/333379871.db2.gz IDRKKDXBPJPBDL-ZDUSSCGKSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000221920607 333379872 /nfs/dbraw/zinc/37/98/72/333379872.db2.gz IDRKKDXBPJPBDL-ZDUSSCGKSA-N 2 1 302.384 4.086 20 0 DIADMP Cc1cc[nH+]c(N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390851795 333399703 /nfs/dbraw/zinc/39/97/03/333399703.db2.gz HERVFEUUJJNJIR-GOSISDBHSA-N 2 1 309.457 4.103 20 0 DIADMP Cc1cc[nH+]c(N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390851795 333399705 /nfs/dbraw/zinc/39/97/05/333399705.db2.gz HERVFEUUJJNJIR-GOSISDBHSA-N 2 1 309.457 4.103 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000021518092 333423612 /nfs/dbraw/zinc/42/36/12/333423612.db2.gz IWFYDYZGFWLNDH-ZDUSSCGKSA-N 2 1 302.384 4.088 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(C)cc1)C1CCC1 ZINC000187246291 333427260 /nfs/dbraw/zinc/42/72/60/333427260.db2.gz WNCTWWTXVZYKKC-FQEVSTJZSA-N 2 1 311.473 4.411 20 0 DIADMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2ccsc2)c2ccc(Cl)cc2)C1 ZINC000563424255 333603399 /nfs/dbraw/zinc/60/33/99/333603399.db2.gz KDSZUGNUHBWEAG-ZACQAIPSSA-N 2 1 320.889 4.350 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414668483 334063030 /nfs/dbraw/zinc/06/30/30/334063030.db2.gz AAWFGEVARXPRED-RDBSUJKOSA-N 2 1 314.395 4.086 20 0 DIADMP c1c2ccccc2oc1CC[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415084293 334272662 /nfs/dbraw/zinc/27/26/62/334272662.db2.gz GSRYDECFBGKONR-UYAOXDASSA-N 2 1 320.436 4.058 20 0 DIADMP Clc1cccc([C@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000415081895 334272852 /nfs/dbraw/zinc/27/28/52/334272852.db2.gz CQBQBWIFNIJWNP-RTBURBONSA-N 2 1 314.860 4.161 20 0 DIADMP Clc1cccc([C@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000415081894 334272998 /nfs/dbraw/zinc/27/29/98/334272998.db2.gz CQBQBWIFNIJWNP-RBUKOAKNSA-N 2 1 314.860 4.161 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000415082246 334273187 /nfs/dbraw/zinc/27/31/87/334273187.db2.gz CWXDBZIYJDLZIK-CQSZACIVSA-N 2 1 314.404 4.021 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+]C[C@@H]1CC[N@@H+](CC)C1 ZINC000320382365 334248858 /nfs/dbraw/zinc/24/88/58/334248858.db2.gz VUZUBWZRLUDDQD-INIZCTEOSA-N 2 1 314.473 4.207 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000534497345 334277828 /nfs/dbraw/zinc/27/78/28/334277828.db2.gz BWJUIIHHEDPEGV-CQSZACIVSA-N 2 1 304.503 4.076 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)Cc1cccs1 ZINC000415090301 334279938 /nfs/dbraw/zinc/27/99/38/334279938.db2.gz YXJVESSPOCNNKR-VDZJLULYSA-N 2 1 314.498 4.010 20 0 DIADMP Clc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000415104248 334282836 /nfs/dbraw/zinc/28/28/36/334282836.db2.gz KYEIAMHQBWKUSE-CWRNSKLLSA-N 2 1 313.272 4.004 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117069 334283979 /nfs/dbraw/zinc/28/39/79/334283979.db2.gz FWALRRLGILVVJB-MDASCCDHSA-N 2 1 314.860 4.484 20 0 DIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837774 334291178 /nfs/dbraw/zinc/29/11/78/334291178.db2.gz OALNBFBNDCMGOL-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837774 334291180 /nfs/dbraw/zinc/29/11/80/334291180.db2.gz OALNBFBNDCMGOL-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837774 334291181 /nfs/dbraw/zinc/29/11/81/334291181.db2.gz OALNBFBNDCMGOL-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837774 334291182 /nfs/dbraw/zinc/29/11/82/334291182.db2.gz OALNBFBNDCMGOL-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303783103 334330451 /nfs/dbraw/zinc/33/04/51/334330451.db2.gz SVEJBGBEKWJULW-GHTZIAJQSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303783103 334330453 /nfs/dbraw/zinc/33/04/53/334330453.db2.gz SVEJBGBEKWJULW-GHTZIAJQSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783103 334330454 /nfs/dbraw/zinc/33/04/54/334330454.db2.gz SVEJBGBEKWJULW-GHTZIAJQSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783103 334330456 /nfs/dbraw/zinc/33/04/56/334330456.db2.gz SVEJBGBEKWJULW-GHTZIAJQSA-N 2 1 308.469 4.172 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2)C1 ZINC000531970662 334331274 /nfs/dbraw/zinc/33/12/74/334331274.db2.gz DWHSDABLJDZOJF-IFMALSPDSA-N 2 1 322.496 4.292 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCCc3ccc(C(C)C)cc32)CC1 ZINC000534908575 334345531 /nfs/dbraw/zinc/34/55/31/334345531.db2.gz OXVXTZVPYRHVDD-FQEVSTJZSA-N 2 1 300.490 4.261 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCc3ccc(C(C)C)cc32)CC1 ZINC000534908576 334345598 /nfs/dbraw/zinc/34/55/98/334345598.db2.gz OXVXTZVPYRHVDD-HXUWFJFHSA-N 2 1 300.490 4.261 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164626514 334635156 /nfs/dbraw/zinc/63/51/56/334635156.db2.gz QLYLBTYOMYBFAS-HNNXBMFYSA-N 2 1 317.502 4.435 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000188068934 334635843 /nfs/dbraw/zinc/63/58/43/334635843.db2.gz WRKOASFQBXPENY-VQTJNVASSA-N 2 1 311.473 4.072 20 0 DIADMP Cc1[nH+]ccn1CC[NH+]1CCC(c2cccc3ccccc32)CC1 ZINC000346304307 335398368 /nfs/dbraw/zinc/39/83/68/335398368.db2.gz HLZGHQKVJPPNTP-UHFFFAOYSA-N 2 1 319.452 4.224 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCCCS2)cc1 ZINC000346809557 335442474 /nfs/dbraw/zinc/44/24/74/335442474.db2.gz QATJVZSWJDKOQZ-RDTXWAMCSA-N 2 1 315.486 4.117 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+]([C@H](C)CCc2ccccc2)CC1 ZINC000352349780 336213508 /nfs/dbraw/zinc/21/35/08/336213508.db2.gz MVHLOGOIFLERSF-GOSISDBHSA-N 2 1 324.468 4.255 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H](C)c2ccccc2)CC1 ZINC000352364506 336214407 /nfs/dbraw/zinc/21/44/07/336214407.db2.gz FCTVRXIYVHCNAA-KRWDZBQOSA-N 2 1 310.441 4.037 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000532542150 336254686 /nfs/dbraw/zinc/25/46/86/336254686.db2.gz PENZACQCULRHJG-KGVIQGDOSA-N 2 1 322.496 4.214 20 0 DIADMP Cc1cc(F)ccc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000101595573 336283581 /nfs/dbraw/zinc/28/35/81/336283581.db2.gz AUFFGPOLJGRGRC-UHFFFAOYSA-N 2 1 314.448 4.264 20 0 DIADMP Clc1csc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000192928121 336284463 /nfs/dbraw/zinc/28/44/63/336284463.db2.gz GLBLFODAOVQNJX-OAHLLOKOSA-N 2 1 320.889 4.013 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](CC)c2ccccc2OC)CC1 ZINC000193023348 336287131 /nfs/dbraw/zinc/28/71/31/336287131.db2.gz ZRRCHNGXUHMSHV-GOSISDBHSA-N 2 1 304.478 4.000 20 0 DIADMP c1coc([C@H](CNc2cc[nH+]c3ccsc32)[NH+]2CCCC2)c1 ZINC000301364444 336302647 /nfs/dbraw/zinc/30/26/47/336302647.db2.gz PNWDCFUVEKOMTH-HNNXBMFYSA-N 2 1 313.426 4.138 20 0 DIADMP c1coc([C@@H](CNc2cc[nH+]c3ccsc32)[NH+]2CCCC2)c1 ZINC000301364445 336302689 /nfs/dbraw/zinc/30/26/89/336302689.db2.gz PNWDCFUVEKOMTH-OAHLLOKOSA-N 2 1 313.426 4.138 20 0 DIADMP CC(C)[NH+]1CCC(N(C)c2cc[nH+]c3ccc(Cl)cc32)CC1 ZINC000301550678 336314161 /nfs/dbraw/zinc/31/41/61/336314161.db2.gz VHIJVVZMOOSIQC-UHFFFAOYSA-N 2 1 317.864 4.197 20 0 DIADMP Cc1cc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811238 336370208 /nfs/dbraw/zinc/37/02/08/336370208.db2.gz GZGCBPJPKLHMEN-DLBZAZTESA-N 2 1 319.811 4.040 20 0 DIADMP Cc1cc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811238 336370209 /nfs/dbraw/zinc/37/02/09/336370209.db2.gz GZGCBPJPKLHMEN-DLBZAZTESA-N 2 1 319.811 4.040 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000152470255 336388692 /nfs/dbraw/zinc/38/86/92/336388692.db2.gz DXKRVUNSZGRYCG-RYUDHWBXSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472273 336389234 /nfs/dbraw/zinc/38/92/34/336389234.db2.gz BGPNMCSGHUBEIC-HOTGVXAUSA-N 2 1 310.441 4.082 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472273 336389235 /nfs/dbraw/zinc/38/92/35/336389235.db2.gz BGPNMCSGHUBEIC-HOTGVXAUSA-N 2 1 310.441 4.082 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](CCC(C)C)c1ccoc1 ZINC000353401469 336415512 /nfs/dbraw/zinc/41/55/12/336415512.db2.gz IDPILBABTYMZPR-MAUKXSAKSA-N 2 1 303.450 4.188 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000194900488 336424678 /nfs/dbraw/zinc/42/46/78/336424678.db2.gz LFIVGJWUYCOKRZ-CQSZACIVSA-N 2 1 303.475 4.044 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCSCC(C)C)cc1 ZINC000358364208 336626474 /nfs/dbraw/zinc/62/64/74/336626474.db2.gz HRJSKSWFIWEFNT-HNNXBMFYSA-N 2 1 317.502 4.221 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000359274545 336665258 /nfs/dbraw/zinc/66/52/58/336665258.db2.gz DNPFYUUDCONCEF-IBGZPJMESA-N 2 1 315.436 4.160 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H]1CCSc2ccccc21)C(C)C ZINC000361806851 336773819 /nfs/dbraw/zinc/77/38/19/336773819.db2.gz OTTSJESCPBBEON-KRWDZBQOSA-N 2 1 306.519 4.322 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCOc3c(Cl)cccc32)C1 ZINC000361971902 336780602 /nfs/dbraw/zinc/78/06/02/336780602.db2.gz OASVNTNAMXYEEF-VBQJREDUSA-N 2 1 322.880 4.016 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000377101810 337046817 /nfs/dbraw/zinc/04/68/17/337046817.db2.gz HGNSHAJHWJSMSZ-TUKIKUTGSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1cc2cc(Cl)ccc2o1 ZINC000377798944 337061464 /nfs/dbraw/zinc/06/14/64/337061464.db2.gz OTMIXEXWTDIPRW-MFKMUULPSA-N 2 1 315.804 4.017 20 0 DIADMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1 ZINC000173386286 337135000 /nfs/dbraw/zinc/13/50/00/337135000.db2.gz AGIDINBZUUYJHU-SUMWQHHRSA-N 2 1 305.853 4.222 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)s1 ZINC000178097525 337160557 /nfs/dbraw/zinc/16/05/57/337160557.db2.gz BPEKUTXKICBKJZ-KBPBESRZSA-N 2 1 309.523 4.065 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000178111418 337162381 /nfs/dbraw/zinc/16/23/81/337162381.db2.gz IZHMHGBIBYLRBM-ZNMIVQPWSA-N 2 1 323.550 4.169 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000178409552 337164552 /nfs/dbraw/zinc/16/45/52/337164552.db2.gz DAJFTDZYAFTCNA-AWEZNQCLSA-N 2 1 309.523 4.102 20 0 DIADMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000178707235 337166288 /nfs/dbraw/zinc/16/62/88/337166288.db2.gz LFLSZRPTIIPMGE-SUMWQHHRSA-N 2 1 305.853 4.222 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398033079 337304807 /nfs/dbraw/zinc/30/48/07/337304807.db2.gz OGSQBBQPBZBHPP-KNKQGSTJSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398033079 337304808 /nfs/dbraw/zinc/30/48/08/337304808.db2.gz OGSQBBQPBZBHPP-KNKQGSTJSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(C)CCCC1 ZINC000398115761 337306199 /nfs/dbraw/zinc/30/61/99/337306199.db2.gz FNPWSSJFSJZMNW-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(C)CCCC1 ZINC000398115763 337306231 /nfs/dbraw/zinc/30/62/31/337306231.db2.gz FNPWSSJFSJZMNW-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1nccc2ccccc21 ZINC000584439553 337325770 /nfs/dbraw/zinc/32/57/70/337325770.db2.gz APCGCNXWUYCIOI-IAGOWNOFSA-N 2 1 311.473 4.150 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1nccc2ccccc21 ZINC000584439553 337325771 /nfs/dbraw/zinc/32/57/71/337325771.db2.gz APCGCNXWUYCIOI-IAGOWNOFSA-N 2 1 311.473 4.150 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000247015243 337556896 /nfs/dbraw/zinc/55/68/96/337556896.db2.gz KNOYUVLQHJDDDB-NWANDNLSSA-N 2 1 309.523 4.098 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c(C)c1 ZINC000422706853 337683585 /nfs/dbraw/zinc/68/35/85/337683585.db2.gz GFJISOUOLJXFFH-DSKINZAPSA-N 2 1 308.469 4.447 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C[C@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC000422807741 337687508 /nfs/dbraw/zinc/68/75/08/337687508.db2.gz PIEFSBONJMFWCY-URVUXULASA-N 2 1 320.480 4.189 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]C[C@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC000422807740 337687551 /nfs/dbraw/zinc/68/75/51/337687551.db2.gz PIEFSBONJMFWCY-SJBKTWHCSA-N 2 1 320.480 4.189 20 0 DIADMP c1ccc([C@H]([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)cc1 ZINC000422813823 337687937 /nfs/dbraw/zinc/68/79/37/337687937.db2.gz ZWOYLXBHFSLKQK-HKBOAZHASA-N 2 1 306.453 4.221 20 0 DIADMP C[C@@H]([NH2+]CCCc1ccc(Cl)cc1Cl)c1c[nH+]ccc1N ZINC000422817476 337688001 /nfs/dbraw/zinc/68/80/01/337688001.db2.gz DFKLAVLBQNREAC-LLVKDONJSA-N 2 1 324.255 4.084 20 0 DIADMP [NH3+][C@H]1C[C@@H]([NH2+]Cc2ccc(OC3CCCC3)cc2)c2ccccc21 ZINC000422950828 337694526 /nfs/dbraw/zinc/69/45/26/337694526.db2.gz ZDEONOYLPRDVSV-LEWJYISDSA-N 2 1 322.452 4.242 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423063007 337697845 /nfs/dbraw/zinc/69/78/45/337697845.db2.gz OEDHYEXLQJJXTH-BRWVUGGUSA-N 2 1 320.358 4.067 20 0 DIADMP CCCOc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)c(C)c1 ZINC000423071812 337698245 /nfs/dbraw/zinc/69/82/45/337698245.db2.gz OXXINEOTVFSAPU-UXHICEINSA-N 2 1 310.441 4.018 20 0 DIADMP COCCCC[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000423085318 337698768 /nfs/dbraw/zinc/69/87/68/337698768.db2.gz KCXQWZWQMAHOHM-ACRUOGEOSA-N 2 1 324.468 4.279 20 0 DIADMP FC1(F)CCCC[C@H](C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC000423136219 337701286 /nfs/dbraw/zinc/70/12/86/337701286.db2.gz UXFDKKFUKRAKPR-JQHSSLGASA-N 2 1 322.443 4.285 20 0 DIADMP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000423383995 337717789 /nfs/dbraw/zinc/71/77/89/337717789.db2.gz FVHAOTMRFYDPSF-ZMYBRWDISA-N 2 1 314.860 4.017 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(Cl)cc1Cl ZINC000423386432 337717958 /nfs/dbraw/zinc/71/79/58/337717958.db2.gz HFEBZWBTAHACKO-LKTVYLICSA-N 2 1 301.261 4.032 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@@H](C)c1oc2ccc(OC)cc2c1C ZINC000514245023 337967834 /nfs/dbraw/zinc/96/78/34/337967834.db2.gz QPUBLJASIHNVCC-HNNXBMFYSA-N 2 1 318.461 4.132 20 0 DIADMP CCCOc1ccc2c(c1)CC[N@H+](CCCc1cnccc1C)C2 ZINC000516038542 338002820 /nfs/dbraw/zinc/00/28/20/338002820.db2.gz QFCUBZCJRWUVFV-UHFFFAOYSA-N 2 1 324.468 4.170 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc2ccc(C)cc2o1 ZINC000426032361 338019828 /nfs/dbraw/zinc/01/98/28/338019828.db2.gz XXGXPXGSSOZEHG-HUUCEWRRSA-N 2 1 311.429 4.233 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc2ccc(C)cc2o1 ZINC000426032359 338019859 /nfs/dbraw/zinc/01/98/59/338019859.db2.gz XXGXPXGSSOZEHG-CABCVRRESA-N 2 1 311.429 4.233 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)[C@@H](C)C1 ZINC000426290781 338024849 /nfs/dbraw/zinc/02/48/49/338024849.db2.gz KJLOYXVEPBDNDQ-UBHSHLNASA-N 2 1 312.910 4.099 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)[C@@H](C)C1 ZINC000426290781 338024850 /nfs/dbraw/zinc/02/48/50/338024850.db2.gz KJLOYXVEPBDNDQ-UBHSHLNASA-N 2 1 312.910 4.099 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@H]2CCC[C@H]21 ZINC000426312708 338026335 /nfs/dbraw/zinc/02/63/35/338026335.db2.gz KFXAGATVGZTMNN-REBRKWNGSA-N 2 1 324.921 4.241 20 0 DIADMP Cc1cccc(N2CCC([NH2+]CCCC3CCCCC3)CC2)[nH+]1 ZINC000428284439 338045628 /nfs/dbraw/zinc/04/56/28/338045628.db2.gz YWFJNHIFPXAQAF-UHFFFAOYSA-N 2 1 315.505 4.309 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000428994315 338068135 /nfs/dbraw/zinc/06/81/35/338068135.db2.gz BJQXRVDHKWXREZ-OXJNMPFZSA-N 2 1 300.490 4.073 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)CCCc1ccccc1C ZINC000429237674 338074200 /nfs/dbraw/zinc/07/42/00/338074200.db2.gz PNDJGRMLFFBFOA-UHFFFAOYSA-N 2 1 313.489 4.099 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCCc1ccccc1C ZINC000429237674 338074201 /nfs/dbraw/zinc/07/42/01/338074201.db2.gz PNDJGRMLFFBFOA-UHFFFAOYSA-N 2 1 313.489 4.099 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCCc1ccccc1C ZINC000429237674 338074202 /nfs/dbraw/zinc/07/42/02/338074202.db2.gz PNDJGRMLFFBFOA-UHFFFAOYSA-N 2 1 313.489 4.099 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000430040528 338094308 /nfs/dbraw/zinc/09/43/08/338094308.db2.gz JAJOKQASIATDPZ-KRWDZBQOSA-N 2 1 324.459 4.170 20 0 DIADMP CCCC[C@@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccccc1 ZINC000432441059 338156606 /nfs/dbraw/zinc/15/66/06/338156606.db2.gz JJMAJOSMEQCGLJ-AZUAARDMSA-N 2 1 318.505 4.008 20 0 DIADMP C[NH+](C)CCC1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000432746382 338165904 /nfs/dbraw/zinc/16/59/04/338165904.db2.gz ZWTCRYZXIFXXBU-UHFFFAOYSA-N 2 1 321.317 4.219 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]([NH+](C)C)CC3)o2)cc1 ZINC000432815059 338168918 /nfs/dbraw/zinc/16/89/18/338168918.db2.gz ZYBPLIMZPODELZ-GOSISDBHSA-N 2 1 312.457 4.171 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]([NH+](C)C)CC3)o2)cc1 ZINC000432815059 338168919 /nfs/dbraw/zinc/16/89/19/338168919.db2.gz ZYBPLIMZPODELZ-GOSISDBHSA-N 2 1 312.457 4.171 20 0 DIADMP CC[C@H](C)[NH+](C)Cc1cc(C[N@H+](C)[C@@H](C)CC)cc(OC)c1 ZINC000432831498 338169689 /nfs/dbraw/zinc/16/96/89/338169689.db2.gz KAZOHAONWXAAFG-HOTGVXAUSA-N 2 1 306.494 4.156 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)CCC2)cc1C ZINC000433084997 338180872 /nfs/dbraw/zinc/18/08/72/338180872.db2.gz UXYJDIDONAHFAN-WSTZPKSXSA-N 2 1 314.517 4.043 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433320757 338192208 /nfs/dbraw/zinc/19/22/08/338192208.db2.gz SWQJQHOFBBTCDW-QGZVFWFLSA-N 2 1 317.864 4.115 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433320757 338192209 /nfs/dbraw/zinc/19/22/09/338192209.db2.gz SWQJQHOFBBTCDW-QGZVFWFLSA-N 2 1 317.864 4.115 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386913 338204201 /nfs/dbraw/zinc/20/42/01/338204201.db2.gz KCVKZCFITQNEDK-NWDGAFQWSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386913 338204202 /nfs/dbraw/zinc/20/42/02/338204202.db2.gz KCVKZCFITQNEDK-NWDGAFQWSA-N 2 1 313.272 4.128 20 0 DIADMP CCc1cccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434692156 338223727 /nfs/dbraw/zinc/22/37/27/338223727.db2.gz WBSVCKXMZKGDNW-UHFFFAOYSA-N 2 1 323.484 4.161 20 0 DIADMP C[C@H]1CCCC[C@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435056232 338231342 /nfs/dbraw/zinc/23/13/42/338231342.db2.gz FMUNKCKVPNMCIE-WMZOPIPTSA-N 2 1 315.505 4.225 20 0 DIADMP C[NH2+]CCC[N@H+](C)[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C ZINC000435874611 338251297 /nfs/dbraw/zinc/25/12/97/338251297.db2.gz LYHQOBYUURFUOS-HNNXBMFYSA-N 2 1 317.502 4.029 20 0 DIADMP C[NH2+]CCC[N@@H+](C)[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C ZINC000435874611 338251298 /nfs/dbraw/zinc/25/12/98/338251298.db2.gz LYHQOBYUURFUOS-HNNXBMFYSA-N 2 1 317.502 4.029 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436267959 338264404 /nfs/dbraw/zinc/26/44/04/338264404.db2.gz FPWAGXNMGDPCCP-HMXCVIKNSA-N 2 1 314.517 4.424 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438079953 338330152 /nfs/dbraw/zinc/33/01/52/338330152.db2.gz ZXIBYVAAIRVZRM-FZKCQIBNSA-N 2 1 320.443 4.065 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438198214 338336254 /nfs/dbraw/zinc/33/62/54/338336254.db2.gz GQOOFBYDMIBZDL-HMXCVIKNSA-N 2 1 314.517 4.207 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438216542 338336944 /nfs/dbraw/zinc/33/69/44/338336944.db2.gz PHNLUEVJFPEYFX-ILXRZTDVSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438216542 338336945 /nfs/dbraw/zinc/33/69/45/338336945.db2.gz PHNLUEVJFPEYFX-ILXRZTDVSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439313829 338366788 /nfs/dbraw/zinc/36/67/88/338366788.db2.gz DXOLNCZBKWKNDC-FXAWDEMLSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439313829 338366789 /nfs/dbraw/zinc/36/67/89/338366789.db2.gz DXOLNCZBKWKNDC-FXAWDEMLSA-N 2 1 311.473 4.240 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000439331570 338367464 /nfs/dbraw/zinc/36/74/64/338367464.db2.gz RXNCRDWASAQVED-KRWDZBQOSA-N 2 1 324.871 4.085 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)Cc2ccoc2)CC1 ZINC000449149484 338597050 /nfs/dbraw/zinc/59/70/50/338597050.db2.gz NUBSPSJIOCKBHH-DLBZAZTESA-N 2 1 312.457 4.026 20 0 DIADMP c1ccc(C[C@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459401946 339027301 /nfs/dbraw/zinc/02/73/01/339027301.db2.gz JKZFGSKCDMAIOG-WIYYLYMNSA-N 2 1 312.501 4.004 20 0 DIADMP Cc1ccccc1[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)C(C)(C)C ZINC000459430390 339028800 /nfs/dbraw/zinc/02/88/00/339028800.db2.gz QMVBUZNRWHNXPA-IBGZPJMESA-N 2 1 300.490 4.299 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000459475568 339031508 /nfs/dbraw/zinc/03/15/08/339031508.db2.gz YVNKARUWPISPKG-RBAQFSTRSA-N 2 1 312.501 4.033 20 0 DIADMP c1ccc([C@H]2CCCC[C@@H]2C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459568152 339036470 /nfs/dbraw/zinc/03/64/70/339036470.db2.gz JFYCAKIJWQXLSM-WIYYLYMNSA-N 2 1 312.501 4.177 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1C(F)(F)F ZINC000459736631 339045256 /nfs/dbraw/zinc/04/52/56/339045256.db2.gz QCDWSLJCGQSORF-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(Cl)c2ccccc21 ZINC000462449245 339079185 /nfs/dbraw/zinc/07/91/85/339079185.db2.gz UUZHMSDJJXCHEC-CYBMUJFWSA-N 2 1 313.832 4.349 20 0 DIADMP CCC[C@H](CC)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463113050 339106291 /nfs/dbraw/zinc/10/62/91/339106291.db2.gz BFWHMFBHMHSRLY-SFHVURJKSA-N 2 1 306.469 4.001 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463117791 339106375 /nfs/dbraw/zinc/10/63/75/339106375.db2.gz VBIAJRSOUXEDHD-UGKGYDQZSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463117791 339106376 /nfs/dbraw/zinc/10/63/76/339106376.db2.gz VBIAJRSOUXEDHD-UGKGYDQZSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000463133409 339106761 /nfs/dbraw/zinc/10/67/61/339106761.db2.gz YEKQRLQELKSBOK-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000463133409 339106762 /nfs/dbraw/zinc/10/67/62/339106762.db2.gz YEKQRLQELKSBOK-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000463141515 339106979 /nfs/dbraw/zinc/10/69/79/339106979.db2.gz CCJVSHSZFWCPOF-DBXWQHBBSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000463141515 339106980 /nfs/dbraw/zinc/10/69/80/339106980.db2.gz CCJVSHSZFWCPOF-DBXWQHBBSA-N 2 1 308.469 4.390 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463204374 339109187 /nfs/dbraw/zinc/10/91/87/339109187.db2.gz ITASNLBAEXPXPU-JENIJYKNSA-N 2 1 320.546 4.161 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463204374 339109188 /nfs/dbraw/zinc/10/91/88/339109188.db2.gz ITASNLBAEXPXPU-JENIJYKNSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(C3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463206512 339109305 /nfs/dbraw/zinc/10/93/05/339109305.db2.gz PPUOKMNCBAQQKF-PXNSSMCTSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(C3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000463206512 339109306 /nfs/dbraw/zinc/10/93/06/339109306.db2.gz PPUOKMNCBAQQKF-PXNSSMCTSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(C3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463206511 339109377 /nfs/dbraw/zinc/10/93/77/339109377.db2.gz PPUOKMNCBAQQKF-FXAWDEMLSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(C3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000463206511 339109378 /nfs/dbraw/zinc/10/93/78/339109378.db2.gz PPUOKMNCBAQQKF-FXAWDEMLSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CCC3(CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463248919 339112024 /nfs/dbraw/zinc/11/20/24/339112024.db2.gz CAYMBKDDXBIHKK-YLJYHZDGSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CCC3(CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463248919 339112025 /nfs/dbraw/zinc/11/20/25/339112025.db2.gz CAYMBKDDXBIHKK-YLJYHZDGSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463249085 339112098 /nfs/dbraw/zinc/11/20/98/339112098.db2.gz YDURHIZOBWIRLA-HNBVOPMISA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463249085 339112099 /nfs/dbraw/zinc/11/20/99/339112099.db2.gz YDURHIZOBWIRLA-HNBVOPMISA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000464782035 339153473 /nfs/dbraw/zinc/15/34/73/339153473.db2.gz VBJYFMLEZBYFQR-CRAIPNDOSA-N 2 1 308.897 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000464782035 339153474 /nfs/dbraw/zinc/15/34/74/339153474.db2.gz VBJYFMLEZBYFQR-CRAIPNDOSA-N 2 1 308.897 4.455 20 0 DIADMP C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460537 339205902 /nfs/dbraw/zinc/20/59/02/339205902.db2.gz CNMYILILXFYXQM-QVOMUQBLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460537 339205903 /nfs/dbraw/zinc/20/59/03/339205903.db2.gz CNMYILILXFYXQM-QVOMUQBLSA-N 2 1 320.443 4.065 20 0 DIADMP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]CC[NH+](C(C)C)C(C)C)C1 ZINC000467306452 339230863 /nfs/dbraw/zinc/23/08/63/339230863.db2.gz BDFLVGJGTXCVCC-OALUTQOASA-N 2 1 317.521 4.125 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000467454657 339239698 /nfs/dbraw/zinc/23/96/98/339239698.db2.gz QAOJUVGHLWLXHC-LELZANKISA-N 2 1 312.501 4.208 20 0 DIADMP CCCCOc1ccccc1C[N@@H+]1CC[C@H](C[NH+](C)CCC)C1 ZINC000468402610 339262069 /nfs/dbraw/zinc/26/20/69/339262069.db2.gz QLFJUFNPSOVOKS-GOSISDBHSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccccc1C[N@H+]1CC[C@H](C[NH+](C)CCC)C1 ZINC000468402610 339262070 /nfs/dbraw/zinc/26/20/70/339262070.db2.gz QLFJUFNPSOVOKS-GOSISDBHSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccccc1C[NH+]1CC[C@H](C[N@H+](C)CCC)C1 ZINC000468402610 339262071 /nfs/dbraw/zinc/26/20/71/339262071.db2.gz QLFJUFNPSOVOKS-GOSISDBHSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccccc1C[NH+]1CC[C@H](C[N@@H+](C)CCC)C1 ZINC000468402610 339262072 /nfs/dbraw/zinc/26/20/72/339262072.db2.gz QLFJUFNPSOVOKS-GOSISDBHSA-N 2 1 318.505 4.029 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CCCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC000469158825 339281692 /nfs/dbraw/zinc/28/16/92/339281692.db2.gz WOEVIAQHCDSIAH-FXAWDEMLSA-N 2 1 302.506 4.063 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000469740359 339297573 /nfs/dbraw/zinc/29/75/73/339297573.db2.gz XGXKSGWTVKURAK-IIBYNOLFSA-N 2 1 318.420 4.449 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000470020634 339308807 /nfs/dbraw/zinc/30/88/07/339308807.db2.gz ZUCAMHQFDXRVNU-SJPCQFCGSA-N 2 1 312.482 4.130 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CCc2ccc3ccccc3c2)C1 ZINC000471047570 339335746 /nfs/dbraw/zinc/33/57/46/339335746.db2.gz KHKJFQYBMWTNTI-LJQANCHMSA-N 2 1 310.485 4.046 20 0 DIADMP COc1ccsc1[C@@H](C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000472157903 339364634 /nfs/dbraw/zinc/36/46/34/339364634.db2.gz NHVVGNDJBTUYFD-HUUCEWRRSA-N 2 1 310.507 4.062 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(C(C)(C)C)s2)CC1 ZINC000472613217 339375206 /nfs/dbraw/zinc/37/52/06/339375206.db2.gz QWYIQPSIRLVGBC-UHFFFAOYSA-N 2 1 306.519 4.106 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2cccc(SCC)c2)CC1 ZINC000473147334 339382991 /nfs/dbraw/zinc/38/29/91/339382991.db2.gz VIBYYARWWFCMSW-UHFFFAOYSA-N 2 1 306.519 4.105 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(SCC)c2)CC1 ZINC000473147334 339382992 /nfs/dbraw/zinc/38/29/92/339382992.db2.gz VIBYYARWWFCMSW-UHFFFAOYSA-N 2 1 306.519 4.105 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1 ZINC000474025425 339397481 /nfs/dbraw/zinc/39/74/81/339397481.db2.gz UYHPJYOWQGHFGV-HNNXBMFYSA-N 2 1 324.459 4.442 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477913617 339504318 /nfs/dbraw/zinc/50/43/18/339504318.db2.gz HFPCQBFYXZGBSW-CQSZACIVSA-N 2 1 323.550 4.348 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc2ccccc2o1 ZINC000477921283 339504718 /nfs/dbraw/zinc/50/47/18/339504718.db2.gz WTFQWKPUHBRGPW-OAHLLOKOSA-N 2 1 300.446 4.205 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1ccc2ccccc2n1)C(C)C ZINC000483690600 339671708 /nfs/dbraw/zinc/67/17/08/339671708.db2.gz XFEDLFGEHKQKKT-KRWDZBQOSA-N 2 1 313.489 4.394 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000484316248 339684870 /nfs/dbraw/zinc/68/48/70/339684870.db2.gz YHDSIACOSSORFB-AOIWGVFYSA-N 2 1 320.525 4.015 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCC2CCCC2)C3)cc1 ZINC000499144268 340030966 /nfs/dbraw/zinc/03/09/66/340030966.db2.gz WRGWMNYRHSDNQY-MZADTFQBSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499143301 340030971 /nfs/dbraw/zinc/03/09/71/340030971.db2.gz SZCYOCOQTWQIPV-QNDFHXLGSA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499147018 340031131 /nfs/dbraw/zinc/03/11/31/340031131.db2.gz ONLPRHOBCHNUOH-ACDBMABISA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499247573 340033169 /nfs/dbraw/zinc/03/31/69/340033169.db2.gz VWRLHOJUUKMUIQ-ADAARDCZSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CCC[NH+]1CCCC1 ZINC000499951737 340047539 /nfs/dbraw/zinc/04/75/39/340047539.db2.gz HKYULHXNHBILOA-CQSZACIVSA-N 2 1 314.395 4.184 20 0 DIADMP C(C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)SC1CCCCC1 ZINC000500130233 340051019 /nfs/dbraw/zinc/05/10/19/340051019.db2.gz RHHDWOXTJWEIFF-KRWDZBQOSA-N 2 1 310.551 4.003 20 0 DIADMP Cc1cccc([C@@H](C)[N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000501018176 340072387 /nfs/dbraw/zinc/07/23/87/340072387.db2.gz DGOVLDIHUKFRNU-GOSISDBHSA-N 2 1 323.484 4.299 20 0 DIADMP C[N@@H+](CCCC1CCCC1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501025118 340072504 /nfs/dbraw/zinc/07/25/04/340072504.db2.gz YTDVHBDFGQEURE-UHFFFAOYSA-N 2 1 315.505 4.200 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501024433 340072572 /nfs/dbraw/zinc/07/25/72/340072572.db2.gz BOSWXPZEHSXCPV-OAQYLSRUSA-N 2 1 323.484 4.381 20 0 DIADMP C[C@@H]([NH2+]CCSC1CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000501064299 340073347 /nfs/dbraw/zinc/07/33/47/340073347.db2.gz PXASMRXUMFUONP-SJORKVTESA-N 2 1 324.578 4.295 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000501074134 340073747 /nfs/dbraw/zinc/07/37/47/340073747.db2.gz BUPXGBNATPNZND-UHFFFAOYSA-N 2 1 323.484 4.047 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)c1 ZINC000502251658 340097838 /nfs/dbraw/zinc/09/78/38/340097838.db2.gz RYQHDHTYTNIIMZ-XUVXKRRUSA-N 2 1 300.490 4.195 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCC23CCC3)C[N@H+]1Cc1ccccc1 ZINC000502411998 340102405 /nfs/dbraw/zinc/10/24/05/340102405.db2.gz BFEDHWZFUBQHLH-MISYRCLQSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC000503035301 340119296 /nfs/dbraw/zinc/11/92/96/340119296.db2.gz NFMCPAFCFKLDGF-RLLQIKCJSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccc(Cl)c(Cl)c2)C[C@H]1n1ccnc1 ZINC000503063489 340119996 /nfs/dbraw/zinc/11/99/96/340119996.db2.gz MVUHJHPGPQHIGX-MLGOLLRUSA-N 2 1 324.255 4.273 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C[C@H]1n1ccnc1 ZINC000503063489 340119997 /nfs/dbraw/zinc/11/99/97/340119997.db2.gz MVUHJHPGPQHIGX-MLGOLLRUSA-N 2 1 324.255 4.273 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccccc1)C1CCCC1 ZINC000503075109 340120393 /nfs/dbraw/zinc/12/03/93/340120393.db2.gz NKUXQVTZEUPLSL-HXUWFJFHSA-N 2 1 311.473 4.493 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000503370047 340126461 /nfs/dbraw/zinc/12/64/61/340126461.db2.gz DNZANBUJKBUXJT-KDOFPFPSSA-N 2 1 317.864 4.150 20 0 DIADMP Fc1cc(-c2ccccc2)ccc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000503561925 340130744 /nfs/dbraw/zinc/13/07/44/340130744.db2.gz HAUDTIAHSATMRN-PMACEKPBSA-N 2 1 324.443 4.209 20 0 DIADMP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000504929016 340156681 /nfs/dbraw/zinc/15/66/81/340156681.db2.gz FUUVDRSQMJXNTI-ZHALLVOQSA-N 2 1 300.490 4.253 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000506323659 340192091 /nfs/dbraw/zinc/19/20/91/340192091.db2.gz BNYZDPDZBGRQFA-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000506323659 340192092 /nfs/dbraw/zinc/19/20/92/340192092.db2.gz BNYZDPDZBGRQFA-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP CC(C)COc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000506337872 340192593 /nfs/dbraw/zinc/19/25/93/340192593.db2.gz DOUCAUMDTLTQBA-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)COc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000506337872 340192594 /nfs/dbraw/zinc/19/25/94/340192594.db2.gz DOUCAUMDTLTQBA-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665839 340276228 /nfs/dbraw/zinc/27/62/28/340276228.db2.gz LXVANEPNBMVMMU-ZFWWWQNUSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665839 340276229 /nfs/dbraw/zinc/27/62/29/340276229.db2.gz LXVANEPNBMVMMU-ZFWWWQNUSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665839 340276230 /nfs/dbraw/zinc/27/62/30/340276230.db2.gz LXVANEPNBMVMMU-ZFWWWQNUSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665839 340276231 /nfs/dbraw/zinc/27/62/31/340276231.db2.gz LXVANEPNBMVMMU-ZFWWWQNUSA-N 2 1 314.395 4.010 20 0 DIADMP CC[C@H](C[NH2+]C1CC(c2ccccc2Cl)C1)[NH+]1CCCC1 ZINC000509845968 340281496 /nfs/dbraw/zinc/28/14/96/340281496.db2.gz JIFQSTWGMPHQHG-UYSNPLJNSA-N 2 1 306.881 4.050 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCc2ccccc2)CC1 ZINC000510102991 340288757 /nfs/dbraw/zinc/28/87/57/340288757.db2.gz QSMYAACUVFAVJT-UHFFFAOYSA-N 2 1 302.506 4.063 20 0 DIADMP CC(C)C1CCC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000302972670 340291402 /nfs/dbraw/zinc/29/14/02/340291402.db2.gz INLBKFQGRTYLNO-UHFFFAOYSA-N 2 1 314.517 4.455 20 0 DIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000510715986 340307871 /nfs/dbraw/zinc/30/78/71/340307871.db2.gz DRTPUUHGTHESMS-AZUAARDMSA-N 2 1 318.480 4.159 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2CCCF)c1 ZINC000510738307 340308962 /nfs/dbraw/zinc/30/89/62/340308962.db2.gz UTQWNQLKFLJHTJ-RTBURBONSA-N 2 1 306.469 4.146 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CC[C@H]2C2CCC2)CC1 ZINC000510753980 340309770 /nfs/dbraw/zinc/30/97/70/340309770.db2.gz MVLHLFTYNIKODG-SFTDATJTSA-N 2 1 312.501 4.128 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C2CC(c3ccccc3Cl)C2)C1 ZINC000510874728 340313607 /nfs/dbraw/zinc/31/36/07/340313607.db2.gz PEUPWCAAUSEDQS-GTPINHCMSA-N 2 1 320.908 4.296 20 0 DIADMP Cc1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303224778 340314010 /nfs/dbraw/zinc/31/40/10/340314010.db2.gz WKYGDQCGEFVUIM-LJQANCHMSA-N 2 1 300.490 4.083 20 0 DIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511017642 340318303 /nfs/dbraw/zinc/31/83/03/340318303.db2.gz RLWDPFBLRAVUHU-AABGKKOBSA-N 2 1 318.480 4.017 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303557427 340333456 /nfs/dbraw/zinc/33/34/56/340333456.db2.gz HTLDVTCKISGURE-QRVBRYPASA-N 2 1 300.490 4.334 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303557427 340333457 /nfs/dbraw/zinc/33/34/57/340333457.db2.gz HTLDVTCKISGURE-QRVBRYPASA-N 2 1 300.490 4.334 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000303557427 340333458 /nfs/dbraw/zinc/33/34/58/340333458.db2.gz HTLDVTCKISGURE-QRVBRYPASA-N 2 1 300.490 4.334 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CCC[C@H](C(C)(C)C)CC2)s1 ZINC000511907957 340342567 /nfs/dbraw/zinc/34/25/67/340342567.db2.gz MSMJGTDSIVEVBP-LSDHHAIUSA-N 2 1 323.550 4.289 20 0 DIADMP C[C@H]([NH2+]Cc1ccc2occc2c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000511912620 340342821 /nfs/dbraw/zinc/34/28/21/340342821.db2.gz QQDAWKQUWGXIEJ-MAUKXSAKSA-N 2 1 312.457 4.175 20 0 DIADMP CCC[C@@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C1CCCCC1 ZINC000512100026 340348504 /nfs/dbraw/zinc/34/85/04/340348504.db2.gz QZFYSLNHOLBGOC-MRXNPFEDSA-N 2 1 309.523 4.043 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C/C=C\c2ccc(F)c(F)c2)C1 ZINC000512145338 340349901 /nfs/dbraw/zinc/34/99/01/340349901.db2.gz MZZRPPTZFYFZEV-HQQUCIOCSA-N 2 1 322.443 4.080 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2F)C1 ZINC000512196199 340351883 /nfs/dbraw/zinc/35/18/83/340351883.db2.gz NMQNKPOMYSLSOV-HZPDHXFCSA-N 2 1 322.443 4.051 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000512327210 340357204 /nfs/dbraw/zinc/35/72/04/340357204.db2.gz XOYUBWZQJIHBPD-BJLQDIEVSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000512328516 340357268 /nfs/dbraw/zinc/35/72/68/340357268.db2.gz BERYSFOXDJAMRO-BJLQDIEVSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000512327214 340357279 /nfs/dbraw/zinc/35/72/79/340357279.db2.gz XOYUBWZQJIHBPD-HBFSDRIKSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512334075 340357577 /nfs/dbraw/zinc/35/75/77/340357577.db2.gz ZIGZWMDTWRRKES-BXTJHSDWSA-N 2 1 316.464 4.056 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C2c3ccccc3-c3ccccc32)C1 ZINC000173914937 340377598 /nfs/dbraw/zinc/37/75/98/340377598.db2.gz OJHHMAHIOWVOEG-MRXNPFEDSA-N 2 1 306.453 4.030 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000173914937 340377599 /nfs/dbraw/zinc/37/75/99/340377599.db2.gz OJHHMAHIOWVOEG-MRXNPFEDSA-N 2 1 306.453 4.030 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000173914937 340377600 /nfs/dbraw/zinc/37/76/00/340377600.db2.gz OJHHMAHIOWVOEG-MRXNPFEDSA-N 2 1 306.453 4.030 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C2c3ccccc3-c3ccccc32)C1 ZINC000173914922 340377618 /nfs/dbraw/zinc/37/76/18/340377618.db2.gz OJHHMAHIOWVOEG-INIZCTEOSA-N 2 1 306.453 4.030 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000173914922 340377619 /nfs/dbraw/zinc/37/76/19/340377619.db2.gz OJHHMAHIOWVOEG-INIZCTEOSA-N 2 1 306.453 4.030 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000173914922 340377620 /nfs/dbraw/zinc/37/76/20/340377620.db2.gz OJHHMAHIOWVOEG-INIZCTEOSA-N 2 1 306.453 4.030 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@@H](C)C[NH+]3CCCC3)o2)cc1 ZINC000513092761 340392977 /nfs/dbraw/zinc/39/29/77/340392977.db2.gz RDHKJFFRLSBFKV-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1c2ccccc2-c2ccccc21 ZINC000183791022 340489232 /nfs/dbraw/zinc/48/92/32/340489232.db2.gz DSANITKCVPKWMD-OAHLLOKOSA-N 2 1 317.436 4.187 20 0 DIADMP CCSc1cccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c1 ZINC000185565718 340502847 /nfs/dbraw/zinc/50/28/47/340502847.db2.gz HKCNJLPBLFIPGW-UHFFFAOYSA-N 2 1 318.530 4.295 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1)c1cccc(O)c1 ZINC000126609820 340829178 /nfs/dbraw/zinc/82/91/78/340829178.db2.gz YTSOPTORALKPIU-BXWFABGCSA-N 2 1 316.489 4.086 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](CC(C)C)c1cccs1 ZINC000540167825 340919932 /nfs/dbraw/zinc/91/99/32/340919932.db2.gz XJXZXEFFBHSEFF-GOEBONIOSA-N 2 1 305.491 4.266 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000542264899 341002667 /nfs/dbraw/zinc/00/26/67/341002667.db2.gz ATMKOAPBPRWZND-KRWDZBQOSA-N 2 1 308.469 4.461 20 0 DIADMP C[C@@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000542518652 341011763 /nfs/dbraw/zinc/01/17/63/341011763.db2.gz ZSMLDVFHNBRVBY-LJQANCHMSA-N 2 1 322.496 4.119 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000542774072 341019848 /nfs/dbraw/zinc/01/98/48/341019848.db2.gz WXWDNTJHZNCJFV-GHTZIAJQSA-N 2 1 308.469 4.016 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000542774072 341019849 /nfs/dbraw/zinc/01/98/49/341019849.db2.gz WXWDNTJHZNCJFV-GHTZIAJQSA-N 2 1 308.469 4.016 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1F ZINC000542843897 341023136 /nfs/dbraw/zinc/02/31/36/341023136.db2.gz KCWVCHXDBCELLS-FZKQIMNGSA-N 2 1 324.871 4.250 20 0 DIADMP C[C@@H](CCc1cccc(F)c1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000543080901 341030967 /nfs/dbraw/zinc/03/09/67/341030967.db2.gz JUXQARNHGNKHDI-PXNSSMCTSA-N 2 1 318.480 4.097 20 0 DIADMP CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000543207290 341036933 /nfs/dbraw/zinc/03/69/33/341036933.db2.gz CITABJVYQUMLNS-QZTJIDSGSA-N 2 1 300.490 4.289 20 0 DIADMP CSc1ccccc1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000543460601 341045855 /nfs/dbraw/zinc/04/58/55/341045855.db2.gz OGQIZNIBJLKZED-NVXWUHKLSA-N 2 1 318.530 4.151 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)CC[N@@H+]1C ZINC000543591387 341049685 /nfs/dbraw/zinc/04/96/85/341049685.db2.gz HLDOSFPUJPCMIW-DEICHXMPSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)CC[N@H+]1C ZINC000543591387 341049686 /nfs/dbraw/zinc/04/96/86/341049686.db2.gz HLDOSFPUJPCMIW-DEICHXMPSA-N 2 1 306.881 4.048 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)s2)C1 ZINC000543600117 341050419 /nfs/dbraw/zinc/05/04/19/341050419.db2.gz BKPQJXRMJQJSMD-JKSUJKDBSA-N 2 1 314.498 4.408 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)C2CCC2)o1 ZINC000543600969 341050513 /nfs/dbraw/zinc/05/05/13/341050513.db2.gz CSPUOPYZVMNWSE-SFHVURJKSA-N 2 1 304.478 4.282 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1F ZINC000131188819 341064503 /nfs/dbraw/zinc/06/45/03/341064503.db2.gz QWLPBVWWEVKUEY-AWEZNQCLSA-N 2 1 324.509 4.319 20 0 DIADMP C[C@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000544010202 341066292 /nfs/dbraw/zinc/06/62/92/341066292.db2.gz ZMJBUEPCJOCTGO-MJGOQNOKSA-N 2 1 320.546 4.123 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)[NH+]1CCCCC1 ZINC000544374606 341078972 /nfs/dbraw/zinc/07/89/72/341078972.db2.gz XPLWJWPDPIQFOZ-STQMWFEESA-N 2 1 314.395 4.019 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568768 341086112 /nfs/dbraw/zinc/08/61/12/341086112.db2.gz ANUFWQNBGDMCNA-LPHOPBHVSA-N 2 1 304.478 4.141 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568768 341086113 /nfs/dbraw/zinc/08/61/13/341086113.db2.gz ANUFWQNBGDMCNA-LPHOPBHVSA-N 2 1 304.478 4.141 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000131832789 341112534 /nfs/dbraw/zinc/11/25/34/341112534.db2.gz VNXVRJCMXNJUGZ-GHTZIAJQSA-N 2 1 322.496 4.281 20 0 DIADMP CCCCOCCC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000132028579 341115181 /nfs/dbraw/zinc/11/51/81/341115181.db2.gz JVXYAAYTHRAXOE-INIZCTEOSA-N 2 1 315.461 4.038 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000545952773 341148218 /nfs/dbraw/zinc/14/82/18/341148218.db2.gz BWCYMUNBHISNJM-LSTHTHJFSA-N 2 1 311.473 4.062 20 0 DIADMP CCc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)o1 ZINC000133509428 341176877 /nfs/dbraw/zinc/17/68/77/341176877.db2.gz IWQFILNOAJGYSQ-YQQQUEKLSA-N 2 1 324.468 4.127 20 0 DIADMP CCc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)o1 ZINC000133509428 341176878 /nfs/dbraw/zinc/17/68/78/341176878.db2.gz IWQFILNOAJGYSQ-YQQQUEKLSA-N 2 1 324.468 4.127 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547399210 341211225 /nfs/dbraw/zinc/21/12/25/341211225.db2.gz NUKYIRQBPWBWKZ-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547399211 341211338 /nfs/dbraw/zinc/21/13/38/341211338.db2.gz NUKYIRQBPWBWKZ-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548156338 341249967 /nfs/dbraw/zinc/24/99/67/341249967.db2.gz JDOZQQGUWZSSRQ-LNLFQRSKSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)N(C)CC[C@H]1CCC[N@H+]1C ZINC000245564135 341302180 /nfs/dbraw/zinc/30/21/80/341302180.db2.gz DFQUWUKLFCFWCW-LSDHHAIUSA-N 2 1 309.523 4.052 20 0 DIADMP C[N@H+]1CCC[C@]2(CC[NH+](CCCc3cccc4ccccc43)C2)C1 ZINC000549839348 341304600 /nfs/dbraw/zinc/30/46/00/341304600.db2.gz GUHSPPOZUJAQKX-QFIPXVFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@H+](CCCc3cccc4ccccc43)C2)C1 ZINC000549839348 341304601 /nfs/dbraw/zinc/30/46/01/341304601.db2.gz GUHSPPOZUJAQKX-QFIPXVFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCCc3cccc4ccccc43)C2)C1 ZINC000549839348 341304602 /nfs/dbraw/zinc/30/46/02/341304602.db2.gz GUHSPPOZUJAQKX-QFIPXVFZSA-N 2 1 322.496 4.190 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245656431 341308004 /nfs/dbraw/zinc/30/80/04/341308004.db2.gz DSQACTBMAPFPTC-HNULKUCHSA-N 2 1 300.490 4.206 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2CC=CCC2)C3)cc1 ZINC000245665586 341308428 /nfs/dbraw/zinc/30/84/28/341308428.db2.gz GOOSGWGNBQITPW-AYWYSENESA-N 2 1 310.485 4.128 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725898 341311905 /nfs/dbraw/zinc/31/19/05/341311905.db2.gz PNXBZDYSOBVEPZ-RSPOEFSDSA-N 2 1 300.490 4.206 20 0 DIADMP Fc1cccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000245760683 341313957 /nfs/dbraw/zinc/31/39/57/341313957.db2.gz VMXADRCUPLKZHY-WKCHPHFGSA-N 2 1 324.443 4.111 20 0 DIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000245940647 341318989 /nfs/dbraw/zinc/31/89/89/341318989.db2.gz UUSQQUDIARSCOU-CHWSQXEVSA-N 2 1 306.837 4.079 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000245940647 341318990 /nfs/dbraw/zinc/31/89/90/341318990.db2.gz UUSQQUDIARSCOU-CHWSQXEVSA-N 2 1 306.837 4.079 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550623027 341319770 /nfs/dbraw/zinc/31/97/70/341319770.db2.gz RKUCMVIACVYZOF-AYOQOUSVSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550623027 341319771 /nfs/dbraw/zinc/31/97/71/341319771.db2.gz RKUCMVIACVYZOF-AYOQOUSVSA-N 2 1 314.498 4.104 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000245963038 341320092 /nfs/dbraw/zinc/32/00/92/341320092.db2.gz VDPUINRQUNTIGT-QZTJIDSGSA-N 2 1 303.494 4.025 20 0 DIADMP CC(C)[C@](C)(Cc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000550919547 341326717 /nfs/dbraw/zinc/32/67/17/341326717.db2.gz SCDKKWUTNKCOFT-LZQZEXGQSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@](C)(Cc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000550919547 341326718 /nfs/dbraw/zinc/32/67/18/341326718.db2.gz SCDKKWUTNKCOFT-LZQZEXGQSA-N 2 1 322.924 4.370 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)CCCC2)c(C)c1 ZINC000550921561 341326798 /nfs/dbraw/zinc/32/67/98/341326798.db2.gz SHUQADWNEYFZRV-OALUTQOASA-N 2 1 314.517 4.188 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550997994 341328665 /nfs/dbraw/zinc/32/86/65/341328665.db2.gz VRCZRTBXTJUJIP-KPFFTGBYSA-N 2 1 312.457 4.026 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550997994 341328666 /nfs/dbraw/zinc/32/86/66/341328666.db2.gz VRCZRTBXTJUJIP-KPFFTGBYSA-N 2 1 312.457 4.026 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCc2cccs2)C[C@@H]1c1ccccc1 ZINC000551087623 341331359 /nfs/dbraw/zinc/33/13/59/341331359.db2.gz VEJCYHARWUXNAF-IEBWSBKVSA-N 2 1 314.498 4.106 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCc2cccs2)C[C@@H]1c1ccccc1 ZINC000551087623 341331360 /nfs/dbraw/zinc/33/13/60/341331360.db2.gz VEJCYHARWUXNAF-IEBWSBKVSA-N 2 1 314.498 4.106 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000551301052 341337769 /nfs/dbraw/zinc/33/77/69/341337769.db2.gz CLLLDDLZMPQYRU-GBESFXJTSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000551301052 341337770 /nfs/dbraw/zinc/33/77/70/341337770.db2.gz CLLLDDLZMPQYRU-GBESFXJTSA-N 2 1 300.490 4.238 20 0 DIADMP CCC1(C[NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000551312991 341338304 /nfs/dbraw/zinc/33/83/04/341338304.db2.gz DTTBGMACCRHFLY-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCCc1ccc(Cl)s1 ZINC000551519795 341343601 /nfs/dbraw/zinc/34/36/01/341343601.db2.gz LBMFRXKEXSYDAF-IPYPFGDCSA-N 2 1 314.926 4.043 20 0 DIADMP FCCCCC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000551700451 341349209 /nfs/dbraw/zinc/34/92/09/341349209.db2.gz ZAADFSBCHIBMAI-WOJBJXKFSA-N 2 1 318.480 4.113 20 0 DIADMP COc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000246872928 341358078 /nfs/dbraw/zinc/35/80/78/341358078.db2.gz CQIICGVDYTXNBM-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000246872928 341358079 /nfs/dbraw/zinc/35/80/79/341358079.db2.gz CQIICGVDYTXNBM-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccoc1 ZINC000247067496 341360514 /nfs/dbraw/zinc/36/05/14/341360514.db2.gz OCZCCIHRMDKLDO-DLBZAZTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000247094126 341360956 /nfs/dbraw/zinc/36/09/56/341360956.db2.gz OGZDSENAZYLQIY-PFRQMTDMSA-N 2 1 312.457 4.087 20 0 DIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000247094126 341360957 /nfs/dbraw/zinc/36/09/57/341360957.db2.gz OGZDSENAZYLQIY-PFRQMTDMSA-N 2 1 312.457 4.087 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)C1 ZINC000247201663 341362303 /nfs/dbraw/zinc/36/23/03/341362303.db2.gz WHQIUPXPXOGERQ-CVEARBPZSA-N 2 1 306.519 4.180 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3ccccc3s2)C[C@@H]1C ZINC000552071415 341367469 /nfs/dbraw/zinc/36/74/69/341367469.db2.gz CWLKLCHGZIYRRO-HOCLYGCPSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3ccccc3s2)C[C@@H]1C ZINC000552071415 341367470 /nfs/dbraw/zinc/36/74/70/341367470.db2.gz CWLKLCHGZIYRRO-HOCLYGCPSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3ccccc3s2)C[C@@H]1C ZINC000552071415 341367471 /nfs/dbraw/zinc/36/74/71/341367471.db2.gz CWLKLCHGZIYRRO-HOCLYGCPSA-N 2 1 302.487 4.206 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccs1 ZINC000248390656 341376283 /nfs/dbraw/zinc/37/62/83/341376283.db2.gz BOGHLGJOASQFFH-VYDXJSESSA-N 2 1 306.519 4.442 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(F)c1F ZINC000248404299 341376550 /nfs/dbraw/zinc/37/65/50/341376550.db2.gz PYHXALBEYGXWMO-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccc(F)c1F ZINC000248404299 341376551 /nfs/dbraw/zinc/37/65/51/341376551.db2.gz PYHXALBEYGXWMO-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(-c3cccnc3)c2)C[C@H]1C ZINC000552290284 341384477 /nfs/dbraw/zinc/38/44/77/341384477.db2.gz FNVIGRRSRGEKPV-UTKZUKDTSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@H]1C ZINC000552290284 341384478 /nfs/dbraw/zinc/38/44/78/341384478.db2.gz FNVIGRRSRGEKPV-UTKZUKDTSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@H]1C ZINC000552290284 341384479 /nfs/dbraw/zinc/38/44/79/341384479.db2.gz FNVIGRRSRGEKPV-UTKZUKDTSA-N 2 1 323.484 4.053 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(-c3cccnc3)c2)C[C@@H]1C ZINC000552290283 341384633 /nfs/dbraw/zinc/38/46/33/341384633.db2.gz FNVIGRRSRGEKPV-LAUBAEHRSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@@H]1C ZINC000552290283 341384634 /nfs/dbraw/zinc/38/46/34/341384634.db2.gz FNVIGRRSRGEKPV-LAUBAEHRSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@@H]1C ZINC000552290283 341384635 /nfs/dbraw/zinc/38/46/35/341384635.db2.gz FNVIGRRSRGEKPV-LAUBAEHRSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000552343606 341388008 /nfs/dbraw/zinc/38/80/08/341388008.db2.gz HNPZFHUAZDDPHH-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000248981245 341391194 /nfs/dbraw/zinc/39/11/94/341391194.db2.gz IXHZZRGVKUZQGF-UWWQBHOKSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000248981245 341391195 /nfs/dbraw/zinc/39/11/95/341391195.db2.gz IXHZZRGVKUZQGF-UWWQBHOKSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000249275129 341395734 /nfs/dbraw/zinc/39/57/34/341395734.db2.gz LQCHHMKQGHZGDK-OAGGEKHMSA-N 2 1 320.443 4.352 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000249416417 341397489 /nfs/dbraw/zinc/39/74/89/341397489.db2.gz ZNRNDSGQXSVVNZ-OAGGEKHMSA-N 2 1 320.443 4.209 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cccc(C)c3C)CC2)[nH+]c1 ZINC000163464384 341698617 /nfs/dbraw/zinc/69/86/17/341698617.db2.gz KZTDICNWIDAQOR-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCCc4ccccc43)CC2)[nH+]c1 ZINC000163522375 524942905 /nfs/dbraw/zinc/94/29/05/524942905.db2.gz VWLIYHGRXYIMNC-FQEVSTJZSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccccn1 ZINC000158888319 525456545 /nfs/dbraw/zinc/45/65/45/525456545.db2.gz IOLXQRVQHCWZHZ-SFHVURJKSA-N 2 1 323.484 4.308 20 0 DIADMP c1csc(C([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cccs2)c1 ZINC000128089540 526577255 /nfs/dbraw/zinc/57/72/55/526577255.db2.gz LJRWLUGKJRTZSQ-ZIAGYGMSSA-N 2 1 318.511 4.115 20 0 DIADMP c1csc(C([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2cccs2)c1 ZINC000128089540 526577259 /nfs/dbraw/zinc/57/72/59/526577259.db2.gz LJRWLUGKJRTZSQ-ZIAGYGMSSA-N 2 1 318.511 4.115 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)CCCn1cc[nH+]c1C ZINC000127615483 526676829 /nfs/dbraw/zinc/67/68/29/526676829.db2.gz UODJAHKGKVSMJD-CQSZACIVSA-N 2 1 320.506 4.163 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)CCCn1cc[nH+]c1C ZINC000127615483 526676833 /nfs/dbraw/zinc/67/68/33/526676833.db2.gz UODJAHKGKVSMJD-CQSZACIVSA-N 2 1 320.506 4.163 20 0 DIADMP Cc1nc2c(s1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)CCC2 ZINC000157885995 527108255 /nfs/dbraw/zinc/10/82/55/527108255.db2.gz JYBFCQYSESVIDN-HOCLYGCPSA-N 2 1 321.534 4.073 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000338015055 527423176 /nfs/dbraw/zinc/42/31/76/527423176.db2.gz VQUPFRAOJSPOGT-NSHDSACASA-N 2 1 312.244 4.239 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000338024783 527425515 /nfs/dbraw/zinc/42/55/15/527425515.db2.gz WTINFGJQYZADHL-HNNXBMFYSA-N 2 1 324.255 4.166 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1Cl ZINC000643545701 1035589012 /nfs/dbraw/zinc/58/90/12/1035589012.db2.gz AXORGBXRELBFEW-YPMHNXCESA-N 2 1 313.272 4.319 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1Cl ZINC000643545699 1035589175 /nfs/dbraw/zinc/58/91/75/1035589175.db2.gz AXORGBXRELBFEW-DGCLKSJQSA-N 2 1 313.272 4.319 20 0 DIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546673 1035592368 /nfs/dbraw/zinc/59/23/68/1035592368.db2.gz SPUKOXIQOZJNDM-DZGCQCFKSA-N 2 1 322.880 4.064 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547265 1035601919 /nfs/dbraw/zinc/60/19/19/1035601919.db2.gz BXLWENKQQFTEMA-WOJBJXKFSA-N 2 1 324.443 4.179 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001206768718 1035659151 /nfs/dbraw/zinc/65/91/51/1035659151.db2.gz LUNPRKUFZYNNFP-OLZOCXBDSA-N 2 1 306.500 4.036 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](F)C2)cc1 ZINC000579832789 1035777613 /nfs/dbraw/zinc/77/76/13/1035777613.db2.gz UGUGNPRLJSSFGS-IAOVAPTHSA-N 2 1 301.409 4.112 20 0 DIADMP CC(C)C[C@H](C[NH2+]C[C@H]1CC[N@H+](C(C)C)C1)c1ccccc1 ZINC000558419433 1036001895 /nfs/dbraw/zinc/00/18/95/1036001895.db2.gz WNGFWBSGQKOWMW-UYAOXDASSA-N 2 1 302.506 4.136 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1ccc(Cl)c(F)c1)Cc1ccccc1 ZINC000063345194 1036122190 /nfs/dbraw/zinc/12/21/90/1036122190.db2.gz SWZPJKNWJLBYRT-UHFFFAOYSA-N 2 1 320.839 4.091 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1ccc(Cl)c(F)c1)Cc1ccccc1 ZINC000063345194 1036122197 /nfs/dbraw/zinc/12/21/97/1036122197.db2.gz SWZPJKNWJLBYRT-UHFFFAOYSA-N 2 1 320.839 4.091 20 0 DIADMP c1ccc(CC[C@H]2CCC[N@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC001209452968 1036195928 /nfs/dbraw/zinc/19/59/28/1036195928.db2.gz AVFAAKRTKBHFEN-OAQYLSRUSA-N 2 1 314.517 4.207 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccsc1 ZINC000398123895 1036242350 /nfs/dbraw/zinc/24/23/50/1036242350.db2.gz HSWQHDDKVNMQRG-BXWFABGCSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccsc1 ZINC000398123895 1036242367 /nfs/dbraw/zinc/24/23/67/1036242367.db2.gz HSWQHDDKVNMQRG-BXWFABGCSA-N 2 1 314.498 4.309 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc2occc2c1 ZINC000349148226 1036246436 /nfs/dbraw/zinc/24/64/36/1036246436.db2.gz JTJWRZNHDBIZHE-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc2occc2c1 ZINC000349148226 1036246457 /nfs/dbraw/zinc/24/64/57/1036246457.db2.gz JTJWRZNHDBIZHE-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1F ZINC000120817571 1036255270 /nfs/dbraw/zinc/25/52/70/1036255270.db2.gz VPWHANVYEHKVNC-IBGZPJMESA-N 2 1 322.443 4.126 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1F ZINC000120817738 1036255505 /nfs/dbraw/zinc/25/55/05/1036255505.db2.gz VPWHANVYEHKVNC-LJQANCHMSA-N 2 1 322.443 4.126 20 0 DIADMP CC(C)(C)c1ccc2c(c1)CC[N@@H+](CCC[NH+]1CCCCC1)C2 ZINC001167270165 1036352792 /nfs/dbraw/zinc/35/27/92/1036352792.db2.gz DRWQMPXXYFLTGT-UHFFFAOYSA-N 2 1 314.517 4.218 20 0 DIADMP CC(C)(C)c1ccc2c(c1)CC[N@H+](CCC[NH+]1CCCCC1)C2 ZINC001167270165 1036352804 /nfs/dbraw/zinc/35/28/04/1036352804.db2.gz DRWQMPXXYFLTGT-UHFFFAOYSA-N 2 1 314.517 4.218 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(Oc3ccccc3)c2)CC1(C)C ZINC001648802230 1036369342 /nfs/dbraw/zinc/36/93/42/1036369342.db2.gz AVPAVLOICVZELN-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cccc(Oc3ccccc3)c2)CC1(C)C ZINC001648802230 1036369363 /nfs/dbraw/zinc/36/93/63/1036369363.db2.gz AVPAVLOICVZELN-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(-c2ccccc2)o1 ZINC000121518448 1036582472 /nfs/dbraw/zinc/58/24/72/1036582472.db2.gz WFSWBLWHKTXKKB-HZPDHXFCSA-N 2 1 323.440 4.438 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H]2CCCC[C@@H]2C)cc1F ZINC001648902912 1036681881 /nfs/dbraw/zinc/68/18/81/1036681881.db2.gz ARMJPDDPMBGDNV-WMLDXEAASA-N 2 1 315.436 4.236 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c(C)c1 ZINC001167325431 1036732604 /nfs/dbraw/zinc/73/26/04/1036732604.db2.gz AWSDGCPVKCTVLN-HXUWFJFHSA-N 2 1 314.517 4.391 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000580098433 1036949027 /nfs/dbraw/zinc/94/90/27/1036949027.db2.gz CRBDMCXRPGRFEX-ZGXWSNOMSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000580098433 1036949037 /nfs/dbraw/zinc/94/90/37/1036949037.db2.gz CRBDMCXRPGRFEX-ZGXWSNOMSA-N 2 1 312.501 4.065 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000580103891 1036954561 /nfs/dbraw/zinc/95/45/61/1036954561.db2.gz UFRQDWGWBXAHHG-NHCUHLMSSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000580103891 1036954581 /nfs/dbraw/zinc/95/45/81/1036954581.db2.gz UFRQDWGWBXAHHG-NHCUHLMSSA-N 2 1 308.469 4.044 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398039723 1037109147 /nfs/dbraw/zinc/10/91/47/1037109147.db2.gz RHVJBVBOFDXTKA-CAOKTKFFSA-N 2 1 300.490 4.065 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398039723 1037109154 /nfs/dbraw/zinc/10/91/54/1037109154.db2.gz RHVJBVBOFDXTKA-CAOKTKFFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H](CC[NH2+]Cc1cc2ccccc2[nH]1)[N@@H+](C)Cc1ccccc1 ZINC000683929283 1037119948 /nfs/dbraw/zinc/11/99/48/1037119948.db2.gz JTQMQNXDQJJZGY-KRWDZBQOSA-N 2 1 321.468 4.168 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001167424234 1037227172 /nfs/dbraw/zinc/22/71/72/1037227172.db2.gz FDUZZPJIDIYLKQ-GVDBMIGSSA-N 2 1 316.480 4.254 20 0 DIADMP CC[C@H](CC(F)F)C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001167424234 1037227175 /nfs/dbraw/zinc/22/71/75/1037227175.db2.gz FDUZZPJIDIYLKQ-GVDBMIGSSA-N 2 1 316.480 4.254 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc(C)c1F ZINC000126787542 1037320391 /nfs/dbraw/zinc/32/03/91/1037320391.db2.gz IOORQLDXOMHVCW-CCNLRDMRSA-N 2 1 304.453 4.108 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc(C)c1F ZINC000126787542 1037320409 /nfs/dbraw/zinc/32/04/09/1037320409.db2.gz IOORQLDXOMHVCW-CCNLRDMRSA-N 2 1 304.453 4.108 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000127451724 1037352505 /nfs/dbraw/zinc/35/25/05/1037352505.db2.gz IZHATGBJWYPSGL-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000127451724 1037352526 /nfs/dbraw/zinc/35/25/26/1037352526.db2.gz IZHATGBJWYPSGL-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(C)c(F)c(C)c2)CC1 ZINC001143385109 1037361202 /nfs/dbraw/zinc/36/12/02/1037361202.db2.gz OBNYXKRZALSDHN-UHFFFAOYSA-N 2 1 306.469 4.139 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(C)c(F)c(C)c2)CC1 ZINC001143385109 1037361218 /nfs/dbraw/zinc/36/12/18/1037361218.db2.gz OBNYXKRZALSDHN-UHFFFAOYSA-N 2 1 306.469 4.139 20 0 DIADMP Cc1ccc(N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)n1 ZINC000580979291 1037393130 /nfs/dbraw/zinc/39/31/30/1037393130.db2.gz PADJRARPRAFMIY-LPHOPBHVSA-N 2 1 309.457 4.021 20 0 DIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(-c4ccccc4)o3)C2)CC1 ZINC000581218089 1037479379 /nfs/dbraw/zinc/47/93/79/1037479379.db2.gz LPSNACDGHIBRAF-IBGZPJMESA-N 2 1 324.468 4.110 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCCc1c[nH+]cn1C ZINC000581259096 1037503260 /nfs/dbraw/zinc/50/32/60/1037503260.db2.gz XVZALTDCBSPHMU-UXHICEINSA-N 2 1 311.473 4.011 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCCc1c[nH+]cn1C ZINC000581259096 1037503263 /nfs/dbraw/zinc/50/32/63/1037503263.db2.gz XVZALTDCBSPHMU-UXHICEINSA-N 2 1 311.473 4.011 20 0 DIADMP CCCC(C)(C)[N@@H+](CCCn1ccnc1)Cc1cccs1 ZINC000558865152 1037808387 /nfs/dbraw/zinc/80/83/87/1037808387.db2.gz ICRQBUNMCPLVOO-UHFFFAOYSA-N 2 1 305.491 4.416 20 0 DIADMP C[NH+](CCCC[N@H+](C)Cc1ccsc1)Cc1ccsc1 ZINC000157353943 1037836125 /nfs/dbraw/zinc/83/61/25/1037836125.db2.gz UKLDMGHPHOEPLD-UHFFFAOYSA-N 2 1 308.516 4.154 20 0 DIADMP Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)s1 ZINC000090402688 1037906657 /nfs/dbraw/zinc/90/66/57/1037906657.db2.gz KDIQDRSFEJQMLG-CQSZACIVSA-N 2 1 317.502 4.143 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cnc3ccsc3c2)CC1 ZINC000126524834 1038104335 /nfs/dbraw/zinc/10/43/35/1038104335.db2.gz FECCIRTUXMLZHD-CQSZACIVSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cnc2ccsc2c1 ZINC000126537690 1038108327 /nfs/dbraw/zinc/10/83/27/1038108327.db2.gz KNJMSDHDYNTLJV-CYBMUJFWSA-N 2 1 317.502 4.210 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000090418589 1038113228 /nfs/dbraw/zinc/11/32/28/1038113228.db2.gz YODARWXGXNPQJE-CABCVRRESA-N 2 1 317.502 4.013 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000090418589 1038113245 /nfs/dbraw/zinc/11/32/45/1038113245.db2.gz YODARWXGXNPQJE-CABCVRRESA-N 2 1 317.502 4.013 20 0 DIADMP CCOc1ccccc1[C@H](CC)[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000341662862 1038213646 /nfs/dbraw/zinc/21/36/46/1038213646.db2.gz VYJLFAPHTYFCLL-WMZOPIPTSA-N 2 1 304.478 4.000 20 0 DIADMP CCOc1ccccc1[C@H](CC)[NH2+]CC[C@@H]1CCCC[N@H+]1C ZINC000341662862 1038213659 /nfs/dbraw/zinc/21/36/59/1038213659.db2.gz VYJLFAPHTYFCLL-WMZOPIPTSA-N 2 1 304.478 4.000 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCc2ccc3ccccc3c2)CC1 ZINC000603933661 1038319347 /nfs/dbraw/zinc/31/93/47/1038319347.db2.gz JLODTKFLTOUEEC-UHFFFAOYSA-N 2 1 324.512 4.435 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc3ccccc3s2)CC1 ZINC000535811513 1038341742 /nfs/dbraw/zinc/34/17/42/1038341742.db2.gz VTKKKBBNICNTJS-UHFFFAOYSA-N 2 1 316.514 4.454 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H](C)c2ccccc2)CC1 ZINC000604885028 1038462472 /nfs/dbraw/zinc/46/24/72/1038462472.db2.gz AFNUEHNONXXHTO-SFHVURJKSA-N 2 1 302.506 4.234 20 0 DIADMP Cc1ccc(CC[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000605575052 1038536751 /nfs/dbraw/zinc/53/67/51/1038536751.db2.gz GTLKNVQDONEKKQ-TZIWHRDSSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000605575052 1038536759 /nfs/dbraw/zinc/53/67/59/1038536759.db2.gz GTLKNVQDONEKKQ-TZIWHRDSSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000605575052 1038536765 /nfs/dbraw/zinc/53/67/65/1038536765.db2.gz GTLKNVQDONEKKQ-TZIWHRDSSA-N 2 1 314.517 4.124 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000657314423 1038555663 /nfs/dbraw/zinc/55/56/63/1038555663.db2.gz VIWKTSWWBVRQPF-ZWKOTPCHSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000657314423 1038555669 /nfs/dbraw/zinc/55/56/69/1038555669.db2.gz VIWKTSWWBVRQPF-ZWKOTPCHSA-N 2 1 312.482 4.132 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2cccs2)cc1 ZINC000657319075 1038561913 /nfs/dbraw/zinc/56/19/13/1038561913.db2.gz QTNRKCOWQOWIIL-UHFFFAOYSA-N 2 1 311.454 4.100 20 0 DIADMP CCC(CC)C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001167554297 1038611081 /nfs/dbraw/zinc/61/10/81/1038611081.db2.gz MZELGGUFGJLOGD-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CCC(CC)C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001167554297 1038611084 /nfs/dbraw/zinc/61/10/84/1038611084.db2.gz MZELGGUFGJLOGD-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CCC(CC)C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001167554297 1038611089 /nfs/dbraw/zinc/61/10/89/1038611089.db2.gz MZELGGUFGJLOGD-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C(CC[N@H+]1CCC[C@H]2CCC[C@@H]21)C[NH+]1CCC[C@@H]2CCC[C@@H]21 ZINC000582339678 1038634992 /nfs/dbraw/zinc/63/49/92/1038634992.db2.gz CPGLNEKTBGXKEJ-YRPNKDGESA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@@H+]1CCC[C@@H]2CCC[C@@H]21)C[NH+]1CCC[C@H]2CCC[C@@H]21 ZINC000582339678 1038634995 /nfs/dbraw/zinc/63/49/95/1038634995.db2.gz CPGLNEKTBGXKEJ-YRPNKDGESA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@H+]1CCC[C@@H]2CCC[C@@H]21)C[NH+]1CCC[C@H]2CCC[C@@H]21 ZINC000582339678 1038635000 /nfs/dbraw/zinc/63/50/00/1038635000.db2.gz CPGLNEKTBGXKEJ-YRPNKDGESA-N 2 1 304.522 4.296 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468235175 1038661567 /nfs/dbraw/zinc/66/15/67/1038661567.db2.gz OVKXWAXHNFZCCT-DNVCBOLYSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468235175 1038661572 /nfs/dbraw/zinc/66/15/72/1038661572.db2.gz OVKXWAXHNFZCCT-DNVCBOLYSA-N 2 1 318.892 4.278 20 0 DIADMP Cn1c[nH+]cc1CCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000563354724 1038664775 /nfs/dbraw/zinc/66/47/75/1038664775.db2.gz KAHWLNJZRVPMDG-UHFFFAOYSA-N 2 1 319.452 4.055 20 0 DIADMP Cc1nccn1CC[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000342589808 1038681126 /nfs/dbraw/zinc/68/11/26/1038681126.db2.gz VIDANHCRNPDKRG-NSHDSACASA-N 2 1 312.244 4.191 20 0 DIADMP CC[NH+]1CCC([N@H+](C)CCCCc2cccc(Cl)c2)CC1 ZINC001167586322 1038712445 /nfs/dbraw/zinc/71/24/45/1038712445.db2.gz KSXOOIFMKXUYBZ-UHFFFAOYSA-N 2 1 308.897 4.079 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)CCCCc2cccc(Cl)c2)CC1 ZINC001167586322 1038712453 /nfs/dbraw/zinc/71/24/53/1038712453.db2.gz KSXOOIFMKXUYBZ-UHFFFAOYSA-N 2 1 308.897 4.079 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC[N@H+]1C ZINC000608061579 1038761792 /nfs/dbraw/zinc/76/17/92/1038761792.db2.gz ZIYUBZVSTSXYTE-HKUYNNGSSA-N 2 1 323.484 4.027 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000077329761 1038864247 /nfs/dbraw/zinc/86/42/47/1038864247.db2.gz VDDBLKHZZKEHEN-UHFFFAOYSA-N 2 1 311.454 4.100 20 0 DIADMP CCC(C)(C)CC[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000608563229 1038884607 /nfs/dbraw/zinc/88/46/07/1038884607.db2.gz PYZHIBPBCKBHPQ-UHFFFAOYSA-N 2 1 302.506 4.409 20 0 DIADMP CCC(C)(C)CC[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000608563229 1038884629 /nfs/dbraw/zinc/88/46/29/1038884629.db2.gz PYZHIBPBCKBHPQ-UHFFFAOYSA-N 2 1 302.506 4.409 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000342863743 1038930929 /nfs/dbraw/zinc/93/09/29/1038930929.db2.gz JIYBAWDPCMRTIB-UHFFFAOYSA-N 2 1 323.440 4.185 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000342863743 1038930939 /nfs/dbraw/zinc/93/09/39/1038930939.db2.gz JIYBAWDPCMRTIB-UHFFFAOYSA-N 2 1 323.440 4.185 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCSCc2ccccc2)C[C@H]1C ZINC000534138983 1038992069 /nfs/dbraw/zinc/99/20/69/1038992069.db2.gz XKPRSTHLOYXUDK-IEBWSBKVSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCSCc2ccccc2)C[C@H]1C ZINC000534138983 1038992086 /nfs/dbraw/zinc/99/20/86/1038992086.db2.gz XKPRSTHLOYXUDK-IEBWSBKVSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCSCc2ccccc2)C[C@H]1C ZINC000534138983 1038992113 /nfs/dbraw/zinc/99/21/13/1038992113.db2.gz XKPRSTHLOYXUDK-IEBWSBKVSA-N 2 1 320.546 4.115 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000534328978 1039028362 /nfs/dbraw/zinc/02/83/62/1039028362.db2.gz SFKOOTIYWOLZCH-GFCCVEGCSA-N 2 1 310.844 4.147 20 0 DIADMP CC1(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCC1 ZINC001167648697 1039083888 /nfs/dbraw/zinc/08/38/88/1039083888.db2.gz WYLALHYAZGUXBY-PMACEKPBSA-N 2 1 312.501 4.163 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2cccs2)cc1F ZINC000153699712 1039093951 /nfs/dbraw/zinc/09/39/51/1039093951.db2.gz PMJWQWGNNCGRTH-LBPRGKRZSA-N 2 1 315.417 4.232 20 0 DIADMP CN1CCC([N@@H+](CC2CCC(F)(F)CC2)C2CCCC2)CC1 ZINC001207351285 1039113736 /nfs/dbraw/zinc/11/37/36/1039113736.db2.gz YZHAMJUMYIBZJE-UHFFFAOYSA-N 2 1 314.464 4.151 20 0 DIADMP CSc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000647282976 1039242892 /nfs/dbraw/zinc/24/28/92/1039242892.db2.gz BXVQZTATCNRMOV-TXPKVOOTSA-N 2 1 316.514 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)CCCSCc2ccccc2)CC1 ZINC000535583769 1039247613 /nfs/dbraw/zinc/24/76/13/1039247613.db2.gz WOWOMGRIKUXYAB-UHFFFAOYSA-N 2 1 320.546 4.115 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498729 1039275439 /nfs/dbraw/zinc/27/54/39/1039275439.db2.gz VIJFDKHCCVHCPD-UONOGXRCSA-N 2 1 320.864 4.469 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498729 1039275457 /nfs/dbraw/zinc/27/54/57/1039275457.db2.gz VIJFDKHCCVHCPD-UONOGXRCSA-N 2 1 320.864 4.469 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000539547085 1039285842 /nfs/dbraw/zinc/28/58/42/1039285842.db2.gz NTHFUBGDHFFWMU-KXBFYZLASA-N 2 1 300.446 4.061 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000080338959 1039320729 /nfs/dbraw/zinc/32/07/29/1039320729.db2.gz AVRPZFCLBXNNJN-SJLPKXTDSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000080338959 1039320746 /nfs/dbraw/zinc/32/07/46/1039320746.db2.gz AVRPZFCLBXNNJN-SJLPKXTDSA-N 2 1 314.498 4.199 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824074 1039340496 /nfs/dbraw/zinc/34/04/96/1039340496.db2.gz VEIIBWFBWKEUIY-QGZVFWFLSA-N 2 1 312.457 4.110 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824074 1039340509 /nfs/dbraw/zinc/34/05/09/1039340509.db2.gz VEIIBWFBWKEUIY-QGZVFWFLSA-N 2 1 312.457 4.110 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824074 1039340528 /nfs/dbraw/zinc/34/05/28/1039340528.db2.gz VEIIBWFBWKEUIY-QGZVFWFLSA-N 2 1 312.457 4.110 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824074 1039340545 /nfs/dbraw/zinc/34/05/45/1039340545.db2.gz VEIIBWFBWKEUIY-QGZVFWFLSA-N 2 1 312.457 4.110 20 0 DIADMP CC(C)CCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000539817748 1039344271 /nfs/dbraw/zinc/34/42/71/1039344271.db2.gz OLUHNRMDYSBLOY-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000539817748 1039344279 /nfs/dbraw/zinc/34/42/79/1039344279.db2.gz OLUHNRMDYSBLOY-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000539817748 1039344290 /nfs/dbraw/zinc/34/42/90/1039344290.db2.gz OLUHNRMDYSBLOY-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000539817748 1039344305 /nfs/dbraw/zinc/34/43/05/1039344305.db2.gz OLUHNRMDYSBLOY-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP C[C@H](CC1CC1)[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540142647 1039425052 /nfs/dbraw/zinc/42/50/52/1039425052.db2.gz DDNMZIOGKCOCGX-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@@H]1[C@H]([NH2+][C@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C)c1ccc(Cl)cc1 ZINC000540189083 1039442630 /nfs/dbraw/zinc/44/26/30/1039442630.db2.gz WUNXEYHDASXHFD-PWFRQKOXSA-N 2 1 320.908 4.355 20 0 DIADMP COc1ccc([C@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C(C)C)cc1 ZINC000540299533 1039468319 /nfs/dbraw/zinc/46/83/19/1039468319.db2.gz KQFLZTCSEBYQRX-YLJYHZDGSA-N 2 1 318.505 4.102 20 0 DIADMP COc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C(C)C)cc1 ZINC000540299530 1039469580 /nfs/dbraw/zinc/46/95/80/1039469580.db2.gz KQFLZTCSEBYQRX-FXAWDEMLSA-N 2 1 318.505 4.102 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1cccc(F)c1)C1CCCC1 ZINC000540432566 1039496827 /nfs/dbraw/zinc/49/68/27/1039496827.db2.gz AGYXFYUOXAEKQC-IBGZPJMESA-N 2 1 315.436 4.242 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+]CC3=CC[N@@H+](C)CC3)c2)cc1 ZINC000540645611 1039537259 /nfs/dbraw/zinc/53/72/59/1039537259.db2.gz WMRLZOGZSRWYLM-UHFFFAOYSA-N 2 1 306.453 4.014 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cc2ccncc2s1 ZINC000657824564 1039585907 /nfs/dbraw/zinc/58/59/07/1039585907.db2.gz URSKURNDMYDZGN-GJZGRUSLSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000541013150 1039613504 /nfs/dbraw/zinc/61/35/04/1039613504.db2.gz FGKBQGWUDBWCKA-SGRWCLLMSA-N 2 1 318.480 4.170 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@@H+]1CC[C@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349806 1039671221 /nfs/dbraw/zinc/67/12/21/1039671221.db2.gz UMWDSZBXNIVXFE-BEFAXECRSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@H+]1CC[C@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349806 1039671230 /nfs/dbraw/zinc/67/12/30/1039671230.db2.gz UMWDSZBXNIVXFE-BEFAXECRSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349809 1039672455 /nfs/dbraw/zinc/67/24/55/1039672455.db2.gz UMWDSZBXNIVXFE-KXBFYZLASA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349809 1039672464 /nfs/dbraw/zinc/67/24/64/1039672464.db2.gz UMWDSZBXNIVXFE-KXBFYZLASA-N 2 1 318.892 4.135 20 0 DIADMP Cc1ccccc1CCC[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000541601903 1039717123 /nfs/dbraw/zinc/71/71/23/1039717123.db2.gz VWESNWHALOUMTI-ICSRJNTNSA-N 2 1 314.517 4.170 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000541660434 1039726136 /nfs/dbraw/zinc/72/61/36/1039726136.db2.gz DMNBSZFIKDQISE-JKSUJKDBSA-N 2 1 300.446 4.266 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC[C@H]1CCCC[N@H+]1C ZINC000541660434 1039726151 /nfs/dbraw/zinc/72/61/51/1039726151.db2.gz DMNBSZFIKDQISE-JKSUJKDBSA-N 2 1 300.446 4.266 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cccnc1 ZINC000091286474 1039837912 /nfs/dbraw/zinc/83/79/12/1039837912.db2.gz YMWABMUXAKFMLQ-IEBWSBKVSA-N 2 1 303.494 4.023 20 0 DIADMP CC(C)[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cccnc1 ZINC000091280320 1039838672 /nfs/dbraw/zinc/83/86/72/1039838672.db2.gz FVIZSFYEAUEEKD-IBGZPJMESA-N 2 1 303.494 4.023 20 0 DIADMP c1c[nH]c([C@@H]2CCC[N@H+](Cc3ccc(-c4ccccc4)o3)C2)n1 ZINC000092071319 1039866705 /nfs/dbraw/zinc/86/67/05/1039866705.db2.gz XFFBSEODFLYEEY-MRXNPFEDSA-N 2 1 307.397 4.049 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccncc3s2)C1 ZINC000657872558 1039952138 /nfs/dbraw/zinc/95/21/38/1039952138.db2.gz OBWZEGIGBVORQM-CABCVRRESA-N 2 1 317.502 4.067 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccncc3s2)C1 ZINC000657872562 1039952955 /nfs/dbraw/zinc/95/29/55/1039952955.db2.gz OBWZEGIGBVORQM-HUUCEWRRSA-N 2 1 317.502 4.067 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1 ZINC000197136796 1039971847 /nfs/dbraw/zinc/97/18/47/1039971847.db2.gz SOJWKPGESCYEFG-FQEVSTJZSA-N 2 1 308.469 4.077 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1 ZINC000197136796 1039971865 /nfs/dbraw/zinc/97/18/65/1039971865.db2.gz SOJWKPGESCYEFG-FQEVSTJZSA-N 2 1 308.469 4.077 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C(C)(C)C(F)F ZINC000657889076 1040038354 /nfs/dbraw/zinc/03/83/54/1040038354.db2.gz PXOKJXNLFQZBGF-HUUCEWRRSA-N 2 1 324.459 4.481 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000708571421 1040088365 /nfs/dbraw/zinc/08/83/65/1040088365.db2.gz SKUXVAXCAWQVMB-ARXXEPJESA-N 2 1 314.517 4.169 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000708571423 1040088801 /nfs/dbraw/zinc/08/88/01/1040088801.db2.gz SKUXVAXCAWQVMB-QIYLELGZSA-N 2 1 314.517 4.169 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000309719924 1040089488 /nfs/dbraw/zinc/08/94/88/1040089488.db2.gz LWYAPIZADXLWQI-FPOVZHCZSA-N 2 1 308.469 4.249 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@H]1CCCC12CCC2 ZINC000708571058 1040090139 /nfs/dbraw/zinc/09/01/39/1040090139.db2.gz QBAHQPHIZZKVCJ-RLLQIKCJSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000708575043 1040094542 /nfs/dbraw/zinc/09/45/42/1040094542.db2.gz PQGJXKHVYYYMTN-JYBIWHBTSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309920832 1040100414 /nfs/dbraw/zinc/10/04/14/1040100414.db2.gz QQECRDPRORAZAK-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]CC1(C)CCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309900151 1040100714 /nfs/dbraw/zinc/10/07/14/1040100714.db2.gz HYCIJTPLKZTPQK-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCSCC2)cc1 ZINC000657903605 1040101079 /nfs/dbraw/zinc/10/10/79/1040101079.db2.gz NBNVUYWLDOUVDF-YOEHRIQHSA-N 2 1 315.486 4.117 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000309991086 1040102759 /nfs/dbraw/zinc/10/27/59/1040102759.db2.gz ZYAZUOOEKFOPGZ-ICSRJNTNSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310197480 1040112801 /nfs/dbraw/zinc/11/28/01/1040112801.db2.gz ASZVBOGXECCEQN-UCNVEGJOSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccoc1 ZINC000178081952 1040139998 /nfs/dbraw/zinc/13/99/98/1040139998.db2.gz VWJHJXLUTSQFCG-QGZVFWFLSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1nccc2ccccc21 ZINC000685647663 1040183852 /nfs/dbraw/zinc/18/38/52/1040183852.db2.gz PMJJLDRCSSHQNP-YJBOKZPZSA-N 2 1 313.489 4.252 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)CC(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000694031519 1040242730 /nfs/dbraw/zinc/24/27/30/1040242730.db2.gz VILYBHIFGRRMER-RDJZCZTQSA-N 2 1 324.459 4.311 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)CC(F)F)CC[N@H+]1Cc1ccccc1 ZINC000694031519 1040242749 /nfs/dbraw/zinc/24/27/49/1040242749.db2.gz VILYBHIFGRRMER-RDJZCZTQSA-N 2 1 324.459 4.311 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309766813 1040258524 /nfs/dbraw/zinc/25/85/24/1040258524.db2.gz ZQPVOOSZZOVWJE-HOJAQTOUSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1)C(C)(C)C(F)F ZINC000658001982 1040262756 /nfs/dbraw/zinc/26/27/56/1040262756.db2.gz DXXLICPPFRVXBH-DZGCQCFKSA-N 2 1 302.453 4.053 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1 ZINC000658064696 1040286929 /nfs/dbraw/zinc/28/69/29/1040286929.db2.gz QDKSKZDRMNINLT-HOTGVXAUSA-N 2 1 320.440 4.030 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCC(C)(C)F)CC1 ZINC000658191092 1040348399 /nfs/dbraw/zinc/34/83/99/1040348399.db2.gz JVADIYQHQXFZPV-UHFFFAOYSA-N 2 1 306.469 4.157 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC[C@]2(C)CC2(F)F)cc1 ZINC000658218143 1040375959 /nfs/dbraw/zinc/37/59/59/1040375959.db2.gz CMPDWEVEVNOPTE-CXAGYDPISA-N 2 1 319.399 4.267 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1 ZINC001167686818 1040457070 /nfs/dbraw/zinc/45/70/70/1040457070.db2.gz ZGRAMIPWWIFFLM-FXAWDEMLSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1 ZINC001167686818 1040457079 /nfs/dbraw/zinc/45/70/79/1040457079.db2.gz ZGRAMIPWWIFFLM-FXAWDEMLSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1 ZINC001167686818 1040457086 /nfs/dbraw/zinc/45/70/86/1040457086.db2.gz ZGRAMIPWWIFFLM-FXAWDEMLSA-N 2 1 302.506 4.047 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1 ZINC001167686819 1040457524 /nfs/dbraw/zinc/45/75/24/1040457524.db2.gz ZGRAMIPWWIFFLM-PXNSSMCTSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1 ZINC001167686819 1040457530 /nfs/dbraw/zinc/45/75/30/1040457530.db2.gz ZGRAMIPWWIFFLM-PXNSSMCTSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1 ZINC001167686819 1040457537 /nfs/dbraw/zinc/45/75/37/1040457537.db2.gz ZGRAMIPWWIFFLM-PXNSSMCTSA-N 2 1 302.506 4.047 20 0 DIADMP C[C@H]1CCCCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309583001 1040710524 /nfs/dbraw/zinc/71/05/24/1040710524.db2.gz PFEJAESHZDFKQC-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]Cc3ccccc3C3CC3)C2)cc1 ZINC000310069345 1040750203 /nfs/dbraw/zinc/75/02/03/1040750203.db2.gz CULGUGPKGYRNGU-IBGZPJMESA-N 2 1 320.480 4.176 20 0 DIADMP CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000414196784 1040987098 /nfs/dbraw/zinc/98/70/98/1040987098.db2.gz WBUZHPUROOENIV-OLZOCXBDSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000414179679 1040965985 /nfs/dbraw/zinc/96/59/85/1040965985.db2.gz LMTQDPXXWVFKCF-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccncc2)c1 ZINC000414183163 1040968112 /nfs/dbraw/zinc/96/81/12/1040968112.db2.gz NPOIBAQUFSCXDM-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP Cc1ccc([C@@H](CNc2cc[nH+]c3ccsc32)[NH+](C)C)cc1 ZINC000462376398 1041015211 /nfs/dbraw/zinc/01/52/11/1041015211.db2.gz QOXHAQWAPSDRIL-QGZVFWFLSA-N 2 1 311.454 4.320 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000414280380 1041076426 /nfs/dbraw/zinc/07/64/26/1041076426.db2.gz CYEWKPOFUBTQST-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000414298684 1041095700 /nfs/dbraw/zinc/09/57/00/1041095700.db2.gz ZHQFCNMLRVEZRI-INIZCTEOSA-N 2 1 312.457 4.252 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccsc2)CC1 ZINC000539820226 1041119977 /nfs/dbraw/zinc/11/99/77/1041119977.db2.gz HOKHHNZMDPGQDO-MRXNPFEDSA-N 2 1 306.519 4.225 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(C(F)F)c(F)c2)CC1 ZINC000892632226 1041166955 /nfs/dbraw/zinc/16/69/55/1041166955.db2.gz LFZJEYFJKDGCRU-UHFFFAOYSA-N 2 1 314.395 4.116 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C\c2ccc(F)cc2)cc1 ZINC000809738638 1041241406 /nfs/dbraw/zinc/24/14/06/1041241406.db2.gz CPGNJRKQIZJKHV-PLNGDYQASA-N 2 1 312.432 4.033 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CCc2[nH+]ccn2C1)c1cc(C)sc1C ZINC000623934895 1041275573 /nfs/dbraw/zinc/27/55/73/1041275573.db2.gz IZWRVNHWMJECOV-HOCLYGCPSA-N 2 1 303.475 4.007 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121050 1041326187 /nfs/dbraw/zinc/32/61/87/1041326187.db2.gz MPRHGPCRNRKDRK-DZGCQCFKSA-N 2 1 323.550 4.132 20 0 DIADMP CCCCCC[C@@H](CC)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001170601982 1041367599 /nfs/dbraw/zinc/36/75/99/1041367599.db2.gz UXWMMBDIZKXCGL-UYAOXDASSA-N 2 1 324.553 4.311 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000236638799 1041398306 /nfs/dbraw/zinc/39/83/06/1041398306.db2.gz WCHTWLXAQGOGOE-UHFFFAOYSA-N 2 1 314.395 4.058 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1F ZINC000893107427 1041489324 /nfs/dbraw/zinc/48/93/24/1041489324.db2.gz CEIJRLBZJMWIIL-MUSFGAPCSA-N 2 1 308.416 4.021 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1F ZINC000893107427 1041489331 /nfs/dbraw/zinc/48/93/31/1041489331.db2.gz CEIJRLBZJMWIIL-MUSFGAPCSA-N 2 1 308.416 4.021 20 0 DIADMP c1c[nH]c([C@@H]2CCC[N@H+](C[C@@H]3CC[C@@H](c4ccccc4)C3)C2)n1 ZINC000660075645 1041600728 /nfs/dbraw/zinc/60/07/28/1041600728.db2.gz CHDVZWSVQDUHBR-BHIYHBOVSA-N 2 1 309.457 4.173 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417323106 1041657764 /nfs/dbraw/zinc/65/77/64/1041657764.db2.gz NYOOEJMGGYJIBD-ZJPYXAASSA-N 2 1 320.546 4.342 20 0 DIADMP CCC(CC)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813880316 1041742620 /nfs/dbraw/zinc/74/26/20/1041742620.db2.gz DZQSBAXQBKTMQF-IHWFROFDSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001170720549 1041758173 /nfs/dbraw/zinc/75/81/73/1041758173.db2.gz MNPIKHGLBJPDIW-RACLHMPKSA-N 2 1 312.501 4.064 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@H+]1Cc1ccccc1 ZINC001170720549 1041758181 /nfs/dbraw/zinc/75/81/81/1041758181.db2.gz MNPIKHGLBJPDIW-RACLHMPKSA-N 2 1 312.501 4.064 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001170727715 1041773441 /nfs/dbraw/zinc/77/34/41/1041773441.db2.gz PEUAZEMPLIQCQN-PBJDKFRLSA-N 2 1 324.512 4.206 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([N@@H+](C3CCCCC3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170738172 1041805900 /nfs/dbraw/zinc/80/59/00/1041805900.db2.gz KVIUWYFIONJXLR-ZXSVEKQISA-N 2 1 304.522 4.326 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1cnc(C2CCCCC2)s1)C1CC1 ZINC000651599745 1041852454 /nfs/dbraw/zinc/85/24/54/1041852454.db2.gz CEMXUTOBOXRQEH-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([N@H+]3CC[C@@]4(CC[NH+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761504 1041858918 /nfs/dbraw/zinc/85/89/18/1041858918.db2.gz MVLKDJOOQDQVBF-XAPVIXHLSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH+]3CC[C@@]4(CC[N@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761504 1041858925 /nfs/dbraw/zinc/85/89/25/1041858925.db2.gz MVLKDJOOQDQVBF-XAPVIXHLSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH+]3CC[C@@]4(CC[N@@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761504 1041858933 /nfs/dbraw/zinc/85/89/33/1041858933.db2.gz MVLKDJOOQDQVBF-XAPVIXHLSA-N 2 1 324.512 4.019 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685723 1041880471 /nfs/dbraw/zinc/88/04/71/1041880471.db2.gz BXYMHPDSHVYMBW-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685723 1041880478 /nfs/dbraw/zinc/88/04/78/1041880478.db2.gz BXYMHPDSHVYMBW-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP Cc1ccccc1[C@@H]1C[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000651910945 1041949193 /nfs/dbraw/zinc/94/91/93/1041949193.db2.gz SPIUJGZCSGDYND-FCHUYYIVSA-N 2 1 320.480 4.105 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164607871 1042022155 /nfs/dbraw/zinc/02/21/55/1042022155.db2.gz IVOMHIWRFYAADW-ZDUSSCGKSA-N 2 1 320.506 4.211 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161560922 1042110985 /nfs/dbraw/zinc/11/09/85/1042110985.db2.gz ONIQZCYTWKHSDR-WBMJQRKESA-N 2 1 310.844 4.004 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161560922 1042110988 /nfs/dbraw/zinc/11/09/88/1042110988.db2.gz ONIQZCYTWKHSDR-WBMJQRKESA-N 2 1 310.844 4.004 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]C3CCCCCC3)C2)c1 ZINC000064616110 1042130156 /nfs/dbraw/zinc/13/01/56/1042130156.db2.gz PQALTHZDHGRIKU-MRXNPFEDSA-N 2 1 306.519 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]C3CCCCCC3)C2)c1 ZINC000064616110 1042130163 /nfs/dbraw/zinc/13/01/63/1042130163.db2.gz PQALTHZDHGRIKU-MRXNPFEDSA-N 2 1 306.519 4.273 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466100 1042177111 /nfs/dbraw/zinc/17/71/11/1042177111.db2.gz OBPHNTCJSMDMLL-AEFFLSMTSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466100 1042177112 /nfs/dbraw/zinc/17/71/12/1042177112.db2.gz OBPHNTCJSMDMLL-AEFFLSMTSA-N 2 1 323.484 4.007 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001167825839 1042215078 /nfs/dbraw/zinc/21/50/78/1042215078.db2.gz KZDSXNMZYWOIQF-UYAOXDASSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001167827268 1042218020 /nfs/dbraw/zinc/21/80/20/1042218020.db2.gz VKLCJNKVBVJIKQ-MRXNPFEDSA-N 2 1 310.913 4.325 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1ccccc1OC ZINC001167827425 1042219325 /nfs/dbraw/zinc/21/93/25/1042219325.db2.gz VUHWDNMAZSFDOX-HKUYNNGSSA-N 2 1 318.505 4.343 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643522252 1042221453 /nfs/dbraw/zinc/22/14/53/1042221453.db2.gz KNSMXAXLFKUWPV-KOLCDFICSA-N 2 1 319.301 4.164 20 0 DIADMP CCc1nc([C@H](C)[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)cs1 ZINC000820809601 1042229280 /nfs/dbraw/zinc/22/92/80/1042229280.db2.gz DSACGXNEXSBCHR-KBPBESRZSA-N 2 1 317.502 4.179 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccc(C)nc1 ZINC001167833621 1042235768 /nfs/dbraw/zinc/23/57/68/1042235768.db2.gz CXJGRXBOEZXPSW-IEBWSBKVSA-N 2 1 303.494 4.037 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001167836360 1042248206 /nfs/dbraw/zinc/24/82/06/1042248206.db2.gz YMJCAPOKMQFQTQ-XLIONFOSSA-N 2 1 320.496 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1cccc(OC)c1 ZINC001167837482 1042250002 /nfs/dbraw/zinc/25/00/02/1042250002.db2.gz LIXACRFNKPSNSG-PXNSSMCTSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCc2cccc(Cl)c2C1 ZINC001167839669 1042250617 /nfs/dbraw/zinc/25/06/17/1042250617.db2.gz BDBKGMDPDFZBKR-HNNXBMFYSA-N 2 1 308.897 4.209 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](CC)Cc1cccc(F)c1F ZINC001167841064 1042255239 /nfs/dbraw/zinc/25/52/39/1042255239.db2.gz JWSXSOPFZMWMIQ-HNNXBMFYSA-N 2 1 312.448 4.297 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](CC)Cc1cccc(F)c1F ZINC001167841065 1042255616 /nfs/dbraw/zinc/25/56/16/1042255616.db2.gz JWSXSOPFZMWMIQ-OAHLLOKOSA-N 2 1 312.448 4.297 20 0 DIADMP C[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CC(C)(C)C1 ZINC001170998216 1042306716 /nfs/dbraw/zinc/30/67/16/1042306716.db2.gz QTHBREQLRLLFPV-UHFFFAOYSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2c(Cl)cccc2C1 ZINC001171018637 1042329004 /nfs/dbraw/zinc/32/90/04/1042329004.db2.gz UYVIPQYYCGZMEV-RDJZCZTQSA-N 2 1 320.908 4.051 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2oc3ccccc3c2C)CC1 ZINC000124125794 1042352228 /nfs/dbraw/zinc/35/22/28/1042352228.db2.gz PZPYVEWVWPWAAH-OAHLLOKOSA-N 2 1 300.446 4.266 20 0 DIADMP Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000246101555 1042408370 /nfs/dbraw/zinc/40/83/70/1042408370.db2.gz LNOKQYWPXXVYIL-OKZBNKHCSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC000246101555 1042408372 /nfs/dbraw/zinc/40/83/72/1042408372.db2.gz LNOKQYWPXXVYIL-OKZBNKHCSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000246101555 1042408374 /nfs/dbraw/zinc/40/83/74/1042408374.db2.gz LNOKQYWPXXVYIL-OKZBNKHCSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000246101555 1042408376 /nfs/dbraw/zinc/40/83/76/1042408376.db2.gz LNOKQYWPXXVYIL-OKZBNKHCSA-N 2 1 315.505 4.268 20 0 DIADMP CC[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)cc1Cl ZINC000401765958 1042409903 /nfs/dbraw/zinc/40/99/03/1042409903.db2.gz GGSSUJLLGRFBLH-HNNXBMFYSA-N 2 1 312.244 4.010 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cccnc1 ZINC000246607314 1042422180 /nfs/dbraw/zinc/42/21/80/1042422180.db2.gz RMNXHXLEJJPOOI-ZWKOTPCHSA-N 2 1 323.484 4.307 20 0 DIADMP CC[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)Cc1ccccn1 ZINC000411317031 1042439169 /nfs/dbraw/zinc/43/91/69/1042439169.db2.gz NRGVMPPNAMPIQQ-UHFFFAOYSA-N 2 1 323.484 4.090 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000513493472 1042547085 /nfs/dbraw/zinc/54/70/85/1042547085.db2.gz BAORHFPSKALTLP-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]Cc2ccsc2)C[N@H+]1Cc1ccccc1 ZINC000513514270 1042549449 /nfs/dbraw/zinc/54/94/49/1042549449.db2.gz WUTMNPNKZBQONO-WMZOPIPTSA-N 2 1 314.498 4.138 20 0 DIADMP Cc1ccncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000279979627 1042561278 /nfs/dbraw/zinc/56/12/78/1042561278.db2.gz QKRFEIFUUVAQNS-SFHVURJKSA-N 2 1 323.484 4.054 20 0 DIADMP CC[N@@H+](CC[C@H]1CC[NH2+]C1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000420299795 1042598164 /nfs/dbraw/zinc/59/81/64/1042598164.db2.gz JGRUHHJTJFRQHY-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000420300107 1042599383 /nfs/dbraw/zinc/59/93/83/1042599383.db2.gz HEKMFQJTJQTZQD-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP Cc1ccc(N2CCC([NH2+]Cc3cccc(C4CC4)c3)CC2)[nH+]c1 ZINC000421362559 1042632313 /nfs/dbraw/zinc/63/23/13/1042632313.db2.gz JMQWAHQHTWAPCX-UHFFFAOYSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000422783222 1042690189 /nfs/dbraw/zinc/69/01/89/1042690189.db2.gz NTYHZQOQGHOVCY-SRVKXCTJSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422800515 1042690755 /nfs/dbraw/zinc/69/07/55/1042690755.db2.gz CBVFIIYIDWMZRE-GOPGUHFVSA-N 2 1 318.367 4.083 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)Cc1cccc(Cl)c1)c1c[nH+]ccc1N ZINC000422877819 1042691763 /nfs/dbraw/zinc/69/17/63/1042691763.db2.gz RVMAFMYSQXFBTO-CYBMUJFWSA-N 2 1 317.864 4.067 20 0 DIADMP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000422922481 1042692679 /nfs/dbraw/zinc/69/26/79/1042692679.db2.gz SWHWFVCCRLJYQU-PWSUYJOCSA-N 2 1 321.827 4.053 20 0 DIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cccc2ccccc21 ZINC000423184710 1042699610 /nfs/dbraw/zinc/69/96/10/1042699610.db2.gz IMXFYROCVAWFFS-QGZVFWFLSA-N 2 1 319.452 4.065 20 0 DIADMP CC[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Cl)s1 ZINC000423190281 1042700575 /nfs/dbraw/zinc/70/05/75/1042700575.db2.gz QWJYJFAZKQRHDS-AWEZNQCLSA-N 2 1 323.893 4.017 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C[NH3+])CC(C)C ZINC000423262363 1042702473 /nfs/dbraw/zinc/70/24/73/1042702473.db2.gz METOPKXUQHUEKE-BBRMVZONSA-N 2 1 317.502 4.143 20 0 DIADMP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1csc(-c2csc(C)n2)c1 ZINC000423289811 1042704175 /nfs/dbraw/zinc/70/41/75/1042704175.db2.gz YLRNHGHNLWIBRE-NSHDSACASA-N 2 1 323.531 4.348 20 0 DIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000423278619 1042705183 /nfs/dbraw/zinc/70/51/83/1042705183.db2.gz RAOYISKBWYJECZ-CZUORRHYSA-N 2 1 317.502 4.061 20 0 DIADMP CCCC[C@@H](C[NH3+])[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423298095 1042705974 /nfs/dbraw/zinc/70/59/74/1042705974.db2.gz NCZOHVGFXJAWGZ-ZDEQEGDKSA-N 2 1 300.899 4.001 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(Cl)cc1Cl ZINC000423386449 1042709588 /nfs/dbraw/zinc/70/95/88/1042709588.db2.gz HFEBZWBTAHACKO-WKPIXPDZSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]1 ZINC000423393040 1042710797 /nfs/dbraw/zinc/71/07/97/1042710797.db2.gz YBNJRZGYBVZRHQ-CCKFTAQKSA-N 2 1 314.860 4.160 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+][C@@H]3CCCC[C@H]3[NH3+])cs2)cs1 ZINC000424371759 1042738514 /nfs/dbraw/zinc/73/85/14/1042738514.db2.gz GNONNHTUPGJLBH-LERXQTSPSA-N 2 1 321.515 4.101 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](C(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000514083315 1042770147 /nfs/dbraw/zinc/77/01/47/1042770147.db2.gz MJPPXWVSVSCFMG-SFTDATJTSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](C(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000514083315 1042770149 /nfs/dbraw/zinc/77/01/49/1042770149.db2.gz MJPPXWVSVSCFMG-SFTDATJTSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](C(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000514083315 1042770154 /nfs/dbraw/zinc/77/01/54/1042770154.db2.gz MJPPXWVSVSCFMG-SFTDATJTSA-N 2 1 320.480 4.192 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167958954 1042801056 /nfs/dbraw/zinc/80/10/56/1042801056.db2.gz KSQRRERPEMYUEM-ZNDGOPKYSA-N 2 1 312.501 4.003 20 0 DIADMP Clc1cc2c(s1)CCC[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000515297031 1042815304 /nfs/dbraw/zinc/81/53/04/1042815304.db2.gz VWYHPKDDMSXBTM-HNNXBMFYSA-N 2 1 324.921 4.243 20 0 DIADMP C[C@H](C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1)c1ccccc1 ZINC000515556849 1042826147 /nfs/dbraw/zinc/82/61/47/1042826147.db2.gz NVUVFHUJSLMESQ-LJQANCHMSA-N 2 1 322.496 4.387 20 0 DIADMP C[C@H](C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1)c1ccccc1 ZINC000515556849 1042826152 /nfs/dbraw/zinc/82/61/52/1042826152.db2.gz NVUVFHUJSLMESQ-LJQANCHMSA-N 2 1 322.496 4.387 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccc1Cl ZINC001167961753 1042848944 /nfs/dbraw/zinc/84/89/44/1042848944.db2.gz PMYNOZHZUVGZRA-HZTRTUMWSA-N 2 1 318.892 4.396 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccc1Cl ZINC001167961753 1042848953 /nfs/dbraw/zinc/84/89/53/1042848953.db2.gz PMYNOZHZUVGZRA-HZTRTUMWSA-N 2 1 318.892 4.396 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CCCSc2ccc(Cl)cc21)C[NH+](C)C ZINC000425926364 1042875997 /nfs/dbraw/zinc/87/59/97/1042875997.db2.gz RYMAFPWZDSUWQT-SWLSCSKDSA-N 2 1 312.910 4.054 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[NH+]1CCC2(CCC[N@H+](C)C2)CC1 ZINC001280225677 1042913839 /nfs/dbraw/zinc/91/38/39/1042913839.db2.gz AAPSGKHOEGEEGO-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204742426 1042955096 /nfs/dbraw/zinc/95/50/96/1042955096.db2.gz NWHUGWFQBNFCHE-UHFFFAOYSA-N 2 1 324.921 4.028 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(-c3ccccc3C)c2)C1 ZINC000520202503 1043023317 /nfs/dbraw/zinc/02/33/17/1043023317.db2.gz MMKXWUXSYNSLJP-FQEVSTJZSA-N 2 1 322.496 4.484 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+]C1CC[NH+](C)CC1 ZINC000441352699 1043038355 /nfs/dbraw/zinc/03/83/55/1043038355.db2.gz FGUUIZGNIXTKED-UHFFFAOYSA-N 2 1 308.878 4.047 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441395970 1043042810 /nfs/dbraw/zinc/04/28/10/1043042810.db2.gz BDDSLEJOGCMTNN-QMMLZNLJSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441395970 1043042815 /nfs/dbraw/zinc/04/28/15/1043042815.db2.gz BDDSLEJOGCMTNN-QMMLZNLJSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441395970 1043042820 /nfs/dbraw/zinc/04/28/20/1043042820.db2.gz BDDSLEJOGCMTNN-QMMLZNLJSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441395970 1043042825 /nfs/dbraw/zinc/04/28/25/1043042825.db2.gz BDDSLEJOGCMTNN-QMMLZNLJSA-N 2 1 310.485 4.013 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccncc1 ZINC000173918713 1043055268 /nfs/dbraw/zinc/05/52/68/1043055268.db2.gz WGRUHUUVUNZPQY-ROUUACIJSA-N 2 1 323.484 4.164 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CC[C@H](C3CCCCC3)C1)C2 ZINC001167994762 1043067313 /nfs/dbraw/zinc/06/73/13/1043067313.db2.gz NSTOQEHWAZWYSF-CBQMWWCCSA-N 2 1 316.533 4.294 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC[N@@H+]1C ZINC000536303152 1043091996 /nfs/dbraw/zinc/09/19/96/1043091996.db2.gz WESWUJZAJIDHSS-XAGWURHQSA-N 2 1 313.272 4.053 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC[N@H+]1C ZINC000536303152 1043092009 /nfs/dbraw/zinc/09/20/09/1043092009.db2.gz WESWUJZAJIDHSS-XAGWURHQSA-N 2 1 313.272 4.053 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccc3ccccc3n2)CC1 ZINC000177837068 1043115457 /nfs/dbraw/zinc/11/54/57/1043115457.db2.gz RORNSOMILXBHLA-MRXNPFEDSA-N 2 1 311.473 4.006 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc3ccccc3n2)CC1 ZINC000178117855 1043121555 /nfs/dbraw/zinc/12/15/55/1043121555.db2.gz GGDHLOAXSYRUSW-MRXNPFEDSA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2ccccc2n1 ZINC000178294734 1043124799 /nfs/dbraw/zinc/12/47/99/1043124799.db2.gz YLYWXICTMZVSNT-INIZCTEOSA-N 2 1 323.484 4.292 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1F ZINC000178254959 1043125488 /nfs/dbraw/zinc/12/54/88/1043125488.db2.gz KTOYNWDHRHTWNI-CYBMUJFWSA-N 2 1 322.493 4.073 20 0 DIADMP CC[C@@H]([NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1)C(C)C ZINC000179840265 1043153556 /nfs/dbraw/zinc/15/35/56/1043153556.db2.gz RCJCGHIVBXFJMJ-LJQANCHMSA-N 2 1 303.494 4.064 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C1CCc2ccccc2CC1 ZINC001202520462 1043156736 /nfs/dbraw/zinc/15/67/36/1043156736.db2.gz PFPUHWBCDXQUDF-NRFANRHFSA-N 2 1 314.517 4.034 20 0 DIADMP Cc1cc(CNC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(C)o1 ZINC000120949893 1043158820 /nfs/dbraw/zinc/15/88/20/1043158820.db2.gz OAJDZMFWGVZEKG-YJBOKZPZSA-N 2 1 318.486 4.131 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c(C)o1 ZINC000120949893 1043158825 /nfs/dbraw/zinc/15/88/25/1043158825.db2.gz OAJDZMFWGVZEKG-YJBOKZPZSA-N 2 1 318.486 4.131 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(C)o1 ZINC000120949893 1043158834 /nfs/dbraw/zinc/15/88/34/1043158834.db2.gz OAJDZMFWGVZEKG-YJBOKZPZSA-N 2 1 318.486 4.131 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(C)ccn1 ZINC000866290773 1043174384 /nfs/dbraw/zinc/17/43/84/1043174384.db2.gz YRSHFHYLPWJBKD-QGZVFWFLSA-N 2 1 303.494 4.084 20 0 DIADMP FC(F)c1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000183949584 1043175011 /nfs/dbraw/zinc/17/50/11/1043175011.db2.gz ZAHDAZAIHCOPLA-QGZVFWFLSA-N 2 1 308.416 4.075 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000183949584 1043175014 /nfs/dbraw/zinc/17/50/14/1043175014.db2.gz ZAHDAZAIHCOPLA-QGZVFWFLSA-N 2 1 308.416 4.075 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CCSc3cc(C)c(C)cc32)CC1 ZINC000427585873 1043190151 /nfs/dbraw/zinc/19/01/51/1043190151.db2.gz BFOQZDXOTPWYSB-SFHVURJKSA-N 2 1 318.530 4.304 20 0 DIADMP C[N@@H+]([C@H]1CCc2ccccc21)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001168005212 1043245638 /nfs/dbraw/zinc/24/56/38/1043245638.db2.gz HZDPJEJKORWVGW-VHRCFOOQSA-N 2 1 310.485 4.011 20 0 DIADMP C[NH+]([C@H]1CCc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001168005212 1043245646 /nfs/dbraw/zinc/24/56/46/1043245646.db2.gz HZDPJEJKORWVGW-VHRCFOOQSA-N 2 1 310.485 4.011 20 0 DIADMP C[NH+]([C@H]1CCc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001168005212 1043245654 /nfs/dbraw/zinc/24/56/54/1043245654.db2.gz HZDPJEJKORWVGW-VHRCFOOQSA-N 2 1 310.485 4.011 20 0 DIADMP C[C@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001168007005 1043259621 /nfs/dbraw/zinc/25/96/21/1043259621.db2.gz QKSVCTOBDVDLRT-BZSNNMDCSA-N 2 1 323.484 4.174 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2occc21 ZINC000192667012 1043272527 /nfs/dbraw/zinc/27/25/27/1043272527.db2.gz ZZIREEZEIKBHHL-LJQANCHMSA-N 2 1 312.457 4.287 20 0 DIADMP Cc1[nH+]ccn1Cc1ccc(-c2cc(C[NH+](C)C)ccc2F)cc1 ZINC000665195430 1043280266 /nfs/dbraw/zinc/28/02/66/1043280266.db2.gz BQMNAABPXACNBM-UHFFFAOYSA-N 2 1 323.415 4.108 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@@H+]1C ZINC000427691652 1043298746 /nfs/dbraw/zinc/29/87/46/1043298746.db2.gz VVVDOMPMKBIPCI-CNDZOEFASA-N 2 1 320.480 4.413 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@H+]1C ZINC000427691652 1043298754 /nfs/dbraw/zinc/29/87/54/1043298754.db2.gz VVVDOMPMKBIPCI-CNDZOEFASA-N 2 1 320.480 4.413 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+]CC3([NH3+])CCCC3)cs2)cs1 ZINC000665249200 1043315401 /nfs/dbraw/zinc/31/54/01/1043315401.db2.gz KZDBNSNDPMDYSN-NSHDSACASA-N 2 1 321.515 4.102 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC000665249806 1043315684 /nfs/dbraw/zinc/31/56/84/1043315684.db2.gz ZQLSROMKSHFYNQ-ZDUSSCGKSA-N 2 1 315.486 4.041 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792269 1043332029 /nfs/dbraw/zinc/33/20/29/1043332029.db2.gz VFPHZRYORADPQH-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792269 1043332041 /nfs/dbraw/zinc/33/20/41/1043332041.db2.gz VFPHZRYORADPQH-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792270 1043332396 /nfs/dbraw/zinc/33/23/96/1043332396.db2.gz VFPHZRYORADPQH-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792270 1043332401 /nfs/dbraw/zinc/33/24/01/1043332401.db2.gz VFPHZRYORADPQH-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(Cl)s1 ZINC000269039823 1043351793 /nfs/dbraw/zinc/35/17/93/1043351793.db2.gz TWHOBVSHFURYCW-AWEZNQCLSA-N 2 1 312.910 4.459 20 0 DIADMP Cc1ccc([C@@H]2CCCCC[N@@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000442383025 1043378275 /nfs/dbraw/zinc/37/82/75/1043378275.db2.gz PNJWXBCMSHHXSU-SFHVURJKSA-N 2 1 315.461 4.490 20 0 DIADMP Cc1ccc([C@@H]2CCCCC[N@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000442383025 1043378281 /nfs/dbraw/zinc/37/82/81/1043378281.db2.gz PNJWXBCMSHHXSU-SFHVURJKSA-N 2 1 315.461 4.490 20 0 DIADMP CC(C)[C@H](C[NH2+]C1CCC(C(F)F)CC1)[NH+]1CCC(C)CC1 ZINC000442712428 1043407831 /nfs/dbraw/zinc/40/78/31/1043407831.db2.gz GLNHAVZQEAOCFP-JCYILVPMSA-N 2 1 316.480 4.156 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(CF)cc2)CC1 ZINC000777559240 1043412464 /nfs/dbraw/zinc/41/24/64/1043412464.db2.gz XIBIWRDBKSZTEK-UHFFFAOYSA-N 2 1 306.469 4.100 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+]C1CCC(C(F)F)CC1 ZINC000442773028 1043413843 /nfs/dbraw/zinc/41/38/43/1043413843.db2.gz BQTFOMFEYHMWKG-UYSNPLJNSA-N 2 1 302.453 4.055 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+]C1CCC(C(F)F)CC1 ZINC000442773028 1043413854 /nfs/dbraw/zinc/41/38/54/1043413854.db2.gz BQTFOMFEYHMWKG-UYSNPLJNSA-N 2 1 302.453 4.055 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+]C1CCC(C(F)F)CC1 ZINC000442773027 1043414131 /nfs/dbraw/zinc/41/41/31/1043414131.db2.gz BQTFOMFEYHMWKG-GPANFISMSA-N 2 1 302.453 4.055 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+]C1CCC(C(F)F)CC1 ZINC000442773027 1043414146 /nfs/dbraw/zinc/41/41/46/1043414146.db2.gz BQTFOMFEYHMWKG-GPANFISMSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000442839797 1043433701 /nfs/dbraw/zinc/43/37/01/1043433701.db2.gz YEPOLZCPJMAHAK-YHNBSYBMSA-N 2 1 314.464 4.053 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000442854773 1043443485 /nfs/dbraw/zinc/44/34/85/1043443485.db2.gz JBTKAPHJHOILIH-HZPDHXFCSA-N 2 1 306.519 4.324 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCC[N@H+](C)Cc1ccccc1 ZINC000521821486 1043487819 /nfs/dbraw/zinc/48/78/19/1043487819.db2.gz YNLJWCSYKLTCMC-MNDPQUGUSA-N 2 1 308.469 4.202 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccsc1 ZINC000443097877 1043493401 /nfs/dbraw/zinc/49/34/01/1043493401.db2.gz ZWZIVPKVLLHKTE-SOLBZPMBSA-N 2 1 324.534 4.068 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000349143481 1043494169 /nfs/dbraw/zinc/49/41/69/1043494169.db2.gz BLJFHSIKTMZFHB-NVXWUHKLSA-N 2 1 315.461 4.074 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000349143481 1043494173 /nfs/dbraw/zinc/49/41/73/1043494173.db2.gz BLJFHSIKTMZFHB-NVXWUHKLSA-N 2 1 315.461 4.074 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1coc2ccccc12 ZINC000349200932 1043496396 /nfs/dbraw/zinc/49/63/96/1043496396.db2.gz ZVLWILCUXWGDOE-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1coc2ccccc12 ZINC000349200932 1043496405 /nfs/dbraw/zinc/49/64/05/1043496405.db2.gz ZVLWILCUXWGDOE-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP C[C@H]([NH2+]C1CCC2(CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000558408759 1043504639 /nfs/dbraw/zinc/50/46/39/1043504639.db2.gz HIBIVTOWSQAAOI-HKUYNNGSSA-N 2 1 312.501 4.209 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H](C)Cc1ccccc1 ZINC000558420326 1043505370 /nfs/dbraw/zinc/50/53/70/1043505370.db2.gz OUYYIPDBGKSTPC-GOSISDBHSA-N 2 1 313.489 4.036 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H](C)Cc1ccccc1 ZINC000558420326 1043505380 /nfs/dbraw/zinc/50/53/80/1043505380.db2.gz OUYYIPDBGKSTPC-GOSISDBHSA-N 2 1 313.489 4.036 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000388924969 1043544932 /nfs/dbraw/zinc/54/49/32/1043544932.db2.gz VWJSSWZODCTDES-DZGCQCFKSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000474061179 1043561784 /nfs/dbraw/zinc/56/17/84/1043561784.db2.gz WAUVOELZJNJHEQ-RLLQIKCJSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000474061179 1043561795 /nfs/dbraw/zinc/56/17/95/1043561795.db2.gz WAUVOELZJNJHEQ-RLLQIKCJSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000474061173 1043561887 /nfs/dbraw/zinc/56/18/87/1043561887.db2.gz WAUVOELZJNJHEQ-HOJAQTOUSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC12CCCC2 ZINC000474061173 1043561900 /nfs/dbraw/zinc/56/19/00/1043561900.db2.gz WAUVOELZJNJHEQ-HOJAQTOUSA-N 2 1 312.501 4.209 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000718338009 1043563259 /nfs/dbraw/zinc/56/32/59/1043563259.db2.gz LFAPYFSPDWRGKS-KRWDZBQOSA-N 2 1 324.459 4.312 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000718338009 1043563266 /nfs/dbraw/zinc/56/32/66/1043563266.db2.gz LFAPYFSPDWRGKS-KRWDZBQOSA-N 2 1 324.459 4.312 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)C2CCC(F)(F)CC2)C1 ZINC000474066007 1043565396 /nfs/dbraw/zinc/56/53/96/1043565396.db2.gz NOKCZPUGFYOLCS-CVEARBPZSA-N 2 1 316.480 4.158 20 0 DIADMP C[C@@H]([NH2+]CC[N@H+](C)C1CCCCC1)C1CCC(F)(F)CC1 ZINC000474076631 1043569512 /nfs/dbraw/zinc/56/95/12/1043569512.db2.gz YLGBHNPGHGZYGG-CQSZACIVSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@@H]([NH2+]CC[N@@H+](C)C1CCCCC1)C1CCC(F)(F)CC1 ZINC000474076631 1043569523 /nfs/dbraw/zinc/56/95/23/1043569523.db2.gz YLGBHNPGHGZYGG-CQSZACIVSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1csc(Cl)c1 ZINC000191350880 1043585135 /nfs/dbraw/zinc/58/51/35/1043585135.db2.gz DYNCFFFAOODPHH-NSHDSACASA-N 2 1 300.899 4.315 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc3cccc(F)c3o2)CC1 ZINC000474097306 1043601017 /nfs/dbraw/zinc/60/10/17/1043601017.db2.gz NCGMLBPSRYVUNP-CYBMUJFWSA-N 2 1 304.409 4.097 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539979 1043616107 /nfs/dbraw/zinc/61/61/07/1043616107.db2.gz NUAUTAWWHWXHAC-JXFKEZNVSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539979 1043616113 /nfs/dbraw/zinc/61/61/13/1043616113.db2.gz NUAUTAWWHWXHAC-JXFKEZNVSA-N 2 1 321.468 4.282 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000443605253 1043617962 /nfs/dbraw/zinc/61/79/62/1043617962.db2.gz PTQQNFVDEAUHHR-HNAYVOBHSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000443605253 1043617968 /nfs/dbraw/zinc/61/79/68/1043617968.db2.gz PTQQNFVDEAUHHR-HNAYVOBHSA-N 2 1 318.892 4.135 20 0 DIADMP C[C@H](Nc1cc(C2CC2)cc[nH+]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000353563537 1043619332 /nfs/dbraw/zinc/61/93/32/1043619332.db2.gz TWFWWEBCVANKDL-OXJNMPFZSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@H](Nc1cc(C2CC2)cc[nH+]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000353563537 1043619334 /nfs/dbraw/zinc/61/93/34/1043619334.db2.gz TWFWWEBCVANKDL-OXJNMPFZSA-N 2 1 321.468 4.282 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccsc2)CC1 ZINC000353633794 1043627894 /nfs/dbraw/zinc/62/78/94/1043627894.db2.gz UDHNLYVLUXDGMR-UHFFFAOYSA-N 2 1 314.498 4.281 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(-c3ccccn3)c2)C[C@H]1C ZINC000353748372 1043641152 /nfs/dbraw/zinc/64/11/52/1043641152.db2.gz RKCBLQPRPCECCY-YLJYHZDGSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@H]1C ZINC000353748372 1043641155 /nfs/dbraw/zinc/64/11/55/1043641155.db2.gz RKCBLQPRPCECCY-YLJYHZDGSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@H]1C ZINC000353748372 1043641158 /nfs/dbraw/zinc/64/11/58/1043641158.db2.gz RKCBLQPRPCECCY-YLJYHZDGSA-N 2 1 323.484 4.053 20 0 DIADMP CCCn1ccnc1CCCN(C)[C@H](C)c1c(F)cccc1F ZINC000191474344 1043642145 /nfs/dbraw/zinc/64/21/45/1043642145.db2.gz HCHJMZIUDODUEN-CQSZACIVSA-N 2 1 321.415 4.197 20 0 DIADMP C[C@@H](Nc1ccc([NH+]2CCC(C)CC2)cc1)C1CC[NH+](C)CC1 ZINC000777612977 1043668338 /nfs/dbraw/zinc/66/83/38/1043668338.db2.gz FAMAFMJRFARBRX-QGZVFWFLSA-N 2 1 315.505 4.065 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cncs2)cc1 ZINC000166674730 1043671261 /nfs/dbraw/zinc/67/12/61/1043671261.db2.gz VKUNVYUBGDJGDG-CHWSQXEVSA-N 2 1 312.442 4.049 20 0 DIADMP CC(C)C[C@H](C[N@H+]1CCC[C@H](c2ncc[nH]2)C1)c1ccccc1 ZINC000474157399 1043673013 /nfs/dbraw/zinc/67/30/13/1043673013.db2.gz XGBKUUHIGTWSRF-RBUKOAKNSA-N 2 1 311.473 4.419 20 0 DIADMP Cc1nc(C(C)C)ccc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000559071300 1043687271 /nfs/dbraw/zinc/68/72/71/1043687271.db2.gz OAQOXECGKDFAIK-UHFFFAOYSA-N 2 1 317.521 4.066 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCNCc1ccc(C(F)(F)F)cc1 ZINC000034081375 1043706959 /nfs/dbraw/zinc/70/69/59/1043706959.db2.gz UUKHGWXBQNGNMB-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000034081375 1043706967 /nfs/dbraw/zinc/70/69/67/1043706967.db2.gz UUKHGWXBQNGNMB-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000034081375 1043706973 /nfs/dbraw/zinc/70/69/73/1043706973.db2.gz UUKHGWXBQNGNMB-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)CC1CC[NH+](C)CC1)c1ccccc1 ZINC000474275460 1043721780 /nfs/dbraw/zinc/72/17/80/1043721780.db2.gz MALKBBQKAKETAK-HXUWFJFHSA-N 2 1 302.506 4.090 20 0 DIADMP CSC(C)(C)C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877064929 1043740215 /nfs/dbraw/zinc/74/02/15/1043740215.db2.gz GFQRWGTUMZPKLB-WMZOPIPTSA-N 2 1 318.530 4.086 20 0 DIADMP CSC(C)(C)C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877064929 1043740227 /nfs/dbraw/zinc/74/02/27/1043740227.db2.gz GFQRWGTUMZPKLB-WMZOPIPTSA-N 2 1 318.530 4.086 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168033064 1043743173 /nfs/dbraw/zinc/74/31/73/1043743173.db2.gz JSEOSUSBEDOOTN-ORDODBJJSA-N 2 1 314.517 4.452 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000474463248 1043790704 /nfs/dbraw/zinc/79/07/04/1043790704.db2.gz BQOMRKMTHZXINW-GJZGRUSLSA-N 2 1 319.518 4.108 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000474470066 1043793726 /nfs/dbraw/zinc/79/37/26/1043793726.db2.gz DKVSOTDOFPBLKP-ZZCKCESHSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000474470066 1043793731 /nfs/dbraw/zinc/79/37/31/1043793731.db2.gz DKVSOTDOFPBLKP-ZZCKCESHSA-N 2 1 306.881 4.048 20 0 DIADMP CC(C)C[C@H](C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000474476227 1043796088 /nfs/dbraw/zinc/79/60/88/1043796088.db2.gz OSCJKLHRUHPKMP-AABGKKOBSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2Cc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039310 1043852187 /nfs/dbraw/zinc/85/21/87/1043852187.db2.gz CWJZABIYYIXEJS-OPMZPASUSA-N 2 1 320.480 4.444 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2Cc3ccccc3C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039310 1043852203 /nfs/dbraw/zinc/85/22/03/1043852203.db2.gz CWJZABIYYIXEJS-OPMZPASUSA-N 2 1 320.480 4.444 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cnccc2C)cc1 ZINC000356700878 1043862795 /nfs/dbraw/zinc/86/27/95/1043862795.db2.gz ROCPMVWOBKGOSH-JKSUJKDBSA-N 2 1 320.440 4.296 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1nccc2ccccc21 ZINC000289875924 1043890980 /nfs/dbraw/zinc/89/09/80/1043890980.db2.gz SKKAVOSNDXWXCN-CQSZACIVSA-N 2 1 311.473 4.195 20 0 DIADMP CC[C@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H](C)C2CCSCC2)C1 ZINC000474711662 1043897027 /nfs/dbraw/zinc/89/70/27/1043897027.db2.gz RUOBYHQGAVVHKZ-CVEARBPZSA-N 2 1 312.567 4.008 20 0 DIADMP CC[C@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H](C)C2CCSCC2)C1 ZINC000474711662 1043897046 /nfs/dbraw/zinc/89/70/46/1043897046.db2.gz RUOBYHQGAVVHKZ-CVEARBPZSA-N 2 1 312.567 4.008 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000474713751 1043897715 /nfs/dbraw/zinc/89/77/15/1043897715.db2.gz PXZDOTRDVVRBOI-UYAOXDASSA-N 2 1 302.506 4.136 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000474818103 1043928899 /nfs/dbraw/zinc/92/88/99/1043928899.db2.gz PTBLGZUBLBFHJO-LSDHHAIUSA-N 2 1 319.880 4.407 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@](C)(CF)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168042069 1043930800 /nfs/dbraw/zinc/93/08/00/1043930800.db2.gz YODDVXFMAJXEPC-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@](C)(CF)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168042069 1043930809 /nfs/dbraw/zinc/93/08/09/1043930809.db2.gz YODDVXFMAJXEPC-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@](C)(CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168042069 1043930817 /nfs/dbraw/zinc/93/08/17/1043930817.db2.gz YODDVXFMAJXEPC-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@](C)(CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168042069 1043930828 /nfs/dbraw/zinc/93/08/28/1043930828.db2.gz YODDVXFMAJXEPC-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP CCCC[N@H+](Cc1oc(C)nc1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000931034341 1043985231 /nfs/dbraw/zinc/98/52/31/1043985231.db2.gz RJGMULQZPDPLMR-UHFFFAOYSA-N 2 1 321.509 4.203 20 0 DIADMP CCCC[N@@H+](Cc1oc(C)nc1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000931034341 1043985242 /nfs/dbraw/zinc/98/52/42/1043985242.db2.gz RJGMULQZPDPLMR-UHFFFAOYSA-N 2 1 321.509 4.203 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C[NH+]2CCCC2)c2ccsc2S1 ZINC000357845915 1043992028 /nfs/dbraw/zinc/99/20/28/1043992028.db2.gz HMMIZQKSIHIXPC-UKRRQHHQSA-N 2 1 324.559 4.385 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(SC(C)C)cc1 ZINC000358039222 1044008741 /nfs/dbraw/zinc/00/87/41/1044008741.db2.gz UNRWYAOOFXVUSG-UHFFFAOYSA-N 2 1 317.502 4.214 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(SC(C)C)cc1 ZINC000358039222 1044008755 /nfs/dbraw/zinc/00/87/55/1044008755.db2.gz UNRWYAOOFXVUSG-UHFFFAOYSA-N 2 1 317.502 4.214 20 0 DIADMP Cc1csc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001137158457 1044058529 /nfs/dbraw/zinc/05/85/29/1044058529.db2.gz TVFNKXAYYSPFMH-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1csc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001137158457 1044058540 /nfs/dbraw/zinc/05/85/40/1044058540.db2.gz TVFNKXAYYSPFMH-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC2(C3CC3)CCC2)cc1 ZINC000358355983 1044060343 /nfs/dbraw/zinc/06/03/43/1044060343.db2.gz SXWZNLJFTWLOIN-OAHLLOKOSA-N 2 1 309.457 4.412 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000359101731 1044130251 /nfs/dbraw/zinc/13/02/51/1044130251.db2.gz DLVGXFQWNUDNAY-QGZVFWFLSA-N 2 1 318.505 4.454 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCOc2ccccc21 ZINC000359949737 1044218369 /nfs/dbraw/zinc/21/83/69/1044218369.db2.gz LMCYDCRDXUNHSX-HKUYNNGSSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCSc2ccccc21 ZINC000359944465 1044219901 /nfs/dbraw/zinc/21/99/01/1044219901.db2.gz UQQJWRGJWCYPLE-SJLPKXTDSA-N 2 1 318.530 4.468 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCSc2ccccc21 ZINC000359944466 1044219973 /nfs/dbraw/zinc/21/99/73/1044219973.db2.gz UQQJWRGJWCYPLE-WMZOPIPTSA-N 2 1 318.530 4.468 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000883250992 1044245161 /nfs/dbraw/zinc/24/51/61/1044245161.db2.gz XWDXXZZAGQADHI-RDJZCZTQSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000883250992 1044245174 /nfs/dbraw/zinc/24/51/74/1044245174.db2.gz XWDXXZZAGQADHI-RDJZCZTQSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1CC([N@@H+](C)CC(C)(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168052352 1044245769 /nfs/dbraw/zinc/24/57/69/1044245769.db2.gz KOPYUHDEHCWOKW-IAGOWNOFSA-N 2 1 302.506 4.406 20 0 DIADMP c1ccc(C[NH+]2CCC3(CCC[N@H+](CC4CCC4)C3)CC2)cc1 ZINC001202775735 1044250751 /nfs/dbraw/zinc/25/07/51/1044250751.db2.gz IPEBBTSXSJTCGS-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP C[C@@H]1CC([N@@H+](C)C2CCCC2)C[C@@H](C)N1Cc1ccccc1 ZINC001168053579 1044261724 /nfs/dbraw/zinc/26/17/24/1044261724.db2.gz PIOFTAFIQYYJCP-IAGOWNOFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CC([N@H+](C)C2CCCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053579 1044261740 /nfs/dbraw/zinc/26/17/40/1044261740.db2.gz PIOFTAFIQYYJCP-IAGOWNOFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CC([N@@H+](C)C2CCCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053579 1044261747 /nfs/dbraw/zinc/26/17/47/1044261747.db2.gz PIOFTAFIQYYJCP-IAGOWNOFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@H]1CC([N@@H+](C)CC2CCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168055576 1044265348 /nfs/dbraw/zinc/26/53/48/1044265348.db2.gz WJKHDSQWAICBKW-IRXDYDNUSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC([N@@H+](C)CC2CCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168055575 1044265391 /nfs/dbraw/zinc/26/53/91/1044265391.db2.gz WJKHDSQWAICBKW-IAGOWNOFSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC([N@H+](CC2CC2)C2CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168056057 1044267599 /nfs/dbraw/zinc/26/75/99/1044267599.db2.gz BXSNAFHMPMORCG-IAGOWNOFSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC([N@@H+](CC2CC2)C2CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168056057 1044267612 /nfs/dbraw/zinc/26/76/12/1044267612.db2.gz BXSNAFHMPMORCG-IAGOWNOFSA-N 2 1 312.501 4.302 20 0 DIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1cc2cc(F)ccc2o1)C(C)(C)C ZINC000360916100 1044330425 /nfs/dbraw/zinc/33/04/25/1044330425.db2.gz MSQKNGNWUAYQCB-QGZVFWFLSA-N 2 1 306.425 4.028 20 0 DIADMP Cc1ccccc1C[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475276522 1044337906 /nfs/dbraw/zinc/33/79/06/1044337906.db2.gz PBXGJPVAXGJSAL-CTNGQTDRSA-N 2 1 322.496 4.038 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCCC[C@H]3C3CC3)C2)cc1 ZINC000475285717 1044346435 /nfs/dbraw/zinc/34/64/35/1044346435.db2.gz HDYFLYBXUKRCJE-HLAWJBBLSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H](C)c1ccccc1 ZINC000475288298 1044347249 /nfs/dbraw/zinc/34/72/49/1044347249.db2.gz RNIPDZZDENWVSM-SVFBPWRDSA-N 2 1 322.496 4.290 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475297523 1044349760 /nfs/dbraw/zinc/34/97/60/1044349760.db2.gz XNABGCAMNZMLHT-PGPKDTDWSA-N 2 1 320.480 4.202 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccccc32)c1 ZINC000361079500 1044357906 /nfs/dbraw/zinc/35/79/06/1044357906.db2.gz JVFPACLVYLINLL-OAQYLSRUSA-N 2 1 308.469 4.306 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@H]2CCC[N@H+]2C)CC1 ZINC000348265385 1044378522 /nfs/dbraw/zinc/37/85/22/1044378522.db2.gz OUQWIFYMNMLZCZ-GOSISDBHSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@H]2CCC[N@@H+]2C)CC1 ZINC000348265385 1044378560 /nfs/dbraw/zinc/37/85/60/1044378560.db2.gz OUQWIFYMNMLZCZ-GOSISDBHSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[N@H+](CC[C@H]2CCC[NH+]2C)CC1 ZINC000348265385 1044378569 /nfs/dbraw/zinc/37/85/69/1044378569.db2.gz OUQWIFYMNMLZCZ-GOSISDBHSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[N@@H+](CC[C@H]2CCC[NH+]2C)CC1 ZINC000348265385 1044378582 /nfs/dbraw/zinc/37/85/82/1044378582.db2.gz OUQWIFYMNMLZCZ-GOSISDBHSA-N 2 1 323.484 4.050 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CCSc2c(F)cccc21)C[NH+]1CCCCC1 ZINC000336851131 1044439161 /nfs/dbraw/zinc/43/91/61/1044439161.db2.gz HEJVQPTZEDRUFD-WMLDXEAASA-N 2 1 322.493 4.074 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1cccnc1 ZINC000112528194 1044442657 /nfs/dbraw/zinc/44/26/57/1044442657.db2.gz RMNXHXLEJJPOOI-ROUUACIJSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cccnc1 ZINC000112527832 1044443290 /nfs/dbraw/zinc/44/32/90/1044443290.db2.gz VGCXFVPZZFQMLI-MSOLQXFVSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cccnc1 ZINC000112528192 1044443832 /nfs/dbraw/zinc/44/38/32/1044443832.db2.gz RMNXHXLEJJPOOI-MSOLQXFVSA-N 2 1 323.484 4.307 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCOc3ccc(Cl)cc32)C1 ZINC000361968186 1044465056 /nfs/dbraw/zinc/46/50/56/1044465056.db2.gz ZFKRFVQHFIMTAW-ZMSDIMECSA-N 2 1 322.880 4.016 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc12 ZINC000119663770 1044497949 /nfs/dbraw/zinc/49/79/49/1044497949.db2.gz NPSWGRCTEVJLPM-HNNXBMFYSA-N 2 1 324.468 4.126 20 0 DIADMP CSc1ccccc1C[N@@H+](C)Cc1ccc(-n2ccnc2)cc1 ZINC000348319535 1044507969 /nfs/dbraw/zinc/50/79/69/1044507969.db2.gz MPTOCOZBSYSALW-UHFFFAOYSA-N 2 1 323.465 4.226 20 0 DIADMP Cc1nc(CNc2ccc(N3CCCCCC3)cc2C)[nH]c1C ZINC000567180769 1044549427 /nfs/dbraw/zinc/54/94/27/1044549427.db2.gz SYNISPIMZFOIKK-UHFFFAOYSA-N 2 1 312.461 4.327 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCC3(CC3)CC2)cc1F ZINC000362924528 1044564349 /nfs/dbraw/zinc/56/43/49/1044564349.db2.gz PSIRUGSUXYFDNS-UHFFFAOYSA-N 2 1 313.420 4.132 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[C@H](c2cccc(Cl)c2)C1)c1c[nH+]ccc1N ZINC000567639636 1044577893 /nfs/dbraw/zinc/57/78/93/1044577893.db2.gz ARCCSLXYNVNMQS-NOLJZWGESA-N 2 1 315.848 4.134 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@H](C)c2c[nH+]ccc2N)c2ccccc21 ZINC000567640550 1044579670 /nfs/dbraw/zinc/57/96/70/1044579670.db2.gz YNYBGWWRMJPOHR-VKJFTORMSA-N 2 1 309.457 4.072 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CCN1C ZINC000444649483 1044582853 /nfs/dbraw/zinc/58/28/53/1044582853.db2.gz KCORXSVDDSNPAR-DNVCBOLYSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649483 1044582899 /nfs/dbraw/zinc/58/28/99/1044582899.db2.gz KCORXSVDDSNPAR-DNVCBOLYSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649483 1044582914 /nfs/dbraw/zinc/58/29/14/1044582914.db2.gz KCORXSVDDSNPAR-DNVCBOLYSA-N 2 1 314.498 4.330 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccccc3C2)c1 ZINC001649171206 1044589991 /nfs/dbraw/zinc/58/99/91/1044589991.db2.gz MFBJGFXRBXCKGY-QFIPXVFZSA-N 2 1 322.496 4.176 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000567966217 1044594700 /nfs/dbraw/zinc/59/47/00/1044594700.db2.gz VAAXMJSJRFJESL-FXQLRMTLSA-N 2 1 320.443 4.064 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2CCc2ccccc2)C1 ZINC000568140565 1044606370 /nfs/dbraw/zinc/60/63/70/1044606370.db2.gz PLUMYDNNCZCHLX-NJDAHSKKSA-N 2 1 314.517 4.108 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000568166638 1044608361 /nfs/dbraw/zinc/60/83/61/1044608361.db2.gz PISBCDFXLPLNPI-PWRODBHTSA-N 2 1 323.484 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000568166638 1044608371 /nfs/dbraw/zinc/60/83/71/1044608371.db2.gz PISBCDFXLPLNPI-PWRODBHTSA-N 2 1 323.484 4.011 20 0 DIADMP CCC1CC([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000568569561 1044635696 /nfs/dbraw/zinc/63/56/96/1044635696.db2.gz BROJLRPDGTUULB-SYYJFZTOSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C3(C4CC4)CCC3)CC23CC3)cc1 ZINC000886392180 1044640149 /nfs/dbraw/zinc/64/01/49/1044640149.db2.gz YZJNQTWBJICLDW-LJQANCHMSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C3(C4CC4)CCC3)CC23CC3)cc1 ZINC000886392180 1044640164 /nfs/dbraw/zinc/64/01/64/1044640164.db2.gz YZJNQTWBJICLDW-LJQANCHMSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc2c(c1)cccc2CCC[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000523552949 1044658637 /nfs/dbraw/zinc/65/86/37/1044658637.db2.gz DQKPLOVDRKJMPK-LJQANCHMSA-N 2 1 322.496 4.190 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc12 ZINC000364439476 1044664825 /nfs/dbraw/zinc/66/48/25/1044664825.db2.gz DZXFPKHNBNFTPQ-BBWFWOEESA-N 2 1 324.468 4.126 20 0 DIADMP C[N@H+]1CC[C@H](NC2(c3ccccc3F)CC2)C[C@H]1c1ccccc1 ZINC000569013754 1044667153 /nfs/dbraw/zinc/66/71/53/1044667153.db2.gz NHPJRUREBHJMNG-PXNSSMCTSA-N 2 1 324.443 4.240 20 0 DIADMP CN1CC[C@H]([NH2+]C2(c3ccccc3F)CC2)C[C@H]1c1ccccc1 ZINC000569013754 1044667156 /nfs/dbraw/zinc/66/71/56/1044667156.db2.gz NHPJRUREBHJMNG-PXNSSMCTSA-N 2 1 324.443 4.240 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CC/C=C/c3ccccc3)CC2)[nH+]c1C ZINC000886660869 1044677564 /nfs/dbraw/zinc/67/75/64/1044677564.db2.gz HSNZFMCMTNOOMJ-UXBLZVDNSA-N 2 1 309.457 4.309 20 0 DIADMP CSc1cccc(C[NH+]2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)c1 ZINC000886659862 1044677790 /nfs/dbraw/zinc/67/77/90/1044677790.db2.gz XLSDCTMIWAIWKS-UHFFFAOYSA-N 2 1 315.486 4.128 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1ccc2cccc(Cl)c2n1 ZINC001137230468 1044712270 /nfs/dbraw/zinc/71/22/70/1044712270.db2.gz WNVHHRAHBKNMSV-UHFFFAOYSA-N 2 1 319.880 4.052 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc2cccc(Cl)c2n1 ZINC001137230468 1044712287 /nfs/dbraw/zinc/71/22/87/1044712287.db2.gz WNVHHRAHBKNMSV-UHFFFAOYSA-N 2 1 319.880 4.052 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000367905630 1044757082 /nfs/dbraw/zinc/75/70/82/1044757082.db2.gz ABKQPOJYOJTXOE-MRXNPFEDSA-N 2 1 303.475 4.116 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000367905630 1044757097 /nfs/dbraw/zinc/75/70/97/1044757097.db2.gz ABKQPOJYOJTXOE-MRXNPFEDSA-N 2 1 303.475 4.116 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000570881580 1044789679 /nfs/dbraw/zinc/78/96/79/1044789679.db2.gz NDWFKJSCTAXCSD-NFOMZHRRSA-N 2 1 308.432 4.065 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000570881580 1044789687 /nfs/dbraw/zinc/78/96/87/1044789687.db2.gz NDWFKJSCTAXCSD-NFOMZHRRSA-N 2 1 308.432 4.065 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2C)cn1 ZINC000126436136 1044814598 /nfs/dbraw/zinc/81/45/98/1044814598.db2.gz XMKOVMIZEMNGEZ-INIZCTEOSA-N 2 1 320.440 4.043 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000370671289 1044848638 /nfs/dbraw/zinc/84/86/38/1044848638.db2.gz PHQWQELLBVXPEK-HRCADAONSA-N 2 1 304.503 4.076 20 0 DIADMP c1ccc(C2CCC(C[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000572408118 1044856098 /nfs/dbraw/zinc/85/60/98/1044856098.db2.gz NJJHHLRWPFQLRB-QPIRBTGLSA-N 2 1 312.501 4.034 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(Cl)c(C)c1 ZINC000573231266 1044900998 /nfs/dbraw/zinc/90/09/98/1044900998.db2.gz APYAUFDIXGKFSL-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(Cl)c(C)c1 ZINC000573231266 1044901008 /nfs/dbraw/zinc/90/10/08/1044901008.db2.gz APYAUFDIXGKFSL-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CCC1CCC([N@H+](CCCCn2cc[nH+]c2C)C2CC2)CC1 ZINC000337650426 1044934871 /nfs/dbraw/zinc/93/48/71/1044934871.db2.gz APMLYWKPIKVQJA-UHFFFAOYSA-N 2 1 303.494 4.405 20 0 DIADMP CCC1CCC([N@@H+](CCCCn2cc[nH+]c2C)C2CC2)CC1 ZINC000337650426 1044934888 /nfs/dbraw/zinc/93/48/88/1044934888.db2.gz APMLYWKPIKVQJA-UHFFFAOYSA-N 2 1 303.494 4.405 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2C[C@@H](C)c3ccccc32)c1 ZINC000574073726 1044938086 /nfs/dbraw/zinc/93/80/86/1044938086.db2.gz BWGISOSMDKJWNN-IERDGZPVSA-N 2 1 308.469 4.476 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1Cl)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000524979999 1044958566 /nfs/dbraw/zinc/95/85/66/1044958566.db2.gz ILTVVTIDIVTASO-STQMWFEESA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1Cl)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000524979998 1044959100 /nfs/dbraw/zinc/95/91/00/1044959100.db2.gz ILTVVTIDIVTASO-QWHCGFSZSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(F)c2ccccc21 ZINC000575213512 1044993144 /nfs/dbraw/zinc/99/31/44/1044993144.db2.gz FQAWGIADOMHKDV-CABCVRRESA-N 2 1 300.421 4.114 20 0 DIADMP CCCCC/C(=C\c1ccccc1)C[NH2+]C1CC[NH+](C)CC1 ZINC000525180616 1045007592 /nfs/dbraw/zinc/00/75/92/1045007592.db2.gz YVNDMZFRCWHKTB-KNTRCKAVSA-N 2 1 300.490 4.334 20 0 DIADMP C[N@H+](C/C=C\c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268841 1045026621 /nfs/dbraw/zinc/02/66/21/1045026621.db2.gz BOHVTFCHTUCRAC-NSDWXSQCSA-N 2 1 320.480 4.154 20 0 DIADMP C[N@@H+](C/C=C\c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268841 1045026629 /nfs/dbraw/zinc/02/66/29/1045026629.db2.gz BOHVTFCHTUCRAC-NSDWXSQCSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C\c1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000525268841 1045026643 /nfs/dbraw/zinc/02/66/43/1045026643.db2.gz BOHVTFCHTUCRAC-NSDWXSQCSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C\c1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000525268841 1045026649 /nfs/dbraw/zinc/02/66/49/1045026649.db2.gz BOHVTFCHTUCRAC-NSDWXSQCSA-N 2 1 320.480 4.154 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)C2CCCC2)cc1 ZINC000446838689 1045054591 /nfs/dbraw/zinc/05/45/91/1045054591.db2.gz LBUKNFWWEYJYBB-FFZOFVMBSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)C2CCCC2)cc1 ZINC000446838689 1045054606 /nfs/dbraw/zinc/05/46/06/1045054606.db2.gz LBUKNFWWEYJYBB-FFZOFVMBSA-N 2 1 300.490 4.299 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(F)c1 ZINC000446942702 1045074862 /nfs/dbraw/zinc/07/48/62/1045074862.db2.gz UCRVPCZWPLPBJE-LPHOPBHVSA-N 2 1 306.469 4.234 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000525694440 1045112335 /nfs/dbraw/zinc/11/23/35/1045112335.db2.gz WWKFYJRTPUUBCA-QGZVFWFLSA-N 2 1 312.457 4.252 20 0 DIADMP C[NH+](CCCCC[N@H+](C)Cc1ccccc1)Cc1ccccc1 ZINC000577329572 1045118073 /nfs/dbraw/zinc/11/80/73/1045118073.db2.gz SKOGCUMCTNAPDY-UHFFFAOYSA-N 2 1 310.485 4.421 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCCc3occc32)C1 ZINC000447546908 1045145577 /nfs/dbraw/zinc/14/55/77/1045145577.db2.gz ZSXASVLXFQKLDI-JZXOWHBKSA-N 2 1 304.478 4.005 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)o1 ZINC000447595672 1045157073 /nfs/dbraw/zinc/15/70/73/1045157073.db2.gz AJXKXEKNAUCQHM-HLLBOEOZSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)o1 ZINC000447595672 1045157081 /nfs/dbraw/zinc/15/70/81/1045157081.db2.gz AJXKXEKNAUCQHM-HLLBOEOZSA-N 2 1 304.478 4.200 20 0 DIADMP C[C@@H](CC[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC000447823506 1045178635 /nfs/dbraw/zinc/17/86/35/1045178635.db2.gz WTGKTDGPINEEPV-MOPGFXCFSA-N 2 1 302.506 4.282 20 0 DIADMP C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cccc(C[NH+](C)C)c1 ZINC000924722848 1045194254 /nfs/dbraw/zinc/19/42/54/1045194254.db2.gz WCIMSOFWIUSSQG-ZIAGYGMSSA-N 2 1 318.411 4.438 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000577984272 1045195371 /nfs/dbraw/zinc/19/53/71/1045195371.db2.gz HVKJHXKRROADQY-HOTGVXAUSA-N 2 1 306.519 4.128 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000577984272 1045195376 /nfs/dbraw/zinc/19/53/76/1045195376.db2.gz HVKJHXKRROADQY-HOTGVXAUSA-N 2 1 306.519 4.128 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Cl)c2)C[C@H]1C ZINC000527116507 1045197822 /nfs/dbraw/zinc/19/78/22/1045197822.db2.gz VGCQZROEWFMCPI-DAYGRLMNSA-N 2 1 308.897 4.248 20 0 DIADMP CCC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ncccc1Cl ZINC000925133993 1045229930 /nfs/dbraw/zinc/22/99/30/1045229930.db2.gz ODKUTQOUHCOKDZ-MRXNPFEDSA-N 2 1 320.868 4.151 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)CC[N@@H+]1C ZINC000527664020 1045246663 /nfs/dbraw/zinc/24/66/63/1045246663.db2.gz CHQDLSAUXBKMEK-GSEOLPGOSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)CC[N@H+]1C ZINC000527664020 1045246672 /nfs/dbraw/zinc/24/66/72/1045246672.db2.gz CHQDLSAUXBKMEK-GSEOLPGOSA-N 2 1 300.490 4.175 20 0 DIADMP C[N@@H+](CCc1ccc(C(C)(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000578585071 1045257813 /nfs/dbraw/zinc/25/78/13/1045257813.db2.gz RIRJHGPOBHXLRU-YOFSQIOKSA-N 2 1 314.517 4.084 20 0 DIADMP C[NH+](CCc1ccc(C(C)(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000578585071 1045257821 /nfs/dbraw/zinc/25/78/21/1045257821.db2.gz RIRJHGPOBHXLRU-YOFSQIOKSA-N 2 1 314.517 4.084 20 0 DIADMP C[NH+](CCc1ccc(C(C)(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000578585071 1045257831 /nfs/dbraw/zinc/25/78/31/1045257831.db2.gz RIRJHGPOBHXLRU-YOFSQIOKSA-N 2 1 314.517 4.084 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000579010496 1045287875 /nfs/dbraw/zinc/28/78/75/1045287875.db2.gz AAQSWHYNNPUKEP-GTAWCEEGSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000579010496 1045287881 /nfs/dbraw/zinc/28/78/81/1045287881.db2.gz AAQSWHYNNPUKEP-GTAWCEEGSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000579010500 1045288958 /nfs/dbraw/zinc/28/89/58/1045288958.db2.gz AAQSWHYNNPUKEP-RSPOEFSDSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000579010500 1045288964 /nfs/dbraw/zinc/28/89/64/1045288964.db2.gz AAQSWHYNNPUKEP-RSPOEFSDSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000697101679 1045309067 /nfs/dbraw/zinc/30/90/67/1045309067.db2.gz PNYJELRJUWJHNV-WBVHZDCISA-N 2 1 324.459 4.311 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@H]3CC[N@H+](C)C[C@H]3C)CCCC2)c(C)c1 ZINC000579383093 1045311448 /nfs/dbraw/zinc/31/14/48/1045311448.db2.gz GJSCYQJTSRQVHJ-QUCCMNQESA-N 2 1 314.517 4.045 20 0 DIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000449071737 1045344054 /nfs/dbraw/zinc/34/40/54/1045344054.db2.gz OLHXCYAEOURVNP-QAPCUYQASA-N 2 1 318.892 4.193 20 0 DIADMP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]Cc2cccc(O)c2)CC1 ZINC000449114335 1045351374 /nfs/dbraw/zinc/35/13/74/1045351374.db2.gz ZGBBQTLIURYUFC-UHFFFAOYSA-N 2 1 318.505 4.161 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CCC1 ZINC000449160149 1045355743 /nfs/dbraw/zinc/35/57/43/1045355743.db2.gz LBMOZNPYKMKMHI-RYRKJORJSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CCC1 ZINC000449160149 1045355749 /nfs/dbraw/zinc/35/57/49/1045355749.db2.gz LBMOZNPYKMKMHI-RYRKJORJSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CCC1 ZINC000449160150 1045355866 /nfs/dbraw/zinc/35/58/66/1045355866.db2.gz LBMOZNPYKMKMHI-SOLBZPMBSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CCC1 ZINC000449160150 1045355872 /nfs/dbraw/zinc/35/58/72/1045355872.db2.gz LBMOZNPYKMKMHI-SOLBZPMBSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC000449178236 1045356270 /nfs/dbraw/zinc/35/62/70/1045356270.db2.gz XGOXVQXNVOWKCN-HUHSQHJXSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC000449178236 1045356272 /nfs/dbraw/zinc/35/62/72/1045356272.db2.gz XGOXVQXNVOWKCN-HUHSQHJXSA-N 2 1 306.881 4.048 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449254765 1045367746 /nfs/dbraw/zinc/36/77/46/1045367746.db2.gz YLRHIIUQUSPHNN-IBGZPJMESA-N 2 1 316.876 4.127 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000697127640 1045393617 /nfs/dbraw/zinc/39/36/17/1045393617.db2.gz IVMQKHTVTFTVLF-WBVHZDCISA-N 2 1 324.459 4.168 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)CC1 ZINC000449449235 1045394591 /nfs/dbraw/zinc/39/45/91/1045394591.db2.gz KYGBRNKXTKDJIV-KRWDZBQOSA-N 2 1 310.844 4.004 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CC2)cc1Cl ZINC000449448138 1045394825 /nfs/dbraw/zinc/39/48/25/1045394825.db2.gz FGSXHNZPXNQZEB-IIDMSEBBSA-N 2 1 322.855 4.147 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)C(C)(F)F ZINC000697138462 1045413959 /nfs/dbraw/zinc/41/39/59/1045413959.db2.gz ZXMUSYSNJJIQBR-RDJZCZTQSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728666 1045555219 /nfs/dbraw/zinc/55/52/19/1045555219.db2.gz PKEZILHOBBLSJU-HRCADAONSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H](NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714739 1045575882 /nfs/dbraw/zinc/57/58/82/1045575882.db2.gz AKISXLIYDAREOV-PKOBYXMFSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714739 1045575896 /nfs/dbraw/zinc/57/58/96/1045575896.db2.gz AKISXLIYDAREOV-PKOBYXMFSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714739 1045575911 /nfs/dbraw/zinc/57/59/11/1045575911.db2.gz AKISXLIYDAREOV-PKOBYXMFSA-N 2 1 312.457 4.233 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335449 1045645788 /nfs/dbraw/zinc/64/57/88/1045645788.db2.gz OSTCUBWJAPFJTR-BDUNBXCCSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335449 1045645792 /nfs/dbraw/zinc/64/57/92/1045645792.db2.gz OSTCUBWJAPFJTR-BDUNBXCCSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335449 1045645797 /nfs/dbraw/zinc/64/57/97/1045645797.db2.gz OSTCUBWJAPFJTR-BDUNBXCCSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335449 1045645803 /nfs/dbraw/zinc/64/58/03/1045645803.db2.gz OSTCUBWJAPFJTR-BDUNBXCCSA-N 2 1 306.881 4.017 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000530667419 1045707157 /nfs/dbraw/zinc/70/71/57/1045707157.db2.gz LOCVOLQBCLZXED-LJQANCHMSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000530667419 1045707162 /nfs/dbraw/zinc/70/71/62/1045707162.db2.gz LOCVOLQBCLZXED-LJQANCHMSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000530667419 1045707169 /nfs/dbraw/zinc/70/71/69/1045707169.db2.gz LOCVOLQBCLZXED-LJQANCHMSA-N 2 1 308.469 4.127 20 0 DIADMP CCCCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000779439815 1045729026 /nfs/dbraw/zinc/72/90/26/1045729026.db2.gz PQLDDEIDZVBQPU-OWZKRDHZSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1C[C@@H](N(C)Cc2sc3ccccc3c2Cl)CC[N@H+]1C ZINC000530905336 1045750242 /nfs/dbraw/zinc/75/02/42/1045750242.db2.gz KPHIAWVYWQXKRR-STQMWFEESA-N 2 1 322.905 4.469 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000530949725 1045761947 /nfs/dbraw/zinc/76/19/47/1045761947.db2.gz JHOJIAVVUQPWQQ-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000530949725 1045761956 /nfs/dbraw/zinc/76/19/56/1045761956.db2.gz JHOJIAVVUQPWQQ-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949725 1045761966 /nfs/dbraw/zinc/76/19/66/1045761966.db2.gz JHOJIAVVUQPWQQ-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949725 1045761971 /nfs/dbraw/zinc/76/19/71/1045761971.db2.gz JHOJIAVVUQPWQQ-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C(C1CCCC1)C1CCCC1 ZINC000754147225 1045854774 /nfs/dbraw/zinc/85/47/74/1045854774.db2.gz CSGIMVDJVKELQI-OAHLLOKOSA-N 2 1 303.494 4.166 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C(C1CCCC1)C1CCCC1 ZINC000754147224 1045855117 /nfs/dbraw/zinc/85/51/17/1045855117.db2.gz CSGIMVDJVKELQI-HNNXBMFYSA-N 2 1 303.494 4.166 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC000531687435 1045892990 /nfs/dbraw/zinc/89/29/90/1045892990.db2.gz WKCYBPACXRGKKC-CMTQZCSUSA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000531704761 1045901595 /nfs/dbraw/zinc/90/15/95/1045901595.db2.gz JPMAPLXBOJZZKK-PZJWPPBQSA-N 2 1 314.517 4.276 20 0 DIADMP CC(C)c1ccc(CCC[NH2+][C@@H]2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1 ZINC000531713582 1045903434 /nfs/dbraw/zinc/90/34/34/1045903434.db2.gz CPMWBWRSZLXQDX-FUHIMQAGSA-N 2 1 302.506 4.061 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3c4ccccc4sc32)C1 ZINC000531715405 1045904512 /nfs/dbraw/zinc/90/45/12/1045904512.db2.gz XSOGNCRPLWOVPO-RHSMWYFYSA-N 2 1 314.498 4.210 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)s1 ZINC000631706517 1045906757 /nfs/dbraw/zinc/90/67/57/1045906757.db2.gz GTWKHJWTSLEKOC-ZQIUZPCESA-N 2 1 321.534 4.145 20 0 DIADMP CCC[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000531724547 1045912957 /nfs/dbraw/zinc/91/29/57/1045912957.db2.gz OSQHITRYOSNVEL-MRXNPFEDSA-N 2 1 300.446 4.190 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192918379 1045955382 /nfs/dbraw/zinc/95/53/82/1045955382.db2.gz YLHQAVCBAGJTHQ-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001137848235 1045982714 /nfs/dbraw/zinc/98/27/14/1045982714.db2.gz ZTPSNNSDKNJISQ-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1cccc(C)c1C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001137848235 1045982733 /nfs/dbraw/zinc/98/27/33/1045982733.db2.gz ZTPSNNSDKNJISQ-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP CC(F)(F)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453215781 1045988587 /nfs/dbraw/zinc/98/85/87/1045988587.db2.gz GZXYLVCEDUPDOA-KSZLIROESA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2sccc21 ZINC000453225048 1045992012 /nfs/dbraw/zinc/99/20/12/1045992012.db2.gz SJHLAWXWERQMBF-ARAOSMHQSA-N 2 1 304.503 4.293 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2sccc21 ZINC000453225051 1045992780 /nfs/dbraw/zinc/99/27/80/1045992780.db2.gz SJHLAWXWERQMBF-GIOUXUJVSA-N 2 1 304.503 4.293 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000453399280 1046075102 /nfs/dbraw/zinc/07/51/02/1046075102.db2.gz LFZHUOJTILLRLQ-HUUCEWRRSA-N 2 1 308.897 4.296 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc2ccccc2s1 ZINC000453405261 1046076841 /nfs/dbraw/zinc/07/68/41/1046076841.db2.gz QFTXZXQZGORPPW-AWEZNQCLSA-N 2 1 302.487 4.426 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)oc2c1 ZINC000453410056 1046079513 /nfs/dbraw/zinc/07/95/13/1046079513.db2.gz USPUQULBXCDMBK-HNNXBMFYSA-N 2 1 300.446 4.266 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccccc1C(F)(F)F ZINC000453419733 1046080688 /nfs/dbraw/zinc/08/06/88/1046080688.db2.gz JRHPGJMEZKDEIV-ZDUSSCGKSA-N 2 1 314.395 4.230 20 0 DIADMP C[N@@H+](CCCC[NH2+]C(c1ccccc1)c1ccccc1)C1CC1 ZINC000453391514 1046081690 /nfs/dbraw/zinc/08/16/90/1046081690.db2.gz DORPEZXHJSYBDX-UHFFFAOYSA-N 2 1 308.469 4.240 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCSc2ccc(Cl)cc21)C1CC1 ZINC000453392430 1046081855 /nfs/dbraw/zinc/08/18/55/1046081855.db2.gz FIQSFTNHIANINQ-INIZCTEOSA-N 2 1 324.921 4.341 20 0 DIADMP Cc1cc([C@@H]([NH2+]CCCC[N@H+](C)C2CC2)C2CC2)ccc1F ZINC000453421013 1046087103 /nfs/dbraw/zinc/08/71/03/1046087103.db2.gz ZZQJKIAHEPDYAM-IBGZPJMESA-N 2 1 304.453 4.049 20 0 DIADMP C[N@@H+](CCCC[NH2+]C1CC(c2ccc(Cl)cc2)C1)C1CC1 ZINC000453420933 1046087330 /nfs/dbraw/zinc/08/73/30/1046087330.db2.gz ZYFUILFHWTUFAL-UHFFFAOYSA-N 2 1 306.881 4.050 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593746 1046095018 /nfs/dbraw/zinc/09/50/18/1046095018.db2.gz HMEQAMXIFDAYCI-SQFISAMPSA-N 2 1 306.881 4.207 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3c2cccc3Cl)C1 ZINC000532214881 1046116725 /nfs/dbraw/zinc/11/67/25/1046116725.db2.gz YWEQIAUONJLJHY-RDTXWAMCSA-N 2 1 306.881 4.037 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000532234959 1046123861 /nfs/dbraw/zinc/12/38/61/1046123861.db2.gz INKPGRCUEJOROG-ZSGPHXLJSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)CC[N@H+]1C ZINC000532234959 1046123866 /nfs/dbraw/zinc/12/38/66/1046123866.db2.gz INKPGRCUEJOROG-ZSGPHXLJSA-N 2 1 306.881 4.048 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001138314887 1046148919 /nfs/dbraw/zinc/14/89/19/1046148919.db2.gz RRFOOIYXFDOROM-UHFFFAOYSA-N 2 1 315.505 4.239 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(Cl)cc1 ZINC000903055909 1046151457 /nfs/dbraw/zinc/15/14/57/1046151457.db2.gz NDDPWRRZQHQSIV-NYOPMGMLSA-N 2 1 304.865 4.148 20 0 DIADMP c1sc2ccccc2c1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903076557 1046156601 /nfs/dbraw/zinc/15/66/01/1046156601.db2.gz RUVWBYDQELIWQD-ZXFUBFMLSA-N 2 1 312.482 4.149 20 0 DIADMP c1ccc2cc(CC[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)ccc2c1 ZINC000903080384 1046158370 /nfs/dbraw/zinc/15/83/70/1046158370.db2.gz GLYRYHLHKKPZBY-XDNSSPFJSA-N 2 1 320.480 4.130 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](C1CCCC1)C1CCN(C)CC1 ZINC001138723529 1046159612 /nfs/dbraw/zinc/15/96/12/1046159612.db2.gz SCAJADKJTYXTHV-UHFFFAOYSA-N 2 1 320.908 4.487 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)C(C)(C)c1ccccc1 ZINC000903086838 1046161580 /nfs/dbraw/zinc/16/15/80/1046161580.db2.gz ATRYABRKFQGJJR-XIHRNRATSA-N 2 1 312.501 4.100 20 0 DIADMP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)Cc1ccccc1 ZINC000903122142 1046168156 /nfs/dbraw/zinc/16/81/56/1046168156.db2.gz WHTNGZRLSGTQTQ-CTXDPNEZSA-N 2 1 312.501 4.003 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+](C)CCC[NH+]1CCCC1 ZINC001138460554 1046189778 /nfs/dbraw/zinc/18/97/78/1046189778.db2.gz NAVLREVQCVSNTC-UHFFFAOYSA-N 2 1 302.487 4.127 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)cc1 ZINC001138549013 1046222413 /nfs/dbraw/zinc/22/24/13/1046222413.db2.gz NRRBIPFBYCKKBU-UYAOXDASSA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)cc1 ZINC001138549013 1046222425 /nfs/dbraw/zinc/22/24/25/1046222425.db2.gz NRRBIPFBYCKKBU-UYAOXDASSA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC001138551875 1046226341 /nfs/dbraw/zinc/22/63/41/1046226341.db2.gz QCNONACCMXUGGV-OAQYLSRUSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC001138551875 1046226352 /nfs/dbraw/zinc/22/63/52/1046226352.db2.gz QCNONACCMXUGGV-OAQYLSRUSA-N 2 1 317.436 4.300 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc4oc5ccccc5c4c3)C2)C1 ZINC000795308346 1046255521 /nfs/dbraw/zinc/25/55/21/1046255521.db2.gz AUFANNZMXXRGMM-NRFANRHFSA-N 2 1 320.436 4.114 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc4oc5ccccc5c4c3)C2)C1 ZINC000795308346 1046255536 /nfs/dbraw/zinc/25/55/36/1046255536.db2.gz AUFANNZMXXRGMM-NRFANRHFSA-N 2 1 320.436 4.114 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc4oc5ccccc5c4c3)C2)C1 ZINC000795308346 1046255546 /nfs/dbraw/zinc/25/55/46/1046255546.db2.gz AUFANNZMXXRGMM-NRFANRHFSA-N 2 1 320.436 4.114 20 0 DIADMP c1cc2cc(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2o1 ZINC001138821569 1046303222 /nfs/dbraw/zinc/30/32/22/1046303222.db2.gz AXUOARWQAPPLBP-IBGZPJMESA-N 2 1 312.457 4.273 20 0 DIADMP c1cc2cc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2o1 ZINC001138821569 1046303240 /nfs/dbraw/zinc/30/32/40/1046303240.db2.gz AXUOARWQAPPLBP-IBGZPJMESA-N 2 1 312.457 4.273 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000638319611 1046314984 /nfs/dbraw/zinc/31/49/84/1046314984.db2.gz YVBSGKURIGEBCW-LRQRDZAKSA-N 2 1 321.468 4.100 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000638319611 1046314999 /nfs/dbraw/zinc/31/49/99/1046314999.db2.gz YVBSGKURIGEBCW-LRQRDZAKSA-N 2 1 321.468 4.100 20 0 DIADMP [NH3+]CC1([C@@H]2CCCC[N@H+]2Cc2cccc(C(F)F)c2)CCC1 ZINC000903812985 1046326151 /nfs/dbraw/zinc/32/61/51/1046326151.db2.gz WRYRYBKQKJMCGD-INIZCTEOSA-N 2 1 308.416 4.108 20 0 DIADMP CCC[N@H+](C[C@@H]([NH3+])CC(F)F)[C@@H](C)c1cc2ccccc2o1 ZINC000903885358 1046335135 /nfs/dbraw/zinc/33/51/35/1046335135.db2.gz FTDDJUOWJOGRHB-JSGCOSHPSA-N 2 1 310.388 4.188 20 0 DIADMP CCC[N@@H+](C[C@@H]([NH3+])CC(F)F)[C@@H](C)c1cc2ccccc2o1 ZINC000903885358 1046335148 /nfs/dbraw/zinc/33/51/48/1046335148.db2.gz FTDDJUOWJOGRHB-JSGCOSHPSA-N 2 1 310.388 4.188 20 0 DIADMP c1c2ccccc2oc1C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001139066595 1046375715 /nfs/dbraw/zinc/37/57/15/1046375715.db2.gz ZMRCTFHIMDPASQ-GOSISDBHSA-N 2 1 312.457 4.273 20 0 DIADMP c1c2ccccc2oc1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001139066595 1046375731 /nfs/dbraw/zinc/37/57/31/1046375731.db2.gz ZMRCTFHIMDPASQ-GOSISDBHSA-N 2 1 312.457 4.273 20 0 DIADMP C[NH+](C)C1CC[NH+](Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001139065321 1046376045 /nfs/dbraw/zinc/37/60/45/1046376045.db2.gz ONOPGLWGEUOJNG-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP Fc1ccc(-c2cccc(C[NH+]3CCC([NH+]4CCC4)CC3)c2)cc1 ZINC001139069758 1046379571 /nfs/dbraw/zinc/37/95/71/1046379571.db2.gz XRVLVHQJBAUXFP-UHFFFAOYSA-N 2 1 324.443 4.163 20 0 DIADMP c1coc(CCC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639335728 1046383068 /nfs/dbraw/zinc/38/30/68/1046383068.db2.gz RFWLGWXIUYKRQW-NQIIRXRSSA-N 2 1 324.468 4.170 20 0 DIADMP c1coc(CCC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639335728 1046383076 /nfs/dbraw/zinc/38/30/76/1046383076.db2.gz RFWLGWXIUYKRQW-NQIIRXRSSA-N 2 1 324.468 4.170 20 0 DIADMP CC1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001168203489 1046419630 /nfs/dbraw/zinc/41/96/30/1046419630.db2.gz QLZCVMKXEBSJPH-CBRFPRNKSA-N 2 1 312.501 4.350 20 0 DIADMP Fc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(-n2ccnc2)cc1 ZINC001139360165 1046437056 /nfs/dbraw/zinc/43/70/56/1046437056.db2.gz JAELHJAEPCYRLP-HXUWFJFHSA-N 2 1 321.399 4.349 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](CCCCC(F)(F)F)CC1 ZINC000639986015 1046439582 /nfs/dbraw/zinc/43/95/82/1046439582.db2.gz IDHAIIWHVJSKKL-UHFFFAOYSA-N 2 1 306.416 4.059 20 0 DIADMP Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124778195 1046459669 /nfs/dbraw/zinc/45/96/69/1046459669.db2.gz STRQEZSKIGLZPJ-MAUKXSAKSA-N 2 1 315.461 4.346 20 0 DIADMP Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124778195 1046459676 /nfs/dbraw/zinc/45/96/76/1046459676.db2.gz STRQEZSKIGLZPJ-MAUKXSAKSA-N 2 1 315.461 4.346 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125798196 1046471926 /nfs/dbraw/zinc/47/19/26/1046471926.db2.gz REBOEIXPGXJJFU-KDOFPFPSSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125798196 1046471930 /nfs/dbraw/zinc/47/19/30/1046471930.db2.gz REBOEIXPGXJJFU-KDOFPFPSSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125870658 1046472936 /nfs/dbraw/zinc/47/29/36/1046472936.db2.gz XJIVFCNFEZMOOX-KSSFIOAISA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125870658 1046472941 /nfs/dbraw/zinc/47/29/41/1046472941.db2.gz XJIVFCNFEZMOOX-KSSFIOAISA-N 2 1 310.432 4.126 20 0 DIADMP c1ccc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCCCC2)cc1 ZINC000677236821 1046475191 /nfs/dbraw/zinc/47/51/91/1046475191.db2.gz VFGBCEMMIVTKIJ-PMACEKPBSA-N 2 1 312.501 4.105 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)c2)c1 ZINC000677238215 1046476599 /nfs/dbraw/zinc/47/65/99/1046476599.db2.gz YCVZYEWGCQTAMH-YADHBBJMSA-N 2 1 320.480 4.378 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(F)cc1F ZINC000677239894 1046476799 /nfs/dbraw/zinc/47/67/99/1046476799.db2.gz OKKSGRAXBUYXJH-RVKKMQEKSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1F ZINC000677239894 1046476803 /nfs/dbraw/zinc/47/68/03/1046476803.db2.gz OKKSGRAXBUYXJH-RVKKMQEKSA-N 2 1 322.443 4.268 20 0 DIADMP c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677237934 1046476912 /nfs/dbraw/zinc/47/69/12/1046476912.db2.gz RCEITCHBXXSCLL-WOZUAGRISA-N 2 1 312.501 4.004 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)cc1 ZINC000677238242 1046476976 /nfs/dbraw/zinc/47/69/76/1046476976.db2.gz ZMOXGXOGLCEUJI-SLFFLAALSA-N 2 1 316.464 4.273 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CC2(Cl)Cl)cc1 ZINC000782052115 1046492702 /nfs/dbraw/zinc/49/27/02/1046492702.db2.gz GLPXQXXTAJVKGY-SMDDNHRTSA-N 2 1 324.255 4.025 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CC2(Cl)Cl)cc1 ZINC000782052111 1046492845 /nfs/dbraw/zinc/49/28/45/1046492845.db2.gz GLPXQXXTAJVKGY-FZMZJTMJSA-N 2 1 324.255 4.025 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000782191499 1046499644 /nfs/dbraw/zinc/49/96/44/1046499644.db2.gz WMEKFDPMBRFAJJ-DNVCBOLYSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000782191499 1046499646 /nfs/dbraw/zinc/49/96/46/1046499646.db2.gz WMEKFDPMBRFAJJ-DNVCBOLYSA-N 2 1 318.892 4.135 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1cccc2ccccc21 ZINC000536607345 1046523424 /nfs/dbraw/zinc/52/34/24/1046523424.db2.gz UAGHNYBVZHGNLA-INIZCTEOSA-N 2 1 307.441 4.428 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1cccc2ccccc21 ZINC000536607345 1046523431 /nfs/dbraw/zinc/52/34/31/1046523431.db2.gz UAGHNYBVZHGNLA-INIZCTEOSA-N 2 1 307.441 4.428 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c1 ZINC001139880755 1046543570 /nfs/dbraw/zinc/54/35/70/1046543570.db2.gz NSFHCYUDUYHMOJ-UHFFFAOYSA-N 2 1 324.512 4.404 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c1 ZINC001139880755 1046543583 /nfs/dbraw/zinc/54/35/83/1046543583.db2.gz NSFHCYUDUYHMOJ-UHFFFAOYSA-N 2 1 324.512 4.404 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cc2ccccc2cn1 ZINC001140001756 1046565235 /nfs/dbraw/zinc/56/52/35/1046565235.db2.gz ZGJZWHLKYNYROX-SFTDATJTSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2cn1 ZINC001140001756 1046565245 /nfs/dbraw/zinc/56/52/45/1046565245.db2.gz ZGJZWHLKYNYROX-SFTDATJTSA-N 2 1 323.484 4.074 20 0 DIADMP CC[N@H+](Cc1ccccc1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140022497 1046571035 /nfs/dbraw/zinc/57/10/35/1046571035.db2.gz HVTHMKSPRCCOBF-UHFFFAOYSA-N 2 1 305.425 4.203 20 0 DIADMP CC[N@@H+](Cc1ccccc1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140022497 1046571051 /nfs/dbraw/zinc/57/10/51/1046571051.db2.gz HVTHMKSPRCCOBF-UHFFFAOYSA-N 2 1 305.425 4.203 20 0 DIADMP CC[N@H+](Cc1cccs1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026653 1046571687 /nfs/dbraw/zinc/57/16/87/1046571687.db2.gz ONGXYFCKPHWXTI-UHFFFAOYSA-N 2 1 311.454 4.264 20 0 DIADMP CC[N@@H+](Cc1cccs1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026653 1046571697 /nfs/dbraw/zinc/57/16/97/1046571697.db2.gz ONGXYFCKPHWXTI-UHFFFAOYSA-N 2 1 311.454 4.264 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccccc1-c1ccccc1 ZINC000729681369 1046578257 /nfs/dbraw/zinc/57/82/57/1046578257.db2.gz WPUOZNLHSABCQE-KRWDZBQOSA-N 2 1 319.452 4.284 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(C)n1 ZINC000678413612 1046630289 /nfs/dbraw/zinc/63/02/89/1046630289.db2.gz LEAHRKKDGFFNKZ-IAGOWNOFSA-N 2 1 303.494 4.004 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(C)n1 ZINC000678413613 1046630502 /nfs/dbraw/zinc/63/05/02/1046630502.db2.gz LEAHRKKDGFFNKZ-IRXDYDNUSA-N 2 1 303.494 4.004 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000532967808 1046631905 /nfs/dbraw/zinc/63/19/05/1046631905.db2.gz VGRGTLDBGHYHDA-QAPCUYQASA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000532967808 1046631910 /nfs/dbraw/zinc/63/19/10/1046631910.db2.gz VGRGTLDBGHYHDA-QAPCUYQASA-N 2 1 306.881 4.351 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(C)nc2C)c1 ZINC000678424614 1046634741 /nfs/dbraw/zinc/63/47/41/1046634741.db2.gz QEELYGYBCQSIHO-MRXNPFEDSA-N 2 1 311.473 4.001 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532989345 1046636264 /nfs/dbraw/zinc/63/62/64/1046636264.db2.gz QMRKVQVQFTVTPV-ICSRJNTNSA-N 2 1 308.469 4.202 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000678425868 1046636420 /nfs/dbraw/zinc/63/64/20/1046636420.db2.gz DACNYBVDSIEUQI-UWVAXJGDSA-N 2 1 315.505 4.084 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H]2CCc3c2cccc3Cl)CC1 ZINC000533099587 1046653222 /nfs/dbraw/zinc/65/32/22/1046653222.db2.gz LSWWFXRECSEULN-IBGZPJMESA-N 2 1 320.908 4.380 20 0 DIADMP CC[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000834789259 1046670166 /nfs/dbraw/zinc/67/01/66/1046670166.db2.gz BUPBNQIOXIUQKU-LEWJYISDSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000643546023 1046670656 /nfs/dbraw/zinc/67/06/56/1046670656.db2.gz HDAQXWNOEDBKOV-XHDPSFHLSA-N 2 1 313.272 4.319 20 0 DIADMP CC[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000834789261 1046672312 /nfs/dbraw/zinc/67/23/12/1046672312.db2.gz BUPBNQIOXIUQKU-RTWAWAEBSA-N 2 1 323.484 4.035 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1OC(F)F ZINC000643547005 1046673277 /nfs/dbraw/zinc/67/32/77/1046673277.db2.gz YFJJBTMQHMGILW-HIFRSBDPSA-N 2 1 324.415 4.003 20 0 DIADMP CC1(C)CC[C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc21 ZINC000678611808 1046678946 /nfs/dbraw/zinc/67/89/46/1046678946.db2.gz NKJNKMFLBYDKNT-SQNIBIBYSA-N 2 1 312.501 4.058 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]([C@H]3CCc4cc(Cl)ccc43)C2)CC1 ZINC000796057349 1046707689 /nfs/dbraw/zinc/70/76/89/1046707689.db2.gz NMVCBJWYYQVHMW-SFHVURJKSA-N 2 1 318.892 4.135 20 0 DIADMP CC(C)(C)Oc1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000679011255 1046756387 /nfs/dbraw/zinc/75/63/87/1046756387.db2.gz BUBMGBGZQOPOEB-UHFFFAOYSA-N 2 1 318.505 4.216 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000645457571 1046792366 /nfs/dbraw/zinc/79/23/66/1046792366.db2.gz QPPMUJLHEGMSGW-GXRSIYKFSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000645457571 1046792373 /nfs/dbraw/zinc/79/23/73/1046792373.db2.gz QPPMUJLHEGMSGW-GXRSIYKFSA-N 2 1 320.480 4.358 20 0 DIADMP Cc1nc2c(s1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCC2 ZINC000246984976 1046821460 /nfs/dbraw/zinc/82/14/60/1046821460.db2.gz JYBFCQYSESVIDN-ZBFHGGJFSA-N 2 1 321.534 4.073 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc2ccncc21 ZINC001140644649 1046832059 /nfs/dbraw/zinc/83/20/59/1046832059.db2.gz WPCXAVJFWAEWPW-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)n1 ZINC000679722952 1046895569 /nfs/dbraw/zinc/89/55/69/1046895569.db2.gz IPHRXUDSQJXMLI-BPQIPLTHSA-N 2 1 315.505 4.002 20 0 DIADMP CC(C)[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC001206581627 1046901869 /nfs/dbraw/zinc/90/18/69/1046901869.db2.gz KOZNGNDUVXRAAL-INIZCTEOSA-N 2 1 315.288 4.346 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@H+](Cc2c[nH]c3cc[nH+]cc23)C1 ZINC001140807383 1046912389 /nfs/dbraw/zinc/91/23/89/1046912389.db2.gz XMVZAKFCQCHWGY-ZDUSSCGKSA-N 2 1 311.816 4.206 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@@H+](Cc2c[nH]c3cc[nH+]cc23)C1 ZINC001140807383 1046912401 /nfs/dbraw/zinc/91/24/01/1046912401.db2.gz XMVZAKFCQCHWGY-ZDUSSCGKSA-N 2 1 311.816 4.206 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000261624670 1046946677 /nfs/dbraw/zinc/94/66/77/1046946677.db2.gz DRUHJLZKHRPTQB-QGZVFWFLSA-N 2 1 320.889 4.239 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CC(C3CC3)C3CC3)CC23CC3)cc1 ZINC000647188514 1046952136 /nfs/dbraw/zinc/95/21/36/1046952136.db2.gz VEJFZZUKJBIOQX-HXUWFJFHSA-N 2 1 324.512 4.209 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CC(C3CC3)C3CC3)CC23CC3)cc1 ZINC000647188514 1046952150 /nfs/dbraw/zinc/95/21/50/1046952150.db2.gz VEJFZZUKJBIOQX-HXUWFJFHSA-N 2 1 324.512 4.209 20 0 DIADMP CSc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000647282975 1046965411 /nfs/dbraw/zinc/96/54/11/1046965411.db2.gz BXVQZTATCNRMOV-JTDSTZFVSA-N 2 1 316.514 4.002 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccoc1 ZINC000680351854 1046969152 /nfs/dbraw/zinc/96/91/52/1046969152.db2.gz GTLHIPXROXIYKA-BVPXEZJJSA-N 2 1 324.468 4.231 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccncc1 ZINC000647294674 1046969333 /nfs/dbraw/zinc/96/93/33/1046969333.db2.gz KIDBLFYMYDKMMJ-ICSRJNTNSA-N 2 1 317.521 4.126 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(F)c1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000680401125 1046979749 /nfs/dbraw/zinc/97/97/49/1046979749.db2.gz DGWJEMGFJAPTGG-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(F)c1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000680401125 1046979759 /nfs/dbraw/zinc/97/97/59/1046979759.db2.gz DGWJEMGFJAPTGG-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C2CCCC2)o1 ZINC000680461181 1046984020 /nfs/dbraw/zinc/98/40/20/1046984020.db2.gz HHWGLGIGLKQPFQ-ZIFCJYIRSA-N 2 1 302.462 4.036 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)o1 ZINC000680461181 1046984028 /nfs/dbraw/zinc/98/40/28/1046984028.db2.gz HHWGLGIGLKQPFQ-ZIFCJYIRSA-N 2 1 302.462 4.036 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000680461825 1046984826 /nfs/dbraw/zinc/98/48/26/1046984826.db2.gz YFZIKMZLRLYJHP-RRIFGTCXSA-N 2 1 318.892 4.193 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccsc1 ZINC000647344319 1046986475 /nfs/dbraw/zinc/98/64/75/1046986475.db2.gz NZDYXQNRDOZHRB-QYZOEREBSA-N 2 1 314.498 4.134 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c2ccccc21 ZINC000647344460 1046986767 /nfs/dbraw/zinc/98/67/67/1046986767.db2.gz QXXUWRIJZRZVKS-REIYTJMXSA-N 2 1 320.480 4.170 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](CCc3ccc4ccccc4c3)C2)CC1 ZINC000799176798 1047007685 /nfs/dbraw/zinc/00/76/85/1047007685.db2.gz FNNDUCVYIXQQCP-UHFFFAOYSA-N 2 1 322.496 4.190 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799179138 1047009363 /nfs/dbraw/zinc/00/93/63/1047009363.db2.gz DGDLCBMSPKCIAL-OAHLLOKOSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccncc1Cl ZINC000421819611 1047015479 /nfs/dbraw/zinc/01/54/79/1047015479.db2.gz HZSCAIUMCBUTBE-OWCLPIDISA-N 2 1 323.912 4.144 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)CCCC1CC[NH2+]CC1 ZINC000647989936 1047026973 /nfs/dbraw/zinc/02/69/73/1047026973.db2.gz GIAABDHLRPJWQP-HNNXBMFYSA-N 2 1 323.550 4.348 20 0 DIADMP CCc1ccccc1C[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001141224781 1047053803 /nfs/dbraw/zinc/05/38/03/1047053803.db2.gz MBNMSFJOTGHKSR-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP CCc1ccccc1C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001141224781 1047053821 /nfs/dbraw/zinc/05/38/21/1047053821.db2.gz MBNMSFJOTGHKSR-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP Cc1cc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)ccc1Cl ZINC001141237164 1047057218 /nfs/dbraw/zinc/05/72/18/1047057218.db2.gz HZTNSKBPYKCBQC-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP CC[N@H+](Cc1cccs1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536710351 1047082971 /nfs/dbraw/zinc/08/29/71/1047082971.db2.gz QZQDAPAMBWLSQO-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP CC[NH+](Cc1cccs1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536710351 1047082987 /nfs/dbraw/zinc/08/29/87/1047082987.db2.gz QZQDAPAMBWLSQO-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP CC[NH+](Cc1cccs1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536710351 1047083004 /nfs/dbraw/zinc/08/30/04/1047083004.db2.gz QZQDAPAMBWLSQO-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP Cc1cccc(C[N@@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000536734028 1047086971 /nfs/dbraw/zinc/08/69/71/1047086971.db2.gz FVACFQNDSQTULF-UHFFFAOYSA-N 2 1 323.484 4.129 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379644653 1047089396 /nfs/dbraw/zinc/08/93/96/1047089396.db2.gz CMHKPILGQYXBEX-LFGUQSLTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379644653 1047089406 /nfs/dbraw/zinc/08/94/06/1047089406.db2.gz CMHKPILGQYXBEX-LFGUQSLTSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658310 1047093768 /nfs/dbraw/zinc/09/37/68/1047093768.db2.gz VYZLLGXZDDANJT-NBYUQASBSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658310 1047093782 /nfs/dbraw/zinc/09/37/82/1047093782.db2.gz VYZLLGXZDDANJT-NBYUQASBSA-N 2 1 300.490 4.208 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000379653742 1047093806 /nfs/dbraw/zinc/09/38/06/1047093806.db2.gz GNJBRZVVESRXMH-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000379653742 1047093820 /nfs/dbraw/zinc/09/38/20/1047093820.db2.gz GNJBRZVVESRXMH-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379641910 1047094286 /nfs/dbraw/zinc/09/42/86/1047094286.db2.gz DMKVQPBWGBCQIY-NQIIRXRSSA-N 2 1 308.469 4.138 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658311 1047095212 /nfs/dbraw/zinc/09/52/12/1047095212.db2.gz VYZLLGXZDDANJT-RNQOJCNYSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658311 1047095228 /nfs/dbraw/zinc/09/52/28/1047095228.db2.gz VYZLLGXZDDANJT-RNQOJCNYSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657513 1047095766 /nfs/dbraw/zinc/09/57/66/1047095766.db2.gz TUMSJRMAXGHLMA-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657513 1047095780 /nfs/dbraw/zinc/09/57/80/1047095780.db2.gz TUMSJRMAXGHLMA-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379656668 1047095935 /nfs/dbraw/zinc/09/59/35/1047095935.db2.gz QDKBUPCOPZIKEA-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379656668 1047095947 /nfs/dbraw/zinc/09/59/47/1047095947.db2.gz QDKBUPCOPZIKEA-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379656669 1047096868 /nfs/dbraw/zinc/09/68/68/1047096868.db2.gz QDKBUPCOPZIKEA-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379656669 1047096887 /nfs/dbraw/zinc/09/68/87/1047096887.db2.gz QDKBUPCOPZIKEA-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657677 1047097633 /nfs/dbraw/zinc/09/76/33/1047097633.db2.gz UJABLMIHCPDBHJ-GRTKDXNDSA-N 2 1 320.480 4.343 20 0 DIADMP CCCCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC001116018431 1047099938 /nfs/dbraw/zinc/09/99/38/1047099938.db2.gz CJXLIEXYJJXKIJ-IBGZPJMESA-N 2 1 318.505 4.077 20 0 DIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536840220 1047107935 /nfs/dbraw/zinc/10/79/35/1047107935.db2.gz QXAZVPGEYQVQMF-QZTJIDSGSA-N 2 1 318.505 4.022 20 0 DIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536840220 1047107939 /nfs/dbraw/zinc/10/79/39/1047107939.db2.gz QXAZVPGEYQVQMF-QZTJIDSGSA-N 2 1 318.505 4.022 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccsc2)c1)CC1CC[NH+](C)CC1 ZINC001141384755 1047113416 /nfs/dbraw/zinc/11/34/16/1047113416.db2.gz XATIQHXYARGUJD-UHFFFAOYSA-N 2 1 314.498 4.189 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000536859508 1047114869 /nfs/dbraw/zinc/11/48/69/1047114869.db2.gz RHVJBVBOFDXTKA-QGZVKYPTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000536859508 1047114874 /nfs/dbraw/zinc/11/48/74/1047114874.db2.gz RHVJBVBOFDXTKA-QGZVKYPTSA-N 2 1 300.490 4.065 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC)C1 ZINC000121822999 1047118124 /nfs/dbraw/zinc/11/81/24/1047118124.db2.gz SUGNKSMQPSFVOY-HOTGVXAUSA-N 2 1 306.519 4.181 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2cc[nH+]c(N3CCCC3)c2)cc1 ZINC001212969277 1047121692 /nfs/dbraw/zinc/12/16/92/1047121692.db2.gz XBSFSWPALNOMJF-UHFFFAOYSA-N 2 1 310.445 4.272 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2ccc3c(c2)C[N@@H+](C)CC3)cc1 ZINC001212970834 1047125533 /nfs/dbraw/zinc/12/55/33/1047125533.db2.gz MGMVQKBDXZYUSS-UHFFFAOYSA-N 2 1 309.457 4.264 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2ccc3c(c2)C[N@H+](C)CC3)cc1 ZINC001212970834 1047125540 /nfs/dbraw/zinc/12/55/40/1047125540.db2.gz MGMVQKBDXZYUSS-UHFFFAOYSA-N 2 1 309.457 4.264 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3c(Cl)cccc32)C1 ZINC001116565044 1047156243 /nfs/dbraw/zinc/15/62/43/1047156243.db2.gz FXPOJBISSBAVGV-RDTXWAMCSA-N 2 1 306.881 4.039 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000649644072 1047157010 /nfs/dbraw/zinc/15/70/10/1047157010.db2.gz RBZSTYXMSKYABF-UHFFFAOYSA-N 2 1 317.864 4.294 20 0 DIADMP C[NH+](C)[C@@H]1CCCC[C@H]1[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001116554738 1047156936 /nfs/dbraw/zinc/15/69/36/1047156936.db2.gz CPJJJWLKYVCTKW-XAWIXRBMSA-N 2 1 306.881 4.048 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@H]1[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001116554737 1047157141 /nfs/dbraw/zinc/15/71/41/1047157141.db2.gz CPJJJWLKYVCTKW-SYNTWQANSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](C)CSc1ccccc1 ZINC000649665586 1047159922 /nfs/dbraw/zinc/15/99/22/1047159922.db2.gz PLFZEZWEVPPIJP-MRXNPFEDSA-N 2 1 317.502 4.084 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)CSc1ccccc1 ZINC000649665586 1047159927 /nfs/dbraw/zinc/15/99/27/1047159927.db2.gz PLFZEZWEVPPIJP-MRXNPFEDSA-N 2 1 317.502 4.084 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537307872 1047164644 /nfs/dbraw/zinc/16/46/44/1047164644.db2.gz RPDVEBXDKCSRJI-LJQANCHMSA-N 2 1 320.908 4.149 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc2ccccc21 ZINC000682130200 1047174416 /nfs/dbraw/zinc/17/44/16/1047174416.db2.gz BXUPXIGWDOTACR-HRAATJIYSA-N 2 1 308.469 4.365 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCC34CCCC4)C2)cc1 ZINC000682731696 1047215655 /nfs/dbraw/zinc/21/56/55/1047215655.db2.gz GBLKAQGVXJCHLL-WOJBJXKFSA-N 2 1 312.501 4.211 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000682734769 1047218501 /nfs/dbraw/zinc/21/85/01/1047218501.db2.gz ZRKDPXXMVSBTMY-IHPCNDPISA-N 2 1 312.501 4.209 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000651211002 1047303530 /nfs/dbraw/zinc/30/35/30/1047303530.db2.gz YOBNALZMCVRDKL-FPOVZHCZSA-N 2 1 323.484 4.035 20 0 DIADMP FC1(F)CC[C@@H](CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000898017877 1047311531 /nfs/dbraw/zinc/31/15/31/1047311531.db2.gz WCEQDMRWWSKAQG-INIZCTEOSA-N 2 1 322.443 4.066 20 0 DIADMP CC(C)Cc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000725799645 1047317536 /nfs/dbraw/zinc/31/75/36/1047317536.db2.gz WJPZRLHKGHGJSA-UHFFFAOYSA-N 2 1 302.506 4.190 20 0 DIADMP Cc1cc(F)ccc1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000725850241 1047321520 /nfs/dbraw/zinc/32/15/20/1047321520.db2.gz UCJBSODTJYDQOD-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@H]3CCCC34CCCC4)C2)cc1 ZINC000328123263 1047328160 /nfs/dbraw/zinc/32/81/60/1047328160.db2.gz RXBFXLUIQDRLBF-PMACEKPBSA-N 2 1 312.501 4.211 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@@H]3CCCC34CCCC4)C2)cc1 ZINC000328123266 1047328410 /nfs/dbraw/zinc/32/84/10/1047328410.db2.gz RXBFXLUIQDRLBF-VQTJNVASSA-N 2 1 312.501 4.211 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1scnc1C1CC1)C1CCCCC1 ZINC000651910122 1047334920 /nfs/dbraw/zinc/33/49/20/1047334920.db2.gz HSFQNBPKQCEHLP-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1scnc1C1CC1)C1CCCCC1 ZINC000651910122 1047334932 /nfs/dbraw/zinc/33/49/32/1047334932.db2.gz HSFQNBPKQCEHLP-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000840809329 1047336440 /nfs/dbraw/zinc/33/64/40/1047336440.db2.gz JHNYWGFXAKNSQX-GJZGRUSLSA-N 2 1 324.896 4.040 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C3(C4CCC4)CC3)CC23CC3)cc1 ZINC000651984086 1047338674 /nfs/dbraw/zinc/33/86/74/1047338674.db2.gz SLFOYCNFGMOLDU-LJQANCHMSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C3(C4CCC4)CC3)CC23CC3)cc1 ZINC000651984086 1047338686 /nfs/dbraw/zinc/33/86/86/1047338686.db2.gz SLFOYCNFGMOLDU-LJQANCHMSA-N 2 1 310.485 4.106 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2cccnc2)C2CCCCC2)C1 ZINC000652142778 1047344190 /nfs/dbraw/zinc/34/41/90/1047344190.db2.gz BICWZFMLXGVVLC-XLIONFOSSA-N 2 1 315.505 4.025 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H]2CCCc3ccc(F)cc32)CC1 ZINC000533114746 1047370331 /nfs/dbraw/zinc/37/03/31/1047370331.db2.gz DMAFUNOWMKLFLA-FQEVSTJZSA-N 2 1 318.480 4.255 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@H](C)C(F)(F)F)CC1)CC(C)C ZINC000536886024 1047417373 /nfs/dbraw/zinc/41/73/73/1047417373.db2.gz PMMDFPZGTOWYNB-HNNXBMFYSA-N 2 1 322.459 4.265 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000537618159 1047457182 /nfs/dbraw/zinc/45/71/82/1047457182.db2.gz OXBUZESXVQAPGE-LAUBAEHRSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000537618159 1047457185 /nfs/dbraw/zinc/45/71/85/1047457185.db2.gz OXBUZESXVQAPGE-LAUBAEHRSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618159 1047457188 /nfs/dbraw/zinc/45/71/88/1047457188.db2.gz OXBUZESXVQAPGE-LAUBAEHRSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618159 1047457190 /nfs/dbraw/zinc/45/71/90/1047457190.db2.gz OXBUZESXVQAPGE-LAUBAEHRSA-N 2 1 308.469 4.268 20 0 DIADMP C[NH+](Cc1ccco1)Cc1cccc(C[N@@H+](C)Cc2ccco2)c1 ZINC000057567112 1047460667 /nfs/dbraw/zinc/46/06/67/1047460667.db2.gz NVIIJFJQYQKUSK-UHFFFAOYSA-N 2 1 324.424 4.137 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000119722013 1047465381 /nfs/dbraw/zinc/46/53/81/1047465381.db2.gz FSZQBEMTOQAWAL-LLVKDONJSA-N 2 1 313.272 4.271 20 0 DIADMP CCSc1ccccc1[C@H](C)NC1CC[NH+](C2CC2)CC1 ZINC000119671931 1047467500 /nfs/dbraw/zinc/46/75/00/1047467500.db2.gz BIMVLDRUXIABDL-AWEZNQCLSA-N 2 1 304.503 4.076 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119671931 1047467507 /nfs/dbraw/zinc/46/75/07/1047467507.db2.gz BIMVLDRUXIABDL-AWEZNQCLSA-N 2 1 304.503 4.076 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@@H](CCc3ccccc3)C2)CC1 ZINC001168330635 1047468111 /nfs/dbraw/zinc/46/81/11/1047468111.db2.gz USVLRHGMRNKQFP-MWXLCCTBSA-N 2 1 314.517 4.204 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168337451 1047495772 /nfs/dbraw/zinc/49/57/72/1047495772.db2.gz NHLFESFDBUCUMJ-KVZIAJEVSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(-c2cccnc2)c1 ZINC000537632264 1047504570 /nfs/dbraw/zinc/50/45/70/1047504570.db2.gz FPOGJKPJARZVDR-NRFANRHFSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cccc(-c2cccnc2)c1 ZINC000537632264 1047504575 /nfs/dbraw/zinc/50/45/75/1047504575.db2.gz FPOGJKPJARZVDR-NRFANRHFSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(-c2cccnc2)c1 ZINC000537632264 1047504579 /nfs/dbraw/zinc/50/45/79/1047504579.db2.gz FPOGJKPJARZVDR-NRFANRHFSA-N 2 1 323.484 4.055 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccccc2)cc1 ZINC000843054315 1047526238 /nfs/dbraw/zinc/52/62/38/1047526238.db2.gz VAEKWMRDXLHSOX-SEJPIABJSA-N 2 1 306.453 4.198 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000537646878 1047557852 /nfs/dbraw/zinc/55/78/52/1047557852.db2.gz BPHNLSDBCQICPU-KRWDZBQOSA-N 2 1 312.457 4.110 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000537646878 1047557862 /nfs/dbraw/zinc/55/78/62/1047557862.db2.gz BPHNLSDBCQICPU-KRWDZBQOSA-N 2 1 312.457 4.110 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537648917 1047562637 /nfs/dbraw/zinc/56/26/37/1047562637.db2.gz YHHYOZSQZGSTAN-KRWDZBQOSA-N 2 1 314.473 4.213 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537648917 1047562645 /nfs/dbraw/zinc/56/26/45/1047562645.db2.gz YHHYOZSQZGSTAN-KRWDZBQOSA-N 2 1 314.473 4.213 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001206632165 1047568106 /nfs/dbraw/zinc/56/81/06/1047568106.db2.gz GOBHTUMYYMTWJH-INIZCTEOSA-N 2 1 312.432 4.054 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCCC[C@@H](C[NH3+])C3)c2)cc1 ZINC001206632129 1047568306 /nfs/dbraw/zinc/56/83/06/1047568306.db2.gz GKAGFQLGUMYHHH-IBGZPJMESA-N 2 1 324.468 4.348 20 0 DIADMP C[N@@H+]1CCC[C@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694169 1047577772 /nfs/dbraw/zinc/57/77/72/1047577772.db2.gz ASWCLUVVFKTRSD-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694169 1047577777 /nfs/dbraw/zinc/57/77/77/1047577777.db2.gz ASWCLUVVFKTRSD-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694169 1047577780 /nfs/dbraw/zinc/57/77/80/1047577780.db2.gz ASWCLUVVFKTRSD-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694169 1047577783 /nfs/dbraw/zinc/57/77/83/1047577783.db2.gz ASWCLUVVFKTRSD-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP COc1cccc([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)c1 ZINC000315100757 1047597491 /nfs/dbraw/zinc/59/74/91/1047597491.db2.gz NYUZJHUSCPFHAV-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP COc1cccc([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)c1 ZINC000315100757 1047597503 /nfs/dbraw/zinc/59/75/03/1047597503.db2.gz NYUZJHUSCPFHAV-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](CC)c2cc(C)ccc2OC)CC1 ZINC000537879922 1047642337 /nfs/dbraw/zinc/64/23/37/1047642337.db2.gz JFFJNSJNLMWYPK-LJQANCHMSA-N 2 1 318.505 4.309 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000537983234 1047649824 /nfs/dbraw/zinc/64/98/24/1047649824.db2.gz DCDXEAZDYTYYOF-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000537983234 1047649832 /nfs/dbraw/zinc/64/98/32/1047649832.db2.gz DCDXEAZDYTYYOF-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCCc2ccc(Cl)cc21 ZINC000537967809 1047650827 /nfs/dbraw/zinc/65/08/27/1047650827.db2.gz AYHDLEZPFYCCDB-SCLBCKFNSA-N 2 1 317.864 4.148 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CCc2ccco2)c1 ZINC000537971011 1047651803 /nfs/dbraw/zinc/65/18/03/1047651803.db2.gz VEVYAKYCHDGBLH-QGZVFWFLSA-N 2 1 314.473 4.231 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000538057891 1047656652 /nfs/dbraw/zinc/65/66/52/1047656652.db2.gz GTHVFTPZHCFIGJ-UZLBHIALSA-N 2 1 318.480 4.379 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2cccs2)cc1 ZINC000538405674 1047673327 /nfs/dbraw/zinc/67/33/27/1047673327.db2.gz AFYCAQMFRFRDAQ-HNNXBMFYSA-N 2 1 312.482 4.328 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000538393717 1047674417 /nfs/dbraw/zinc/67/44/17/1047674417.db2.gz QMILHIBIKNRCGD-CVEARBPZSA-N 2 1 314.473 4.296 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000538393717 1047674419 /nfs/dbraw/zinc/67/44/19/1047674419.db2.gz QMILHIBIKNRCGD-CVEARBPZSA-N 2 1 314.473 4.296 20 0 DIADMP CCCCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000538717468 1047699681 /nfs/dbraw/zinc/69/96/81/1047699681.db2.gz CKOCEHOKUPELDS-IEBWSBKVSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000538717468 1047699684 /nfs/dbraw/zinc/69/96/84/1047699684.db2.gz CKOCEHOKUPELDS-IEBWSBKVSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000538717468 1047699687 /nfs/dbraw/zinc/69/96/87/1047699687.db2.gz CKOCEHOKUPELDS-IEBWSBKVSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000538717468 1047699690 /nfs/dbraw/zinc/69/96/90/1047699690.db2.gz CKOCEHOKUPELDS-IEBWSBKVSA-N 2 1 318.505 4.170 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3)s2)CCN1C ZINC000538738214 1047704213 /nfs/dbraw/zinc/70/42/13/1047704213.db2.gz GGGTVKAHDNJODO-WBVHZDCISA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)s2)CC[N@@H+]1C ZINC000538738214 1047704216 /nfs/dbraw/zinc/70/42/16/1047704216.db2.gz GGGTVKAHDNJODO-WBVHZDCISA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)s2)CC[N@H+]1C ZINC000538738214 1047704222 /nfs/dbraw/zinc/70/42/22/1047704222.db2.gz GGGTVKAHDNJODO-WBVHZDCISA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)s2)CC[NH+]1C ZINC000538738214 1047704229 /nfs/dbraw/zinc/70/42/29/1047704229.db2.gz GGGTVKAHDNJODO-WBVHZDCISA-N 2 1 314.498 4.330 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)s2)C1 ZINC000538750101 1047707347 /nfs/dbraw/zinc/70/73/47/1047707347.db2.gz ASCGCFZKNDHDRU-MRXNPFEDSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC000538750101 1047707354 /nfs/dbraw/zinc/70/73/54/1047707354.db2.gz ASCGCFZKNDHDRU-MRXNPFEDSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC000538750101 1047707359 /nfs/dbraw/zinc/70/73/59/1047707359.db2.gz ASCGCFZKNDHDRU-MRXNPFEDSA-N 2 1 314.498 4.189 20 0 DIADMP Cc1c[nH+]c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)cc1C ZINC001156318613 1047707866 /nfs/dbraw/zinc/70/78/66/1047707866.db2.gz WSRQKOVEYHHUOU-HSALFYBXSA-N 2 1 321.468 4.021 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)CCC2 ZINC000539046050 1047731702 /nfs/dbraw/zinc/73/17/02/1047731702.db2.gz GAKJEVVANMSAKE-ZTNFWEORSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)CCC2 ZINC000539046050 1047731709 /nfs/dbraw/zinc/73/17/09/1047731709.db2.gz GAKJEVVANMSAKE-ZTNFWEORSA-N 2 1 300.490 4.260 20 0 DIADMP CCc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C(C)C)cc1 ZINC000539162637 1047739143 /nfs/dbraw/zinc/73/91/43/1047739143.db2.gz IHPAZWVTSLSNRG-PXNSSMCTSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccnc1 ZINC000539162532 1047739329 /nfs/dbraw/zinc/73/93/29/1047739329.db2.gz BFSAXSOQTCBRCD-NSHGMRRFSA-N 2 1 317.521 4.126 20 0 DIADMP Cc1c[nH+]c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(C)c1 ZINC001159294108 1047826424 /nfs/dbraw/zinc/82/64/24/1047826424.db2.gz NWKLQYMPIVEDHG-OWZKRDHZSA-N 2 1 321.468 4.306 20 0 DIADMP Cc1c[nH+]c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(C)c1 ZINC001159294108 1047826430 /nfs/dbraw/zinc/82/64/30/1047826430.db2.gz NWKLQYMPIVEDHG-OWZKRDHZSA-N 2 1 321.468 4.306 20 0 DIADMP c1cc2c(c(Nc3ccc([NH+]4CCCCCC4)cc3)c1)CC[NH2+]C2 ZINC001159541993 1047864604 /nfs/dbraw/zinc/86/46/04/1047864604.db2.gz HKYNPRPOPZKFMH-UHFFFAOYSA-N 2 1 321.468 4.456 20 0 DIADMP C[C@@H](C[NH+]1CCC(C)([NH+]2CCCC2)CC1)c1cccc(Cl)c1 ZINC001183226454 1047905511 /nfs/dbraw/zinc/90/55/11/1047905511.db2.gz ICHCKNOWZHBCJY-INIZCTEOSA-N 2 1 320.908 4.394 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000479510560 1047914828 /nfs/dbraw/zinc/91/48/28/1047914828.db2.gz JJNXZTZUNKDHJW-LJRKYQKZSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479510560 1047914835 /nfs/dbraw/zinc/91/48/35/1047914835.db2.gz JJNXZTZUNKDHJW-LJRKYQKZSA-N 2 1 316.464 4.056 20 0 DIADMP Clc1cccc2c1CCC[C@H]2[NH2+]C1CC(N2CCCCC2)C1 ZINC000479524259 1047915315 /nfs/dbraw/zinc/91/53/15/1047915315.db2.gz HTIKHOJTJVLHIH-JFIBYHEFSA-N 2 1 318.892 4.324 20 0 DIADMP Clc1cccc2c1CCC[C@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479524259 1047915322 /nfs/dbraw/zinc/91/53/22/1047915322.db2.gz HTIKHOJTJVLHIH-JFIBYHEFSA-N 2 1 318.892 4.324 20 0 DIADMP c1ccc(C[C@]2(C[NH2+]C3CC[NH+](C4CC4)CC3)C=CCCC2)cc1 ZINC001183282938 1047917349 /nfs/dbraw/zinc/91/73/49/1047917349.db2.gz XFFIRYBGMZQDPY-QFIPXVFZSA-N 2 1 324.512 4.172 20 0 DIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc2c(c1)CCCC2 ZINC000479538442 1047921145 /nfs/dbraw/zinc/92/11/45/1047921145.db2.gz BWGYJPSSFSWPCO-ATIQYGATSA-N 2 1 312.501 4.233 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2ccccc21 ZINC000479538106 1047921603 /nfs/dbraw/zinc/92/16/03/1047921603.db2.gz DLFPNOJOIDERMT-ZHAWHOEGSA-N 2 1 312.501 4.478 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479539528 1047921672 /nfs/dbraw/zinc/92/16/72/1047921672.db2.gz JSLPUCVFEQQHPQ-FAEJEUNOSA-N 2 1 318.530 4.466 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001183570522 1047943096 /nfs/dbraw/zinc/94/30/96/1047943096.db2.gz BWLWDIRZZQPAES-FBBABVLZSA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001183570522 1047943103 /nfs/dbraw/zinc/94/31/03/1047943103.db2.gz BWLWDIRZZQPAES-FBBABVLZSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC001205280475 1047954953 /nfs/dbraw/zinc/95/49/53/1047954953.db2.gz AFGQEBZGQMCDKE-GOSISDBHSA-N 2 1 300.471 4.118 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC001184024241 1047990568 /nfs/dbraw/zinc/99/05/68/1047990568.db2.gz YBZCNCYYXNGYMN-MOPGFXCFSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC1 ZINC001205288097 1047992116 /nfs/dbraw/zinc/99/21/16/1047992116.db2.gz FYIPMLAMFHTEPV-MRXNPFEDSA-N 2 1 306.500 4.180 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCC2(C)C)CC1 ZINC000554085533 1048004734 /nfs/dbraw/zinc/00/47/34/1048004734.db2.gz LEJZITYKOFIZMQ-ACBHZAAOSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(O[C@H]2CCC[NH2+]C2)c(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001160233620 1048007534 /nfs/dbraw/zinc/00/75/34/1048007534.db2.gz RAZAEDNZIHWIBT-SFHVURJKSA-N 2 1 319.408 4.109 20 0 DIADMP CC[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(F)cc1F ZINC000480045021 1048036797 /nfs/dbraw/zinc/03/67/97/1048036797.db2.gz ZCXCROQZZRFZBC-INIZCTEOSA-N 2 1 310.432 4.315 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)CC1(C)C ZINC001199237548 1048048308 /nfs/dbraw/zinc/04/83/08/1048048308.db2.gz DBFOABKQFITQRG-CTWPCTMYSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]CC2(C)CCC2)C1 ZINC001199265769 1048048645 /nfs/dbraw/zinc/04/86/45/1048048645.db2.gz DOMJXKLSUAJMEK-QGZVFWFLSA-N 2 1 300.490 4.198 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CCCCC1 ZINC001199265470 1048050190 /nfs/dbraw/zinc/05/01/90/1048050190.db2.gz AGUWCRVIXZBRHJ-QGZVFWFLSA-N 2 1 300.490 4.483 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC001199336871 1048055299 /nfs/dbraw/zinc/05/52/99/1048055299.db2.gz ZATRMBODYSKGMJ-VQTJNVASSA-N 2 1 316.533 4.357 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001199344331 1048056818 /nfs/dbraw/zinc/05/68/18/1048056818.db2.gz GIVWPFISGOMLFH-KRWDZBQOSA-N 2 1 300.490 4.166 20 0 DIADMP COc1ccc2oc([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)c(C)c2c1 ZINC000480200252 1048088591 /nfs/dbraw/zinc/08/85/91/1048088591.db2.gz WSQZNJGVXQBQQT-OAHLLOKOSA-N 2 1 318.461 4.131 20 0 DIADMP COc1ccc2oc([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)c(C)c2c1 ZINC000480200252 1048088601 /nfs/dbraw/zinc/08/86/01/1048088601.db2.gz WSQZNJGVXQBQQT-OAHLLOKOSA-N 2 1 318.461 4.131 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000480193476 1048088834 /nfs/dbraw/zinc/08/88/34/1048088834.db2.gz KUXBAWHCXVUOFF-KRWDZBQOSA-N 2 1 311.473 4.130 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480220703 1048095239 /nfs/dbraw/zinc/09/52/39/1048095239.db2.gz DKOSTAIMRGHIEX-BARDWOONSA-N 2 1 308.432 4.064 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480220703 1048095254 /nfs/dbraw/zinc/09/52/54/1048095254.db2.gz DKOSTAIMRGHIEX-BARDWOONSA-N 2 1 308.432 4.064 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCC2 ZINC000480244102 1048098788 /nfs/dbraw/zinc/09/87/88/1048098788.db2.gz VCFAKBKUAQNHTD-IBGZPJMESA-N 2 1 318.892 4.324 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000480232473 1048099968 /nfs/dbraw/zinc/09/99/68/1048099968.db2.gz OIYINSAJYOJDGI-MRXNPFEDSA-N 2 1 314.498 4.156 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000480232473 1048099983 /nfs/dbraw/zinc/09/99/83/1048099983.db2.gz OIYINSAJYOJDGI-MRXNPFEDSA-N 2 1 314.498 4.156 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccccc1-c1ccc(C)cc1C ZINC001199863550 1048108871 /nfs/dbraw/zinc/10/88/71/1048108871.db2.gz BAPGAYGRTBTVJQ-UHFFFAOYSA-N 2 1 319.452 4.265 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1Cl ZINC001168363009 1048148364 /nfs/dbraw/zinc/14/83/64/1048148364.db2.gz PGKPDHJTTAESGM-SFHVURJKSA-N 2 1 306.881 4.255 20 0 DIADMP Cc1ccccc1C[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001200980943 1048165279 /nfs/dbraw/zinc/16/52/79/1048165279.db2.gz QYRDLOHUWMUQQH-NGRWLJPCSA-N 2 1 322.496 4.241 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2ccc(-c3ccccc3)cc2)CC1(C)C ZINC001201017580 1048173850 /nfs/dbraw/zinc/17/38/50/1048173850.db2.gz KJBKLZGCYYRELX-OAQYLSRUSA-N 2 1 322.496 4.359 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480600519 1048187206 /nfs/dbraw/zinc/18/72/06/1048187206.db2.gz ISJNOIBWOPGMLM-ZNMIVQPWSA-N 2 1 323.550 4.033 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480600519 1048187215 /nfs/dbraw/zinc/18/72/15/1048187215.db2.gz ISJNOIBWOPGMLM-ZNMIVQPWSA-N 2 1 323.550 4.033 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000480610485 1048191697 /nfs/dbraw/zinc/19/16/97/1048191697.db2.gz JHRMKEKHTXXXLQ-HNAYVOBHSA-N 2 1 304.453 4.057 20 0 DIADMP CC(C)C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000480618841 1048194988 /nfs/dbraw/zinc/19/49/88/1048194988.db2.gz PTIKSZRZFFNIKY-ICSRJNTNSA-N 2 1 317.521 4.271 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000480618834 1048195034 /nfs/dbraw/zinc/19/50/34/1048195034.db2.gz PTIKSZRZFFNIKY-AZUAARDMSA-N 2 1 317.521 4.271 20 0 DIADMP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000480630663 1048195056 /nfs/dbraw/zinc/19/50/56/1048195056.db2.gz MUVQZWJTNAAHMR-DLBZAZTESA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc(F)cc(F)c1 ZINC000480628191 1048195447 /nfs/dbraw/zinc/19/54/47/1048195447.db2.gz WPRCHCRPVVWGFA-HUUCEWRRSA-N 2 1 310.432 4.128 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(F)c1 ZINC000480607465 1048195736 /nfs/dbraw/zinc/19/57/36/1048195736.db2.gz GDWSGMYXYKBFLI-HZPDHXFCSA-N 2 1 322.468 4.140 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1F ZINC000480620892 1048198177 /nfs/dbraw/zinc/19/81/77/1048198177.db2.gz BZSXUKDSPVDNPF-JKSUJKDBSA-N 2 1 322.468 4.140 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)cc(F)c1 ZINC000480634761 1048201779 /nfs/dbraw/zinc/20/17/79/1048201779.db2.gz VHAPAFOHUVEJGK-LSDHHAIUSA-N 2 1 310.432 4.270 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@@H]1CC[NH+](C)C[C@H]1C)c1ccccc1 ZINC000554890889 1048219765 /nfs/dbraw/zinc/21/97/65/1048219765.db2.gz ZQIOHDZQDJRUOY-MISYRCLQSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@@H]1CC[NH+](C)C[C@H]1C)c1ccccc1 ZINC000554890889 1048219778 /nfs/dbraw/zinc/21/97/78/1048219778.db2.gz ZQIOHDZQDJRUOY-MISYRCLQSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@H+](C)C[C@H]1C)c1ccccc1 ZINC000554890889 1048219787 /nfs/dbraw/zinc/21/97/87/1048219787.db2.gz ZQIOHDZQDJRUOY-MISYRCLQSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@@H+](C)C[C@H]1C)c1ccccc1 ZINC000554890889 1048219802 /nfs/dbraw/zinc/21/98/02/1048219802.db2.gz ZQIOHDZQDJRUOY-MISYRCLQSA-N 2 1 302.506 4.088 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CCC[C@H](C[NH3+])[C@H]3C)c(C)c12 ZINC001205915151 1048226337 /nfs/dbraw/zinc/22/63/37/1048226337.db2.gz OQXYGXOFUPZBRQ-CHWSQXEVSA-N 2 1 308.516 4.139 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CCC[C@@H](C[NH3+])[C@@H]3C)c(C)c12 ZINC001205915157 1048227088 /nfs/dbraw/zinc/22/70/88/1048227088.db2.gz OQXYGXOFUPZBRQ-STQMWFEESA-N 2 1 308.516 4.139 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)oc2cc1C ZINC000480738103 1048230018 /nfs/dbraw/zinc/23/00/18/1048230018.db2.gz JOAFZSXLJSETHK-RYQLBKOJSA-N 2 1 312.457 4.327 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)oc2cc1C ZINC000480738103 1048230032 /nfs/dbraw/zinc/23/00/32/1048230032.db2.gz JOAFZSXLJSETHK-RYQLBKOJSA-N 2 1 312.457 4.327 20 0 DIADMP CC[C@H](C[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1)[NH+]1CCCC1 ZINC000480803275 1048249016 /nfs/dbraw/zinc/24/90/16/1048249016.db2.gz IOLQWGKNVWMHCY-LAUBAEHRSA-N 2 1 323.484 4.274 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@H]3C2)cc1 ZINC001201426332 1048262899 /nfs/dbraw/zinc/26/28/99/1048262899.db2.gz JAFLHSGTYWTDNR-FDFHNCONSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]3C2)cc1 ZINC001201426332 1048262908 /nfs/dbraw/zinc/26/29/08/1048262908.db2.gz JAFLHSGTYWTDNR-FDFHNCONSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]3C2)cc1 ZINC001201426332 1048262919 /nfs/dbraw/zinc/26/29/19/1048262919.db2.gz JAFLHSGTYWTDNR-FDFHNCONSA-N 2 1 324.512 4.187 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2CCCc2ccccc2)CC1 ZINC001175350930 1048271847 /nfs/dbraw/zinc/27/18/47/1048271847.db2.gz KANSTRJOSLQQSW-NRFANRHFSA-N 2 1 314.517 4.206 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CC(C)(C)C)C[C@H]21 ZINC001201435935 1048272994 /nfs/dbraw/zinc/27/29/94/1048272994.db2.gz YLAFHGVHNBFSDL-KBAYOESNSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CC(C)(C)C)C[C@H]21 ZINC001201435935 1048273001 /nfs/dbraw/zinc/27/30/01/1048273001.db2.gz YLAFHGVHNBFSDL-KBAYOESNSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](CC(C)(C)C)C[C@H]21 ZINC001201435935 1048273009 /nfs/dbraw/zinc/27/30/09/1048273009.db2.gz YLAFHGVHNBFSDL-KBAYOESNSA-N 2 1 320.546 4.327 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450730 1048279081 /nfs/dbraw/zinc/27/90/81/1048279081.db2.gz ZSVGWJLVVLSAMA-HSALFYBXSA-N 2 1 312.501 4.352 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450730 1048279091 /nfs/dbraw/zinc/27/90/91/1048279091.db2.gz ZSVGWJLVVLSAMA-HSALFYBXSA-N 2 1 312.501 4.352 20 0 DIADMP CC[C@H](C)C[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201501397 1048287345 /nfs/dbraw/zinc/28/73/45/1048287345.db2.gz JNYDCJBQAOOIPE-FUHWJXTLSA-N 2 1 304.478 4.002 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026049 1048294969 /nfs/dbraw/zinc/29/49/69/1048294969.db2.gz RKJLQFNFZSXBHE-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026049 1048294982 /nfs/dbraw/zinc/29/49/82/1048294982.db2.gz RKJLQFNFZSXBHE-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCC(C)C)cc2)C1 ZINC000481029413 1048295190 /nfs/dbraw/zinc/29/51/90/1048295190.db2.gz YHEGRWSXJQKDGV-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP CCC(CC)C[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001201534901 1048298963 /nfs/dbraw/zinc/29/89/63/1048298963.db2.gz CXXALIFRKRKOLW-UHFFFAOYSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053956 1048302709 /nfs/dbraw/zinc/30/27/09/1048302709.db2.gz QVHDPTROLCANHP-GJZGRUSLSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053956 1048302720 /nfs/dbraw/zinc/30/27/20/1048302720.db2.gz QVHDPTROLCANHP-GJZGRUSLSA-N 2 1 324.896 4.121 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(C)C)cc2)C1 ZINC001201557893 1048314474 /nfs/dbraw/zinc/31/44/74/1048314474.db2.gz NMWPZDCNSNZOAE-LJQANCHMSA-N 2 1 302.506 4.268 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3)CCCC2)CC[N@H+]1C ZINC000481163108 1048317824 /nfs/dbraw/zinc/31/78/24/1048317824.db2.gz DNLPUJWRDRFQDF-MAUKXSAKSA-N 2 1 320.908 4.224 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Cl)c2)CCCC1 ZINC000481184000 1048324785 /nfs/dbraw/zinc/32/47/85/1048324785.db2.gz RVWNKNVAUDIWJE-CRAIPNDOSA-N 2 1 320.908 4.082 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Cl)c2)CCCC1 ZINC000481184003 1048325976 /nfs/dbraw/zinc/32/59/76/1048325976.db2.gz RVWNKNVAUDIWJE-MAUKXSAKSA-N 2 1 320.908 4.082 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3cccs3)cc2)C1 ZINC000481305067 1048358560 /nfs/dbraw/zinc/35/85/60/1048358560.db2.gz JZFMJXADGATFQX-HOTGVXAUSA-N 2 1 314.498 4.408 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3cccs3)cc2)C1 ZINC000481305068 1048359077 /nfs/dbraw/zinc/35/90/77/1048359077.db2.gz JZFMJXADGATFQX-HZPDHXFCSA-N 2 1 314.498 4.408 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](CC)C2)cc1 ZINC000481319101 1048364125 /nfs/dbraw/zinc/36/41/25/1048364125.db2.gz FKFLOCGKPVSDIU-ZWKOTPCHSA-N 2 1 318.505 4.248 20 0 DIADMP CSc1ccc(CN[C@H](C)c2ccc(-n3ccnc3)cc2)o1 ZINC001201851246 1048381063 /nfs/dbraw/zinc/38/10/63/1048381063.db2.gz SHPHLRBXBRSHFC-CYBMUJFWSA-N 2 1 313.426 4.038 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc2c(s1)CCCC2 ZINC000481432590 1048401878 /nfs/dbraw/zinc/40/18/78/1048401878.db2.gz KSMHEYWCQKATFI-CQSZACIVSA-N 2 1 318.530 4.294 20 0 DIADMP CSc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001201947254 1048407634 /nfs/dbraw/zinc/40/76/34/1048407634.db2.gz VOWVRSZZKDCDNL-DOTOQJQBSA-N 2 1 318.530 4.151 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CC[C@H](c2ccc(C)cc2)C1(C)C ZINC001175714085 1048421897 /nfs/dbraw/zinc/42/18/97/1048421897.db2.gz FMYJTZZUERDBGF-LJQANCHMSA-N 2 1 302.506 4.295 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(c3cccc(F)c3)CCCCC2)CC[N@H+]1C ZINC000481539972 1048428496 /nfs/dbraw/zinc/42/84/96/1048428496.db2.gz FPCBNCFNVAEUPA-QFBILLFUSA-N 2 1 318.480 4.100 20 0 DIADMP CC(C)(C)CC[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001202073142 1048431329 /nfs/dbraw/zinc/43/13/29/1048431329.db2.gz IHMCMJWEAKLCPV-UHFFFAOYSA-N 2 1 320.546 4.472 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCCC1 ZINC000481559599 1048432216 /nfs/dbraw/zinc/43/22/16/1048432216.db2.gz RZIHYBWYYHQHOW-MAUKXSAKSA-N 2 1 320.908 4.082 20 0 DIADMP c1cc(C2CC2)cc(NC2CC[NH+](C[C@H]3CC=CCC3)CC2)[nH+]1 ZINC001163320724 1048452310 /nfs/dbraw/zinc/45/23/10/1048452310.db2.gz YRJMLRVORUDGAL-INIZCTEOSA-N 2 1 311.473 4.192 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@@H+]1C ZINC000481717208 1048464959 /nfs/dbraw/zinc/46/49/59/1048464959.db2.gz JKVPPGDXJXIFAR-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@H+]1C ZINC000481717208 1048464965 /nfs/dbraw/zinc/46/49/65/1048464965.db2.gz JKVPPGDXJXIFAR-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP CC1(C)CCC[C@H](C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202227570 1048488953 /nfs/dbraw/zinc/48/89/53/1048488953.db2.gz MVZBRIKNYMUCMY-PMACEKPBSA-N 2 1 314.517 4.315 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556039305 1048520271 /nfs/dbraw/zinc/52/02/71/1048520271.db2.gz UYCNXKFWFRXTDX-ILWGZMRPSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556039305 1048520283 /nfs/dbraw/zinc/52/02/83/1048520283.db2.gz UYCNXKFWFRXTDX-ILWGZMRPSA-N 2 1 320.480 4.489 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C)c1c(Cl)cccc1Cl ZINC000482096340 1048557194 /nfs/dbraw/zinc/55/71/94/1048557194.db2.gz QIYMWGROPSQQMB-TYNCELHUSA-N 2 1 315.288 4.027 20 0 DIADMP Cc1ccc(C[C@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000482321606 1048588734 /nfs/dbraw/zinc/58/87/34/1048588734.db2.gz PTWVKQNZXZQYPW-CTNGQTDRSA-N 2 1 314.517 4.026 20 0 DIADMP Cc1ccc(C[C@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000482321608 1048588906 /nfs/dbraw/zinc/58/89/06/1048588906.db2.gz PTWVKQNZXZQYPW-FPOVZHCZSA-N 2 1 314.517 4.026 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCC3)c1 ZINC000482342115 1048590842 /nfs/dbraw/zinc/59/08/42/1048590842.db2.gz CVDNLZSPLOJKCK-KRWDZBQOSA-N 2 1 322.496 4.478 20 0 DIADMP Cc1[nH+]c2c(Nc3cccc(C[NH+]4CCCC4)c3)cccn2c1C ZINC001176195636 1048592280 /nfs/dbraw/zinc/59/22/80/1048592280.db2.gz HOERZTWYZCNIBE-UHFFFAOYSA-N 2 1 320.440 4.291 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359815 1048594323 /nfs/dbraw/zinc/59/43/23/1048594323.db2.gz QUFSBJSLCORPSD-UONOGXRCSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359815 1048594336 /nfs/dbraw/zinc/59/43/36/1048594336.db2.gz QUFSBJSLCORPSD-UONOGXRCSA-N 2 1 312.860 4.250 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000482454165 1048610742 /nfs/dbraw/zinc/61/07/42/1048610742.db2.gz WQOBJAKRYHJICS-RBBKRZOGSA-N 2 1 322.496 4.292 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000482454163 1048612031 /nfs/dbraw/zinc/61/20/31/1048612031.db2.gz WQOBJAKRYHJICS-IRLDBZIGSA-N 2 1 322.496 4.292 20 0 DIADMP CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)nc2)CC1 ZINC000850037392 1048612419 /nfs/dbraw/zinc/61/24/19/1048612419.db2.gz CDKYZKYNYVBTSC-WMZOPIPTSA-N 2 1 312.461 4.024 20 0 DIADMP Cc1cc[nH+]c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1C ZINC001164487829 1048634412 /nfs/dbraw/zinc/63/44/12/1048634412.db2.gz ZALPLPURTMGPJK-SLFFLAALSA-N 2 1 321.468 4.021 20 0 DIADMP CC(C)(C)c1ccc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)cc1 ZINC001204398339 1048726660 /nfs/dbraw/zinc/72/66/60/1048726660.db2.gz FXMJUSITRBPHRC-UHFFFAOYSA-N 2 1 314.517 4.434 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H]2CCc3ccc(F)cc32)CC1 ZINC001190408473 1048733579 /nfs/dbraw/zinc/73/35/79/1048733579.db2.gz ZMUAJUSFLWALMK-FQEVSTJZSA-N 2 1 318.480 4.257 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)C1CCCCC1 ZINC000483147760 1048746807 /nfs/dbraw/zinc/74/68/07/1048746807.db2.gz CCNQUMFFKWYMLE-LJQANCHMSA-N 2 1 315.505 4.307 20 0 DIADMP C[C@]1(Cc2cccs2)CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001176663612 1048752596 /nfs/dbraw/zinc/75/25/96/1048752596.db2.gz HBIZDLALEZMFGW-GOSISDBHSA-N 2 1 306.519 4.021 20 0 DIADMP CCC[C@@H](C)[C@@H](CC)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000483202806 1048754079 /nfs/dbraw/zinc/75/40/79/1048754079.db2.gz RLGSFRXSYRGDCJ-CRAIPNDOSA-N 2 1 303.494 4.163 20 0 DIADMP Cc1occc1C[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001190672305 1048775214 /nfs/dbraw/zinc/77/52/14/1048775214.db2.gz DQMLBNDQPMPMMQ-UHFFFAOYSA-N 2 1 312.457 4.206 20 0 DIADMP Cc1occc1C[N@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001190672305 1048775220 /nfs/dbraw/zinc/77/52/20/1048775220.db2.gz DQMLBNDQPMPMMQ-UHFFFAOYSA-N 2 1 312.457 4.206 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]([NH2+]CC[C@H]2CC=CCC2)C3)cc1 ZINC000716654381 1048786431 /nfs/dbraw/zinc/78/64/31/1048786431.db2.gz GAEZJDCFMPDMHM-UVUJQTEASA-N 2 1 324.512 4.376 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCCC(C)(F)F)CC1 ZINC001190791739 1048787070 /nfs/dbraw/zinc/78/70/70/1048787070.db2.gz PELKCSKDNRRHKT-UHFFFAOYSA-N 2 1 324.459 4.266 20 0 DIADMP Cc1cc(-n2ccnc2)ccc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000483513618 1048813287 /nfs/dbraw/zinc/81/32/87/1048813287.db2.gz NSPBUAHMIFIOCD-QGZVFWFLSA-N 2 1 305.425 4.374 20 0 DIADMP Cc1cc(-n2ccnc2)ccc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000483531108 1048816483 /nfs/dbraw/zinc/81/64/83/1048816483.db2.gz LJPXQCFAFINQLM-HNNXBMFYSA-N 2 1 311.454 4.435 20 0 DIADMP CCC[C@H](C[NH2+]CC(C)(C)[NH+]1CCCCC1)c1ccccc1 ZINC001177086982 1048829856 /nfs/dbraw/zinc/82/98/56/1048829856.db2.gz RHMQKNDUYUTVQN-LJQANCHMSA-N 2 1 302.506 4.424 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C1CCCCCC1 ZINC001177153801 1048840359 /nfs/dbraw/zinc/84/03/59/1048840359.db2.gz YBRABGMZHPLSLW-UHFFFAOYSA-N 2 1 302.506 4.457 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721996 1048845776 /nfs/dbraw/zinc/84/57/76/1048845776.db2.gz CRAYOZYNXIGAMA-FIKGOQFSSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721996 1048845794 /nfs/dbraw/zinc/84/57/94/1048845794.db2.gz CRAYOZYNXIGAMA-FIKGOQFSSA-N 2 1 308.469 4.487 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000483726133 1048846438 /nfs/dbraw/zinc/84/64/38/1048846438.db2.gz MCFLMTDWMRQREL-JENIJYKNSA-N 2 1 318.505 4.389 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000483726133 1048846457 /nfs/dbraw/zinc/84/64/57/1048846457.db2.gz MCFLMTDWMRQREL-JENIJYKNSA-N 2 1 318.505 4.389 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCC(C)(C)C2CC2)C1 ZINC001191048755 1048847276 /nfs/dbraw/zinc/84/72/76/1048847276.db2.gz TWKJTRGLNQBCPM-MSOLQXFVSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCC(C)(C)C2CC2)C1 ZINC001191048755 1048847291 /nfs/dbraw/zinc/84/72/91/1048847291.db2.gz TWKJTRGLNQBCPM-MSOLQXFVSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCC(C)(C)C2CC2)C1 ZINC001191048755 1048847300 /nfs/dbraw/zinc/84/73/00/1048847300.db2.gz TWKJTRGLNQBCPM-MSOLQXFVSA-N 2 1 306.538 4.399 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000483726131 1048847172 /nfs/dbraw/zinc/84/71/72/1048847172.db2.gz MCFLMTDWMRQREL-AOIWGVFYSA-N 2 1 318.505 4.389 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000483726131 1048847185 /nfs/dbraw/zinc/84/71/85/1048847185.db2.gz MCFLMTDWMRQREL-AOIWGVFYSA-N 2 1 318.505 4.389 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000483732925 1048850660 /nfs/dbraw/zinc/85/06/60/1048850660.db2.gz URZSYJYBGNCFAE-SNRMKQJTSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000483732925 1048850668 /nfs/dbraw/zinc/85/06/68/1048850668.db2.gz URZSYJYBGNCFAE-SNRMKQJTSA-N 2 1 322.924 4.370 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483746445 1048855295 /nfs/dbraw/zinc/85/52/95/1048855295.db2.gz OUHQMVAVSWKKGA-ZZCKCESHSA-N 2 1 308.897 4.500 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483746445 1048855313 /nfs/dbraw/zinc/85/53/13/1048855313.db2.gz OUHQMVAVSWKKGA-ZZCKCESHSA-N 2 1 308.897 4.500 20 0 DIADMP Cc1cc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)s1 ZINC001177290150 1048858797 /nfs/dbraw/zinc/85/87/97/1048858797.db2.gz ORTGNIBYXXUGPB-GASCZTMLSA-N 2 1 308.535 4.213 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCCN1Cc1ccccc1Cl ZINC001203385180 1048885194 /nfs/dbraw/zinc/88/51/94/1048885194.db2.gz MSRJAYLTBRVZGQ-IRXDYDNUSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccccc1Cl ZINC001203385180 1048885209 /nfs/dbraw/zinc/88/52/09/1048885209.db2.gz MSRJAYLTBRVZGQ-IRXDYDNUSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccccc1Cl ZINC001203385180 1048885226 /nfs/dbraw/zinc/88/52/26/1048885226.db2.gz MSRJAYLTBRVZGQ-IRXDYDNUSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccccc1Cl ZINC001203385180 1048885244 /nfs/dbraw/zinc/88/52/44/1048885244.db2.gz MSRJAYLTBRVZGQ-IRXDYDNUSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccccc1Cl ZINC001203385180 1048885259 /nfs/dbraw/zinc/88/52/59/1048885259.db2.gz MSRJAYLTBRVZGQ-IRXDYDNUSA-N 2 1 306.881 4.179 20 0 DIADMP Cc1cccc([C@@H]2CCCC[N@@H+]2CCCc2cncn2C)c1C ZINC001191213464 1048886332 /nfs/dbraw/zinc/88/63/32/1048886332.db2.gz IEXUIKBMGDYTMN-FQEVSTJZSA-N 2 1 311.473 4.197 20 0 DIADMP Cc1cccc([C@@H]2CCCC[N@H+]2CCCc2c[nH+]cn2C)c1C ZINC001191213464 1048886359 /nfs/dbraw/zinc/88/63/59/1048886359.db2.gz IEXUIKBMGDYTMN-FQEVSTJZSA-N 2 1 311.473 4.197 20 0 DIADMP Cc1cccc([C@@H]2CCCC[N@@H+]2CCCc2c[nH+]cn2C)c1C ZINC001191213464 1048886380 /nfs/dbraw/zinc/88/63/80/1048886380.db2.gz IEXUIKBMGDYTMN-FQEVSTJZSA-N 2 1 311.473 4.197 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@H](C)C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001177458784 1048890161 /nfs/dbraw/zinc/89/01/61/1048890161.db2.gz IGPLOINXOJVVNB-FUMNGEBKSA-N 2 1 316.533 4.211 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000484154337 1048909839 /nfs/dbraw/zinc/90/98/39/1048909839.db2.gz BMVKRVJBYOCGQS-ROUUACIJSA-N 2 1 323.484 4.326 20 0 DIADMP CC/C=C/CC[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359295 1048933691 /nfs/dbraw/zinc/93/36/91/1048933691.db2.gz TYSKQWZUWTWBHH-YEFOHOTDSA-N 2 1 312.501 4.331 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC001177741589 1048938557 /nfs/dbraw/zinc/93/85/57/1048938557.db2.gz AUTGYVRJUCZHBK-INIZCTEOSA-N 2 1 306.494 4.096 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001177741589 1048938566 /nfs/dbraw/zinc/93/85/66/1048938566.db2.gz AUTGYVRJUCZHBK-INIZCTEOSA-N 2 1 306.494 4.096 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2CC(C)C)C[C@H]1C ZINC001191417647 1048939367 /nfs/dbraw/zinc/93/93/67/1048939367.db2.gz QDFQKRKAFPUDBX-YLJYHZDGSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2CC(C)C)C[C@H]1C ZINC001191417647 1048939371 /nfs/dbraw/zinc/93/93/71/1048939371.db2.gz QDFQKRKAFPUDBX-YLJYHZDGSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2CC(C)C)C[C@H]1C ZINC001191417647 1048939396 /nfs/dbraw/zinc/93/93/96/1048939396.db2.gz QDFQKRKAFPUDBX-YLJYHZDGSA-N 2 1 302.506 4.190 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC)c(C)c2C)CC1 ZINC001203726816 1048982650 /nfs/dbraw/zinc/98/26/50/1048982650.db2.gz LDCMEVAMEJLKCW-UHFFFAOYSA-N 2 1 318.505 4.008 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2csc3ccccc23)C1 ZINC001178249998 1049001363 /nfs/dbraw/zinc/00/13/63/1049001363.db2.gz ZGURKAVGLJDHSR-MRXNPFEDSA-N 2 1 316.514 4.359 20 0 DIADMP Cc1cc([C@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)ccc1F ZINC001178218720 1049005123 /nfs/dbraw/zinc/00/51/23/1049005123.db2.gz XLLZCQBYNMYGNU-FUHWJXTLSA-N 2 1 304.453 4.048 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)CC1 ZINC001206324830 1049012536 /nfs/dbraw/zinc/01/25/36/1049012536.db2.gz DPYNEJVVOAMZMF-HNNXBMFYSA-N 2 1 319.251 4.083 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001203856543 1049015919 /nfs/dbraw/zinc/01/59/19/1049015919.db2.gz LDQDOMIEOZNOPG-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001203856543 1049015931 /nfs/dbraw/zinc/01/59/31/1049015931.db2.gz LDQDOMIEOZNOPG-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP C[N@H+]1CC[C@]2(CCN(Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943633 1049036767 /nfs/dbraw/zinc/03/67/67/1049036767.db2.gz IKQCARIDJNJFQU-NRFANRHFSA-N 2 1 322.452 4.007 20 0 DIADMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943633 1049036776 /nfs/dbraw/zinc/03/67/76/1049036776.db2.gz IKQCARIDJNJFQU-NRFANRHFSA-N 2 1 322.452 4.007 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943633 1049036785 /nfs/dbraw/zinc/03/67/85/1049036785.db2.gz IKQCARIDJNJFQU-NRFANRHFSA-N 2 1 322.452 4.007 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943633 1049036792 /nfs/dbraw/zinc/03/67/92/1049036792.db2.gz IKQCARIDJNJFQU-NRFANRHFSA-N 2 1 322.452 4.007 20 0 DIADMP COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904340640 1049037099 /nfs/dbraw/zinc/03/70/99/1049037099.db2.gz AOGAHJAMUASEEK-TXPKVOOTSA-N 2 1 324.468 4.092 20 0 DIADMP CC[N@@H+](Cc1ccc(Oc2ccccc2)cc1)C1CCN(C)CC1 ZINC001203945186 1049039853 /nfs/dbraw/zinc/03/98/53/1049039853.db2.gz DHJCZWQFFVJITI-UHFFFAOYSA-N 2 1 324.468 4.395 20 0 DIADMP CN1CCC([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001203946897 1049041809 /nfs/dbraw/zinc/04/18/09/1049041809.db2.gz ZSRRFFIBRFJOCQ-UHFFFAOYSA-N 2 1 310.441 4.005 20 0 DIADMP CN(Cc1ccc(Oc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC001203946897 1049041821 /nfs/dbraw/zinc/04/18/21/1049041821.db2.gz ZSRRFFIBRFJOCQ-UHFFFAOYSA-N 2 1 310.441 4.005 20 0 DIADMP Cc1ccsc1C[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001204022631 1049067090 /nfs/dbraw/zinc/06/70/90/1049067090.db2.gz ZSOUPJYABOJCNC-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP Cc1ccsc1C[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001204022631 1049067103 /nfs/dbraw/zinc/06/71/03/1049067103.db2.gz ZSOUPJYABOJCNC-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195132167 1049069503 /nfs/dbraw/zinc/06/95/03/1049069503.db2.gz YMYSLWZTYDQSKP-FUHWJXTLSA-N 2 1 314.498 4.229 20 0 DIADMP c1ccc2c(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccnc2c1 ZINC001204086540 1049078575 /nfs/dbraw/zinc/07/85/75/1049078575.db2.gz DBPMOIJYZAXWJI-LJQANCHMSA-N 2 1 323.484 4.075 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001178922089 1049109960 /nfs/dbraw/zinc/10/99/60/1049109960.db2.gz PALXEIIOXDDRAT-VAMGGRTRSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001178922089 1049109965 /nfs/dbraw/zinc/10/99/65/1049109965.db2.gz PALXEIIOXDDRAT-VAMGGRTRSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2(C3CCC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001178921597 1049110210 /nfs/dbraw/zinc/11/02/10/1049110210.db2.gz ADSCJNCCWJTMIL-XLIONFOSSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2(C3CCC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001178921597 1049110215 /nfs/dbraw/zinc/11/02/15/1049110215.db2.gz ADSCJNCCWJTMIL-XLIONFOSSA-N 2 1 312.501 4.352 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238653 1049118117 /nfs/dbraw/zinc/11/81/17/1049118117.db2.gz RCTMXAWVTCGMTA-WJMWBRGCSA-N 2 1 314.517 4.301 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238653 1049118126 /nfs/dbraw/zinc/11/81/26/1049118126.db2.gz RCTMXAWVTCGMTA-WJMWBRGCSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238653 1049118136 /nfs/dbraw/zinc/11/81/36/1049118136.db2.gz RCTMXAWVTCGMTA-WJMWBRGCSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238653 1049118141 /nfs/dbraw/zinc/11/81/41/1049118141.db2.gz RCTMXAWVTCGMTA-WJMWBRGCSA-N 2 1 314.517 4.301 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(C)cc(Cl)cc2C)C[C@@H]1C ZINC001204238188 1049119434 /nfs/dbraw/zinc/11/94/34/1049119434.db2.gz OZCPPJHOUHPMPY-DOTOQJQBSA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@@H]1C ZINC001204238188 1049119437 /nfs/dbraw/zinc/11/94/37/1049119437.db2.gz OZCPPJHOUHPMPY-DOTOQJQBSA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@@H]1C ZINC001204238188 1049119446 /nfs/dbraw/zinc/11/94/46/1049119446.db2.gz OZCPPJHOUHPMPY-DOTOQJQBSA-N 2 1 308.897 4.261 20 0 DIADMP CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001192645070 1049126354 /nfs/dbraw/zinc/12/63/54/1049126354.db2.gz GRQWBXOUJAVKDL-PXNSSMCTSA-N 2 1 300.490 4.435 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC001179081762 1049128963 /nfs/dbraw/zinc/12/89/63/1049128963.db2.gz OCTSCXRGVIDLBV-UHFFFAOYSA-N 2 1 316.514 4.483 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CC1 ZINC000716710926 1049144583 /nfs/dbraw/zinc/14/45/83/1049144583.db2.gz YXUDZBZPOLGKJQ-ZIBCJSCZSA-N 2 1 312.501 4.064 20 0 DIADMP CC[C@H](C)[C@@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001192909088 1049146359 /nfs/dbraw/zinc/14/63/59/1049146359.db2.gz CGEPDUTZPSNCAP-DLBZAZTESA-N 2 1 303.494 4.055 20 0 DIADMP CC[C@H](C)[C@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001192909090 1049146681 /nfs/dbraw/zinc/14/66/81/1049146681.db2.gz CGEPDUTZPSNCAP-IRXDYDNUSA-N 2 1 303.494 4.055 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)[C@H]2CCc3ccc(F)cc32)cc1 ZINC001192911150 1049148910 /nfs/dbraw/zinc/14/89/10/1049148910.db2.gz ZORDKTAWCVDRDI-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP CC(C)C1CCC(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC001179266931 1049151091 /nfs/dbraw/zinc/15/10/91/1049151091.db2.gz ZWRQZVANFCCUSO-SKINQDTJSA-N 2 1 306.538 4.160 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CC[C@@H](Cc2ccc(C(C)C)cc2)C1 ZINC001193068247 1049170494 /nfs/dbraw/zinc/17/04/94/1049170494.db2.gz JHFFPQNFYYGNOT-FQEVSTJZSA-N 2 1 316.533 4.406 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615538 1049199959 /nfs/dbraw/zinc/19/99/59/1049199959.db2.gz IVEJXWGIJBITOC-WSCHBXBGSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615538 1049199962 /nfs/dbraw/zinc/19/99/62/1049199962.db2.gz IVEJXWGIJBITOC-WSCHBXBGSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001204615538 1049199965 /nfs/dbraw/zinc/19/99/65/1049199965.db2.gz IVEJXWGIJBITOC-WSCHBXBGSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204615538 1049199968 /nfs/dbraw/zinc/19/99/68/1049199968.db2.gz IVEJXWGIJBITOC-WSCHBXBGSA-N 2 1 314.517 4.431 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC001179904459 1049239398 /nfs/dbraw/zinc/23/93/98/1049239398.db2.gz BZUSWHZRJQYOSU-SXLOBPIMSA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC001179904459 1049239409 /nfs/dbraw/zinc/23/94/09/1049239409.db2.gz BZUSWHZRJQYOSU-SXLOBPIMSA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC001179904459 1049239422 /nfs/dbraw/zinc/23/94/22/1049239422.db2.gz BZUSWHZRJQYOSU-SXLOBPIMSA-N 2 1 302.506 4.088 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)c2ccccc12 ZINC001204735387 1049246695 /nfs/dbraw/zinc/24/66/95/1049246695.db2.gz SBYGPOVLFFBRMW-UHFFFAOYSA-N 2 1 308.469 4.114 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2Cc2ccccc2Cl)CC1 ZINC001180038895 1049262388 /nfs/dbraw/zinc/26/23/88/1049262388.db2.gz DXAKURRALMCWBN-GOSISDBHSA-N 2 1 320.908 4.079 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1Cl ZINC000858491101 1049264815 /nfs/dbraw/zinc/26/48/15/1049264815.db2.gz YCOPIGDDKHYMMA-LSDHHAIUSA-N 2 1 324.896 4.040 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485481771 1049264845 /nfs/dbraw/zinc/26/48/45/1049264845.db2.gz VEPRWBRRAXJNTD-IBGZPJMESA-N 2 1 314.517 4.409 20 0 DIADMP Cc1cc(C)c(C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)c(C)c1 ZINC001193870505 1049277133 /nfs/dbraw/zinc/27/71/33/1049277133.db2.gz DPOMOLQRQYZPPN-UHFFFAOYSA-N 2 1 324.468 4.359 20 0 DIADMP C[C@]1([NH3+])CCC[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001204937589 1049315431 /nfs/dbraw/zinc/31/54/31/1049315431.db2.gz FOKQVSXKVHSENM-NRFANRHFSA-N 2 1 319.452 4.148 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001204937589 1049315442 /nfs/dbraw/zinc/31/54/42/1049315442.db2.gz FOKQVSXKVHSENM-NRFANRHFSA-N 2 1 319.452 4.148 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001204937432 1049316348 /nfs/dbraw/zinc/31/63/48/1049316348.db2.gz JUYVYUIWLZIOFB-NXNFSMPISA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)(C)CC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001180300785 1049326757 /nfs/dbraw/zinc/32/67/57/1049326757.db2.gz DVKAPIRESFAUMK-HSALFYBXSA-N 2 1 314.517 4.313 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC2(C)CCCC2)CC1)CC1CC1 ZINC001180322714 1049344951 /nfs/dbraw/zinc/34/49/51/1049344951.db2.gz NBSSUTJCDJLIDR-UHFFFAOYSA-N 2 1 306.538 4.401 20 0 DIADMP CCC(C)(C)CC[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001194270507 1049354039 /nfs/dbraw/zinc/35/40/39/1049354039.db2.gz XYZIPHTYOWEUCN-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CCC(C)(C)CC[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001194270507 1049354050 /nfs/dbraw/zinc/35/40/50/1049354050.db2.gz XYZIPHTYOWEUCN-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000485908709 1049361532 /nfs/dbraw/zinc/36/15/32/1049361532.db2.gz VYZKOZYGSMFBOR-MHTWAQMVSA-N 2 1 312.501 4.129 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000485908709 1049361538 /nfs/dbraw/zinc/36/15/38/1049361538.db2.gz VYZKOZYGSMFBOR-MHTWAQMVSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001205075761 1049365048 /nfs/dbraw/zinc/36/50/48/1049365048.db2.gz LZBFOIURHMVCEJ-YOEHRIQHSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001205075761 1049365060 /nfs/dbraw/zinc/36/50/60/1049365060.db2.gz LZBFOIURHMVCEJ-YOEHRIQHSA-N 2 1 314.860 4.319 20 0 DIADMP Cc1ccc(N(C)c2ccc(C[N@H+]3CCC[C@H]([NH3+])CC3)cc2)cc1 ZINC001205102411 1049377337 /nfs/dbraw/zinc/37/73/37/1049377337.db2.gz RQSKRTUNRYETHZ-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP c1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)cc(C[NH+]2CCCCC2)c1 ZINC001194435855 1049377759 /nfs/dbraw/zinc/37/77/59/1049377759.db2.gz PQVPKZYESRBYRV-OYRHEFFESA-N 2 1 312.501 4.295 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)CC1 ZINC001205109929 1049381592 /nfs/dbraw/zinc/38/15/92/1049381592.db2.gz NHFWJNDDQTZKJQ-KRWDZBQOSA-N 2 1 314.860 4.320 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCC[C@H]([NH3+])CC3)c2)cc1 ZINC001205109520 1049381904 /nfs/dbraw/zinc/38/19/04/1049381904.db2.gz HKBACTWPCTWQCY-SFHVURJKSA-N 2 1 310.441 4.101 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@H]1C[NH3+] ZINC001205146100 1049394364 /nfs/dbraw/zinc/39/43/64/1049394364.db2.gz OFLDXJVIKHUJSW-WMLDXEAASA-N 2 1 314.860 4.034 20 0 DIADMP c1ccc([C@@H]2CCCC[N@@H+]2Cc2ccc3c(c2)CC[NH2+]C3)cc1 ZINC001205170791 1049401582 /nfs/dbraw/zinc/40/15/82/1049401582.db2.gz DRQIHJJPLJHFPE-NRFANRHFSA-N 2 1 306.453 4.060 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC001194640927 1049403091 /nfs/dbraw/zinc/40/30/91/1049403091.db2.gz JZKCWQFHFRATTG-LAUBAEHRSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC001194640927 1049403096 /nfs/dbraw/zinc/40/30/96/1049403096.db2.gz JZKCWQFHFRATTG-LAUBAEHRSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC001194640927 1049403101 /nfs/dbraw/zinc/40/31/01/1049403101.db2.gz JZKCWQFHFRATTG-LAUBAEHRSA-N 2 1 314.517 4.463 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205266790 1049421830 /nfs/dbraw/zinc/42/18/30/1049421830.db2.gz XWTMGGVYQLBSIK-HXUWFJFHSA-N 2 1 318.505 4.349 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccccc2Oc2ccccc2)CC1 ZINC001205272954 1049423782 /nfs/dbraw/zinc/42/37/82/1049423782.db2.gz BHYQGVBKQWCTGU-FQEVSTJZSA-N 2 1 310.441 4.182 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001205273873 1049424039 /nfs/dbraw/zinc/42/40/39/1049424039.db2.gz QQTYBHAAQLOIAD-HXUWFJFHSA-N 2 1 312.432 4.196 20 0 DIADMP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CC1 ZINC001205280853 1049426840 /nfs/dbraw/zinc/42/68/40/1049426840.db2.gz KENJJPZHLTTYTG-AWEZNQCLSA-N 2 1 320.786 4.062 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CC1 ZINC001205280853 1049426846 /nfs/dbraw/zinc/42/68/46/1049426846.db2.gz KENJJPZHLTTYTG-AWEZNQCLSA-N 2 1 320.786 4.062 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2sccc2Oc2ccccc2)CC1 ZINC001205280926 1049426975 /nfs/dbraw/zinc/42/69/75/1049426975.db2.gz LZBRUBSKLKTLIL-SFHVURJKSA-N 2 1 316.470 4.244 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@](C)([NH3+])CC3)cc2)c1 ZINC001205288540 1049428440 /nfs/dbraw/zinc/42/84/40/1049428440.db2.gz LIINVNFUGZLBAH-NRFANRHFSA-N 2 1 308.469 4.365 20 0 DIADMP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181314799 1049465209 /nfs/dbraw/zinc/46/52/09/1049465209.db2.gz ICIPSVWQCCLRNB-PCCBWWKXSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@H]1CCCC[C@H]1C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001181383832 1049469668 /nfs/dbraw/zinc/46/96/68/1049469668.db2.gz ZOMQRASFGTZYGK-ROUUACIJSA-N 2 1 316.489 4.450 20 0 DIADMP CCCC[N@@H+](C)CC1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000486919036 1049492705 /nfs/dbraw/zinc/49/27/05/1049492705.db2.gz DHTRKKBUQIZAJA-UHFFFAOYSA-N 2 1 311.473 4.183 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC001205560007 1049497373 /nfs/dbraw/zinc/49/73/73/1049497373.db2.gz YBSPXGJDZNTHEP-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC1 ZINC001205578943 1049503077 /nfs/dbraw/zinc/50/30/77/1049503077.db2.gz KKRSHKACDSAJMO-MRXNPFEDSA-N 2 1 324.490 4.130 20 0 DIADMP C[C@H](C[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1)c1cccc2ccccc21 ZINC001205604433 1049509254 /nfs/dbraw/zinc/50/92/54/1049509254.db2.gz VNPIVKUSXJMWAS-SCTDSRPQSA-N 2 1 310.485 4.250 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2Oc2ccccc2)CC[C@@H]1C[NH3+] ZINC001205616438 1049511964 /nfs/dbraw/zinc/51/19/64/1049511964.db2.gz FPYQHHSPZMXHIJ-QZTJIDSGSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccccc2Oc2ccccc2)CC[C@H]1C[NH3+] ZINC001205616439 1049512455 /nfs/dbraw/zinc/51/24/55/1049512455.db2.gz FPYQHHSPZMXHIJ-ROUUACIJSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC[C@@H]1C[NH3+] ZINC001205625347 1049513270 /nfs/dbraw/zinc/51/32/70/1049513270.db2.gz BBYDDHXRLPSFQG-CRAIPNDOSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccccc2-c2cccs2)CC[C@H]1C[NH3+] ZINC001205628447 1049513689 /nfs/dbraw/zinc/51/36/89/1049513689.db2.gz VEYSDAPHILPFAR-HOTGVXAUSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)CC[C@@H]1C[NH3+] ZINC001205625951 1049514216 /nfs/dbraw/zinc/51/42/16/1049514216.db2.gz CXFWZQYKRBAKPT-HZPDHXFCSA-N 2 1 322.452 4.393 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@H](C)[C@@H](C[NH3+])CC3)cc2)o1 ZINC001205636824 1049518067 /nfs/dbraw/zinc/51/80/67/1049518067.db2.gz FGXZCPCKYIIWDW-HNAYVOBHSA-N 2 1 312.457 4.062 20 0 DIADMP Cc1csc2sc(C[N@H+]3CC[C@@H](C[NH3+])[C@@H](C)CC3)c(C)c12 ZINC001205638673 1049518124 /nfs/dbraw/zinc/51/81/24/1049518124.db2.gz QQWIIXOERHTEKW-FZMZJTMJSA-N 2 1 322.543 4.386 20 0 DIADMP CCc1ccc(C[N@H+](CCCc2c[nH+]cn2C)CC(C)C)cc1 ZINC001195413987 1049522731 /nfs/dbraw/zinc/52/27/31/1049522731.db2.gz SVSAQWDSDBUPMX-UHFFFAOYSA-N 2 1 313.489 4.073 20 0 DIADMP CCc1ccc(C[N@@H+](CCCc2c[nH+]cn2C)CC(C)C)cc1 ZINC001195413987 1049522747 /nfs/dbraw/zinc/52/27/47/1049522747.db2.gz SVSAQWDSDBUPMX-UHFFFAOYSA-N 2 1 313.489 4.073 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2sc(Cl)c3ccccc32)CC[C@@H]1C[NH3+] ZINC001205651323 1049523449 /nfs/dbraw/zinc/52/34/49/1049523449.db2.gz CSIKQLLUQOOGQX-QWHCGFSZSA-N 2 1 322.905 4.362 20 0 DIADMP Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c(Cl)cc1Cl ZINC001205652597 1049524556 /nfs/dbraw/zinc/52/45/56/1049524556.db2.gz QAYXVSOVEPXOAW-YPMHNXCESA-N 2 1 315.288 4.109 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC001205692616 1049534013 /nfs/dbraw/zinc/53/40/13/1049534013.db2.gz HGGKZVPFNUQGLM-AWEZNQCLSA-N 2 1 316.411 4.083 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(F)c2ccccc12 ZINC001205696507 1049534327 /nfs/dbraw/zinc/53/43/27/1049534327.db2.gz KLFPSIOZLOFODP-UHFFFAOYSA-N 2 1 302.437 4.143 20 0 DIADMP Cc1occc1C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001182070839 1049568729 /nfs/dbraw/zinc/56/87/29/1049568729.db2.gz DKLUVXCPUJHNRO-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814840 1049572868 /nfs/dbraw/zinc/57/28/68/1049572868.db2.gz DOIFYIVORJTYDF-LSDHHAIUSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814840 1049572873 /nfs/dbraw/zinc/57/28/73/1049572873.db2.gz DOIFYIVORJTYDF-LSDHHAIUSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814839 1049573022 /nfs/dbraw/zinc/57/30/22/1049573022.db2.gz DOIFYIVORJTYDF-HUUCEWRRSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814839 1049573034 /nfs/dbraw/zinc/57/30/34/1049573034.db2.gz DOIFYIVORJTYDF-HUUCEWRRSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001205901990 1049595422 /nfs/dbraw/zinc/59/54/22/1049595422.db2.gz GQSHTEABZFEZDZ-QWHCGFSZSA-N 2 1 306.500 4.036 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205902206 1049595829 /nfs/dbraw/zinc/59/58/29/1049595829.db2.gz IQNXDPWALQBCQB-DNVCBOLYSA-N 2 1 312.432 4.052 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@H](C[NH3+])[C@@H]2C)cc1 ZINC001205902245 1049596264 /nfs/dbraw/zinc/59/62/64/1049596264.db2.gz JDQGJARCZHTMEK-UWVAXJGDSA-N 2 1 302.506 4.048 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@@H](C[NH3+])[C@H]2C)cc1 ZINC001205904510 1049597045 /nfs/dbraw/zinc/59/70/45/1049597045.db2.gz VQMRIFVGQLSADU-MJGOQNOKSA-N 2 1 318.505 4.205 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001205903625 1049598121 /nfs/dbraw/zinc/59/81/21/1049598121.db2.gz QJKQSECGOOLPPL-HIFRSBDPSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC001205903654 1049598647 /nfs/dbraw/zinc/59/86/47/1049598647.db2.gz QPNBRHXQCBNOAM-AEFFLSMTSA-N 2 1 310.441 4.038 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@@H]2C)cccc1-c1ccccc1 ZINC001205912381 1049600591 /nfs/dbraw/zinc/60/05/91/1049600591.db2.gz ABMIMSDXQUPPOW-HKUYNNGSSA-N 2 1 308.469 4.221 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)Cc1ccc(Cl)cc1 ZINC001205924033 1049603544 /nfs/dbraw/zinc/60/35/44/1049603544.db2.gz HAWYNCBDUYIGGT-LPHOPBHVSA-N 2 1 322.924 4.371 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001205995484 1049620286 /nfs/dbraw/zinc/62/02/86/1049620286.db2.gz OIYYGTGDKDTUIE-UKRRQHHQSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001205995482 1049622643 /nfs/dbraw/zinc/62/26/43/1049622643.db2.gz OIYYGTGDKDTUIE-HIFRSBDPSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3)s2)CCC[C@@H]1C[NH3+] ZINC001206003510 1049625739 /nfs/dbraw/zinc/62/57/39/1049625739.db2.gz IUYDUTJMUJPBGC-DOTOQJQBSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC001206004860 1049626029 /nfs/dbraw/zinc/62/60/29/1049626029.db2.gz HXBCYZBMPIJRCR-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001206004860 1049626036 /nfs/dbraw/zinc/62/60/36/1049626036.db2.gz HXBCYZBMPIJRCR-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001206004860 1049626044 /nfs/dbraw/zinc/62/60/44/1049626044.db2.gz HXBCYZBMPIJRCR-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3cccs3)cc2)CCC[C@H]1C[NH3+] ZINC001206012019 1049629415 /nfs/dbraw/zinc/62/94/15/1049629415.db2.gz IBFOVBKGWQWZIL-QAPCUYQASA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cc(-c3ccsc3)cs2)CCC[C@H]1C[NH3+] ZINC001206021749 1049632181 /nfs/dbraw/zinc/63/21/81/1049632181.db2.gz AVXNAMZOOWACTN-KGLIPLIRSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c1Cl ZINC001206027320 1049632806 /nfs/dbraw/zinc/63/28/06/1049632806.db2.gz WDQQWDHGKGDYIU-QWHCGFSZSA-N 2 1 315.288 4.109 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2sc(Cl)c3ccccc32)CCC[C@@H]1C[NH3+] ZINC001206037874 1049635532 /nfs/dbraw/zinc/63/55/32/1049635532.db2.gz YSJBKEURSHLAFL-CHWSQXEVSA-N 2 1 322.905 4.362 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2sc(Cl)c3ccccc32)CCC[C@H]1C[NH3+] ZINC001206037875 1049636235 /nfs/dbraw/zinc/63/62/35/1049636235.db2.gz YSJBKEURSHLAFL-OLZOCXBDSA-N 2 1 322.905 4.362 20 0 DIADMP C[C@H]1C[N@@H+](Cc2sc(Cl)c3ccccc32)CCC[C@@H]1C[NH3+] ZINC001206037876 1049636253 /nfs/dbraw/zinc/63/62/53/1049636253.db2.gz YSJBKEURSHLAFL-QWHCGFSZSA-N 2 1 322.905 4.362 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC000774265379 1049639756 /nfs/dbraw/zinc/63/97/56/1049639756.db2.gz DQWCRTBAIDJEGU-QYYYHEGRSA-N 2 1 312.501 4.402 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C[C@H]1[NH3+] ZINC001206043908 1049639765 /nfs/dbraw/zinc/63/97/65/1049639765.db2.gz ZIDIQBBOSPOMBV-DNVCBOLYSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C[C@H]1[NH3+] ZINC001206043908 1049639770 /nfs/dbraw/zinc/63/97/70/1049639770.db2.gz ZIDIQBBOSPOMBV-DNVCBOLYSA-N 2 1 319.452 4.004 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)CS1 ZINC000488419030 1049647496 /nfs/dbraw/zinc/64/74/96/1049647496.db2.gz ZJBGOBONBXENCW-RTBURBONSA-N 2 1 320.546 4.147 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)CS1 ZINC000488419029 1049648079 /nfs/dbraw/zinc/64/80/79/1049648079.db2.gz ZJBGOBONBXENCW-RBUKOAKNSA-N 2 1 320.546 4.147 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001206084295 1049650423 /nfs/dbraw/zinc/65/04/23/1049650423.db2.gz GKJCCQVYIMUQGK-OXJNMPFZSA-N 2 1 318.480 4.472 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001206084295 1049650425 /nfs/dbraw/zinc/65/04/25/1049650425.db2.gz GKJCCQVYIMUQGK-OXJNMPFZSA-N 2 1 318.480 4.472 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001206084409 1049650693 /nfs/dbraw/zinc/65/06/93/1049650693.db2.gz JKGJHNWTQMCPEG-MXWWQKGMSA-N 2 1 308.897 4.296 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001206084409 1049650696 /nfs/dbraw/zinc/65/06/96/1049650696.db2.gz JKGJHNWTQMCPEG-MXWWQKGMSA-N 2 1 308.897 4.296 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488436759 1049653505 /nfs/dbraw/zinc/65/35/05/1049653505.db2.gz VHQFQPBBDUYBSE-IXDOHACOSA-N 2 1 312.567 4.008 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436091 1049654513 /nfs/dbraw/zinc/65/45/13/1049654513.db2.gz WWTNOJDSMSRGOA-YLJYHZDGSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436091 1049654520 /nfs/dbraw/zinc/65/45/20/1049654520.db2.gz WWTNOJDSMSRGOA-YLJYHZDGSA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]CCCc1c(Cl)cccc1Cl ZINC001206136414 1049663825 /nfs/dbraw/zinc/66/38/25/1049663825.db2.gz SOPVPALVCMFBAI-CYBMUJFWSA-N 2 1 317.304 4.244 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]CCCc1c(Cl)cccc1Cl ZINC001206136414 1049663829 /nfs/dbraw/zinc/66/38/29/1049663829.db2.gz SOPVPALVCMFBAI-CYBMUJFWSA-N 2 1 317.304 4.244 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cc(C)sc2C)CC1 ZINC001196727475 1049683290 /nfs/dbraw/zinc/68/32/90/1049683290.db2.gz DZVCQTMWSKOOJP-UHFFFAOYSA-N 2 1 306.519 4.205 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)[C@H]1CC1(C)C ZINC001182542111 1049685148 /nfs/dbraw/zinc/68/51/48/1049685148.db2.gz BENBFFOKQNDEHX-IYWMVGAKSA-N 2 1 314.517 4.136 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001206225015 1049685759 /nfs/dbraw/zinc/68/57/59/1049685759.db2.gz XVTFKBSEHITAFB-VURPSTOHSA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001206225015 1049685764 /nfs/dbraw/zinc/68/57/64/1049685764.db2.gz XVTFKBSEHITAFB-VURPSTOHSA-N 2 1 312.501 4.379 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)C1CCCCC1 ZINC001182542497 1049685729 /nfs/dbraw/zinc/68/57/29/1049685729.db2.gz DRVWOVLAXMAMQR-UIFIKXQLSA-N 2 1 314.517 4.138 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)C1CCCCC1 ZINC001182542498 1049685861 /nfs/dbraw/zinc/68/58/61/1049685861.db2.gz DRVWOVLAXMAMQR-WMQCIHAUSA-N 2 1 314.517 4.138 20 0 DIADMP CCCC[C@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001182542789 1049686281 /nfs/dbraw/zinc/68/62/81/1049686281.db2.gz GAMOGGAVSVMPSU-WOZUAGRISA-N 2 1 314.517 4.280 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001206257425 1049691132 /nfs/dbraw/zinc/69/11/32/1049691132.db2.gz DYBMDZSOTSKFIL-AWEZNQCLSA-N 2 1 310.466 4.238 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[NH2+]C[C@@H]2C)c1 ZINC001206262969 1049693123 /nfs/dbraw/zinc/69/31/23/1049693123.db2.gz KLUIIBXBLAEIDR-SFHVURJKSA-N 2 1 308.469 4.154 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[NH2+]C[C@@H]2C)c1 ZINC001206262969 1049693127 /nfs/dbraw/zinc/69/31/27/1049693127.db2.gz KLUIIBXBLAEIDR-SFHVURJKSA-N 2 1 308.469 4.154 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)sc2Cl)CC1 ZINC001206311538 1049708871 /nfs/dbraw/zinc/70/88/71/1049708871.db2.gz QLXGSCMTEPUPEK-ZDUSSCGKSA-N 2 1 307.290 4.006 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001182713764 1049703971 /nfs/dbraw/zinc/70/39/71/1049703971.db2.gz IVTPBDIXBDHOES-FQEVSTJZSA-N 2 1 318.480 4.329 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001206296975 1049704445 /nfs/dbraw/zinc/70/44/45/1049704445.db2.gz VTYWAPTVKDOQDG-NRFANRHFSA-N 2 1 308.469 4.305 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2-c2ccccc2)CC1 ZINC001206311072 1049708113 /nfs/dbraw/zinc/70/81/13/1049708113.db2.gz HTHCJHSUNAMQQP-NRFANRHFSA-N 2 1 308.469 4.305 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001206311725 1049708650 /nfs/dbraw/zinc/70/86/50/1049708650.db2.gz SSSMCOYVKSORDP-QFIPXVFZSA-N 2 1 320.480 4.209 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206318150 1049709448 /nfs/dbraw/zinc/70/94/48/1049709448.db2.gz NLEXBSXKVVHIRY-SFHVURJKSA-N 2 1 302.487 4.161 20 0 DIADMP CC(C)CCC[N@@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001196961728 1049709856 /nfs/dbraw/zinc/70/98/56/1049709856.db2.gz LLTMGNDNNWNRPX-OYRHEFFESA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)CCC[N@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001196961728 1049709869 /nfs/dbraw/zinc/70/98/69/1049709869.db2.gz LLTMGNDNNWNRPX-OYRHEFFESA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)CCC[NH+]1C[C@]2(C)C[N@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001196961728 1049709883 /nfs/dbraw/zinc/70/98/83/1049709883.db2.gz LLTMGNDNNWNRPX-OYRHEFFESA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)CCC[NH+]1C[C@]2(C)C[N@@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001196961728 1049709892 /nfs/dbraw/zinc/70/98/92/1049709892.db2.gz LLTMGNDNNWNRPX-OYRHEFFESA-N 2 1 314.517 4.267 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206324452 1049712352 /nfs/dbraw/zinc/71/23/52/1049712352.db2.gz BRHKHWQZGHXLPB-HXUWFJFHSA-N 2 1 318.505 4.042 20 0 DIADMP Cc1ccc(-c2cncc(C[N@H+]3CCC[C@@](C)(C[NH3+])CC3)c2)cc1 ZINC001206326155 1049713568 /nfs/dbraw/zinc/71/35/68/1049713568.db2.gz KSGBDENWHWNDPE-OAQYLSRUSA-N 2 1 323.484 4.008 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001206336341 1049714925 /nfs/dbraw/zinc/71/49/25/1049714925.db2.gz MDQIGJDPXXGLDL-HNNXBMFYSA-N 2 1 319.251 4.083 20 0 DIADMP Cc1ccc(CCC[N@H+](CC(C)C)CC2CC[NH+](C)CC2)cc1 ZINC001197193798 1049726436 /nfs/dbraw/zinc/72/64/36/1049726436.db2.gz FORUZQWMAHRHTQ-UHFFFAOYSA-N 2 1 316.533 4.227 20 0 DIADMP CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@H](C)c1ccccc1 ZINC000489320678 1049743340 /nfs/dbraw/zinc/74/33/40/1049743340.db2.gz BHSSFGVRWBKCMG-GOSISDBHSA-N 2 1 323.484 4.381 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]C1CCC(c2ccccc2)CC1 ZINC001206538495 1049753206 /nfs/dbraw/zinc/75/32/06/1049753206.db2.gz ZUQISCVESWMOLX-UHFFFAOYSA-N 2 1 302.506 4.280 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@](C)(C[NH3+])C1)c1cccc2ccccc21 ZINC001206542076 1049753712 /nfs/dbraw/zinc/75/37/12/1049753712.db2.gz QVMJPUOYJZBNAB-LAUBAEHRSA-N 2 1 310.485 4.394 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206542241 1049753876 /nfs/dbraw/zinc/75/38/76/1049753876.db2.gz VXSZBRRRMHRYMZ-PKOBYXMFSA-N 2 1 312.542 4.059 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H](C)C1CCSCC1)C1CCCCC1 ZINC001206559282 1049755226 /nfs/dbraw/zinc/75/52/26/1049755226.db2.gz CSZGXYIYWYIMQK-INIZCTEOSA-N 2 1 312.567 4.152 20 0 DIADMP COc1cc(C)c(C[N@H+]2CCCC[C@@](C)(C[NH3+])C2)cc1C(C)C ZINC001206563908 1049757202 /nfs/dbraw/zinc/75/72/02/1049757202.db2.gz KGOMZELWSKXIPH-FQEVSTJZSA-N 2 1 318.505 4.078 20 0 DIADMP CSc1cccc(Cl)c1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206566235 1049757469 /nfs/dbraw/zinc/75/74/69/1049757469.db2.gz YUPXNODHQSGFOT-MRXNPFEDSA-N 2 1 312.910 4.013 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206566235 1049757477 /nfs/dbraw/zinc/75/74/77/1049757477.db2.gz YUPXNODHQSGFOT-MRXNPFEDSA-N 2 1 312.910 4.013 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)CCCO2 ZINC000489518104 1049762611 /nfs/dbraw/zinc/76/26/11/1049762611.db2.gz RLZQBRXDJVQCOA-SZVBFZGTSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)CCCO2 ZINC000489518104 1049762618 /nfs/dbraw/zinc/76/26/18/1049762618.db2.gz RLZQBRXDJVQCOA-SZVBFZGTSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)CCCO2 ZINC000489518104 1049762634 /nfs/dbraw/zinc/76/26/34/1049762634.db2.gz RLZQBRXDJVQCOA-SZVBFZGTSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(-c2ccccn2)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206588598 1049763505 /nfs/dbraw/zinc/76/35/05/1049763505.db2.gz CJIOSDKFLSWYIH-HXUWFJFHSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(F)c2ccccc12)[C@@H]1CCC[NH2+]CC1 ZINC001206590017 1049764120 /nfs/dbraw/zinc/76/41/20/1049764120.db2.gz KPDVUPAVYAHJSK-QGZVFWFLSA-N 2 1 314.448 4.331 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2ccncc2)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206591030 1049764421 /nfs/dbraw/zinc/76/44/21/1049764421.db2.gz PGPDXMPFKWOKEU-OAQYLSRUSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2c(F)cccc12)[C@H]1CCC[NH2+]CC1 ZINC001206597402 1049765337 /nfs/dbraw/zinc/76/53/37/1049765337.db2.gz CBCXFVMGDSRGCH-KRWDZBQOSA-N 2 1 314.448 4.331 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1-c1ccncc1)[C@H]1CCC[NH2+]CC1 ZINC001206598061 1049765899 /nfs/dbraw/zinc/76/58/99/1049765899.db2.gz HRXRWQYYNLOGGO-FQEVSTJZSA-N 2 1 323.484 4.101 20 0 DIADMP Cc1c(Cl)ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1F ZINC001206598383 1049765906 /nfs/dbraw/zinc/76/59/06/1049765906.db2.gz IZTSIHBAJGBRLM-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1F ZINC001206598383 1049765911 /nfs/dbraw/zinc/76/59/11/1049765911.db2.gz IZTSIHBAJGBRLM-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP CC(C)[N@@H+](Cc1ccc2ccsc2c1)[C@@H]1CCC[NH2+]CC1 ZINC001206599301 1049766027 /nfs/dbraw/zinc/76/60/27/1049766027.db2.gz QMHPVVKRTBRQHJ-QGZVFWFLSA-N 2 1 302.487 4.254 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(C2CCC2)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206599945 1049767378 /nfs/dbraw/zinc/76/73/78/1049767378.db2.gz ZMMQFSRLUUHXAD-HXUWFJFHSA-N 2 1 300.490 4.307 20 0 DIADMP Cc1ccc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c(C)c1Cl ZINC001206606823 1049769179 /nfs/dbraw/zinc/76/91/79/1049769179.db2.gz UBHHIJCXVUIBRF-QGZVFWFLSA-N 2 1 308.897 4.309 20 0 DIADMP CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001206617027 1049771340 /nfs/dbraw/zinc/77/13/40/1049771340.db2.gz YEKBHTCFEBAARO-HNNXBMFYSA-N 2 1 313.489 4.026 20 0 DIADMP Cc1c(C[N@H+]2CCCC[C@@H](C[NH3+])C2)cccc1-c1ccccc1 ZINC001206640987 1049773371 /nfs/dbraw/zinc/77/33/71/1049773371.db2.gz QPVBCTZZIPBWDD-SFHVURJKSA-N 2 1 308.469 4.223 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC2CCCC2)CC1 ZINC000489681660 1049777269 /nfs/dbraw/zinc/77/72/69/1049777269.db2.gz VOGFOMFOILSTSX-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1cc(N(C)C)[nH+]cc1Nc1ccc(C2CC[NH+](C)CC2)cc1 ZINC001206738079 1049787080 /nfs/dbraw/zinc/78/70/80/1049787080.db2.gz VVQMUYVMHBGJDF-UHFFFAOYSA-N 2 1 324.472 4.009 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@H]3C)c2)cc1 ZINC001206768009 1049794666 /nfs/dbraw/zinc/79/46/66/1049794666.db2.gz GRABIHVBMXJUPV-MJGOQNOKSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001206769051 1049794917 /nfs/dbraw/zinc/79/49/17/1049794917.db2.gz MZHGNELOLRGWSW-NVXWUHKLSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1ccc2c(c1)CCCC2 ZINC001206800109 1049801024 /nfs/dbraw/zinc/80/10/24/1049801024.db2.gz HWPOLKGGFPJEML-UWJYYQICSA-N 2 1 314.517 4.118 20 0 DIADMP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1ccc2c(c1)CCCC2 ZINC001206800105 1049801121 /nfs/dbraw/zinc/80/11/21/1049801121.db2.gz HWPOLKGGFPJEML-UTKZUKDTSA-N 2 1 314.517 4.118 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001206807223 1049802944 /nfs/dbraw/zinc/80/29/44/1049802944.db2.gz HTSIFBYPYNWKEK-WMZOPIPTSA-N 2 1 300.490 4.294 20 0 DIADMP CC(C)[C@H](CSc1ccccc1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000490145563 1049803575 /nfs/dbraw/zinc/80/35/75/1049803575.db2.gz VFVVWEQAKVMYSV-SCTDSRPQSA-N 2 1 318.530 4.020 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1C[C@@H](C[NH3+])CC[C@H]1C ZINC001206808149 1049804270 /nfs/dbraw/zinc/80/42/70/1049804270.db2.gz JVUSKSYXGIKUBY-QZTJIDSGSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001206807222 1049804708 /nfs/dbraw/zinc/80/47/08/1049804708.db2.gz HTSIFBYPYNWKEK-SJLPKXTDSA-N 2 1 300.490 4.294 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@H](C[NH3+])CC[C@@H]2C)ccc1Oc1ccccc1 ZINC001206806212 1049804822 /nfs/dbraw/zinc/80/48/22/1049804822.db2.gz FZLPXXKZQJRKDS-HKUYNNGSSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001206810541 1049805303 /nfs/dbraw/zinc/80/53/03/1049805303.db2.gz NUXWHHYTCGIELQ-NEPJUHHUSA-N 2 1 308.878 4.114 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000490167188 1049807384 /nfs/dbraw/zinc/80/73/84/1049807384.db2.gz GVFLMTUAKPCDCS-SFHVURJKSA-N 2 1 308.469 4.098 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000490167188 1049807388 /nfs/dbraw/zinc/80/73/88/1049807388.db2.gz GVFLMTUAKPCDCS-SFHVURJKSA-N 2 1 308.469 4.098 20 0 DIADMP CC(C)c1ccc(CC[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC001206826824 1049808451 /nfs/dbraw/zinc/80/84/51/1049808451.db2.gz FDCVFAMJTPIGAG-FQEVSTJZSA-N 2 1 314.517 4.064 20 0 DIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167560 1049809038 /nfs/dbraw/zinc/80/90/38/1049809038.db2.gz KQDULMMXUBGWKY-WIYYLYMNSA-N 2 1 308.469 4.016 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167560 1049809052 /nfs/dbraw/zinc/80/90/52/1049809052.db2.gz KQDULMMXUBGWKY-WIYYLYMNSA-N 2 1 308.469 4.016 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001207185613 1049858311 /nfs/dbraw/zinc/85/83/11/1049858311.db2.gz QSTLXLIXIWEPJS-GDBMZVCRSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001207185613 1049858316 /nfs/dbraw/zinc/85/83/16/1049858316.db2.gz QSTLXLIXIWEPJS-GDBMZVCRSA-N 2 1 320.443 4.494 20 0 DIADMP Cc1cccc2c1C[N@@H+](CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001207286993 1049875431 /nfs/dbraw/zinc/87/54/31/1049875431.db2.gz QIHRRJMMTJHRSR-UHFFFAOYSA-N 2 1 320.480 4.223 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001207287609 1049875568 /nfs/dbraw/zinc/87/55/68/1049875568.db2.gz TYLYWSKOQKVCLP-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP Fc1ccc2c(c1)C[N@H+](CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001207292083 1049876559 /nfs/dbraw/zinc/87/65/59/1049876559.db2.gz IUFMGSRYENLJNK-UHFFFAOYSA-N 2 1 324.443 4.054 20 0 DIADMP CCC[N@@H+](CC(C)C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207292239 1049876599 /nfs/dbraw/zinc/87/65/99/1049876599.db2.gz BPOKYOCQRQOJTN-UHFFFAOYSA-N 2 1 302.506 4.267 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491059036 1049883338 /nfs/dbraw/zinc/88/33/38/1049883338.db2.gz QTFJCUCQWDNUEH-ROUUACIJSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491059036 1049883341 /nfs/dbraw/zinc/88/33/41/1049883341.db2.gz QTFJCUCQWDNUEH-ROUUACIJSA-N 2 1 318.480 4.475 20 0 DIADMP C(=C\c1ccccc1)\C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491056827 1049883677 /nfs/dbraw/zinc/88/36/77/1049883677.db2.gz JQFRCPPYPZQWSA-UOMAQRANSA-N 2 1 312.501 4.288 20 0 DIADMP C(=C\c1ccccc1)\C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491056827 1049883683 /nfs/dbraw/zinc/88/36/83/1049883683.db2.gz JQFRCPPYPZQWSA-UOMAQRANSA-N 2 1 312.501 4.288 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC1 ZINC001207484300 1049897758 /nfs/dbraw/zinc/89/77/58/1049897758.db2.gz JEDZZZRADYWJQF-CQSZACIVSA-N 2 1 312.910 4.270 20 0 DIADMP C[N@@H+](CCC1CC[NH+](C)CC1)Cc1ccc(Cl)c(Cl)c1 ZINC001207481522 1049897775 /nfs/dbraw/zinc/89/77/75/1049897775.db2.gz JTBMEOJAPDQIGH-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)CC(c1ccccc1)c1ccccc1 ZINC001207527572 1049906373 /nfs/dbraw/zinc/90/63/73/1049906373.db2.gz HLOGRCFWROJADF-UHFFFAOYSA-N 2 1 310.485 4.092 20 0 DIADMP Cc1cccc(CC[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)c1 ZINC001207554792 1049908889 /nfs/dbraw/zinc/90/88/89/1049908889.db2.gz MKOQMJRSZNBOIL-UHFFFAOYSA-N 2 1 314.517 4.266 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+](Cc2ccc3c(c2)CCCC3)CC1 ZINC001207581317 1049911333 /nfs/dbraw/zinc/91/13/33/1049911333.db2.gz MVVWCQFHYNXXDB-UHFFFAOYSA-N 2 1 312.501 4.016 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCCc1cccc(F)c1 ZINC001207605931 1049915284 /nfs/dbraw/zinc/91/52/84/1049915284.db2.gz YICJMJXOEXZGKN-PMACEKPBSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCCc1cccc(F)c1 ZINC001207605931 1049915287 /nfs/dbraw/zinc/91/52/87/1049915287.db2.gz YICJMJXOEXZGKN-PMACEKPBSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@H+](C)Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001207739039 1049932797 /nfs/dbraw/zinc/93/27/97/1049932797.db2.gz VQKHQLUBINLGOG-UHFFFAOYSA-N 2 1 314.517 4.461 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@@H+](C)Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001207739039 1049932799 /nfs/dbraw/zinc/93/27/99/1049932799.db2.gz VQKHQLUBINLGOG-UHFFFAOYSA-N 2 1 314.517 4.461 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)c1ccccc1 ZINC001207912072 1049954827 /nfs/dbraw/zinc/95/48/27/1049954827.db2.gz NDRPOGLQHIKLSE-YSIASYRMSA-N 2 1 300.490 4.129 20 0 DIADMP C[C@@H](C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC001207912072 1049954829 /nfs/dbraw/zinc/95/48/29/1049954829.db2.gz NDRPOGLQHIKLSE-YSIASYRMSA-N 2 1 300.490 4.129 20 0 DIADMP C[C@@H](C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC001207912072 1049954831 /nfs/dbraw/zinc/95/48/31/1049954831.db2.gz NDRPOGLQHIKLSE-YSIASYRMSA-N 2 1 300.490 4.129 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)cc1 ZINC001207936476 1049958461 /nfs/dbraw/zinc/95/84/61/1049958461.db2.gz HFULEJFDGYXRPK-WIYYLYMNSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)cc1 ZINC001207936476 1049958479 /nfs/dbraw/zinc/95/84/79/1049958479.db2.gz HFULEJFDGYXRPK-WIYYLYMNSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1 ZINC001207936476 1049958486 /nfs/dbraw/zinc/95/84/86/1049958486.db2.gz HFULEJFDGYXRPK-WIYYLYMNSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CCc3[nH+]ccn3CC2)CC1 ZINC001207937835 1049961542 /nfs/dbraw/zinc/96/15/42/1049961542.db2.gz OUGAMGZVKBVLIB-LJQANCHMSA-N 2 1 313.489 4.214 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CCc3[nH+]ccn3CC2)CC1 ZINC001207937835 1049961548 /nfs/dbraw/zinc/96/15/48/1049961548.db2.gz OUGAMGZVKBVLIB-LJQANCHMSA-N 2 1 313.489 4.214 20 0 DIADMP Cc1ccc(CCC[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)o1 ZINC001207948947 1049963353 /nfs/dbraw/zinc/96/33/53/1049963353.db2.gz GTHRPUBXMLFEBU-UHFFFAOYSA-N 2 1 318.505 4.250 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)ccc1F ZINC000571901453 1049969720 /nfs/dbraw/zinc/96/97/20/1049969720.db2.gz FQKHPVKYQJGQKK-ICSRJNTNSA-N 2 1 312.432 4.059 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)ccc1F ZINC000571901453 1049969729 /nfs/dbraw/zinc/96/97/29/1049969729.db2.gz FQKHPVKYQJGQKK-ICSRJNTNSA-N 2 1 312.432 4.059 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001208107398 1049974131 /nfs/dbraw/zinc/97/41/31/1049974131.db2.gz SJVWIWLAHBGEJP-QGZVFWFLSA-N 2 1 306.881 4.209 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)CC[C@@H](C)c2ccc(C)o2)CC1 ZINC001208165609 1049979703 /nfs/dbraw/zinc/97/97/03/1049979703.db2.gz SEZGPHGUTXCICI-MRXNPFEDSA-N 2 1 306.494 4.278 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@@H+](C)CCC[NH+]1CCCC1 ZINC001208207194 1049985754 /nfs/dbraw/zinc/98/57/54/1049985754.db2.gz WCICXFKWDOTPEG-SFHVURJKSA-N 2 1 312.542 4.026 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CCC3CC3)C[C@@H]21 ZINC001208683136 1050001665 /nfs/dbraw/zinc/00/16/65/1050001665.db2.gz YODLMQADXGQRIP-YTQUADARSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CCC3CC3)C[C@@H]21 ZINC001208683136 1050001668 /nfs/dbraw/zinc/00/16/68/1050001668.db2.gz YODLMQADXGQRIP-YTQUADARSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](CCC3CC3)C[C@@H]21 ZINC001208683136 1050001673 /nfs/dbraw/zinc/00/16/73/1050001673.db2.gz YODLMQADXGQRIP-YTQUADARSA-N 2 1 318.530 4.081 20 0 DIADMP c1ccc(C[NH+]2CCC3(CCC[N@H+](CCC4CC4)C3)CC2)cc1 ZINC001208686005 1050002308 /nfs/dbraw/zinc/00/23/08/1050002308.db2.gz GBWSQZCGQUQGEO-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP C[C@@H](C[N@H+]1CCC2(C1)CC[NH+](C)CC2)c1cccc2ccccc21 ZINC001208709289 1050004901 /nfs/dbraw/zinc/00/49/01/1050004901.db2.gz KYERYMIXUCBWAP-SFHVURJKSA-N 2 1 322.496 4.361 20 0 DIADMP C[N@@H+](Cc1ccccc1NC1=CC[NH+](C)CC1)C1CCCCC1 ZINC001208910420 1050022180 /nfs/dbraw/zinc/02/21/80/1050022180.db2.gz OZRAIIUKQXGZDU-UHFFFAOYSA-N 2 1 313.489 4.082 20 0 DIADMP C[NH+](Cc1ccccc1NC1=CC[N@H+](C)CC1)C1CCCCC1 ZINC001208910420 1050022185 /nfs/dbraw/zinc/02/21/85/1050022185.db2.gz OZRAIIUKQXGZDU-UHFFFAOYSA-N 2 1 313.489 4.082 20 0 DIADMP C[NH+](Cc1ccccc1NC1=CC[N@@H+](C)CC1)C1CCCCC1 ZINC001208910420 1050022189 /nfs/dbraw/zinc/02/21/89/1050022189.db2.gz OZRAIIUKQXGZDU-UHFFFAOYSA-N 2 1 313.489 4.082 20 0 DIADMP Cc1ccc(C[N@@H+](C)C[C@H]2CCC[NH+](Cc3ccccc3)C2)cc1 ZINC001208931641 1050025414 /nfs/dbraw/zinc/02/54/14/1050025414.db2.gz BTIPXKGABOVZQU-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC001208931641 1050025421 /nfs/dbraw/zinc/02/54/21/1050025421.db2.gz BTIPXKGABOVZQU-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001208931641 1050025426 /nfs/dbraw/zinc/02/54/26/1050025426.db2.gz BTIPXKGABOVZQU-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3C[C@@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208932098 1050025644 /nfs/dbraw/zinc/02/56/44/1050025644.db2.gz OESTVQSDXSONIJ-ACRUOGEOSA-N 2 1 312.501 4.021 20 0 DIADMP Cc1cccc2c1C[N@H+](C[C@H]1CCC[NH+](Cc3ccccc3)C1)C2 ZINC001208930676 1050025931 /nfs/dbraw/zinc/02/59/31/1050025931.db2.gz CKDQARRATBIUGF-FQEVSTJZSA-N 2 1 320.480 4.223 20 0 DIADMP Cc1cccc2c1C[N@@H+](C[C@H]1CCC[NH+](Cc3ccccc3)C1)C2 ZINC001208930676 1050025933 /nfs/dbraw/zinc/02/59/33/1050025933.db2.gz CKDQARRATBIUGF-FQEVSTJZSA-N 2 1 320.480 4.223 20 0 DIADMP Cc1cccc2c1C[NH+](C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001208930676 1050025937 /nfs/dbraw/zinc/02/59/37/1050025937.db2.gz CKDQARRATBIUGF-FQEVSTJZSA-N 2 1 320.480 4.223 20 0 DIADMP Cc1cccc2c1C[NH+](C[C@H]1CCC[N@@H+](Cc3ccccc3)C1)C2 ZINC001208930676 1050025941 /nfs/dbraw/zinc/02/59/41/1050025941.db2.gz CKDQARRATBIUGF-FQEVSTJZSA-N 2 1 320.480 4.223 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC[C@H]3c3ccccc3)C2)cc1 ZINC001208938726 1050027330 /nfs/dbraw/zinc/02/73/30/1050027330.db2.gz DLYMZZVQHMQBQO-UNMCSNQZSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CC[C@H]3c3ccccc3)C2)cc1 ZINC001208938726 1050027337 /nfs/dbraw/zinc/02/73/37/1050027337.db2.gz DLYMZZVQHMQBQO-UNMCSNQZSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CC[C@H]3c3ccccc3)C2)cc1 ZINC001208938726 1050027341 /nfs/dbraw/zinc/02/73/41/1050027341.db2.gz DLYMZZVQHMQBQO-UNMCSNQZSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC4(CCCC4)C3)C2)cc1 ZINC001208940360 1050027450 /nfs/dbraw/zinc/02/74/50/1050027450.db2.gz BWSBOFXCZZXLAA-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCCC4(CCCC4)C3)C2)cc1 ZINC001208940360 1050027455 /nfs/dbraw/zinc/02/74/55/1050027455.db2.gz BWSBOFXCZZXLAA-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCCC4(CCCC4)C3)C2)cc1 ZINC001208940360 1050027460 /nfs/dbraw/zinc/02/74/60/1050027460.db2.gz BWSBOFXCZZXLAA-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP CCC[N@H+](CC(C)C)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208942080 1050027498 /nfs/dbraw/zinc/02/74/98/1050027498.db2.gz FXOAKPIXYFPMEH-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[N@@H+](CC(C)C)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208942080 1050027503 /nfs/dbraw/zinc/02/75/03/1050027503.db2.gz FXOAKPIXYFPMEH-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[NH+](CC(C)C)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208942080 1050027509 /nfs/dbraw/zinc/02/75/09/1050027509.db2.gz FXOAKPIXYFPMEH-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[NH+](CC(C)C)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208942080 1050027515 /nfs/dbraw/zinc/02/75/15/1050027515.db2.gz FXOAKPIXYFPMEH-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP C[C@H]1C[N@@H+](C[C@@H]2CC[NH+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208940340 1050027997 /nfs/dbraw/zinc/02/79/97/1050027997.db2.gz BOEMXHYJNKKXSU-AZUAARDMSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1C[NH+](C[C@@H]2CC[N@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208940340 1050028001 /nfs/dbraw/zinc/02/80/01/1050028001.db2.gz BOEMXHYJNKKXSU-AZUAARDMSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1C[NH+](C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208940340 1050028007 /nfs/dbraw/zinc/02/80/07/1050028007.db2.gz BOEMXHYJNKKXSU-AZUAARDMSA-N 2 1 320.480 4.128 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCCC3)C2)cc1 ZINC001208939754 1050028094 /nfs/dbraw/zinc/02/80/94/1050028094.db2.gz IDWZEUSPCOSXRY-FQEVSTJZSA-N 2 1 300.490 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC[C@H]4CCC[C@H]4C3)C2)cc1 ZINC001208938161 1050028735 /nfs/dbraw/zinc/02/87/35/1050028735.db2.gz VIBFIHNOEMNUJX-HBMCJLEFSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CC[C@H]4CCC[C@H]4C3)C2)cc1 ZINC001208938161 1050028742 /nfs/dbraw/zinc/02/87/42/1050028742.db2.gz VIBFIHNOEMNUJX-HBMCJLEFSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CC[C@H]4CCC[C@H]4C3)C2)cc1 ZINC001208938161 1050028748 /nfs/dbraw/zinc/02/87/48/1050028748.db2.gz VIBFIHNOEMNUJX-HBMCJLEFSA-N 2 1 312.501 4.021 20 0 DIADMP CC[N@H+](Cc1ccc(C)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208951799 1050029271 /nfs/dbraw/zinc/02/92/71/1050029271.db2.gz BOAFFIKUTHRTMR-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccc(C)cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208951799 1050029276 /nfs/dbraw/zinc/02/92/76/1050029276.db2.gz BOAFFIKUTHRTMR-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccc(C)cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208951799 1050029281 /nfs/dbraw/zinc/02/92/81/1050029281.db2.gz BOAFFIKUTHRTMR-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP CC(C)(C)C1CC[NH+](C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208949460 1050029401 /nfs/dbraw/zinc/02/94/01/1050029401.db2.gz VTVUPNDLBJHJOU-LJQANCHMSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H]1c2ccccc2CC[N@@H+]1C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949924 1050030153 /nfs/dbraw/zinc/03/01/53/1050030153.db2.gz ZPWAFVWLGNWVMX-AZUAARDMSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1c2ccccc2CC[NH+]1C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949924 1050030159 /nfs/dbraw/zinc/03/01/59/1050030159.db2.gz ZPWAFVWLGNWVMX-AZUAARDMSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1c2ccccc2CC[NH+]1C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949924 1050030164 /nfs/dbraw/zinc/03/01/64/1050030164.db2.gz ZPWAFVWLGNWVMX-AZUAARDMSA-N 2 1 320.480 4.128 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949332 1050030680 /nfs/dbraw/zinc/03/06/80/1050030680.db2.gz LBCJGSRQGHSFGR-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H]1CCCC[NH+]1C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949332 1050030684 /nfs/dbraw/zinc/03/06/84/1050030684.db2.gz LBCJGSRQGHSFGR-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H]1CCCC[NH+]1C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949332 1050030689 /nfs/dbraw/zinc/03/06/89/1050030689.db2.gz LBCJGSRQGHSFGR-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1C[C@H]1C[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001209433880 1050058826 /nfs/dbraw/zinc/05/88/26/1050058826.db2.gz WGJZEEQLHWGJHI-ICSRJNTNSA-N 2 1 312.501 4.021 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)C2CC[NH+](CC3CC3)CC2)c1C ZINC001168395129 1050061245 /nfs/dbraw/zinc/06/12/45/1050061245.db2.gz MOAZPAGOZRGCBM-UHFFFAOYSA-N 2 1 312.501 4.142 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168395249 1050064306 /nfs/dbraw/zinc/06/43/06/1050064306.db2.gz SDFXYZMRPYNVBS-NRFANRHFSA-N 2 1 312.501 4.315 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc2cc[nH]c2c1 ZINC001209515660 1050065236 /nfs/dbraw/zinc/06/52/36/1050065236.db2.gz ZSCKVFGQDJPMLC-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc2cc[nH]c2c1 ZINC001209515660 1050065240 /nfs/dbraw/zinc/06/52/40/1050065240.db2.gz ZSCKVFGQDJPMLC-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc2cc[nH]c2c1 ZINC001209515660 1050065244 /nfs/dbraw/zinc/06/52/44/1050065244.db2.gz ZSCKVFGQDJPMLC-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+](C)CCCOc1ccc(Nc2cccc3cc[nH+]cc32)cc1 ZINC001210231990 1050170564 /nfs/dbraw/zinc/17/05/64/1050170564.db2.gz VFEIENYSNVYAOW-UHFFFAOYSA-N 2 1 321.424 4.309 20 0 DIADMP CC[N@H+](CCC1CC[NH+](C/C(Cl)=C/Cl)CC1)CC1CC1 ZINC000771474639 1050254922 /nfs/dbraw/zinc/25/49/22/1050254922.db2.gz ANPCODKLQDDIHQ-WJDWOHSUSA-N 2 1 319.320 4.139 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C/C(Cl)=C/Cl)CC1)CC1CC1 ZINC000771474639 1050254929 /nfs/dbraw/zinc/25/49/29/1050254929.db2.gz ANPCODKLQDDIHQ-WJDWOHSUSA-N 2 1 319.320 4.139 20 0 DIADMP C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)CC[NH2+]1 ZINC001210499277 1050268732 /nfs/dbraw/zinc/26/87/32/1050268732.db2.gz UOIDXHIRGIXUHR-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)CC[NH2+]1 ZINC001210499277 1050268746 /nfs/dbraw/zinc/26/87/46/1050268746.db2.gz UOIDXHIRGIXUHR-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3cccc(F)c23)CC1 ZINC001136988367 1050276391 /nfs/dbraw/zinc/27/63/91/1050276391.db2.gz DFFNSLQRAYOOSP-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP c1ccc(C[N@H+](CC[C@H]2CCC[NH2+]C2)C2CCCCC2)cc1 ZINC001210580152 1050303484 /nfs/dbraw/zinc/30/34/84/1050303484.db2.gz GFHHHVLXOXYDJR-GOSISDBHSA-N 2 1 300.490 4.211 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2c(C)cccc2F)cc1 ZINC000766216141 1050465425 /nfs/dbraw/zinc/46/54/25/1050465425.db2.gz LMNTXRZHLCEEIR-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)CC1CC[NH+](C)CC1 ZINC000738312704 1050529992 /nfs/dbraw/zinc/52/99/92/1050529992.db2.gz VDUZJPBVMFQNTA-UHFFFAOYSA-N 2 1 322.452 4.360 20 0 DIADMP CC(C)CCC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001170072196 1050588414 /nfs/dbraw/zinc/58/84/14/1050588414.db2.gz YMVHEIFFDUBUOS-MRXNPFEDSA-N 2 1 306.469 4.290 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(-c2ccccc2)cn1 ZINC000845941151 1050637238 /nfs/dbraw/zinc/63/72/38/1050637238.db2.gz CSKXNQJTMCATGP-DBVUQKKJSA-N 2 1 323.484 4.272 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3(C)CCC3)C2)s1 ZINC001170085519 1050696778 /nfs/dbraw/zinc/69/67/78/1050696778.db2.gz JSBUZHCWGDFAAB-INIZCTEOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3(C)CCC3)C2)s1 ZINC001170085519 1050696785 /nfs/dbraw/zinc/69/67/85/1050696785.db2.gz JSBUZHCWGDFAAB-INIZCTEOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3(C)CCC3)C2)s1 ZINC001170085519 1050696790 /nfs/dbraw/zinc/69/67/90/1050696790.db2.gz JSBUZHCWGDFAAB-INIZCTEOSA-N 2 1 306.519 4.000 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000788761339 1050740359 /nfs/dbraw/zinc/74/03/59/1050740359.db2.gz YXYQNNZKZSSGRY-VHBXLISGSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1cccc(N([C@H](C)CCCC(C)C)C2CC[NH2+]CC2)[nH+]1 ZINC001170089769 1050755845 /nfs/dbraw/zinc/75/58/45/1050755845.db2.gz DMFKKFDFRVRJOR-QGZVFWFLSA-N 2 1 303.494 4.163 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc(C)c(OC)c(Cl)c2)CC1 ZINC000796678137 1050823692 /nfs/dbraw/zinc/82/36/92/1050823692.db2.gz YNQZTSJZPRHOAT-AWEZNQCLSA-N 2 1 324.896 4.182 20 0 DIADMP Cc1csc2sc(C[N@H+](C)CCC[NH+]3CCCC3)c(C)c12 ZINC001231831920 1050837319 /nfs/dbraw/zinc/83/73/19/1050837319.db2.gz FSVFFNSNQSIYJZ-UHFFFAOYSA-N 2 1 322.543 4.497 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)CCC[NH+]3CCCC3)c(C)c12 ZINC001231831920 1050837335 /nfs/dbraw/zinc/83/73/35/1050837335.db2.gz FSVFFNSNQSIYJZ-UHFFFAOYSA-N 2 1 322.543 4.497 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170117313 1050877662 /nfs/dbraw/zinc/87/76/62/1050877662.db2.gz JXAQKQVZSXRWDJ-AXUOBQJMSA-N 2 1 304.453 4.086 20 0 DIADMP Cc1ccc(C[N@H+]([C@@H]2CC[C@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001170119444 1050880997 /nfs/dbraw/zinc/88/09/97/1050880997.db2.gz ASFPUHJHIKSHAB-FRYIKTPZSA-N 2 1 300.490 4.256 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000790498892 1050965454 /nfs/dbraw/zinc/96/54/54/1050965454.db2.gz VHPBDAMARYXCQA-LDNXJKPSSA-N 2 1 312.501 4.128 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[C@H]3[N@@H+](C)Cc3ccco3)CC2)C1 ZINC001170139430 1050968755 /nfs/dbraw/zinc/96/87/55/1050968755.db2.gz UXLIAXUPLUIQQD-ZHALLVOQSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[C@@H]3[N@@H+](C)Cc3ccco3)CC2)C1 ZINC001170139427 1050968871 /nfs/dbraw/zinc/96/88/71/1050968871.db2.gz UXLIAXUPLUIQQD-AOIWGVFYSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[C@@H]3[N@@H+](C)Cc3ccco3)CC2)C1 ZINC001170139429 1050969342 /nfs/dbraw/zinc/96/93/42/1050969342.db2.gz UXLIAXUPLUIQQD-LMMKCTJWSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001170151287 1051038589 /nfs/dbraw/zinc/03/85/89/1051038589.db2.gz QLOUWWXWBLNKMA-XLIONFOSSA-N 2 1 300.490 4.019 20 0 DIADMP CCOc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000773074735 1051050792 /nfs/dbraw/zinc/05/07/92/1051050792.db2.gz HNKPMQUZXQRXDM-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001170265784 1051167365 /nfs/dbraw/zinc/16/73/65/1051167365.db2.gz JPNGNDOMBMIJIG-HZPDHXFCSA-N 2 1 308.897 4.112 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC001170250189 1051171778 /nfs/dbraw/zinc/17/17/78/1051171778.db2.gz HDONSUKWHNXTLB-JKSUJKDBSA-N 2 1 308.897 4.125 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1cncc(Cl)c1 ZINC001171628615 1051171921 /nfs/dbraw/zinc/17/19/21/1051171921.db2.gz CVNLAVFYWMEHSJ-GFCCVEGCSA-N 2 1 309.885 4.037 20 0 DIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@H+](C(C)C)C[C@@H]2C)cc1 ZINC001171666545 1051189882 /nfs/dbraw/zinc/18/98/82/1051189882.db2.gz ZFFYKCDHKQUKQT-CMKODMSKSA-N 2 1 302.506 4.025 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171638204 1051194510 /nfs/dbraw/zinc/19/45/10/1051194510.db2.gz WTMXPQHTGUYJBY-UHFFFAOYSA-N 2 1 308.897 4.423 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+]2Cc3cccc(Cl)c3C2)CC1(C)C ZINC001171643521 1051197951 /nfs/dbraw/zinc/19/79/51/1051197951.db2.gz WLGBGMQKSVMIIA-UHFFFAOYSA-N 2 1 306.881 4.307 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2Cc3cccc(Cl)c3C2)CC1(C)C ZINC001171643521 1051197960 /nfs/dbraw/zinc/19/79/60/1051197960.db2.gz WLGBGMQKSVMIIA-UHFFFAOYSA-N 2 1 306.881 4.307 20 0 DIADMP CC1(C)C[C@@H]([NH2+]Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001171965057 1051247988 /nfs/dbraw/zinc/24/79/88/1051247988.db2.gz NVMXUPBVQPXTCY-FQEVSTJZSA-N 2 1 308.469 4.219 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@H]2CC[C@@H](F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171966646 1051248792 /nfs/dbraw/zinc/24/87/92/1051248792.db2.gz VYFWSYVNIPPPSV-OTWHNJEPSA-N 2 1 318.480 4.300 20 0 DIADMP CC(C)(C)C(=[NH2+])N[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964685 1051249289 /nfs/dbraw/zinc/24/92/89/1051249289.db2.gz MFINSEYJLUACRC-MRXNPFEDSA-N 2 1 301.478 4.043 20 0 DIADMP CC[C@@H]1CC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989289 1051256711 /nfs/dbraw/zinc/25/67/11/1051256711.db2.gz CGMITFODQMXBCY-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989289 1051256722 /nfs/dbraw/zinc/25/67/22/1051256722.db2.gz CGMITFODQMXBCY-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989289 1051256733 /nfs/dbraw/zinc/25/67/33/1051256733.db2.gz CGMITFODQMXBCY-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989289 1051256743 /nfs/dbraw/zinc/25/67/43/1051256743.db2.gz CGMITFODQMXBCY-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C(C)(C)C ZINC001171970098 1051262128 /nfs/dbraw/zinc/26/21/28/1051262128.db2.gz YKERNCIOOVYOSJ-WMZOPIPTSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975419 1051263798 /nfs/dbraw/zinc/26/37/98/1051263798.db2.gz CTTYJRDRLRHVBS-MJGOQNOKSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975419 1051263806 /nfs/dbraw/zinc/26/38/06/1051263806.db2.gz CTTYJRDRLRHVBS-MJGOQNOKSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975419 1051263813 /nfs/dbraw/zinc/26/38/13/1051263813.db2.gz CTTYJRDRLRHVBS-MJGOQNOKSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975419 1051263820 /nfs/dbraw/zinc/26/38/20/1051263820.db2.gz CTTYJRDRLRHVBS-MJGOQNOKSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976049 1051264311 /nfs/dbraw/zinc/26/43/11/1051264311.db2.gz HURXBSTZPMCCIN-QUCCMNQESA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976049 1051264322 /nfs/dbraw/zinc/26/43/22/1051264322.db2.gz HURXBSTZPMCCIN-QUCCMNQESA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976049 1051264332 /nfs/dbraw/zinc/26/43/32/1051264332.db2.gz HURXBSTZPMCCIN-QUCCMNQESA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976049 1051264340 /nfs/dbraw/zinc/26/43/40/1051264340.db2.gz HURXBSTZPMCCIN-QUCCMNQESA-N 2 1 318.480 4.254 20 0 DIADMP C[C@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976345 1051266194 /nfs/dbraw/zinc/26/61/94/1051266194.db2.gz KEPOPQUBXSUUFD-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976345 1051266206 /nfs/dbraw/zinc/26/62/06/1051266206.db2.gz KEPOPQUBXSUUFD-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976345 1051266220 /nfs/dbraw/zinc/26/62/20/1051266220.db2.gz KEPOPQUBXSUUFD-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976345 1051266230 /nfs/dbraw/zinc/26/62/30/1051266230.db2.gz KEPOPQUBXSUUFD-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@]1(CF)CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978007 1051268212 /nfs/dbraw/zinc/26/82/12/1051268212.db2.gz VQUVWKHEDGEYQG-UYAOXDASSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@]1(CF)CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978007 1051268225 /nfs/dbraw/zinc/26/82/25/1051268225.db2.gz VQUVWKHEDGEYQG-UYAOXDASSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@]1(CF)CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978007 1051268234 /nfs/dbraw/zinc/26/82/34/1051268234.db2.gz VQUVWKHEDGEYQG-UYAOXDASSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980120 1051268655 /nfs/dbraw/zinc/26/86/55/1051268655.db2.gz SMTRHKPVDBRZPY-KVPLUYHFSA-N 2 1 314.517 4.454 20 0 DIADMP C[N@@H+](CCC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171988098 1051270784 /nfs/dbraw/zinc/27/07/84/1051270784.db2.gz ORDYTANYVWGUSG-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CCC1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171988098 1051270791 /nfs/dbraw/zinc/27/07/91/1051270791.db2.gz ORDYTANYVWGUSG-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CCC1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171988098 1051270798 /nfs/dbraw/zinc/27/07/98/1051270798.db2.gz ORDYTANYVWGUSG-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)C2 ZINC001172101103 1051278197 /nfs/dbraw/zinc/27/81/97/1051278197.db2.gz WFKOUECUEDCOIK-WKCHPHFGSA-N 2 1 320.480 4.381 20 0 DIADMP CC[C@@H]1CCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076097 1051278839 /nfs/dbraw/zinc/27/88/39/1051278839.db2.gz VGKCQFNVDVSBOI-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076097 1051278848 /nfs/dbraw/zinc/27/88/48/1051278848.db2.gz VGKCQFNVDVSBOI-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076097 1051278853 /nfs/dbraw/zinc/27/88/53/1051278853.db2.gz VGKCQFNVDVSBOI-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076097 1051278863 /nfs/dbraw/zinc/27/88/63/1051278863.db2.gz VGKCQFNVDVSBOI-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)C2 ZINC001172100246 1051283908 /nfs/dbraw/zinc/28/39/08/1051283908.db2.gz BZWOMPGCRMVPII-BTTYYORXSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)C2 ZINC001172100246 1051283917 /nfs/dbraw/zinc/28/39/17/1051283917.db2.gz BZWOMPGCRMVPII-BTTYYORXSA-N 2 1 313.272 4.098 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2C=CCCC2)C3)cc1 ZINC001172067583 1051284601 /nfs/dbraw/zinc/28/46/01/1051284601.db2.gz HDNGEYXAYZXGNQ-NCYKPQTJSA-N 2 1 310.485 4.270 20 0 DIADMP CC[C@@H](C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067758 1051285007 /nfs/dbraw/zinc/28/50/07/1051285007.db2.gz NQNGWZULUXCUFY-RSPOEFSDSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2C[C@@H]4CC[C@H]2C4)C3)cc1 ZINC001172066640 1051285546 /nfs/dbraw/zinc/28/55/46/1051285546.db2.gz CEZHFQJYKKMABZ-BGJURXJTSA-N 2 1 324.512 4.350 20 0 DIADMP CC1(C)CCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172067747 1051286232 /nfs/dbraw/zinc/28/62/32/1051286232.db2.gz FKQSHIPJJQWRFP-ACDBMABISA-N 2 1 312.501 4.447 20 0 DIADMP CC1(C)CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172067747 1051286239 /nfs/dbraw/zinc/28/62/39/1051286239.db2.gz FKQSHIPJJQWRFP-ACDBMABISA-N 2 1 312.501 4.447 20 0 DIADMP CC1(C)CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172067747 1051286248 /nfs/dbraw/zinc/28/62/48/1051286248.db2.gz FKQSHIPJJQWRFP-ACDBMABISA-N 2 1 312.501 4.447 20 0 DIADMP CC1(C)CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067747 1051286256 /nfs/dbraw/zinc/28/62/56/1051286256.db2.gz FKQSHIPJJQWRFP-ACDBMABISA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H](C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067750 1051286680 /nfs/dbraw/zinc/28/66/80/1051286680.db2.gz NQNGWZULUXCUFY-FFGOWVMKSA-N 2 1 300.490 4.208 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(C)(c3ccccc3)CC1)C2 ZINC001172127746 1051288108 /nfs/dbraw/zinc/28/81/08/1051288108.db2.gz KCUVTCNUIOMMCS-ACDBMABISA-N 2 1 312.501 4.055 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(C)(c3ccccc3)CC1)C2 ZINC001172127746 1051288114 /nfs/dbraw/zinc/28/81/14/1051288114.db2.gz KCUVTCNUIOMMCS-ACDBMABISA-N 2 1 312.501 4.055 20 0 DIADMP C[C@@H]1C[C@@H](F)C[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070064 1051288386 /nfs/dbraw/zinc/28/83/86/1051288386.db2.gz WLIVRYIJUBRUMN-XLSIIYIISA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@@H](F)C[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070064 1051288399 /nfs/dbraw/zinc/28/83/99/1051288399.db2.gz WLIVRYIJUBRUMN-XLSIIYIISA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@@H](F)C[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070064 1051288409 /nfs/dbraw/zinc/28/84/09/1051288409.db2.gz WLIVRYIJUBRUMN-XLSIIYIISA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@@H](F)C[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070064 1051288425 /nfs/dbraw/zinc/28/84/25/1051288425.db2.gz WLIVRYIJUBRUMN-XLSIIYIISA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129083 1051289117 /nfs/dbraw/zinc/28/91/17/1051289117.db2.gz WAOIOAKTFPBMCQ-RUGDWHBFSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129083 1051289127 /nfs/dbraw/zinc/28/91/27/1051289127.db2.gz WAOIOAKTFPBMCQ-RUGDWHBFSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172129083 1051289137 /nfs/dbraw/zinc/28/91/37/1051289137.db2.gz WAOIOAKTFPBMCQ-RUGDWHBFSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172129083 1051289150 /nfs/dbraw/zinc/28/91/50/1051289150.db2.gz WAOIOAKTFPBMCQ-RUGDWHBFSA-N 2 1 306.881 4.348 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127403 1051290712 /nfs/dbraw/zinc/29/07/12/1051290712.db2.gz JCTMLUKOXOIJDU-MXEMCNAFSA-N 2 1 312.501 4.271 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127403 1051290719 /nfs/dbraw/zinc/29/07/19/1051290719.db2.gz JCTMLUKOXOIJDU-MXEMCNAFSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127403 1051290730 /nfs/dbraw/zinc/29/07/30/1051290730.db2.gz JCTMLUKOXOIJDU-MXEMCNAFSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127403 1051290740 /nfs/dbraw/zinc/29/07/40/1051290740.db2.gz JCTMLUKOXOIJDU-MXEMCNAFSA-N 2 1 312.501 4.271 20 0 DIADMP CC[N@H+](Cc1cccc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129963 1051291254 /nfs/dbraw/zinc/29/12/54/1051291254.db2.gz MOTHFSNSQQCFLG-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129963 1051291267 /nfs/dbraw/zinc/29/12/67/1051291267.db2.gz MOTHFSNSQQCFLG-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1cccc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172129963 1051291276 /nfs/dbraw/zinc/29/12/76/1051291276.db2.gz MOTHFSNSQQCFLG-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1cccc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172129963 1051291285 /nfs/dbraw/zinc/29/12/85/1051291285.db2.gz MOTHFSNSQQCFLG-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129085 1051291875 /nfs/dbraw/zinc/29/18/75/1051291875.db2.gz WAOIOAKTFPBMCQ-VIBAHUMZSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129085 1051291889 /nfs/dbraw/zinc/29/18/89/1051291889.db2.gz WAOIOAKTFPBMCQ-VIBAHUMZSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172129085 1051291900 /nfs/dbraw/zinc/29/19/00/1051291900.db2.gz WAOIOAKTFPBMCQ-VIBAHUMZSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172129085 1051291915 /nfs/dbraw/zinc/29/19/15/1051291915.db2.gz WAOIOAKTFPBMCQ-VIBAHUMZSA-N 2 1 306.881 4.348 20 0 DIADMP Cc1cccc(C[NH+](C2CC2)[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1C ZINC001172134617 1051293765 /nfs/dbraw/zinc/29/37/65/1051293765.db2.gz YIDMSGNXCFHQTK-AERCQKQUSA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[NH+](C2CC2)[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1C ZINC001172134617 1051293780 /nfs/dbraw/zinc/29/37/80/1051293780.db2.gz YIDMSGNXCFHQTK-AERCQKQUSA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[N@H+](C2CC2)[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1C ZINC001172134617 1051293791 /nfs/dbraw/zinc/29/37/91/1051293791.db2.gz YIDMSGNXCFHQTK-AERCQKQUSA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1C ZINC001172134617 1051293805 /nfs/dbraw/zinc/29/38/05/1051293805.db2.gz YIDMSGNXCFHQTK-AERCQKQUSA-N 2 1 312.501 4.283 20 0 DIADMP CC[N@H+](Cc1ccc(C)c(C)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131965 1051294519 /nfs/dbraw/zinc/29/45/19/1051294519.db2.gz ZVDBSIJRBQFVFF-ACDBMABISA-N 2 1 300.490 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131965 1051294528 /nfs/dbraw/zinc/29/45/28/1051294528.db2.gz ZVDBSIJRBQFVFF-ACDBMABISA-N 2 1 300.490 4.141 20 0 DIADMP CC[NH+](Cc1ccc(C)c(C)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131965 1051294538 /nfs/dbraw/zinc/29/45/38/1051294538.db2.gz ZVDBSIJRBQFVFF-ACDBMABISA-N 2 1 300.490 4.141 20 0 DIADMP CC[NH+](Cc1ccc(C)c(C)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131965 1051294553 /nfs/dbraw/zinc/29/45/53/1051294553.db2.gz ZVDBSIJRBQFVFF-ACDBMABISA-N 2 1 300.490 4.141 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1c3ccccc3-c3ccccc31)C2 ZINC001172108386 1051295126 /nfs/dbraw/zinc/29/51/26/1051295126.db2.gz VWUWEEBUGDSDKN-BJWYYQGGSA-N 2 1 318.464 4.361 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104762 1051297678 /nfs/dbraw/zinc/29/76/78/1051297678.db2.gz CRCPVDJAYMXLFZ-FCGDIQPGSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104762 1051297690 /nfs/dbraw/zinc/29/76/90/1051297690.db2.gz CRCPVDJAYMXLFZ-FCGDIQPGSA-N 2 1 304.453 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc3sccc3c1)C2 ZINC001172104541 1051297841 /nfs/dbraw/zinc/29/78/41/1051297841.db2.gz CNBDYZNCSGIGGD-BJWYYQGGSA-N 2 1 300.471 4.006 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1c(F)cccc1Cl ZINC001172107565 1051298492 /nfs/dbraw/zinc/29/84/92/1051298492.db2.gz FNYLAZMFGVFOOI-XDQVBPFNSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1c(F)cccc1Cl ZINC001172107565 1051298502 /nfs/dbraw/zinc/29/85/02/1051298502.db2.gz FNYLAZMFGVFOOI-XDQVBPFNSA-N 2 1 310.844 4.145 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C)c1 ZINC001172110417 1051299791 /nfs/dbraw/zinc/29/97/91/1051299791.db2.gz MNXUOHVGIYQRIV-YSTOQKLRSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1 ZINC001172110417 1051299801 /nfs/dbraw/zinc/29/98/01/1051299801.db2.gz MNXUOHVGIYQRIV-YSTOQKLRSA-N 2 1 300.490 4.441 20 0 DIADMP Cc1ccccc1CC(C)(C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172111274 1051300432 /nfs/dbraw/zinc/30/04/32/1051300432.db2.gz PKSJSIWIBIDQGL-ACDBMABISA-N 2 1 314.517 4.169 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(C)cc(C)c1 ZINC001172111188 1051301799 /nfs/dbraw/zinc/30/17/99/1051301799.db2.gz TVXDAVBELMIYOJ-YRPNKDGESA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(C)cc(C)c1 ZINC001172111188 1051301807 /nfs/dbraw/zinc/30/18/07/1051301807.db2.gz TVXDAVBELMIYOJ-YRPNKDGESA-N 2 1 300.490 4.359 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001172109097 1051301838 /nfs/dbraw/zinc/30/18/38/1051301838.db2.gz AXSQBOFKUXUCPN-FCMAGTKHSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001172109097 1051301845 /nfs/dbraw/zinc/30/18/45/1051301845.db2.gz AXSQBOFKUXUCPN-FCMAGTKHSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccccc3Cl)CCC1)C2 ZINC001172113487 1051302284 /nfs/dbraw/zinc/30/22/84/1051302284.db2.gz HSSMCEITQRNESG-PHZGNYQRSA-N 2 1 318.892 4.324 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccccc1F)C1CCC1)C2 ZINC001172111039 1051302836 /nfs/dbraw/zinc/30/28/36/1051302836.db2.gz PVVXJHLIUGLWRD-LJCCNALRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccccc1F)C1CCC1)C2 ZINC001172111039 1051302847 /nfs/dbraw/zinc/30/28/47/1051302847.db2.gz PVVXJHLIUGLWRD-LJCCNALRSA-N 2 1 316.464 4.272 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1Cl ZINC001172115865 1051305723 /nfs/dbraw/zinc/30/57/23/1051305723.db2.gz FTGBRGIFWRJVSZ-LLLHUVSDSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1Cl ZINC001172115865 1051305732 /nfs/dbraw/zinc/30/57/32/1051305732.db2.gz FTGBRGIFWRJVSZ-LLLHUVSDSA-N 2 1 306.881 4.314 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001172121766 1051307316 /nfs/dbraw/zinc/30/73/16/1051307316.db2.gz MGGAPLGWWWAIRE-FCGDIQPGSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001172121766 1051307328 /nfs/dbraw/zinc/30/73/28/1051307328.db2.gz MGGAPLGWWWAIRE-FCGDIQPGSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001172121766 1051307338 /nfs/dbraw/zinc/30/73/38/1051307338.db2.gz MGGAPLGWWWAIRE-FCGDIQPGSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@]13C[C@H]4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172119004 1051307431 /nfs/dbraw/zinc/30/74/31/1051307431.db2.gz UTICVJWMLHPHHA-ALVHGOEWSA-N 2 1 316.533 4.340 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@]13C[C@H]4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172119004 1051307436 /nfs/dbraw/zinc/30/74/36/1051307436.db2.gz UTICVJWMLHPHHA-ALVHGOEWSA-N 2 1 316.533 4.340 20 0 DIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334468 1051359314 /nfs/dbraw/zinc/35/93/14/1051359314.db2.gz MLOMUUMUZUBSHP-PIKOESSRSA-N 2 1 324.553 4.342 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000380907862 1051366867 /nfs/dbraw/zinc/36/68/67/1051366867.db2.gz IJWOTXLIDKEBCM-HKUYNNGSSA-N 2 1 312.457 4.151 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000380907862 1051366877 /nfs/dbraw/zinc/36/68/77/1051366877.db2.gz IJWOTXLIDKEBCM-HKUYNNGSSA-N 2 1 312.457 4.151 20 0 DIADMP CC[C@H](CC(C)C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172405858 1051381473 /nfs/dbraw/zinc/38/14/73/1051381473.db2.gz DBAQARAFFFBUJC-LJQANCHMSA-N 2 1 302.506 4.408 20 0 DIADMP CC[C@H](CC(C)C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172392315 1051394730 /nfs/dbraw/zinc/39/47/30/1051394730.db2.gz CRUNKFSTRWWIHQ-QGZVFWFLSA-N 2 1 308.897 4.415 20 0 DIADMP CC[C@@H](CC(C)C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172398034 1051398954 /nfs/dbraw/zinc/39/89/54/1051398954.db2.gz DXFBNOGLCCSARP-IBGZPJMESA-N 2 1 302.506 4.455 20 0 DIADMP CC(C)OCC[C@@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437862 1051405908 /nfs/dbraw/zinc/40/59/08/1051405908.db2.gz WYCLJQQYZYVCJG-ZHALLVOQSA-N 2 1 310.526 4.095 20 0 DIADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001170452454 1051416055 /nfs/dbraw/zinc/41/60/55/1051416055.db2.gz YPUGOLCJICFMMT-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001170452454 1051416059 /nfs/dbraw/zinc/41/60/59/1051416059.db2.gz YPUGOLCJICFMMT-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001170452454 1051416067 /nfs/dbraw/zinc/41/60/67/1051416067.db2.gz YPUGOLCJICFMMT-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001172550012 1051433278 /nfs/dbraw/zinc/43/32/78/1051433278.db2.gz AWEPJAXKUADXRO-DFQSSKMNSA-N 2 1 300.490 4.177 20 0 DIADMP CC[NH+]1CCC([N@H+](C)[C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172552045 1051434349 /nfs/dbraw/zinc/43/43/49/1051434349.db2.gz KCHMZHLQMSTYBP-UYAOXDASSA-N 2 1 300.490 4.129 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)[C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172552045 1051434357 /nfs/dbraw/zinc/43/43/57/1051434357.db2.gz KCHMZHLQMSTYBP-UYAOXDASSA-N 2 1 300.490 4.129 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172534850 1051449718 /nfs/dbraw/zinc/44/97/18/1051449718.db2.gz AXSQBOFKUXUCPN-XNTOXWQXSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172534850 1051449726 /nfs/dbraw/zinc/44/97/26/1051449726.db2.gz AXSQBOFKUXUCPN-XNTOXWQXSA-N 2 1 312.501 4.318 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172546956 1051457273 /nfs/dbraw/zinc/45/72/73/1051457273.db2.gz SWLXRLQXTNNHKD-CWJKEVGVSA-N 2 1 314.517 4.421 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172546955 1051457293 /nfs/dbraw/zinc/45/72/93/1051457293.db2.gz SWLXRLQXTNNHKD-AYWYSENESA-N 2 1 314.517 4.421 20 0 DIADMP CC[C@H]1CC[C@H](C2CCC(n3c[nH+]cc3CC[NH3+])CC2)CC1 ZINC001172589550 1051465139 /nfs/dbraw/zinc/46/51/39/1051465139.db2.gz ZQRLGJVCFVJXHY-MJYONLJCSA-N 2 1 303.494 4.332 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1C1CC(C)(C)OC(C)(C)C1 ZINC001172659138 1051474146 /nfs/dbraw/zinc/47/41/46/1051474146.db2.gz NIORLHQAGUEZGE-IRXDYDNUSA-N 2 1 322.537 4.061 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1C1CC(C)(C)OC(C)(C)C1 ZINC001172659138 1051474154 /nfs/dbraw/zinc/47/41/54/1051474154.db2.gz NIORLHQAGUEZGE-IRXDYDNUSA-N 2 1 322.537 4.061 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1C1CC(C)(C)OC(C)(C)C1 ZINC001172659138 1051474159 /nfs/dbraw/zinc/47/41/59/1051474159.db2.gz NIORLHQAGUEZGE-IRXDYDNUSA-N 2 1 322.537 4.061 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001169061495 1051502016 /nfs/dbraw/zinc/50/20/16/1051502016.db2.gz LLFIZTRCUMGSMZ-MXEMCNAFSA-N 2 1 314.517 4.249 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001169061495 1051502029 /nfs/dbraw/zinc/50/20/29/1051502029.db2.gz LLFIZTRCUMGSMZ-MXEMCNAFSA-N 2 1 314.517 4.249 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001169061497 1051503021 /nfs/dbraw/zinc/50/30/21/1051503021.db2.gz LLFIZTRCUMGSMZ-XSDIEEQYSA-N 2 1 314.517 4.249 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001169061497 1051503033 /nfs/dbraw/zinc/50/30/33/1051503033.db2.gz LLFIZTRCUMGSMZ-XSDIEEQYSA-N 2 1 314.517 4.249 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCCCCCCCCCCCO)C2 ZINC001169102247 1051511313 /nfs/dbraw/zinc/51/13/13/1051511313.db2.gz YGOGLFLCQFUSGN-ACDBMABISA-N 2 1 324.553 4.095 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(Cl)cc(Cl)c1 ZINC001169101481 1051512034 /nfs/dbraw/zinc/51/20/34/1051512034.db2.gz SQAPFDRKIXSPSS-BLQKSXIESA-N 2 1 313.272 4.269 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(-c3ccsc3)cc1)C2 ZINC001169100522 1051512358 /nfs/dbraw/zinc/51/23/58/1051512358.db2.gz KJPVKZOVSBGPFF-REPLKXPHSA-N 2 1 312.482 4.130 20 0 DIADMP CC[NH+]1CCC([N@H+](C)[C@H](Cc2ccccc2)CC(C)C)CC1 ZINC001169081679 1051514382 /nfs/dbraw/zinc/51/43/82/1051514382.db2.gz ZREHZVMGYDMLNF-FQEVSTJZSA-N 2 1 302.506 4.060 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)[C@H](Cc2ccccc2)CC(C)C)CC1 ZINC001169081679 1051514390 /nfs/dbraw/zinc/51/43/90/1051514390.db2.gz ZREHZVMGYDMLNF-FQEVSTJZSA-N 2 1 302.506 4.060 20 0 DIADMP CC[NH+]1CCC([N@H+](C)[C@@H](Cc2ccccc2)CC(C)C)CC1 ZINC001169081680 1051515656 /nfs/dbraw/zinc/51/56/56/1051515656.db2.gz ZREHZVMGYDMLNF-HXUWFJFHSA-N 2 1 302.506 4.060 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)[C@@H](Cc2ccccc2)CC(C)C)CC1 ZINC001169081680 1051515664 /nfs/dbraw/zinc/51/56/64/1051515664.db2.gz ZREHZVMGYDMLNF-HXUWFJFHSA-N 2 1 302.506 4.060 20 0 DIADMP CC[N@@H+](C)C1CC[NH+]([C@@H](Cc2ccccc2)CC(C)C)CC1 ZINC001169086214 1051516238 /nfs/dbraw/zinc/51/62/38/1051516238.db2.gz RPPQAQQBBBBCRD-HXUWFJFHSA-N 2 1 302.506 4.060 20 0 DIADMP CC[N@@H+](C)C1CC[NH+]([C@H](Cc2ccccc2)CC(C)C)CC1 ZINC001169086213 1051517098 /nfs/dbraw/zinc/51/70/98/1051517098.db2.gz RPPQAQQBBBBCRD-FQEVSTJZSA-N 2 1 302.506 4.060 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001169085548 1051517439 /nfs/dbraw/zinc/51/74/39/1051517439.db2.gz OMDPZTNCRHXBAV-IBGZPJMESA-N 2 1 311.473 4.180 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](NCc1ccccc1Oc1ccccc1)C2 ZINC001169089344 1051519485 /nfs/dbraw/zinc/51/94/85/1051519485.db2.gz BWTCUXCIUAJHAT-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccccc1Oc1ccccc1)C2 ZINC001169089344 1051519497 /nfs/dbraw/zinc/51/94/97/1051519497.db2.gz BWTCUXCIUAJHAT-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccccc1Oc1ccccc1)C2 ZINC001169089344 1051519506 /nfs/dbraw/zinc/51/95/06/1051519506.db2.gz BWTCUXCIUAJHAT-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1CN[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169090703 1051520399 /nfs/dbraw/zinc/52/03/99/1051520399.db2.gz LLQIBZCQMQUABC-ZSOGYDGISA-N 2 1 313.272 4.017 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124435 1051522434 /nfs/dbraw/zinc/52/24/34/1051522434.db2.gz CMXFUBPQDYQQMF-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124435 1051522447 /nfs/dbraw/zinc/52/24/47/1051522447.db2.gz CMXFUBPQDYQQMF-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124435 1051522455 /nfs/dbraw/zinc/52/24/55/1051522455.db2.gz CMXFUBPQDYQQMF-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+](Cc1ccccc1)C1CCCCC1)C2 ZINC001169124435 1051522468 /nfs/dbraw/zinc/52/24/68/1051522468.db2.gz CMXFUBPQDYQQMF-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001169140122 1051527297 /nfs/dbraw/zinc/52/72/97/1051527297.db2.gz HNACMMNRAXQYQL-MHORFTMASA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001169140122 1051527303 /nfs/dbraw/zinc/52/73/03/1051527303.db2.gz HNACMMNRAXQYQL-MHORFTMASA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001169140122 1051527310 /nfs/dbraw/zinc/52/73/10/1051527310.db2.gz HNACMMNRAXQYQL-MHORFTMASA-N 2 1 304.865 4.102 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155536 1051537353 /nfs/dbraw/zinc/53/73/53/1051537353.db2.gz QMUGCZMNKIXGGG-OQIJWPOYSA-N 2 1 308.469 4.458 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169155536 1051537359 /nfs/dbraw/zinc/53/73/59/1051537359.db2.gz QMUGCZMNKIXGGG-OQIJWPOYSA-N 2 1 308.469 4.458 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169155536 1051537369 /nfs/dbraw/zinc/53/73/69/1051537369.db2.gz QMUGCZMNKIXGGG-OQIJWPOYSA-N 2 1 308.469 4.458 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155649 1051538727 /nfs/dbraw/zinc/53/87/27/1051538727.db2.gz UDCOQLOMXPTCAR-KYHPRHEASA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169155649 1051538740 /nfs/dbraw/zinc/53/87/40/1051538740.db2.gz UDCOQLOMXPTCAR-KYHPRHEASA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169155649 1051538752 /nfs/dbraw/zinc/53/87/52/1051538752.db2.gz UDCOQLOMXPTCAR-KYHPRHEASA-N 2 1 316.514 4.171 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172861919 1051546937 /nfs/dbraw/zinc/54/69/37/1051546937.db2.gz XFSVPRKKKBEITC-YYQUZTFQSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172861919 1051546948 /nfs/dbraw/zinc/54/69/48/1051546948.db2.gz XFSVPRKKKBEITC-YYQUZTFQSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001172874703 1051558832 /nfs/dbraw/zinc/55/88/32/1051558832.db2.gz HYZVQOYGKZCRQI-HNKHHVNMSA-N 2 1 324.921 4.035 20 0 DIADMP CC[NH+]1CCC([N@@H+]2CCCC[C@H]2c2ccc(C)c(C)c2)CC1 ZINC001169261895 1051560428 /nfs/dbraw/zinc/56/04/28/1051560428.db2.gz QKRLYJNXSDSBGK-FQEVSTJZSA-N 2 1 300.490 4.315 20 0 DIADMP CC[NH+]1CCC([N@H+]2CCCC[C@H]2c2ccc(C)c(C)c2)CC1 ZINC001169261895 1051560432 /nfs/dbraw/zinc/56/04/32/1051560432.db2.gz QKRLYJNXSDSBGK-FQEVSTJZSA-N 2 1 300.490 4.315 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234320 1051563625 /nfs/dbraw/zinc/56/36/25/1051563625.db2.gz NULAEJDPPSRDSH-GJZGRUSLSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234320 1051563635 /nfs/dbraw/zinc/56/36/35/1051563635.db2.gz NULAEJDPPSRDSH-GJZGRUSLSA-N 2 1 320.527 4.372 20 0 DIADMP Cc1cn2cc(Nc3ccc(C4CC[NH+](C)CC4)cc3)ccc2[nH+]1 ZINC001212688904 1051563835 /nfs/dbraw/zinc/56/38/35/1051563835.db2.gz BHIUYODWASMEOU-UHFFFAOYSA-N 2 1 320.440 4.196 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001172882734 1051566342 /nfs/dbraw/zinc/56/63/42/1051566342.db2.gz PMOSLYSWFKTWFQ-GRTSSRMGSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccsc1 ZINC000178335760 1051567814 /nfs/dbraw/zinc/56/78/14/1051567814.db2.gz NHQSHZHBRNWUIL-GJYPPUQNSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccsc1 ZINC000178335760 1051567826 /nfs/dbraw/zinc/56/78/26/1051567826.db2.gz NHQSHZHBRNWUIL-GJYPPUQNSA-N 2 1 314.498 4.452 20 0 DIADMP CO[C@@H]1CCC[C@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928446 1051574327 /nfs/dbraw/zinc/57/43/27/1051574327.db2.gz LDBAEWCSSDBUTD-LWYYNNOASA-N 2 1 322.537 4.096 20 0 DIADMP Cc1ccc(C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1C ZINC001170469334 1051586520 /nfs/dbraw/zinc/58/65/20/1051586520.db2.gz NWZVRCGDPMIZBC-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](c3cccc(F)c3)C2)CC1 ZINC001173115198 1051611648 /nfs/dbraw/zinc/61/16/48/1051611648.db2.gz YSMKNKKVQFALGS-KKXNLOMOSA-N 2 1 318.480 4.268 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2cccc(F)c2F)CC1 ZINC001173112741 1051611952 /nfs/dbraw/zinc/61/19/52/1051611952.db2.gz CPLDRGSAWLHOIP-UHFFFAOYSA-N 2 1 324.459 4.440 20 0 DIADMP CCCC[N@H+](CC)CC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173194760 1051627065 /nfs/dbraw/zinc/62/70/65/1051627065.db2.gz FFRGPYDMCGDZGS-UHFFFAOYSA-N 2 1 318.505 4.088 20 0 DIADMP CCCC[N@@H+](CC)CC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173194760 1051627072 /nfs/dbraw/zinc/62/70/72/1051627072.db2.gz FFRGPYDMCGDZGS-UHFFFAOYSA-N 2 1 318.505 4.088 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293173 1051675682 /nfs/dbraw/zinc/67/56/82/1051675682.db2.gz JZCRHGJIFWHCQY-DYESRHJHSA-N 2 1 312.501 4.088 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293173 1051675686 /nfs/dbraw/zinc/67/56/86/1051675686.db2.gz JZCRHGJIFWHCQY-DYESRHJHSA-N 2 1 312.501 4.088 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001173296124 1051678125 /nfs/dbraw/zinc/67/81/25/1051678125.db2.gz SHTAGCZPPRCKBH-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001173296124 1051678133 /nfs/dbraw/zinc/67/81/33/1051678133.db2.gz SHTAGCZPPRCKBH-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001173296124 1051678140 /nfs/dbraw/zinc/67/81/40/1051678140.db2.gz SHTAGCZPPRCKBH-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP CCSC[C@@H](C)[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173299209 1051680414 /nfs/dbraw/zinc/68/04/14/1051680414.db2.gz SMZCNZUNDNGHCL-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001173276392 1051683949 /nfs/dbraw/zinc/68/39/49/1051683949.db2.gz QHEJVBIMSCVSEI-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183199190 1051710673 /nfs/dbraw/zinc/71/06/73/1051710673.db2.gz DBGUYVRWXDPYDN-SQWLQELKSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183190408 1051711171 /nfs/dbraw/zinc/71/11/71/1051711171.db2.gz QBMKSMAFRZWAQU-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183190408 1051711185 /nfs/dbraw/zinc/71/11/85/1051711185.db2.gz QBMKSMAFRZWAQU-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP CC[C@H]1CC[C@@H]1Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000806158011 1051760962 /nfs/dbraw/zinc/76/09/62/1051760962.db2.gz VJXQVJQSBWJAEQ-PXNSSMCTSA-N 2 1 315.505 4.065 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c(C)o1 ZINC000767364614 1051796229 /nfs/dbraw/zinc/79/62/29/1051796229.db2.gz SIUGRENZCOPNPD-UHFFFAOYSA-N 2 1 304.478 4.031 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)CCC2CC2)CC1 ZINC000186341979 1051811184 /nfs/dbraw/zinc/81/11/84/1051811184.db2.gz DNMGDQFTAHNEED-DLBZAZTESA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cscc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000494495254 1051904422 /nfs/dbraw/zinc/90/44/22/1051904422.db2.gz MVBVNIHJBOCKMS-KXBFYZLASA-N 2 1 314.498 4.057 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CC(C(F)F)C2)cc1 ZINC000768680299 1051948433 /nfs/dbraw/zinc/94/84/33/1051948433.db2.gz XSGDKTDUUSYYED-RWBZWWBESA-N 2 1 322.443 4.194 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccccc1)CC1CC[NH+](C)CC1 ZINC000769330606 1052025788 /nfs/dbraw/zinc/02/57/88/1052025788.db2.gz POYJBWWNBKHTAE-UHFFFAOYSA-N 2 1 308.469 4.127 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CCN1C ZINC000769484132 1052051973 /nfs/dbraw/zinc/05/19/73/1052051973.db2.gz DLCCGGUJSKHLIA-FXAWDEMLSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@@H+]1C ZINC000769484132 1052051985 /nfs/dbraw/zinc/05/19/85/1052051985.db2.gz DLCCGGUJSKHLIA-FXAWDEMLSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@H+]1C ZINC000769484132 1052051998 /nfs/dbraw/zinc/05/19/98/1052051998.db2.gz DLCCGGUJSKHLIA-FXAWDEMLSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484132 1052052006 /nfs/dbraw/zinc/05/20/06/1052052006.db2.gz DLCCGGUJSKHLIA-FXAWDEMLSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484132 1052052015 /nfs/dbraw/zinc/05/20/15/1052052015.db2.gz DLCCGGUJSKHLIA-FXAWDEMLSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CCN1C ZINC000769484135 1052052781 /nfs/dbraw/zinc/05/27/81/1052052781.db2.gz DLCCGGUJSKHLIA-YLJYHZDGSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@@H+]1C ZINC000769484135 1052052792 /nfs/dbraw/zinc/05/27/92/1052052792.db2.gz DLCCGGUJSKHLIA-YLJYHZDGSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@H+]1C ZINC000769484135 1052052806 /nfs/dbraw/zinc/05/28/06/1052052806.db2.gz DLCCGGUJSKHLIA-YLJYHZDGSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484135 1052052814 /nfs/dbraw/zinc/05/28/14/1052052814.db2.gz DLCCGGUJSKHLIA-YLJYHZDGSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484135 1052052829 /nfs/dbraw/zinc/05/28/29/1052052829.db2.gz DLCCGGUJSKHLIA-YLJYHZDGSA-N 2 1 308.469 4.268 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)cc1 ZINC001204141500 1052157198 /nfs/dbraw/zinc/15/71/98/1052157198.db2.gz UTNKZOPVAWYSNH-ROUUACIJSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001204141500 1052157204 /nfs/dbraw/zinc/15/72/04/1052157204.db2.gz UTNKZOPVAWYSNH-ROUUACIJSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001204141500 1052157205 /nfs/dbraw/zinc/15/72/05/1052157205.db2.gz UTNKZOPVAWYSNH-ROUUACIJSA-N 2 1 318.530 4.247 20 0 DIADMP CCCCC[C@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218224237 1052210009 /nfs/dbraw/zinc/21/00/09/1052210009.db2.gz STWDGPDBBNILLY-IBGZPJMESA-N 2 1 318.505 4.347 20 0 DIADMP CCC(CC)[C@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218296817 1052218895 /nfs/dbraw/zinc/21/88/95/1052218895.db2.gz QGASSJRFNCHFRY-FQEVSTJZSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccc([C@@H](C)Oc2ccc(C[NH+]3CCC([NH3+])CC3)cc2)cc1 ZINC001218344043 1052228126 /nfs/dbraw/zinc/22/81/26/1052228126.db2.gz OOUIRRLHSVKSIL-QGZVFWFLSA-N 2 1 324.468 4.058 20 0 DIADMP CCCC[C@@H](CCC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218355988 1052231178 /nfs/dbraw/zinc/23/11/78/1052231178.db2.gz ZDDSBUSEDPULJN-LJQANCHMSA-N 2 1 318.505 4.347 20 0 DIADMP CCC[C@@H](C)[C@@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218439804 1052240350 /nfs/dbraw/zinc/24/03/50/1052240350.db2.gz WSYFMXXNIULCML-VQIMIIECSA-N 2 1 318.505 4.203 20 0 DIADMP CC1(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000309787668 1052245349 /nfs/dbraw/zinc/24/53/49/1052245349.db2.gz NQUKNBZGESCIAN-LJQANCHMSA-N 2 1 300.490 4.069 20 0 DIADMP Cc1cc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)cc(C)[nH+]1 ZINC000310273570 1052262262 /nfs/dbraw/zinc/26/22/62/1052262262.db2.gz UGMSKGIKUMIMOT-HLAWJBBLSA-N 2 1 321.468 4.021 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001168492426 1052407586 /nfs/dbraw/zinc/40/75/86/1052407586.db2.gz RLPPFISNMUMMIE-PXNSSMCTSA-N 2 1 318.480 4.097 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000236820815 1052432060 /nfs/dbraw/zinc/43/20/60/1052432060.db2.gz KYQCWSWDRIDGHB-ZDUSSCGKSA-N 2 1 314.395 4.229 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237120083 1052436290 /nfs/dbraw/zinc/43/62/90/1052436290.db2.gz XFRPXLOPYGHBFL-ROUUACIJSA-N 2 1 302.506 4.108 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237355705 1052438913 /nfs/dbraw/zinc/43/89/13/1052438913.db2.gz WZNHLERIISTUMI-IBGZPJMESA-N 2 1 322.496 4.180 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)c2)cs1 ZINC001222155201 1052453115 /nfs/dbraw/zinc/45/31/15/1052453115.db2.gz XQADFQKTOYQFRO-KRWDZBQOSA-N 2 1 318.511 4.052 20 0 DIADMP COc1ccc(CNCCC[N@@H+](C)C2CCCCC2)cc1Cl ZINC000315841863 1052453430 /nfs/dbraw/zinc/45/34/30/1052453430.db2.gz CQSVOPPBUYOIKR-UHFFFAOYSA-N 2 1 324.896 4.093 20 0 DIADMP COc1ccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1Cl ZINC000315841863 1052453431 /nfs/dbraw/zinc/45/34/31/1052453431.db2.gz CQSVOPPBUYOIKR-UHFFFAOYSA-N 2 1 324.896 4.093 20 0 DIADMP COc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1Cl ZINC000315841863 1052453433 /nfs/dbraw/zinc/45/34/33/1052453433.db2.gz CQSVOPPBUYOIKR-UHFFFAOYSA-N 2 1 324.896 4.093 20 0 DIADMP c1ccc(C(C[N@H+]2CCC[C@@]23CCC[NH2+]C3)c2ccccc2)cc1 ZINC001222230880 1052465270 /nfs/dbraw/zinc/46/52/70/1052465270.db2.gz FXOSOCWACNCOHF-JOCHJYFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222242145 1052467986 /nfs/dbraw/zinc/46/79/86/1052467986.db2.gz BNKMXUYECAEFCW-OAQYLSRUSA-N 2 1 320.436 4.304 20 0 DIADMP c1cc(-c2cccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]C4)c2)cs1 ZINC001222249594 1052468888 /nfs/dbraw/zinc/46/88/88/1052468888.db2.gz URUFBGKCXIMCRX-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP c1cc(-c2cccc(C[N@H+]3CCC[C@@]34CCC[NH2+]C4)c2)cs1 ZINC001222249594 1052468895 /nfs/dbraw/zinc/46/88/95/1052468895.db2.gz URUFBGKCXIMCRX-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CCC[C@]34CCC[NH2+]C4)cc2)c1 ZINC001222249835 1052469080 /nfs/dbraw/zinc/46/90/80/1052469080.db2.gz WYROGTFZLPTMIY-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]C4)cc2)c1 ZINC001222249835 1052469086 /nfs/dbraw/zinc/46/90/86/1052469086.db2.gz WYROGTFZLPTMIY-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222259469 1052470168 /nfs/dbraw/zinc/47/01/68/1052470168.db2.gz QPJDKLSQOILEOD-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222259469 1052470172 /nfs/dbraw/zinc/47/01/72/1052470172.db2.gz QPJDKLSQOILEOD-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]C3)C2)s1 ZINC001222265048 1052470843 /nfs/dbraw/zinc/47/08/43/1052470843.db2.gz MOZAGWUWUNWRHZ-SFHVURJKSA-N 2 1 306.519 4.056 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CCC[NH2+]C4)C3)cc2)o1 ZINC001222271604 1052471801 /nfs/dbraw/zinc/47/18/01/1052471801.db2.gz IFGDAEZHBATVSD-OAQYLSRUSA-N 2 1 324.468 4.221 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000316789447 1052472679 /nfs/dbraw/zinc/47/26/79/1052472679.db2.gz NPCSNVZUARPIFW-AEGPPILISA-N 2 1 321.534 4.026 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000316789447 1052472685 /nfs/dbraw/zinc/47/26/85/1052472685.db2.gz NPCSNVZUARPIFW-AEGPPILISA-N 2 1 321.534 4.026 20 0 DIADMP c1sc2ccccc2c1C[NH+]1CCC2(CCCC[NH2+]2)CC1 ZINC001222293560 1052474706 /nfs/dbraw/zinc/47/47/06/1052474706.db2.gz XFCIEVGDWKWRQO-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222308043 1052479107 /nfs/dbraw/zinc/47/91/07/1052479107.db2.gz FWPHIYGDYGVNRJ-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP Fc1ccc([C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000393391068 1052481243 /nfs/dbraw/zinc/48/12/43/1052481243.db2.gz CFAVITVRYUMNNI-PWRODBHTSA-N 2 1 324.443 4.132 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320533 1052481750 /nfs/dbraw/zinc/48/17/50/1052481750.db2.gz JEPMTRLLBCLGLM-QGZVFWFLSA-N 2 1 324.921 4.170 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[NH+]1CC2(C1)CCC[NH2+]C2 ZINC001222335367 1052485880 /nfs/dbraw/zinc/48/58/80/1052485880.db2.gz JBIVHIMGZZZVKP-UHFFFAOYSA-N 2 1 322.477 4.240 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222355706 1052489606 /nfs/dbraw/zinc/48/96/06/1052489606.db2.gz UAAXSUFIPIJLDA-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222355706 1052489608 /nfs/dbraw/zinc/48/96/08/1052489608.db2.gz UAAXSUFIPIJLDA-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP c1ccc(C([NH2+]CCC[NH+]2CCCCC2)c2ccccc2)cc1 ZINC000320353773 1052504324 /nfs/dbraw/zinc/50/43/24/1052504324.db2.gz QIENUPBSPARYPU-UHFFFAOYSA-N 2 1 308.469 4.242 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@@H]1CC1(C)C ZINC000397602567 1052530380 /nfs/dbraw/zinc/53/03/80/1052530380.db2.gz ALOWXFALOIXGGM-JFRXWTBNSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)[C@@H]1CC1(C)C ZINC000397602567 1052530384 /nfs/dbraw/zinc/53/03/84/1052530384.db2.gz ALOWXFALOIXGGM-JFRXWTBNSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)C(C)(C)C ZINC000670270443 1052548393 /nfs/dbraw/zinc/54/83/93/1052548393.db2.gz GDYNBGCEPBHGKT-OAHLLOKOSA-N 2 1 303.494 4.081 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C/C=C\c1ccccc1 ZINC000398007160 1052561964 /nfs/dbraw/zinc/56/19/64/1052561964.db2.gz ZSOFFMWZFURAKI-QATSVWFZSA-N 2 1 320.480 4.200 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000037649031 1052628340 /nfs/dbraw/zinc/62/83/40/1052628340.db2.gz DDAQXDZMMXAYPU-NWDGAFQWSA-N 2 1 313.272 4.128 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(F)cc(F)c2)c1 ZINC000123949430 1052636528 /nfs/dbraw/zinc/63/65/28/1052636528.db2.gz QMTCZORGCYVNQY-CQSZACIVSA-N 2 1 318.411 4.267 20 0 DIADMP c1ccc(C[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000124357146 1052639747 /nfs/dbraw/zinc/63/97/47/1052639747.db2.gz DKAOWVSEUOXQAC-KNQAVFIVSA-N 2 1 320.480 4.044 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)o1 ZINC000125188769 1052646022 /nfs/dbraw/zinc/64/60/22/1052646022.db2.gz WNQQIDAUMYKLMZ-SJORKVTESA-N 2 1 312.457 4.464 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000125773673 1052653594 /nfs/dbraw/zinc/65/35/94/1052653594.db2.gz GDSJLRYJLJBNGX-GOEBONIOSA-N 2 1 323.550 4.346 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1F ZINC000125810265 1052655141 /nfs/dbraw/zinc/65/51/41/1052655141.db2.gz JRZIHEWPSXLLLB-LSDHHAIUSA-N 2 1 324.509 4.319 20 0 DIADMP c1ccc(-c2ccccc2C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000917395406 1052723934 /nfs/dbraw/zinc/72/39/34/1052723934.db2.gz MVNLZAANGPUTGH-VQTJNVASSA-N 2 1 306.453 4.070 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2cc3c(s2)CCCC3)CC1 ZINC000129348188 1052784096 /nfs/dbraw/zinc/78/40/96/1052784096.db2.gz UXEQESHHRGLSNQ-AWEZNQCLSA-N 2 1 306.519 4.150 20 0 DIADMP CCc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556093985 1052797774 /nfs/dbraw/zinc/79/77/74/1052797774.db2.gz NXIUUKJEKACCDQ-FGZHOGPDSA-N 2 1 322.496 4.217 20 0 DIADMP CCc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556093985 1052797778 /nfs/dbraw/zinc/79/77/78/1052797778.db2.gz NXIUUKJEKACCDQ-FGZHOGPDSA-N 2 1 322.496 4.217 20 0 DIADMP C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129625121 1052798511 /nfs/dbraw/zinc/79/85/11/1052798511.db2.gz NMYBCUXBSCIRSZ-GVXVVHGQSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@H]1CCN(C)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129625121 1052798514 /nfs/dbraw/zinc/79/85/14/1052798514.db2.gz NMYBCUXBSCIRSZ-GVXVVHGQSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1C ZINC000322011440 1052800561 /nfs/dbraw/zinc/80/05/61/1052800561.db2.gz PEZJHDLBBUKSOD-OPYAIIAOSA-N 2 1 314.517 4.108 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000556177555 1052816367 /nfs/dbraw/zinc/81/63/67/1052816367.db2.gz BHYHFKCMRUMCRO-RTWAWAEBSA-N 2 1 320.480 4.187 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000556177555 1052816370 /nfs/dbraw/zinc/81/63/70/1052816370.db2.gz BHYHFKCMRUMCRO-RTWAWAEBSA-N 2 1 320.480 4.187 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C[C@H]1C ZINC000556172738 1052816517 /nfs/dbraw/zinc/81/65/17/1052816517.db2.gz VXCQDYHPGGLEHZ-SCQOQHIRSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C[C@H]1C ZINC000556172738 1052816521 /nfs/dbraw/zinc/81/65/21/1052816521.db2.gz VXCQDYHPGGLEHZ-SCQOQHIRSA-N 2 1 300.490 4.236 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(C(C)(F)F)cc2)CC1 ZINC000556218395 1052823214 /nfs/dbraw/zinc/82/32/14/1052823214.db2.gz SURSYCZYTMVUDP-UHFFFAOYSA-N 2 1 310.432 4.151 20 0 DIADMP CC(C)C[C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000556260130 1052828498 /nfs/dbraw/zinc/82/84/98/1052828498.db2.gz CWAQKZAZPHBKAM-QHGAOEGBSA-N 2 1 302.506 4.454 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000322361542 1052882095 /nfs/dbraw/zinc/88/20/95/1052882095.db2.gz HDFQHXQGBYOWBF-UYAOXDASSA-N 2 1 300.490 4.067 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000322361539 1052882114 /nfs/dbraw/zinc/88/21/14/1052882114.db2.gz HDFQHXQGBYOWBF-AZUAARDMSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)(C)C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000556884968 1052892918 /nfs/dbraw/zinc/89/29/18/1052892918.db2.gz SBUYYAULGODJDA-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000518946909 1053105421 /nfs/dbraw/zinc/10/54/21/1053105421.db2.gz AAVZKRKQAHQMJJ-LWASTNQWSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000518946909 1053105425 /nfs/dbraw/zinc/10/54/25/1053105425.db2.gz AAVZKRKQAHQMJJ-LWASTNQWSA-N 2 1 300.490 4.236 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187325 1053224782 /nfs/dbraw/zinc/22/47/82/1053224782.db2.gz MEVDWFYHSSNVIT-WMLDXEAASA-N 2 1 324.896 4.121 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187325 1053224792 /nfs/dbraw/zinc/22/47/92/1053224792.db2.gz MEVDWFYHSSNVIT-WMLDXEAASA-N 2 1 324.896 4.121 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC001319192155 1053227484 /nfs/dbraw/zinc/22/74/84/1053227484.db2.gz JHMVAZGRDBBMRR-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000090585302 1053237177 /nfs/dbraw/zinc/23/71/77/1053237177.db2.gz SCZWJOGMKIZNSL-HOCLYGCPSA-N 2 1 323.550 4.033 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccccn1 ZINC000090586170 1053237472 /nfs/dbraw/zinc/23/74/72/1053237472.db2.gz CCSSGXPPWSOLKS-ICSRJNTNSA-N 2 1 317.521 4.126 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccn1 ZINC000090586170 1053237485 /nfs/dbraw/zinc/23/74/85/1053237485.db2.gz CCSSGXPPWSOLKS-ICSRJNTNSA-N 2 1 317.521 4.126 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000091266434 1053257646 /nfs/dbraw/zinc/25/76/46/1053257646.db2.gz FWKOAHDESJQEJP-INIZCTEOSA-N 2 1 315.288 4.374 20 0 DIADMP C[NH+]1CCC([NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091266431 1053259477 /nfs/dbraw/zinc/25/94/77/1053259477.db2.gz YWORZWIHNUVAAA-INIZCTEOSA-N 2 1 313.272 4.128 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](c2ccccc2)C2CC2)c1 ZINC000091333125 1053261562 /nfs/dbraw/zinc/26/15/62/1053261562.db2.gz LFMIGLLLWVPZRC-OAQYLSRUSA-N 2 1 308.469 4.379 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC001319908215 1053285374 /nfs/dbraw/zinc/28/53/74/1053285374.db2.gz WUUOGNWRJGFTDE-GOSISDBHSA-N 2 1 308.469 4.098 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC001319908215 1053285382 /nfs/dbraw/zinc/28/53/82/1053285382.db2.gz WUUOGNWRJGFTDE-GOSISDBHSA-N 2 1 308.469 4.098 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001474744495 1053295869 /nfs/dbraw/zinc/29/58/69/1053295869.db2.gz IJAFCJTYGXJVJO-FFZBTMFNSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1CCC[N@H+]1CC1CCCCC1 ZINC001200105893 1053386030 /nfs/dbraw/zinc/38/60/30/1053386030.db2.gz PMCNAEOSIOXWTN-BHIYHBOVSA-N 2 1 306.538 4.445 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(C)c1 ZINC001200255896 1053502126 /nfs/dbraw/zinc/50/21/26/1053502126.db2.gz RCDGSJDADHNVGW-AQDCRGGLSA-N 2 1 314.517 4.335 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183196072 1053601352 /nfs/dbraw/zinc/60/13/52/1053601352.db2.gz ZUZYJKPMQYYOEH-OWCLPIDISA-N 2 1 312.567 4.149 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270905 1053724335 /nfs/dbraw/zinc/72/43/35/1053724335.db2.gz QCFVFHQCTSVAMT-IMJJTQAJSA-N 2 1 314.395 4.000 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270905 1053724345 /nfs/dbraw/zinc/72/43/45/1053724345.db2.gz QCFVFHQCTSVAMT-IMJJTQAJSA-N 2 1 314.395 4.000 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270900 1053725016 /nfs/dbraw/zinc/72/50/16/1053725016.db2.gz QCFVFHQCTSVAMT-BPUTZDHNSA-N 2 1 314.395 4.000 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270900 1053725027 /nfs/dbraw/zinc/72/50/27/1053725027.db2.gz QCFVFHQCTSVAMT-BPUTZDHNSA-N 2 1 314.395 4.000 20 0 DIADMP Clc1cc(Cl)cc(C[NH2+]C2CC[NH+](C3CCC3)CC2)c1 ZINC000620758018 1053728140 /nfs/dbraw/zinc/72/81/40/1053728140.db2.gz RWMUBBPHDNUGEX-UHFFFAOYSA-N 2 1 313.272 4.100 20 0 DIADMP Cc1cc(C)c(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1C ZINC001231484391 1053763837 /nfs/dbraw/zinc/76/38/37/1053763837.db2.gz MWQICKSBTRAWHP-UHFFFAOYSA-N 2 1 302.506 4.164 20 0 DIADMP c1ccc(-c2cccc(C[NH+]3CCC([NH+]4CCC4)CC3)c2)cc1 ZINC001231511968 1053775498 /nfs/dbraw/zinc/77/54/98/1053775498.db2.gz IBFWDZJPXSZMOP-UHFFFAOYSA-N 2 1 306.453 4.024 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1c(Cl)cccc1Cl ZINC000155939733 1053792013 /nfs/dbraw/zinc/79/20/13/1053792013.db2.gz PZEXKYFBWYRAJJ-FRRDWIJNSA-N 2 1 315.288 4.169 20 0 DIADMP Cc1ccc(-c2ccc(CN3CCC([N@@H+](C)C4CC4)CC3)cc2)o1 ZINC001231599431 1053798460 /nfs/dbraw/zinc/79/84/60/1053798460.db2.gz IOCLMXFQTOLOIX-UHFFFAOYSA-N 2 1 324.468 4.314 20 0 DIADMP Fc1ccc(-c2ccccc2C[NH+]2CCC([NH+]3CCC3)CC2)cc1 ZINC001231827364 1053883150 /nfs/dbraw/zinc/88/31/50/1053883150.db2.gz QALKEJSDLFKVSJ-UHFFFAOYSA-N 2 1 324.443 4.163 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000158195179 1053894117 /nfs/dbraw/zinc/89/41/17/1053894117.db2.gz IFDGEIBFGBIVMD-HOTGVXAUSA-N 2 1 306.519 4.180 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2ccccc2C(C)C)CC1 ZINC001231876417 1053903497 /nfs/dbraw/zinc/90/34/97/1053903497.db2.gz XMPBZBBJNHQNBW-UHFFFAOYSA-N 2 1 323.484 4.252 20 0 DIADMP Clc1ccc([C@H]2CC[N@@H+](Cc3cc4c[nH+]ccc4[nH]3)C2)cc1 ZINC001232016203 1053943349 /nfs/dbraw/zinc/94/33/49/1053943349.db2.gz URTIKUXDPBPFMC-AWEZNQCLSA-N 2 1 311.816 4.206 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CCC(N3CCC3)CC2)cc1 ZINC001232080121 1053955761 /nfs/dbraw/zinc/95/57/61/1053955761.db2.gz AOIHIEMRGZOBEZ-UHFFFAOYSA-N 2 1 300.490 4.044 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC001232150555 1053970995 /nfs/dbraw/zinc/97/09/95/1053970995.db2.gz ZDXYEVUJHGDLSL-UHFFFAOYSA-N 2 1 312.432 4.052 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+](C)Cc2ccccc2Cl)c1 ZINC001232146873 1053972406 /nfs/dbraw/zinc/97/24/06/1053972406.db2.gz IUVHKGIYBNYWKT-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+](C)Cc2ccccc2Cl)c1 ZINC001232146873 1053972415 /nfs/dbraw/zinc/97/24/15/1053972415.db2.gz IUVHKGIYBNYWKT-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC001232145784 1053973248 /nfs/dbraw/zinc/97/32/48/1053973248.db2.gz ASNYIUQLXOEOGF-HXUWFJFHSA-N 2 1 312.432 4.224 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC1 ZINC000159318104 1054036933 /nfs/dbraw/zinc/03/69/33/1054036933.db2.gz IUTVSHUYCMXDOJ-NSHDSACASA-N 2 1 301.261 4.128 20 0 DIADMP CS[C@@H]1CC[C@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001200855331 1054042861 /nfs/dbraw/zinc/04/28/61/1054042861.db2.gz YJVLJKYSXICNQQ-ZWKOTPCHSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000290287194 1054047239 /nfs/dbraw/zinc/04/72/39/1054047239.db2.gz XRCQPCCQJWGXCP-AZUAARDMSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000290287205 1054047661 /nfs/dbraw/zinc/04/76/61/1054047661.db2.gz XRCQPCCQJWGXCP-UYAOXDASSA-N 2 1 323.484 4.035 20 0 DIADMP COc1ccc2cc([C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)ccc2c1 ZINC000296028048 1054084706 /nfs/dbraw/zinc/08/47/06/1054084706.db2.gz SNGPNYVSUGSXRA-PHHCVGHBSA-N 2 1 324.468 4.124 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421703 1054154458 /nfs/dbraw/zinc/15/44/58/1054154458.db2.gz MCLQHKDJEJGSKE-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421703 1054154466 /nfs/dbraw/zinc/15/44/66/1054154466.db2.gz MCLQHKDJEJGSKE-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCCC(F)(F)F)CC1)CC1CC1 ZINC001333611625 1054162404 /nfs/dbraw/zinc/16/24/04/1054162404.db2.gz JMLPDFVYDOJMRO-UHFFFAOYSA-N 2 1 320.443 4.163 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]CCCC(F)(F)F)CC1 ZINC001333723396 1054168810 /nfs/dbraw/zinc/16/88/10/1054168810.db2.gz GRQNHHKTVHAWBX-AWEZNQCLSA-N 2 1 314.395 4.144 20 0 DIADMP CC[C@@H](C)c1ccc(NC(=[NH2+])NCCCC[N@@H+](C)C2CC2)cc1 ZINC000849039843 1054353066 /nfs/dbraw/zinc/35/30/66/1054353066.db2.gz UJFKLCGRISMJJY-OAHLLOKOSA-N 2 1 316.493 4.011 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cs1 ZINC000172341612 1054423841 /nfs/dbraw/zinc/42/38/41/1054423841.db2.gz DLNUWASDOCNLFQ-CQSZACIVSA-N 2 1 317.502 4.179 20 0 DIADMP C[NH2+][C@@H](C)CC[NH2+][C@H](C)c1ccc2ccccc2c1OC(F)F ZINC001345481486 1054496425 /nfs/dbraw/zinc/49/64/25/1054496425.db2.gz CSIXJUZWOQGHAE-QWHCGFSZSA-N 2 1 322.399 4.090 20 0 DIADMP CC[NH+](CC)[C@H](CNC(=[NH2+])Nc1ccccc1C)c1ccccc1 ZINC001346588332 1054541554 /nfs/dbraw/zinc/54/15/54/1054541554.db2.gz FNIICPIPYXLKKI-LJQANCHMSA-N 2 1 324.472 4.014 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000192677582 1054567151 /nfs/dbraw/zinc/56/71/51/1054567151.db2.gz KIYRADFZZIVLDR-YLJYHZDGSA-N 2 1 315.505 4.035 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)CC1(C)C ZINC000623512596 1054609162 /nfs/dbraw/zinc/60/91/62/1054609162.db2.gz NVVWTDUUECVTFQ-KLHKWILBSA-N 2 1 324.871 4.130 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCCc2ccc(Cl)s2)CC1(C)C ZINC000623516861 1054612316 /nfs/dbraw/zinc/61/23/16/1054612316.db2.gz ITXOTXHXNYOFMM-CYBMUJFWSA-N 2 1 314.926 4.187 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cccc2ccccc21 ZINC000177295302 1054616789 /nfs/dbraw/zinc/61/67/89/1054616789.db2.gz UQAQHYLJTDDMFJ-JKSUJKDBSA-N 2 1 307.441 4.332 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1 ZINC000177295354 1054617320 /nfs/dbraw/zinc/61/73/20/1054617320.db2.gz MRNYBBQLNUMOLL-CVEARBPZSA-N 2 1 307.441 4.332 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc2ccccc2c1 ZINC000177295373 1054618215 /nfs/dbraw/zinc/61/82/15/1054618215.db2.gz MRNYBBQLNUMOLL-JKSUJKDBSA-N 2 1 307.441 4.332 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cccc2ccccc21 ZINC000177370400 1054620649 /nfs/dbraw/zinc/62/06/49/1054620649.db2.gz UCMSBZNGMOZBOG-MRXNPFEDSA-N 2 1 307.441 4.476 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001234994814 1054638190 /nfs/dbraw/zinc/63/81/90/1054638190.db2.gz WGLFYNIMSVCIIZ-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001234994814 1054638197 /nfs/dbraw/zinc/63/81/97/1054638197.db2.gz WGLFYNIMSVCIIZ-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001234994364 1054638596 /nfs/dbraw/zinc/63/85/96/1054638596.db2.gz SHPCKCDJHGGUSR-OAQYLSRUSA-N 2 1 320.436 4.162 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001234997324 1054640677 /nfs/dbraw/zinc/64/06/77/1054640677.db2.gz AXOADVLLBRQAJP-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)cccc1-c1ccccc1 ZINC001235002884 1054641200 /nfs/dbraw/zinc/64/12/00/1054641200.db2.gz YHCXHFBGJUDHPE-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)s1 ZINC001235036697 1054643169 /nfs/dbraw/zinc/64/31/69/1054643169.db2.gz AWHKCEIAFHJITL-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@]4(CC[NH2+]C4)C3)cc12 ZINC001235033029 1054644049 /nfs/dbraw/zinc/64/40/49/1054644049.db2.gz NXGPFZDYYMBSKM-FQEVSTJZSA-N 2 1 322.477 4.240 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)cc2)cc1 ZINC001235040693 1054645840 /nfs/dbraw/zinc/64/58/40/1054645840.db2.gz MYJNNSAQWHVCIN-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c1 ZINC001235046297 1054646522 /nfs/dbraw/zinc/64/65/22/1054646522.db2.gz PCJVLEAATOUBPW-HXUWFJFHSA-N 2 1 300.490 4.092 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235041715 1054646794 /nfs/dbraw/zinc/64/67/94/1054646794.db2.gz RWVPATXWLUXCQV-QUCCMNQESA-N 2 1 324.553 4.216 20 0 DIADMP Fc1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c2ccccc12 ZINC001235048556 1054647157 /nfs/dbraw/zinc/64/71/57/1054647157.db2.gz YPTPANFSCIDVAH-HXUWFJFHSA-N 2 1 312.432 4.087 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001235040496 1054647640 /nfs/dbraw/zinc/64/76/40/1054647640.db2.gz KZSAIDDECNCIIY-YTQUADARSA-N 2 1 318.892 4.052 20 0 DIADMP C[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1ccoc1 ZINC000178489091 1054652482 /nfs/dbraw/zinc/65/24/82/1054652482.db2.gz MCDXQJCUKWWSNN-ULQDDVLXSA-N 2 1 312.457 4.087 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)s2)c1 ZINC001235093799 1054653005 /nfs/dbraw/zinc/65/30/05/1054653005.db2.gz SWCURVCPBCRRQR-UHFFFAOYSA-N 2 1 318.511 4.052 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)cc12 ZINC001235092293 1054654075 /nfs/dbraw/zinc/65/40/75/1054654075.db2.gz HETSOFHGIDOUCI-UHFFFAOYSA-N 2 1 320.436 4.162 20 0 DIADMP CC(C)=CCC[C@@H](C)CC[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001235086147 1054654201 /nfs/dbraw/zinc/65/42/01/1054654201.db2.gz AFERTYJIZNMXMY-SJORKVTESA-N 2 1 314.464 4.080 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001235091959 1054654627 /nfs/dbraw/zinc/65/46/27/1054654627.db2.gz GDQBPGJBFLXQDS-SFHVURJKSA-N 2 1 314.517 4.064 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2CCC23CC[NH2+]CC3)c1 ZINC001235104664 1054657194 /nfs/dbraw/zinc/65/71/94/1054657194.db2.gz WBDISRVFQGNVEC-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CCC23CC[NH2+]CC3)c1 ZINC001235104664 1054657199 /nfs/dbraw/zinc/65/71/99/1054657199.db2.gz WBDISRVFQGNVEC-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP C[C@@H](C[N@@H+]1CCCC[C@@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120422 1054661884 /nfs/dbraw/zinc/66/18/84/1054661884.db2.gz BIGCCYRZIJJXMS-UWJYYQICSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120422 1054661892 /nfs/dbraw/zinc/66/18/92/1054661892.db2.gz BIGCCYRZIJJXMS-UWJYYQICSA-N 2 1 308.469 4.161 20 0 DIADMP Clc1ccccc1CCC[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235153404 1054666801 /nfs/dbraw/zinc/66/68/01/1054666801.db2.gz SCCQQKKHXCJQKN-IBGZPJMESA-N 2 1 320.908 4.127 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235152792 1054667222 /nfs/dbraw/zinc/66/72/22/1054667222.db2.gz BIARXBZSXACZLI-GOSISDBHSA-N 2 1 318.530 4.153 20 0 DIADMP Cc1cccc(Cl)c1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235155678 1054667494 /nfs/dbraw/zinc/66/74/94/1054667494.db2.gz PFRPAFXKQYGRNL-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP Fc1ccc(C[N@H+]2CCCC23CC[NH2+]CC3)cc1-c1ccccc1 ZINC001235146087 1054667688 /nfs/dbraw/zinc/66/76/88/1054667688.db2.gz ZFABRKRDGFYYAQ-UHFFFAOYSA-N 2 1 324.443 4.211 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000179233710 1054673881 /nfs/dbraw/zinc/67/38/81/1054673881.db2.gz JDUSQWLJVINIFS-HNNXBMFYSA-N 2 1 317.502 4.435 20 0 DIADMP c1cc2c(cccc2C[N@@H+]2CCCC[C@]23CCC[NH2+]C3)s1 ZINC001235177837 1054675879 /nfs/dbraw/zinc/67/58/79/1054675879.db2.gz LIQBVKRUYPHKNC-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCC[C@]23CCC[NH2+]C3)s1 ZINC001235177837 1054675888 /nfs/dbraw/zinc/67/58/88/1054675888.db2.gz LIQBVKRUYPHKNC-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1cccc(C)c1C[N@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1 ZINC001235249212 1054691405 /nfs/dbraw/zinc/69/14/05/1054691405.db2.gz MHOHZNUVBUNAIX-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cccc(OC(C)C)c1 ZINC000179664556 1054694684 /nfs/dbraw/zinc/69/46/84/1054694684.db2.gz RXTKLMIGTZXQNJ-INIZCTEOSA-N 2 1 315.461 4.110 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccc(F)c(F)c1)C(C)C ZINC000179676531 1054694822 /nfs/dbraw/zinc/69/48/22/1054694822.db2.gz JCSKEDNTIMBWFP-SCLBCKFNSA-N 2 1 321.415 4.093 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@H]2[NH2+]CC[C@@H]2C1 ZINC001235272736 1054696717 /nfs/dbraw/zinc/69/67/17/1054696717.db2.gz QVDPMNUJIPGRFG-RDTXWAMCSA-N 2 1 322.477 4.238 20 0 DIADMP CCOc1ccccc1[C@H](CC)[NH2+]CCCCn1cc[nH+]c1C ZINC000179733878 1054699463 /nfs/dbraw/zinc/69/94/63/1054699463.db2.gz IQIZRAXAFWSIKM-SFHVURJKSA-N 2 1 315.461 4.111 20 0 DIADMP Cc1ccc(-c2cccc(C[NH+]3CC[C@@]4(CC[N@H+](C)C4)C3)c2)cc1 ZINC001235316001 1054699477 /nfs/dbraw/zinc/69/94/77/1054699477.db2.gz PYWFYJZVVUCQHN-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CC[C@@]4(CC[NH+](C)C4)C3)c2)cc1 ZINC001235316001 1054699481 /nfs/dbraw/zinc/69/94/81/1054699481.db2.gz PYWFYJZVVUCQHN-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3CC[C@@]4(CC[NH+](C)C4)C3)c2)cc1 ZINC001235316001 1054699486 /nfs/dbraw/zinc/69/94/86/1054699486.db2.gz PYWFYJZVVUCQHN-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235427426 1054714776 /nfs/dbraw/zinc/71/47/76/1054714776.db2.gz RWIYCHVUZSCSCA-IRXDYDNUSA-N 2 1 314.498 4.113 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235427423 1054716234 /nfs/dbraw/zinc/71/62/34/1054716234.db2.gz RWIYCHVUZSCSCA-DLBZAZTESA-N 2 1 314.498 4.113 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c2ccccc12 ZINC001235424001 1054716735 /nfs/dbraw/zinc/71/67/35/1054716735.db2.gz ILRVSUVLHKNAEQ-MOPGFXCFSA-N 2 1 322.496 4.360 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC001235428549 1054718189 /nfs/dbraw/zinc/71/81/89/1054718189.db2.gz QQCLKHXDSMSNMK-UXHICEINSA-N 2 1 300.490 4.022 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+](C)CC2CC[NH2+]CC2)c1 ZINC001235433342 1054718377 /nfs/dbraw/zinc/71/83/77/1054718377.db2.gz TYLSFBVTQWRRKR-UHFFFAOYSA-N 2 1 322.496 4.402 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)CC1CC[NH2+]CC1 ZINC001235433587 1054718603 /nfs/dbraw/zinc/71/86/03/1054718603.db2.gz FJZVBWAVVQKCCJ-KRWDZBQOSA-N 2 1 316.533 4.094 20 0 DIADMP Cc1cc(C[N@@H+](C)CC2CC[NH2+]CC2)ccc1Oc1ccccc1 ZINC001235433176 1054719429 /nfs/dbraw/zinc/71/94/29/1054719429.db2.gz RDISAGCZGCAHIJ-UHFFFAOYSA-N 2 1 324.468 4.219 20 0 DIADMP c1cc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c2cccccc1-2 ZINC001235430864 1054719985 /nfs/dbraw/zinc/71/99/85/1054719985.db2.gz YINPHJNRZBEILU-MOPGFXCFSA-N 2 1 308.469 4.003 20 0 DIADMP C[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)CC1CC[NH2+]CC1 ZINC001235432625 1054720309 /nfs/dbraw/zinc/72/03/09/1054720309.db2.gz OKQHCXVDDJBFJV-UHFFFAOYSA-N 2 1 321.679 4.078 20 0 DIADMP C[N@@H+](CCC[NH3+])Cc1ccc(-c2ccccc2C(F)(F)F)cc1 ZINC001235435560 1054721641 /nfs/dbraw/zinc/72/16/41/1054721641.db2.gz PIEQWRQESZKQHU-UHFFFAOYSA-N 2 1 322.374 4.153 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(C)cc(Cl)c2)CC1 ZINC001235541216 1054740509 /nfs/dbraw/zinc/74/05/09/1054740509.db2.gz RLTITUIHZFLHLK-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(C)cc(Cl)c2)CC1 ZINC001235541216 1054740522 /nfs/dbraw/zinc/74/05/22/1054740522.db2.gz RLTITUIHZFLHLK-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC001235664849 1054763443 /nfs/dbraw/zinc/76/34/43/1054763443.db2.gz YKCSTOICKQIDGT-UHFFFAOYSA-N 2 1 308.469 4.135 20 0 DIADMP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001235674441 1054769536 /nfs/dbraw/zinc/76/95/36/1054769536.db2.gz GFNJXGQJJRQYEN-OAHLLOKOSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001235674441 1054769554 /nfs/dbraw/zinc/76/95/54/1054769554.db2.gz GFNJXGQJJRQYEN-OAHLLOKOSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC001235675259 1054769775 /nfs/dbraw/zinc/76/97/75/1054769775.db2.gz TVTYQBXIHZFEGJ-GOSISDBHSA-N 2 1 300.833 4.136 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001235675328 1054771104 /nfs/dbraw/zinc/77/11/04/1054771104.db2.gz VROZMGSMEGTSBQ-HNNXBMFYSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)cc1 ZINC001235695045 1054780071 /nfs/dbraw/zinc/78/00/71/1054780071.db2.gz YEXGMLOROFDFAR-SFHVURJKSA-N 2 1 300.833 4.136 20 0 DIADMP COc1ccccc1[C@@H]1CCC[N@@H+]1CCC[NH2+]C1CCCCC1 ZINC001235710691 1054785855 /nfs/dbraw/zinc/78/58/55/1054785855.db2.gz DJIFRMLOBXQZNV-IBGZPJMESA-N 2 1 316.489 4.145 20 0 DIADMP COc1ccccc1[C@@H]1CCC[N@H+]1CCC[NH2+]C1CCCCC1 ZINC001235710691 1054785866 /nfs/dbraw/zinc/78/58/66/1054785866.db2.gz DJIFRMLOBXQZNV-IBGZPJMESA-N 2 1 316.489 4.145 20 0 DIADMP COc1ccccc1[C@H]1CCC[N@@H+]1CCC[NH2+]C1CCCCC1 ZINC001235710693 1054786778 /nfs/dbraw/zinc/78/67/78/1054786778.db2.gz DJIFRMLOBXQZNV-LJQANCHMSA-N 2 1 316.489 4.145 20 0 DIADMP COc1ccccc1[C@H]1CCC[N@H+]1CCC[NH2+]C1CCCCC1 ZINC001235710693 1054786794 /nfs/dbraw/zinc/78/67/94/1054786794.db2.gz DJIFRMLOBXQZNV-LJQANCHMSA-N 2 1 316.489 4.145 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(-c2cccs2)cc1 ZINC001235716931 1054788778 /nfs/dbraw/zinc/78/87/78/1054788778.db2.gz NMGVEKSDSWJHRW-UHFFFAOYSA-N 2 1 314.498 4.237 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccccc1-c1cccs1 ZINC001235716696 1054789844 /nfs/dbraw/zinc/78/98/44/1054789844.db2.gz GUBXXWVSWHNPHM-UHFFFAOYSA-N 2 1 314.498 4.237 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccc(/C=C/c3ccccc3)cc2)CC1 ZINC001235724731 1054790168 /nfs/dbraw/zinc/79/01/68/1054790168.db2.gz CPRKLSDPOXUVEZ-CMDGGOBGSA-N 2 1 320.480 4.431 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(C)sc1C ZINC000623861174 1054791737 /nfs/dbraw/zinc/79/17/37/1054791737.db2.gz QLTXRRGHZLQPMU-YJBOKZPZSA-N 2 1 306.519 4.280 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(C)sc1C ZINC000623866236 1054795296 /nfs/dbraw/zinc/79/52/96/1054795296.db2.gz PHSNVHFKEBFCFP-NUJGCVRESA-N 2 1 306.519 4.423 20 0 DIADMP CC[N@H+](Cc1sccc1Oc1ccccc1)C1CC[NH2+]CC1 ZINC001235762294 1054801283 /nfs/dbraw/zinc/80/12/83/1054801283.db2.gz RJOZKQDRJXKURL-UHFFFAOYSA-N 2 1 316.470 4.114 20 0 DIADMP CC[N@@H+](Cc1sccc1Oc1ccccc1)C1CC[NH2+]CC1 ZINC001235762294 1054801290 /nfs/dbraw/zinc/80/12/90/1054801290.db2.gz RJOZKQDRJXKURL-UHFFFAOYSA-N 2 1 316.470 4.114 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3[C@@H]4CC[C@H]3C[C@@H]([NH3+])C4)cc2)c1 ZINC001235808395 1054809594 /nfs/dbraw/zinc/80/95/94/1054809594.db2.gz CQOPPOBZTVRCOU-WKCHPHFGSA-N 2 1 306.453 4.116 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)c1 ZINC001235810717 1054812773 /nfs/dbraw/zinc/81/27/73/1054812773.db2.gz MTAZKJOOLHKDSG-BJWYYQGGSA-N 2 1 306.519 4.325 20 0 DIADMP c1ccc([C@@H]2CSCC[N@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001235812486 1054812809 /nfs/dbraw/zinc/81/28/09/1054812809.db2.gz XNAJAQDDSRVFLW-IBGZPJMESA-N 2 1 318.530 4.089 20 0 DIADMP c1ccc([C@@H]2CSCC[N@@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001235812486 1054812823 /nfs/dbraw/zinc/81/28/23/1054812823.db2.gz XNAJAQDDSRVFLW-IBGZPJMESA-N 2 1 318.530 4.089 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)CC1 ZINC001235810902 1054813000 /nfs/dbraw/zinc/81/30/00/1054813000.db2.gz PIUMVHKDLFMYTG-YSTOQKLRSA-N 2 1 302.506 4.413 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3sc21)C[C@H]1CC[NH2+]C1 ZINC001235841729 1054817553 /nfs/dbraw/zinc/81/75/53/1054817553.db2.gz IHSJTFTWAZKBPV-AWEZNQCLSA-N 2 1 310.466 4.096 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccc(Cl)cc1)C[C@H]1CC[NH2+]C1 ZINC001235841960 1054818724 /nfs/dbraw/zinc/81/87/24/1054818724.db2.gz KSFVJPXQADISIT-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccc(Cl)cc1)C[C@@H]1CC[NH2+]C1 ZINC001235841962 1054819277 /nfs/dbraw/zinc/81/92/77/1054819277.db2.gz KSFVJPXQADISIT-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP [NH3+]CCCCC[N@H+]1CCC[C@@H]1C(c1ccccc1)c1ccccc1 ZINC001235865547 1054826749 /nfs/dbraw/zinc/82/67/49/1054826749.db2.gz CWKLGXQTSIPXAT-OAQYLSRUSA-N 2 1 322.496 4.412 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891669 1054833798 /nfs/dbraw/zinc/83/37/98/1054833798.db2.gz HIZQEHWDVVBRDJ-OCCSQVGLSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891669 1054833811 /nfs/dbraw/zinc/83/38/11/1054833811.db2.gz HIZQEHWDVVBRDJ-OCCSQVGLSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906855 1054842597 /nfs/dbraw/zinc/84/25/97/1054842597.db2.gz OZVOESBSVQDIRG-DZGCQCFKSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906855 1054842602 /nfs/dbraw/zinc/84/26/02/1054842602.db2.gz OZVOESBSVQDIRG-DZGCQCFKSA-N 2 1 310.466 4.366 20 0 DIADMP C[N@@H+](CC[C@@H]1CCC[NH2+]C1)Cc1sc2ccccc2c1Cl ZINC001235948345 1054863385 /nfs/dbraw/zinc/86/33/85/1054863385.db2.gz MDRUEXOJXVMOKI-ZDUSSCGKSA-N 2 1 322.905 4.376 20 0 DIADMP c1ccc(CC[N@H+](CC[C@@H]2CCC[NH2+]C2)Cc2ccccc2)cc1 ZINC001235948659 1054864819 /nfs/dbraw/zinc/86/48/19/1054864819.db2.gz RZKIDAZJQHHTBE-NRFANRHFSA-N 2 1 322.496 4.121 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C[C@@H]1CCC[NH2+]C1 ZINC001235952489 1054867154 /nfs/dbraw/zinc/86/71/54/1054867154.db2.gz YANHDCSJRPHKEJ-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C[C@@H]1CCC[NH2+]C1 ZINC001235952489 1054867160 /nfs/dbraw/zinc/86/71/60/1054867160.db2.gz YANHDCSJRPHKEJ-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](Cc3ccc4c(c3)C[NH2+]CC4)CC2)cc1 ZINC001235959862 1054872567 /nfs/dbraw/zinc/87/25/67/1054872567.db2.gz MAQODXDIIHBCKE-FQEVSTJZSA-N 2 1 320.480 4.102 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](Cc3ccc4c(c3)CC[NH2+]C4)CC2)cc1 ZINC001235960594 1054872986 /nfs/dbraw/zinc/87/29/86/1054872986.db2.gz UQVXPZAVAUFMLK-FQEVSTJZSA-N 2 1 320.480 4.102 20 0 DIADMP CC1(C[N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)CCCCC1 ZINC001235972843 1054876159 /nfs/dbraw/zinc/87/61/59/1054876159.db2.gz DETHCLUQCAKTLW-UHFFFAOYSA-N 2 1 312.501 4.094 20 0 DIADMP c1ccc2c(c1)C[N@H+](CCCC1CCCC1)CC21CC[NH2+]CC1 ZINC001235972764 1054877615 /nfs/dbraw/zinc/87/76/15/1054877615.db2.gz BDXPGZNGMOIPMO-UHFFFAOYSA-N 2 1 312.501 4.094 20 0 DIADMP C[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124072 1054883969 /nfs/dbraw/zinc/88/39/69/1054883969.db2.gz WJQGOMQOBFKLLA-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124072 1054883982 /nfs/dbraw/zinc/88/39/82/1054883982.db2.gz WJQGOMQOBFKLLA-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124072 1054883998 /nfs/dbraw/zinc/88/39/98/1054883998.db2.gz WJQGOMQOBFKLLA-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001236068458 1054923696 /nfs/dbraw/zinc/92/36/96/1054923696.db2.gz UAHPVGJWGLMRAM-OAHLLOKOSA-N 2 1 310.466 4.096 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001236108191 1054951464 /nfs/dbraw/zinc/95/14/64/1054951464.db2.gz JQPNPBUSCXCQRG-LJQANCHMSA-N 2 1 324.493 4.349 20 0 DIADMP CC(C)[N@@H+](Cc1c(Cl)cccc1Cl)CC12CC([NH3+])(C1)C2 ZINC001236110752 1054953605 /nfs/dbraw/zinc/95/36/05/1054953605.db2.gz DUGYZOGIKXOWIV-UHFFFAOYSA-N 2 1 313.272 4.085 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236141270 1054967910 /nfs/dbraw/zinc/96/79/10/1054967910.db2.gz FYPBWSZDZUFPNK-UHFFFAOYSA-N 2 1 307.441 4.006 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC001236152718 1054971030 /nfs/dbraw/zinc/97/10/30/1054971030.db2.gz XFWAIOUJAMBTLG-IBGZPJMESA-N 2 1 312.844 4.280 20 0 DIADMP CCC[N@@H+](CC(c1ccccc1)c1ccccc1)C1CC[NH2+]CC1 ZINC001236180213 1054980647 /nfs/dbraw/zinc/98/06/47/1054980647.db2.gz CSHQVXCLWJGJHU-UHFFFAOYSA-N 2 1 322.496 4.283 20 0 DIADMP CCC[N@@H+](CC[C@@H](C)CCCC(C)(C)OC)C1CC[NH2+]CC1 ZINC001236181378 1054981396 /nfs/dbraw/zinc/98/13/96/1054981396.db2.gz YJEQHLWOOQECBT-KRWDZBQOSA-N 2 1 312.542 4.072 20 0 DIADMP CCC[N@@H+](Cc1ccc(Oc2ccccc2)cc1)C1CC[NH2+]CC1 ZINC001236180278 1054981537 /nfs/dbraw/zinc/98/15/37/1054981537.db2.gz FWJRWDQLROYDFF-UHFFFAOYSA-N 2 1 324.468 4.443 20 0 DIADMP C[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccc2ccccc2c1 ZINC001236183095 1054982229 /nfs/dbraw/zinc/98/22/29/1054982229.db2.gz DRKINXMIHHRXRV-UHFFFAOYSA-N 2 1 322.477 4.179 20 0 DIADMP CC[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1cccc(Cl)c1 ZINC001236192671 1054990091 /nfs/dbraw/zinc/99/00/91/1054990091.db2.gz IXQQVAHGFVLGIS-UHFFFAOYSA-N 2 1 320.889 4.069 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001236196413 1054996431 /nfs/dbraw/zinc/99/64/31/1054996431.db2.gz ZLPULBVHZCKTOY-NRFANRHFSA-N 2 1 317.436 4.108 20 0 DIADMP Cc1cc(Cl)c(C[N@H+](C)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)c1 ZINC001236224685 1055014112 /nfs/dbraw/zinc/01/41/12/1055014112.db2.gz VJFBLCSQHUSBNP-HAQNSBGRSA-N 2 1 301.261 4.004 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)[C@]1(C)CCC[NH2+]C1 ZINC001236206716 1055000353 /nfs/dbraw/zinc/00/03/53/1055000353.db2.gz LGOWGZXVIRBNLE-OAQYLSRUSA-N 2 1 308.469 4.236 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)[C@]1(C)CCC[NH2+]C1 ZINC001236206716 1055000368 /nfs/dbraw/zinc/00/03/68/1055000368.db2.gz LGOWGZXVIRBNLE-OAQYLSRUSA-N 2 1 308.469 4.236 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2-c2ccccc2)CC1 ZINC001236212115 1055001140 /nfs/dbraw/zinc/00/11/40/1055001140.db2.gz DOETZSDWTHWUIE-UHFFFAOYSA-N 2 1 308.469 4.316 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2-c2cccs2)CC1 ZINC001236212613 1055001217 /nfs/dbraw/zinc/00/12/17/1055001217.db2.gz JNLMCZACZQWRCV-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(-c3cccs3)s2)CC1 ZINC001236212611 1055001865 /nfs/dbraw/zinc/00/18/65/1055001865.db2.gz JLOLUTIQALTHRZ-UHFFFAOYSA-N 2 1 320.527 4.439 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cccc(-c3ccccc3)c2)CC1 ZINC001236214456 1055003384 /nfs/dbraw/zinc/00/33/84/1055003384.db2.gz FODFZEUXHIGENL-UHFFFAOYSA-N 2 1 308.469 4.316 20 0 DIADMP COc1ccc(-c2cccc(C[N@H+](C)[C@H]3CCCC[C@@H]3[NH3+])c2)cc1 ZINC001236216265 1055005344 /nfs/dbraw/zinc/00/53/44/1055005344.db2.gz JWOLOAXIADOPDH-SFTDATJTSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2cccc(C[N@@H+](C)[C@H]3CCCC[C@@H]3[NH3+])c2)cc1 ZINC001236216265 1055005359 /nfs/dbraw/zinc/00/53/59/1055005359.db2.gz JWOLOAXIADOPDH-SFTDATJTSA-N 2 1 324.468 4.064 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)[C@H]3CCCC[C@@H]3[NH3+])c(C)c12 ZINC001236219468 1055008569 /nfs/dbraw/zinc/00/85/69/1055008569.db2.gz WOMJRZQNLVCXLJ-STQMWFEESA-N 2 1 308.516 4.281 20 0 DIADMP Cc1csc2sc(C[N@H+](C)[C@H]3CCCC[C@@H]3[NH3+])c(C)c12 ZINC001236219468 1055008584 /nfs/dbraw/zinc/00/85/84/1055008584.db2.gz WOMJRZQNLVCXLJ-STQMWFEESA-N 2 1 308.516 4.281 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccs2)cc1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236219479 1055009445 /nfs/dbraw/zinc/00/94/45/1055009445.db2.gz WUDULGHFYNOPQT-IRXDYDNUSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccs2)cc1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236219479 1055009455 /nfs/dbraw/zinc/00/94/55/1055009455.db2.gz WUDULGHFYNOPQT-IRXDYDNUSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236221896 1055012633 /nfs/dbraw/zinc/01/26/33/1055012633.db2.gz HZUVCRFEPICHHQ-WKILWMFISA-N 2 1 318.848 4.302 20 0 DIADMP C[N@@H+](Cc1sc(Cl)c2ccccc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236225099 1055013770 /nfs/dbraw/zinc/01/37/70/1055013770.db2.gz ZWEHHWWZPIASOM-HAQNSBGRSA-N 2 1 308.878 4.256 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1C(F)(F)F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224280 1055014303 /nfs/dbraw/zinc/01/43/03/1055014303.db2.gz SJBISKXWDIRIBW-JOCQHMNTSA-N 2 1 320.786 4.061 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccc(Cl)c2)o1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224423 1055015924 /nfs/dbraw/zinc/01/59/24/1055015924.db2.gz UHHNYAYNAWVELU-WKILWMFISA-N 2 1 318.848 4.302 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccccc2)Cc2ccccc2F)CC1 ZINC001236227615 1055018360 /nfs/dbraw/zinc/01/83/60/1055018360.db2.gz IOBIVPDOLGMGQP-UHFFFAOYSA-N 2 1 312.432 4.098 20 0 DIADMP CC[N@@H+](CC[C@H]1CCCC[NH2+]1)Cc1ccc(C(F)(F)F)cc1 ZINC001236242528 1055028099 /nfs/dbraw/zinc/02/80/99/1055028099.db2.gz WTSJWFZTXYXJIH-MRXNPFEDSA-N 2 1 314.395 4.060 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH3+])cc1)Cc1ccc(C(F)(F)F)cc1 ZINC001236239647 1055028212 /nfs/dbraw/zinc/02/82/12/1055028212.db2.gz KLGGDEYZTYDNTP-UHFFFAOYSA-N 2 1 322.374 4.186 20 0 DIADMP C[N@@H+](CC[C@H]1CCC[NH2+]C1)Cc1cccc(Oc2ccccc2)c1 ZINC001236242188 1055028254 /nfs/dbraw/zinc/02/82/54/1055028254.db2.gz WHWXWBWYIRPEEM-GOSISDBHSA-N 2 1 324.468 4.300 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000183165874 1055034230 /nfs/dbraw/zinc/03/42/30/1055034230.db2.gz WDNWMOVLJSACHA-KRWDZBQOSA-N 2 1 322.880 4.016 20 0 DIADMP CC[N@@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccc(Cl)cc1Cl ZINC001236266458 1055044644 /nfs/dbraw/zinc/04/46/44/1055044644.db2.gz SKYDKCBUKOXGEY-CYBMUJFWSA-N 2 1 315.288 4.205 20 0 DIADMP CC1(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CCCCC1 ZINC001236287376 1055049008 /nfs/dbraw/zinc/04/90/08/1055049008.db2.gz SKOXZWWQEGNSTH-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP C[C@@H](C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1)c1ccccc1 ZINC001236288201 1055050106 /nfs/dbraw/zinc/05/01/06/1055050106.db2.gz XNDJXPYDWGPJBV-SFHVURJKSA-N 2 1 308.469 4.044 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1 ZINC001236288029 1055050749 /nfs/dbraw/zinc/05/07/49/1055050749.db2.gz VNALVIBHPYAQNS-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP Fc1ccccc1C[N@H+](CCCC1CCCC1)C1CC[NH2+]CC1 ZINC001236366848 1055076980 /nfs/dbraw/zinc/07/69/80/1055076980.db2.gz HQRVBPDLEMOWIE-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP Fc1ccccc1C[N@@H+](CCCC1CCCC1)C1CC[NH2+]CC1 ZINC001236366848 1055076990 /nfs/dbraw/zinc/07/69/90/1055076990.db2.gz HQRVBPDLEMOWIE-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP C[C@H](C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1)c1ccccc1 ZINC001236373499 1055078430 /nfs/dbraw/zinc/07/84/30/1055078430.db2.gz XUROYHKHQKMTQV-QZTJIDSGSA-N 2 1 300.490 4.034 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(F)c1F ZINC001236372721 1055078554 /nfs/dbraw/zinc/07/85/54/1055078554.db2.gz CVUXWZLLJOFTSG-OAHLLOKOSA-N 2 1 322.443 4.017 20 0 DIADMP Fc1ccc(Cl)c(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373784 1055078663 /nfs/dbraw/zinc/07/86/63/1055078663.db2.gz LCLBJQYRYSBRNS-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1ccc(Cl)c(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373784 1055078676 /nfs/dbraw/zinc/07/86/76/1055078676.db2.gz LCLBJQYRYSBRNS-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236372892 1055079320 /nfs/dbraw/zinc/07/93/20/1055079320.db2.gz FBYBJOKKCUQQAF-SFHVURJKSA-N 2 1 300.490 4.048 20 0 DIADMP C[C@H](C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1)c1ccccc1 ZINC001236373498 1055079563 /nfs/dbraw/zinc/07/95/63/1055079563.db2.gz XUROYHKHQKMTQV-MSOLQXFVSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)(C)c1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)[nH]1 ZINC001236374376 1055081011 /nfs/dbraw/zinc/08/10/11/1055081011.db2.gz PXWPNIQUTJPGMW-INIZCTEOSA-N 2 1 317.521 4.056 20 0 DIADMP Fc1cc(Cl)cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236376932 1055081796 /nfs/dbraw/zinc/08/17/96/1055081796.db2.gz WCZKUMBRZIREQQ-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1Cl ZINC001236376914 1055081994 /nfs/dbraw/zinc/08/19/94/1055081994.db2.gz VXTSYSZDERESLN-KRWDZBQOSA-N 2 1 320.908 4.393 20 0 DIADMP c1cc2c(cccc2C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)o1 ZINC001236376168 1055082850 /nfs/dbraw/zinc/08/28/50/1055082850.db2.gz PYWJBWFYQRXEKL-MRXNPFEDSA-N 2 1 312.457 4.177 20 0 DIADMP CSc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236377093 1055083124 /nfs/dbraw/zinc/08/31/24/1055083124.db2.gz XOYSECFLNCAGCH-AWEZNQCLSA-N 2 1 324.559 4.214 20 0 DIADMP Clc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236374391 1055083312 /nfs/dbraw/zinc/08/33/12/1055083312.db2.gz QHXARGBVRGVAES-MRXNPFEDSA-N 2 1 306.881 4.084 20 0 DIADMP Cc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(F)cc1F ZINC001236376227 1055083335 /nfs/dbraw/zinc/08/33/35/1055083335.db2.gz PHYNKGNVSFNGTF-OAHLLOKOSA-N 2 1 322.443 4.017 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(Cl)c1 ZINC001236374534 1055083557 /nfs/dbraw/zinc/08/35/57/1055083557.db2.gz DPGVGCAGOCTOLZ-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)sc1C ZINC001236375212 1055083748 /nfs/dbraw/zinc/08/37/48/1055083748.db2.gz JGRIGBZCJBDCQE-MRXNPFEDSA-N 2 1 306.519 4.109 20 0 DIADMP c1c2ccccc2oc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375473 1055083988 /nfs/dbraw/zinc/08/39/88/1055083988.db2.gz YLLFIGVGBJMCCH-MRXNPFEDSA-N 2 1 312.457 4.177 20 0 DIADMP CCC(CC)C[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001236381596 1055085149 /nfs/dbraw/zinc/08/51/49/1055085149.db2.gz KZKCAYJYSZLQRJ-UHFFFAOYSA-N 2 1 306.469 4.064 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccnc1 ZINC000185034134 1055086631 /nfs/dbraw/zinc/08/66/31/1055086631.db2.gz QANDCBCIVXFVQQ-HKUYNNGSSA-N 2 1 303.494 4.025 20 0 DIADMP CCC[C@@H](C)C[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001236381916 1055087122 /nfs/dbraw/zinc/08/71/22/1055087122.db2.gz NXKWIXJUGINAHX-MRXNPFEDSA-N 2 1 306.469 4.064 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cccnc1 ZINC000185033757 1055087288 /nfs/dbraw/zinc/08/72/88/1055087288.db2.gz OAJJFAGUMYFDPS-HKUYNNGSSA-N 2 1 303.494 4.167 20 0 DIADMP CC(C)(C)CC[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001236383758 1055088113 /nfs/dbraw/zinc/08/81/13/1055088113.db2.gz WWTUZHJIKPJUFQ-UHFFFAOYSA-N 2 1 306.469 4.064 20 0 DIADMP C[C@@H]([NH2+]CCSc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185681823 1055095782 /nfs/dbraw/zinc/09/57/82/1055095782.db2.gz SNQRUZMWXUMVIR-SJORKVTESA-N 2 1 318.530 4.021 20 0 DIADMP CC[N@H+](Cc1cccc(Oc2ccc(C)cc2)c1)C[C@H]1CC[NH2+]C1 ZINC001236410323 1055102486 /nfs/dbraw/zinc/10/24/86/1055102486.db2.gz YSVULHKFPIEWAE-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP CC[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)CC(F)F ZINC000660307318 1055114147 /nfs/dbraw/zinc/11/41/47/1055114147.db2.gz WIIAXNVZSUUDOC-BQFCYCMXSA-N 2 1 324.459 4.168 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc2ccccc2o1)C1CC[NH2+]CC1 ZINC001236458056 1055125306 /nfs/dbraw/zinc/12/53/06/1055125306.db2.gz QEFFYTZOIKLGJM-UHFFFAOYSA-N 2 1 300.446 4.033 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(F)c(C2CC2)c1)C1CC[NH2+]CC1 ZINC001236459702 1055126273 /nfs/dbraw/zinc/12/62/73/1055126273.db2.gz XNIPXXWVSKUYEW-UHFFFAOYSA-N 2 1 318.480 4.303 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc(C(F)F)c1)C1CC[NH2+]CC1 ZINC001236458813 1055126797 /nfs/dbraw/zinc/12/67/97/1055126797.db2.gz YYZXTGBUDHJYEE-UHFFFAOYSA-N 2 1 310.432 4.224 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)ccc1Cl ZINC001236458576 1055127177 /nfs/dbraw/zinc/12/71/77/1055127177.db2.gz XXUQBACGLLOEFQ-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP Cc1cc(C)c(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c(C)c1 ZINC001236458684 1055128012 /nfs/dbraw/zinc/12/80/12/1055128012.db2.gz VPTIJYYEWOWLHD-UHFFFAOYSA-N 2 1 302.506 4.212 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C[C@@H]2CC=CCC2)C2CC[NH2+]CC2)c1 ZINC001236481385 1055138378 /nfs/dbraw/zinc/13/83/78/1055138378.db2.gz VFFWOGAABYOXGM-QGZVFWFLSA-N 2 1 316.464 4.044 20 0 DIADMP Fc1ccc(C[N@@H+](CCC2CCCC2)C2CC[NH2+]CC2)cc1F ZINC001236499291 1055150362 /nfs/dbraw/zinc/15/03/62/1055150362.db2.gz KQNLEHMFTXXOQT-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236534183 1055164878 /nfs/dbraw/zinc/16/48/78/1055164878.db2.gz QXMBULSLIRYRHX-KBAYOESNSA-N 2 1 306.469 4.334 20 0 DIADMP Cc1cc(C)c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236539467 1055168697 /nfs/dbraw/zinc/16/86/97/1055168697.db2.gz FGIPZDJABFOUSV-MEMLXQNLSA-N 2 1 314.517 4.484 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236540501 1055170877 /nfs/dbraw/zinc/17/08/77/1055170877.db2.gz FHIXLEIEFJNSIR-VBSBHUPXSA-N 2 1 304.522 4.351 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2C(F)F)CC2CCC2)CC1 ZINC001236540914 1055171047 /nfs/dbraw/zinc/17/10/47/1055171047.db2.gz FTODSFZJACXNQJ-QAQDUYKDSA-N 2 1 322.443 4.496 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2c[nH]c3ccccc23)CC2CCC2)CC1 ZINC001236540572 1055171223 /nfs/dbraw/zinc/17/12/23/1055171223.db2.gz GQWRWMHWLYQNHZ-IYARVYRRSA-N 2 1 311.473 4.040 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCC2)CC2(c3ccccc3)CC2)CC1 ZINC001236542651 1055172700 /nfs/dbraw/zinc/17/27/00/1055172700.db2.gz ZERKSJRLQGDKTI-MXVIHJGJSA-N 2 1 312.501 4.090 20 0 DIADMP Cc1cc(C)c(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236550109 1055177372 /nfs/dbraw/zinc/17/73/72/1055177372.db2.gz DJOJTMDCYZNJGP-WGSAOQKQSA-N 2 1 300.490 4.094 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236550828 1055177645 /nfs/dbraw/zinc/17/76/45/1055177645.db2.gz NJCBBVNETSKLMY-SZMVWBNQSA-N 2 1 306.494 4.310 20 0 DIADMP Cc1ccc2c(C[N@@H+](CC3CC3)[C@H]3CC[C@H]([NH3+])CC3)cccc2n1 ZINC001236549929 1055178291 /nfs/dbraw/zinc/17/82/91/1055178291.db2.gz CZTFTCHECWJRQQ-WGSAOQKQSA-N 2 1 323.484 4.025 20 0 DIADMP CC(C)C[N@@H+](Cc1c[nH]c2cc(F)ccc12)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551313 1055179895 /nfs/dbraw/zinc/17/98/95/1055179895.db2.gz PNYPRNPPUZPVMO-QAQDUYKDSA-N 2 1 317.452 4.035 20 0 DIADMP CC(C)C[N@@H+](Cc1cc(F)cc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552484 1055180377 /nfs/dbraw/zinc/18/03/77/1055180377.db2.gz RAOJSERTWHHSRF-QAQDUYKDSA-N 2 1 312.860 4.207 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236554677 1055181711 /nfs/dbraw/zinc/18/17/11/1055181711.db2.gz PWNMHYDMKJBCAI-QAQDUYKDSA-N 2 1 308.897 4.376 20 0 DIADMP C[C@H]([NH2+]C1CCC(C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381774752 1055182086 /nfs/dbraw/zinc/18/20/86/1055182086.db2.gz ABLJTDIIFPXQCF-OWODTTCDSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1cc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1Cl ZINC001236553180 1055182111 /nfs/dbraw/zinc/18/21/11/1055182111.db2.gz OVBSVWHASKMMHO-QAQDUYKDSA-N 2 1 306.881 4.130 20 0 DIADMP Cc1c(Cl)ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236553110 1055182356 /nfs/dbraw/zinc/18/23/56/1055182356.db2.gz WZOOPURLZJAFQR-WKILWMFISA-N 2 1 324.871 4.269 20 0 DIADMP C[C@@H]([NH2+]C1CCC(C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381774750 1055182298 /nfs/dbraw/zinc/18/22/98/1055182298.db2.gz ABLJTDIIFPXQCF-NSPNGIHDSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236554978 1055184563 /nfs/dbraw/zinc/18/45/63/1055184563.db2.gz BHVQLTVOYNIKLV-WGSAOQKQSA-N 2 1 312.457 4.169 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cccc(F)c2)C2CCCCC2)CC1 ZINC001236566274 1055185817 /nfs/dbraw/zinc/18/58/17/1055185817.db2.gz VTVUWEYXGFJYRT-KESTWPANSA-N 2 1 318.480 4.273 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2)C2CCCC2)CC1 ZINC001236566185 1055186712 /nfs/dbraw/zinc/18/67/12/1055186712.db2.gz DTAOGJIXNMIESU-SAABIXHNSA-N 2 1 306.881 4.355 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000381859808 1055187552 /nfs/dbraw/zinc/18/75/52/1055187552.db2.gz IJCYTRSVIDTDFG-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000381859794 1055187763 /nfs/dbraw/zinc/18/77/63/1055187763.db2.gz IJCYTRSVIDTDFG-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2(c3ccccc3)CC2)C2CCCC2)CC1 ZINC001236567101 1055187882 /nfs/dbraw/zinc/18/78/82/1055187882.db2.gz SZEGQMQMBUPUFV-KESTWPANSA-N 2 1 312.501 4.233 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCC(F)(F)CC2)C2CCCC2)CC1 ZINC001236566909 1055188192 /nfs/dbraw/zinc/18/81/92/1055188192.db2.gz OVFKUTAJANPRGJ-JCNLHEQBSA-N 2 1 314.464 4.326 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3ncccc23)C2CCCC2)CC1 ZINC001236566783 1055188216 /nfs/dbraw/zinc/18/82/16/1055188216.db2.gz LMHFMAZBSUQLJO-UAPYVXQJSA-N 2 1 323.484 4.249 20 0 DIADMP CCc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)nc1 ZINC001236567141 1055188496 /nfs/dbraw/zinc/18/84/96/1055188496.db2.gz JFLJTPTWPJTSBQ-IRJFHVNHSA-N 2 1 315.505 4.049 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccccc2F)C2CCCC2)CC1 ZINC001236567442 1055188719 /nfs/dbraw/zinc/18/87/19/1055188719.db2.gz WERRCXHMLMSSGD-UAPYVXQJSA-N 2 1 318.480 4.273 20 0 DIADMP CC1=CC[C@H](CC[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)C1(C)C ZINC001236571746 1055192939 /nfs/dbraw/zinc/19/29/39/1055192939.db2.gz FOTZCBYEHHKJNQ-ZHALLVOQSA-N 2 1 304.522 4.493 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccc(F)cc2Cl)C2CCC2)CC1 ZINC001236571873 1055193386 /nfs/dbraw/zinc/19/33/86/1055193386.db2.gz IUVBDHNPRYWFIN-JCNLHEQBSA-N 2 1 324.871 4.146 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccccc2Cl)C2CCC2)CC1 ZINC001236572255 1055193556 /nfs/dbraw/zinc/19/35/56/1055193556.db2.gz OEVVYUCCBMEEIB-SAABIXHNSA-N 2 1 320.908 4.397 20 0 DIADMP CC(C)c1nc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cs1 ZINC001236571635 1055193614 /nfs/dbraw/zinc/19/36/14/1055193614.db2.gz LBWMBLOUXIJPAL-CZIWCDLHSA-N 2 1 321.534 4.281 20 0 DIADMP Cc1cnc(Cl)c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236571988 1055193747 /nfs/dbraw/zinc/19/37/47/1055193747.db2.gz OYQUPLDXGDCAIU-JCNLHEQBSA-N 2 1 321.896 4.058 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(Cl)c2F)C2CCC2)CC1 ZINC001236572473 1055193906 /nfs/dbraw/zinc/19/39/06/1055193906.db2.gz PVOAHGXMHVYOJW-CTYIDZIISA-N 2 1 310.844 4.104 20 0 DIADMP CSc1ccccc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571885 1055193921 /nfs/dbraw/zinc/19/39/21/1055193921.db2.gz LSDKOOMRVSAIFX-SAABIXHNSA-N 2 1 318.530 4.423 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236606000 1055204501 /nfs/dbraw/zinc/20/45/01/1055204501.db2.gz YJHALAHIMYJAMM-NRFANRHFSA-N 2 1 319.452 4.006 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)C[C@H]1CCC[NH2+]C1 ZINC001236661303 1055218258 /nfs/dbraw/zinc/21/82/58/1055218258.db2.gz BVQPSAYSCDWCNE-PMACEKPBSA-N 2 1 302.506 4.109 20 0 DIADMP CC1(C[N@@H+](Cc2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)CCCCC1 ZINC001236671117 1055222658 /nfs/dbraw/zinc/22/26/58/1055222658.db2.gz DHMUXWHRHCCQQV-UAPYVXQJSA-N 2 1 315.505 4.124 20 0 DIADMP CC[NH+](CC)C1CC[NH+](Cc2cccc3sccc32)CC1 ZINC001236680341 1055226458 /nfs/dbraw/zinc/22/64/58/1055226458.db2.gz WGWHWVCWIKQNHI-UHFFFAOYSA-N 2 1 302.487 4.208 20 0 DIADMP Cc1cccc(CC[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236681822 1055229846 /nfs/dbraw/zinc/22/98/46/1055229846.db2.gz JTBYYOLXBCPNKO-HZCBDIJESA-N 2 1 322.496 4.310 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236714265 1055235886 /nfs/dbraw/zinc/23/58/86/1055235886.db2.gz LLFWGZOAICCNMV-WIYBCGNWSA-N 2 1 324.512 4.279 20 0 DIADMP CS[C@@H](C)CC[N@@H+](Cc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236725726 1055239184 /nfs/dbraw/zinc/23/91/84/1055239184.db2.gz DEUKXPAIUYADQF-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP Cc1cccc(C[N@@H+](CCc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236725760 1055240057 /nfs/dbraw/zinc/24/00/57/1055240057.db2.gz FFTDGDLQCIHULT-HZCBDIJESA-N 2 1 322.496 4.310 20 0 DIADMP CC(C)CCC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236743267 1055249270 /nfs/dbraw/zinc/24/92/70/1055249270.db2.gz VZHFWUMCWCWNEF-WGSAOQKQSA-N 2 1 306.469 4.334 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)sn1 ZINC001236759350 1055250416 /nfs/dbraw/zinc/25/04/16/1055250416.db2.gz UYWJFXPACXBIMY-QAQDUYKDSA-N 2 1 321.534 4.104 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)n1 ZINC001236765936 1055251121 /nfs/dbraw/zinc/25/11/21/1055251121.db2.gz BNAPKGAXZVFWQC-WKILWMFISA-N 2 1 323.912 4.161 20 0 DIADMP COc1ccc(C)cc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236766068 1055251530 /nfs/dbraw/zinc/25/15/30/1055251530.db2.gz CVCNGZCKEZYRTB-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cn1 ZINC001236758071 1055251717 /nfs/dbraw/zinc/25/17/17/1055251717.db2.gz BGQPZXVTNIJOET-MXVIHJGJSA-N 2 1 315.505 4.042 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc2c(c1)CCC2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767524 1055252257 /nfs/dbraw/zinc/25/22/57/1055252257.db2.gz ITGSOVJDIQKASC-MXVIHJGJSA-N 2 1 314.517 4.293 20 0 DIADMP Cc1ncccc1C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236754543 1055252430 /nfs/dbraw/zinc/25/24/30/1055252430.db2.gz HNJUWWIGUCITMN-MXVIHJGJSA-N 2 1 315.505 4.042 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccco2)cc1 ZINC000764776125 1055253169 /nfs/dbraw/zinc/25/31/69/1055253169.db2.gz YGZMVOODUVAFNH-LSDHHAIUSA-N 2 1 309.413 4.056 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc(O)c1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236780907 1055254102 /nfs/dbraw/zinc/25/41/02/1055254102.db2.gz WUGJSBPRCZXQCF-SHTZXODSSA-N 2 1 324.896 4.164 20 0 DIADMP CCC(CC)[N@@H+](Cc1c(C)cc(O)cc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781152 1055254284 /nfs/dbraw/zinc/25/42/84/1055254284.db2.gz AUGWSYTUGUEGTA-SAABIXHNSA-N 2 1 318.505 4.270 20 0 DIADMP CCOc1ccccc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236769474 1055254383 /nfs/dbraw/zinc/25/43/83/1055254383.db2.gz WCFOPTUFLUGVCS-IYARVYRRSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236769501 1055254750 /nfs/dbraw/zinc/25/47/50/1055254750.db2.gz WRCYBDFBMZBOKH-WGSAOQKQSA-N 2 1 302.506 4.421 20 0 DIADMP CC(C)(C)C[N@@H+](CCCc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236769709 1055255308 /nfs/dbraw/zinc/25/53/08/1055255308.db2.gz ZRZOFLYBLHXTPL-WGSAOQKQSA-N 2 1 320.496 4.376 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236779427 1055256236 /nfs/dbraw/zinc/25/62/36/1055256236.db2.gz IVQUHQGBSOSNCC-IYARVYRRSA-N 2 1 306.469 4.252 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(OC)cc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782566 1055257510 /nfs/dbraw/zinc/25/75/10/1055257510.db2.gz UOWSNICIKDAVFE-JCNLHEQBSA-N 2 1 322.468 4.095 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(C(C)(C)C)c[nH]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783204 1055258150 /nfs/dbraw/zinc/25/81/50/1055258150.db2.gz QOCTVRIRQYLHCR-SAABIXHNSA-N 2 1 319.537 4.430 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(F)c(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783278 1055259697 /nfs/dbraw/zinc/25/96/97/1055259697.db2.gz ROVXEOJCIOKGJI-KOMQPUFPSA-N 2 1 310.432 4.225 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccnc(Cl)c1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790931 1055260931 /nfs/dbraw/zinc/26/09/31/1055260931.db2.gz MYHWOQBLIZTOLZ-JCNLHEQBSA-N 2 1 323.912 4.304 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc2cc[nH]c21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790880 1055262756 /nfs/dbraw/zinc/26/27/56/1055262756.db2.gz MDMOQRKRIKDSAG-UAPYVXQJSA-N 2 1 313.489 4.428 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(Cl)c(O)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236791447 1055263852 /nfs/dbraw/zinc/26/38/52/1055263852.db2.gz UJWLBXOKOHYJTL-KOMQPUFPSA-N 2 1 324.896 4.306 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(O)c1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790494 1055264315 /nfs/dbraw/zinc/26/43/15/1055264315.db2.gz ISZNDKJQFKSMSY-KOMQPUFPSA-N 2 1 324.896 4.306 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2cccs2)s1)C[C@H]1CC[NH2+]C1 ZINC001236834839 1055285711 /nfs/dbraw/zinc/28/57/11/1055285711.db2.gz IRSNAWYDWYBXTG-AWEZNQCLSA-N 2 1 320.527 4.298 20 0 DIADMP CCC[N@H+](Cc1sc(Cl)c2ccccc21)C[C@@H]1CC[NH2+]C1 ZINC001236842894 1055286542 /nfs/dbraw/zinc/28/65/42/1055286542.db2.gz CAYNTSQXZKROJI-CYBMUJFWSA-N 2 1 322.905 4.376 20 0 DIADMP Cc1cccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1Cl ZINC001236854385 1055291405 /nfs/dbraw/zinc/29/14/05/1055291405.db2.gz RDGAECYXWLIUFO-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000764966019 1055307874 /nfs/dbraw/zinc/30/78/74/1055307874.db2.gz XOZLYVHCDGNAEL-HZPDHXFCSA-N 2 1 300.556 4.008 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1ccccc1OC(C)(C)C ZINC001237026407 1055342392 /nfs/dbraw/zinc/34/23/92/1055342392.db2.gz BQDNJJZNFKMODE-UHFFFAOYSA-N 2 1 306.494 4.028 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccccc1OC(C)(C)C ZINC001237026407 1055342404 /nfs/dbraw/zinc/34/24/04/1055342404.db2.gz BQDNJJZNFKMODE-UHFFFAOYSA-N 2 1 306.494 4.028 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)C1 ZINC001237057947 1055355859 /nfs/dbraw/zinc/35/58/59/1055355859.db2.gz ORUGWNKYRKBOLF-HXUWFJFHSA-N 2 1 310.441 4.040 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCC[C@@](C)(C[NH3+])C3)c2)cc1 ZINC001237081812 1055361919 /nfs/dbraw/zinc/36/19/19/1055361919.db2.gz MRGZWCYTDNJFEP-NRFANRHFSA-N 2 1 308.469 4.223 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1Oc1ccccc1 ZINC001237081989 1055362839 /nfs/dbraw/zinc/36/28/39/1055362839.db2.gz MHQFCXDTEKLBKK-JLYLLQBASA-N 2 1 322.452 4.181 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2ccc3cccccc2-3)CC1 ZINC001237185197 1055395538 /nfs/dbraw/zinc/39/55/38/1055395538.db2.gz MAUFMRSASSDHGY-UHFFFAOYSA-N 2 1 308.469 4.242 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc3ccccc3c2)CC[N@H+]1C ZINC000624267318 1055399432 /nfs/dbraw/zinc/39/94/32/1055399432.db2.gz JYTCGNYBOVUVHE-UZLBHIALSA-N 2 1 310.485 4.190 20 0 DIADMP CCc1cccc(C)c1C[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001237374294 1055442841 /nfs/dbraw/zinc/44/28/41/1055442841.db2.gz DFOSEECYFVEDPB-UHFFFAOYSA-N 2 1 320.480 4.152 20 0 DIADMP Cc1c(C[N@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cccc1-c1ccccc1 ZINC001237410954 1055449662 /nfs/dbraw/zinc/44/96/62/1055449662.db2.gz DYGIPLRZTZVKAN-RBBKRZOGSA-N 2 1 320.480 4.236 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]C2CCC(C)CC2)C[N@H+]1Cc1ccccc1 ZINC001620864097 1055491569 /nfs/dbraw/zinc/49/15/69/1055491569.db2.gz ODNACEAUJFVPHN-JLMIFGBASA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]C2CCC(C)CC2)C[N@H+]1Cc1ccccc1 ZINC001620864098 1055491926 /nfs/dbraw/zinc/49/19/26/1055491926.db2.gz ODNACEAUJFVPHN-OHWJTAOLSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]C2CCC(C)CC2)C[N@H+]1Cc1ccccc1 ZINC001620864100 1055492033 /nfs/dbraw/zinc/49/20/33/1055492033.db2.gz ODNACEAUJFVPHN-YWDUDDICSA-N 2 1 314.517 4.455 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC001620868615 1055496695 /nfs/dbraw/zinc/49/66/95/1055496695.db2.gz JTKTWLIFCVKPJH-NRFANRHFSA-N 2 1 316.533 4.343 20 0 DIADMP C[NH+](C)CCC[N@H+](C)Cc1cccc(-c2ccc(F)cc2F)c1 ZINC001237664065 1055497239 /nfs/dbraw/zinc/49/72/39/1055497239.db2.gz OJPZLZXNTNONHE-UHFFFAOYSA-N 2 1 318.411 4.015 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)Cc1cccc(-c2ccc(F)cc2F)c1 ZINC001237664065 1055497245 /nfs/dbraw/zinc/49/72/45/1055497245.db2.gz OJPZLZXNTNONHE-UHFFFAOYSA-N 2 1 318.411 4.015 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001620872960 1055501820 /nfs/dbraw/zinc/50/18/20/1055501820.db2.gz LLIZUYUQANHCJX-PWRODBHTSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001620898293 1055523032 /nfs/dbraw/zinc/52/30/32/1055523032.db2.gz OEGWQIUVFDRBNO-OAHLLOKOSA-N 2 1 300.446 4.095 20 0 DIADMP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCC[C@H](C(C)(C)C)CC2)CCCO1 ZINC001620899762 1055525445 /nfs/dbraw/zinc/52/54/45/1055525445.db2.gz NJIDZIJYFSMHSN-QYZOEREBSA-N 2 1 324.553 4.072 20 0 DIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H]2CCC[C@H](C(C)(C)C)CC2)CCCO1 ZINC001620899762 1055525461 /nfs/dbraw/zinc/52/54/61/1055525461.db2.gz NJIDZIJYFSMHSN-QYZOEREBSA-N 2 1 324.553 4.072 20 0 DIADMP C[C@H]1CCC[C@H]1C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001620913107 1055537602 /nfs/dbraw/zinc/53/76/02/1055537602.db2.gz UMGHPOFFBZRWBY-HKUYNNGSSA-N 2 1 302.506 4.170 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC001620925058 1055545101 /nfs/dbraw/zinc/54/51/01/1055545101.db2.gz YDNIGYIBKWJVBL-IZBJGVDFSA-N 2 1 302.506 4.279 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC001620925057 1055545596 /nfs/dbraw/zinc/54/55/96/1055545596.db2.gz YDNIGYIBKWJVBL-HNBVOPMISA-N 2 1 302.506 4.279 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC(F)(F)[C@@H](C)C3)cc21 ZINC001237880753 1055546716 /nfs/dbraw/zinc/54/67/16/1055546716.db2.gz JYPYXAAJUMYRPN-AWEZNQCLSA-N 2 1 320.427 4.165 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+](C)Cc3ccc(F)cc3)cc21 ZINC001237881834 1055547256 /nfs/dbraw/zinc/54/72/56/1055547256.db2.gz VZAPJJOOAKVLQN-UHFFFAOYSA-N 2 1 324.443 4.459 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCCC4(CCC4)C3)cc21 ZINC001237889351 1055550465 /nfs/dbraw/zinc/55/04/65/1055550465.db2.gz JADGRJODSFNNJZ-UHFFFAOYSA-N 2 1 310.485 4.454 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(C)c(OCC)c2)CC1 ZINC001238076346 1055601628 /nfs/dbraw/zinc/60/16/28/1055601628.db2.gz SWWZNYNNAXTGII-UHFFFAOYSA-N 2 1 318.505 4.090 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(C)c(OCC)c2)CC1 ZINC001238076346 1055601644 /nfs/dbraw/zinc/60/16/44/1055601644.db2.gz SWWZNYNNAXTGII-UHFFFAOYSA-N 2 1 318.505 4.090 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2c(C)cc(OC(C)C)cc2C)CC1 ZINC001238665240 1055713954 /nfs/dbraw/zinc/71/39/54/1055713954.db2.gz ZTAOEFBKVQYILG-UHFFFAOYSA-N 2 1 318.505 4.007 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2c(C)cc(OC(C)C)cc2C)CC1 ZINC001238665240 1055713967 /nfs/dbraw/zinc/71/39/67/1055713967.db2.gz ZTAOEFBKVQYILG-UHFFFAOYSA-N 2 1 318.505 4.007 20 0 DIADMP CSc1cc(C)cc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)c1 ZINC001238685737 1055720213 /nfs/dbraw/zinc/72/02/13/1055720213.db2.gz PQEQNUGGAHWBDN-UHFFFAOYSA-N 2 1 320.546 4.269 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCC[C@@]2(CCC[NH+](CCOC)C2)C1 ZINC001278273475 1055737689 /nfs/dbraw/zinc/73/76/89/1055737689.db2.gz XOMCWZWDWWHDND-VQTJNVASSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCC[C@@]2(CCC[N@H+](CCOC)C2)C1 ZINC001278273475 1055737696 /nfs/dbraw/zinc/73/76/96/1055737696.db2.gz XOMCWZWDWWHDND-VQTJNVASSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCC[C@@]2(CCC[N@@H+](CCOC)C2)C1 ZINC001278273475 1055737706 /nfs/dbraw/zinc/73/77/06/1055737706.db2.gz XOMCWZWDWWHDND-VQTJNVASSA-N 2 1 324.553 4.027 20 0 DIADMP CC[C@H](c1ccccc1OC)[N@H+](C)CCCCn1cc[nH+]c1C ZINC000347537224 1055787380 /nfs/dbraw/zinc/78/73/80/1055787380.db2.gz JMLOHNOSXWANSO-GOSISDBHSA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@H](c1ccccc1OC)[N@@H+](C)CCCCn1cc[nH+]c1C ZINC000347537224 1055787392 /nfs/dbraw/zinc/78/73/92/1055787392.db2.gz JMLOHNOSXWANSO-GOSISDBHSA-N 2 1 315.461 4.063 20 0 DIADMP CSc1ccc(C[NH2+]CCC[N@@H+](C)Cc2ccccc2)cc1 ZINC000061556844 1055869087 /nfs/dbraw/zinc/86/90/87/1055869087.db2.gz YKAVPFTWHMLNES-UHFFFAOYSA-N 2 1 314.498 4.020 20 0 DIADMP c1ccc(CC[N@H+]2CC[C@@H](C[NH2+]CC3CCCCCC3)C2)cc1 ZINC001620770258 1055938047 /nfs/dbraw/zinc/93/80/47/1055938047.db2.gz HBVLEUJAXAOQKE-NRFANRHFSA-N 2 1 314.517 4.111 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)C1CCCCC1 ZINC001620997119 1055966258 /nfs/dbraw/zinc/96/62/58/1055966258.db2.gz XMAHXOBLYVPJIA-IEBWSBKVSA-N 2 1 324.553 4.214 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+]CC[C@@H](C)[NH+](C)C ZINC001621021631 1055986651 /nfs/dbraw/zinc/98/66/51/1055986651.db2.gz QYPPKROUTYBBBL-OAHLLOKOSA-N 2 1 302.462 4.205 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c(C)c1 ZINC001620724905 1055987790 /nfs/dbraw/zinc/98/77/90/1055987790.db2.gz OACOQKWLJNABSW-MRXNPFEDSA-N 2 1 302.506 4.214 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001620798698 1055994293 /nfs/dbraw/zinc/99/42/93/1055994293.db2.gz TVPCHKMDKWZXMF-WIRSXHRWSA-N 2 1 312.501 4.380 20 0 DIADMP C[NH+](C)Cc1ccccc1-c1ccc2[nH]c3cc[nH+]cc3c2c1 ZINC001239686351 1056028622 /nfs/dbraw/zinc/02/86/22/1056028622.db2.gz OYHJTCMSTBHBJI-UHFFFAOYSA-N 2 1 301.393 4.445 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(C)ccc32)c1 ZINC000765775742 1056067117 /nfs/dbraw/zinc/06/71/17/1056067117.db2.gz NCJUSWISAMGIGB-NRFANRHFSA-N 2 1 308.469 4.224 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474460274 1056317947 /nfs/dbraw/zinc/31/79/47/1056317947.db2.gz LXIJUJLGEUVNHR-DNDYEEKYSA-N 2 1 308.432 4.064 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474723144 1056343292 /nfs/dbraw/zinc/34/32/92/1056343292.db2.gz DAECDYSIVYPASR-HESLUPGFSA-N 2 1 308.432 4.064 20 0 DIADMP CC[NH+](CC)C[C@@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474727506 1056343463 /nfs/dbraw/zinc/34/34/63/1056343463.db2.gz REZWACPMZOUWQQ-YIYPIFLZSA-N 2 1 314.926 4.213 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(C[NH2+]C(C)(C)C)cc2)nc1)C1CC1 ZINC001240365694 1056450600 /nfs/dbraw/zinc/45/06/00/1056450600.db2.gz AXDWQBGHBHDIFN-UHFFFAOYSA-N 2 1 323.484 4.231 20 0 DIADMP Cc1cc2[nH]ccc2c(C2=CCC[N@H+](Cc3ccccc3)C2)[nH+]1 ZINC001240385817 1056465482 /nfs/dbraw/zinc/46/54/82/1056465482.db2.gz LWXKYKVZOCKWKZ-UHFFFAOYSA-N 2 1 303.409 4.161 20 0 DIADMP Cc1cc2[nH]ccc2c(C2=CCC[N@@H+](Cc3ccccc3)C2)[nH+]1 ZINC001240385817 1056465497 /nfs/dbraw/zinc/46/54/97/1056465497.db2.gz LWXKYKVZOCKWKZ-UHFFFAOYSA-N 2 1 303.409 4.161 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@@H](C)c2ccc(Cl)cc2)C1 ZINC001116873897 1056508403 /nfs/dbraw/zinc/50/84/03/1056508403.db2.gz NJNOPQGVBGDQFC-OWCLPIDISA-N 2 1 308.897 4.154 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cs1 ZINC001615435542 1056510168 /nfs/dbraw/zinc/51/01/68/1056510168.db2.gz ACUUKTCFFVYQHF-QGZVFWFLSA-N 2 1 306.519 4.145 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cs1 ZINC001615435542 1056510183 /nfs/dbraw/zinc/51/01/83/1056510183.db2.gz ACUUKTCFFVYQHF-QGZVFWFLSA-N 2 1 306.519 4.145 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)CCC[NH+]1CCCCC1 ZINC001615510493 1056527144 /nfs/dbraw/zinc/52/71/44/1056527144.db2.gz TVSNFIWBLYHNFD-MRXNPFEDSA-N 2 1 308.897 4.079 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001615665354 1056557852 /nfs/dbraw/zinc/55/78/52/1056557852.db2.gz MXFBHVOEKDBGAS-NRSPTQNISA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001615665354 1056557862 /nfs/dbraw/zinc/55/78/62/1056557862.db2.gz MXFBHVOEKDBGAS-NRSPTQNISA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001615665354 1056557878 /nfs/dbraw/zinc/55/78/78/1056557878.db2.gz MXFBHVOEKDBGAS-NRSPTQNISA-N 2 1 314.517 4.267 20 0 DIADMP CC1(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCC1 ZINC001615740943 1056573984 /nfs/dbraw/zinc/57/39/84/1056573984.db2.gz YGJBPRNFWPPEDL-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP CC1(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCC1 ZINC001615740943 1056573997 /nfs/dbraw/zinc/57/39/97/1056573997.db2.gz YGJBPRNFWPPEDL-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP CC1(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCC1 ZINC001615740943 1056574007 /nfs/dbraw/zinc/57/40/07/1056574007.db2.gz YGJBPRNFWPPEDL-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP C=C/C=C/CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615846788 1056585997 /nfs/dbraw/zinc/58/59/97/1056585997.db2.gz ONQAOYCLKHFOIZ-ZCWZMJLSSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C/CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615846788 1056586009 /nfs/dbraw/zinc/58/60/09/1056586009.db2.gz ONQAOYCLKHFOIZ-ZCWZMJLSSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C/CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615846788 1056586018 /nfs/dbraw/zinc/58/60/18/1056586018.db2.gz ONQAOYCLKHFOIZ-ZCWZMJLSSA-N 2 1 310.485 4.105 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2ccccc2)CC1 ZINC001615868056 1056588932 /nfs/dbraw/zinc/58/89/32/1056588932.db2.gz MNLSKAKBHCZIKD-IBGZPJMESA-N 2 1 314.517 4.206 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](CC1CCCCC1)c1ccccc1 ZINC001616874622 1056731441 /nfs/dbraw/zinc/73/14/41/1056731441.db2.gz VSJJDQHUGIWJCI-FQEVSTJZSA-N 2 1 311.473 4.264 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](CC1CCCCC1)c1ccccc1 ZINC001616874624 1056732188 /nfs/dbraw/zinc/73/21/88/1056732188.db2.gz VSJJDQHUGIWJCI-HXUWFJFHSA-N 2 1 311.473 4.264 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000672605471 1056734997 /nfs/dbraw/zinc/73/49/97/1056734997.db2.gz LUVGVTYDMJPMKT-NBYUQASBSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CCCC3CC3)C2)s1 ZINC001617784387 1056882824 /nfs/dbraw/zinc/88/28/24/1056882824.db2.gz TWSXJGRGXKGBKO-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CCCC3CC3)C2)s1 ZINC001617784387 1056882832 /nfs/dbraw/zinc/88/28/32/1056882832.db2.gz TWSXJGRGXKGBKO-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCCC3CC3)C2)s1 ZINC001617784387 1056882835 /nfs/dbraw/zinc/88/28/35/1056882835.db2.gz TWSXJGRGXKGBKO-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP CC(C)CCC[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001617868895 1056892335 /nfs/dbraw/zinc/89/23/35/1056892335.db2.gz WNGBYOBTKJAKFR-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CCC[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001617868895 1056892340 /nfs/dbraw/zinc/89/23/40/1056892340.db2.gz WNGBYOBTKJAKFR-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CCC[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001617868895 1056892346 /nfs/dbraw/zinc/89/23/46/1056892346.db2.gz WNGBYOBTKJAKFR-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CCC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001618208288 1056934158 /nfs/dbraw/zinc/93/41/58/1056934158.db2.gz LXNAZCPCBLGFRY-UHFFFAOYSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCSc3c(Cl)cccc32)CC1 ZINC000358065061 1056970519 /nfs/dbraw/zinc/97/05/19/1056970519.db2.gz RGRFEHJVRMEHCU-INIZCTEOSA-N 2 1 324.921 4.339 20 0 DIADMP CC[NH+]1CCC(c2ccc(-c3c[nH+]c(N(C)C)cc3C)cc2)CC1 ZINC001241257166 1056983386 /nfs/dbraw/zinc/98/33/86/1056983386.db2.gz GREBKUKJKWSUCJ-UHFFFAOYSA-N 2 1 323.484 4.322 20 0 DIADMP CC(C)([NH3+])c1cccc(C2=CC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001241506319 1057076347 /nfs/dbraw/zinc/07/63/47/1057076347.db2.gz BZGVBIMEHMXFHX-UHFFFAOYSA-N 2 1 306.453 4.170 20 0 DIADMP CC[NH+](CC)Cc1ccc(-c2ccc(C[N@@H+](C)C3CC3)cn2)cc1 ZINC001241575820 1057096006 /nfs/dbraw/zinc/09/60/06/1057096006.db2.gz OTYGCOPKYJTXNH-UHFFFAOYSA-N 2 1 323.484 4.185 20 0 DIADMP CC[NH+](CC)Cc1ccc(-c2ccc3c(c2)CC[N@H+](C)C3)cc1 ZINC001241583049 1057097639 /nfs/dbraw/zinc/09/76/39/1057097639.db2.gz MQGOLGRWFUBEAQ-UHFFFAOYSA-N 2 1 308.469 4.183 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCSc3c(Cl)cccc32)C1 ZINC000361964808 1057103175 /nfs/dbraw/zinc/10/31/75/1057103175.db2.gz CKZCFALXBYDORT-ZENOOKHLSA-N 2 1 324.921 4.339 20 0 DIADMP Cc1ccc(F)c(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000172043943 1057246890 /nfs/dbraw/zinc/24/68/90/1057246890.db2.gz CEJSLKQIJRCCRI-UHFFFAOYSA-N 2 1 314.448 4.264 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2ccc(F)c(F)c2)CC1 ZINC000675495258 1057383887 /nfs/dbraw/zinc/38/38/87/1057383887.db2.gz FXVABHFHGPAONY-QGZVFWFLSA-N 2 1 322.443 4.019 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2-c2cccc(F)c2Cl)CC1 ZINC001242574927 1057410672 /nfs/dbraw/zinc/41/06/72/1057410672.db2.gz LHBYQBWBGCRUEI-UHFFFAOYSA-N 2 1 318.823 4.069 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000675777571 1057412361 /nfs/dbraw/zinc/41/23/61/1057412361.db2.gz YHIQOTZGDPEXEA-SFHVURJKSA-N 2 1 322.496 4.359 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccncc2)cc1 ZINC000675926903 1057432799 /nfs/dbraw/zinc/43/27/99/1057432799.db2.gz IUBNEFOPPJGJQM-JKSUJKDBSA-N 2 1 320.440 4.030 20 0 DIADMP c1cc(-c2ccccc2)sc1C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000073381208 1057508086 /nfs/dbraw/zinc/50/80/86/1057508086.db2.gz PCFROHHJFBIJLB-UHFFFAOYSA-N 2 1 312.482 4.132 20 0 DIADMP FC1(F)CCC[NH+](CCCC[N@@H+]2CCCC(F)(F)CC2)CC1 ZINC000625769506 1057513017 /nfs/dbraw/zinc/51/30/17/1057513017.db2.gz ISRQOSXZYWTLFG-UHFFFAOYSA-N 2 1 324.406 4.009 20 0 DIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000671770033 1057560147 /nfs/dbraw/zinc/56/01/47/1057560147.db2.gz QFCTYLMHRQQYSL-OTWHNJEPSA-N 2 1 320.908 4.296 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000161661207 1057600500 /nfs/dbraw/zinc/60/05/00/1057600500.db2.gz SGWNKSIGJIFGTR-NSHGMRRFSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)CCCCCCC[NH3+] ZINC000842476350 1057609276 /nfs/dbraw/zinc/60/92/76/1057609276.db2.gz MKPWVZUDADUNDV-OAHLLOKOSA-N 2 1 311.539 4.477 20 0 DIADMP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccoc2)C1 ZINC000727466747 1057655018 /nfs/dbraw/zinc/65/50/18/1057655018.db2.gz FAOGZKBNABYTRS-IRXDYDNUSA-N 2 1 312.457 4.047 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-c2cccnc2)cc1 ZINC000166765532 1057676797 /nfs/dbraw/zinc/67/67/97/1057676797.db2.gz SZNPAZASGGRJSQ-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP C1=CC[C@H](C[N@H+]2CCC[C@]3(CC[NH+](C4CCCC4)C3)C2)CC1 ZINC001278386352 1058023375 /nfs/dbraw/zinc/02/33/75/1058023375.db2.gz PBXCJVYODMPJPZ-ICSRJNTNSA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@H](C[NH+]2CCC[C@]3(CC[N@@H+](C4CCCC4)C3)C2)CC1 ZINC001278386352 1058023376 /nfs/dbraw/zinc/02/33/76/1058023376.db2.gz PBXCJVYODMPJPZ-ICSRJNTNSA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@H](C[NH+]2CCC[C@]3(CC[N@H+](C4CCCC4)C3)C2)CC1 ZINC001278386352 1058023378 /nfs/dbraw/zinc/02/33/78/1058023378.db2.gz PBXCJVYODMPJPZ-ICSRJNTNSA-N 2 1 302.506 4.073 20 0 DIADMP CC[C@@H](C)C[N@@H+]1C[C@@H]2CC[NH+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278393491 1058082940 /nfs/dbraw/zinc/08/29/40/1058082940.db2.gz XAFBPMHZPXWJDW-OAGGEKHMSA-N 2 1 320.443 4.019 20 0 DIADMP CC[C@@H](C)C[NH+]1C[C@@H]2CC[N@@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278393491 1058082942 /nfs/dbraw/zinc/08/29/42/1058082942.db2.gz XAFBPMHZPXWJDW-OAGGEKHMSA-N 2 1 320.443 4.019 20 0 DIADMP CC[C@@H](C)C[NH+]1C[C@@H]2CC[N@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278393491 1058082944 /nfs/dbraw/zinc/08/29/44/1058082944.db2.gz XAFBPMHZPXWJDW-OAGGEKHMSA-N 2 1 320.443 4.019 20 0 DIADMP Cc1ccc(C2([NH2+][C@H]3CC[C@H](c4[nH+]ccn4C)C3)CCC2)cc1 ZINC001550512888 1058341720 /nfs/dbraw/zinc/34/17/20/1058341720.db2.gz IULPOMOJSPRALO-WMZOPIPTSA-N 2 1 309.457 4.034 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[C@@H](c2[nH+]ccn2C)C1)c1cccc(C2CC2)c1 ZINC001550505031 1058341849 /nfs/dbraw/zinc/34/18/49/1058341849.db2.gz GUYVSUQDWSOPIF-KYNGSXCRSA-N 2 1 309.457 4.284 20 0 DIADMP Cc1ccccc1C1([NH2+][C@H]2CC[C@H](c3[nH+]ccn3C)C2)CCC1 ZINC001550512554 1058343610 /nfs/dbraw/zinc/34/36/10/1058343610.db2.gz AGRCEEZECUPSSL-IRXDYDNUSA-N 2 1 309.457 4.034 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC001246074977 1058667208 /nfs/dbraw/zinc/66/72/08/1058667208.db2.gz HNNVQOJNLSNCBI-NOHGZBONSA-N 2 1 301.261 4.173 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246076322 1058666273 /nfs/dbraw/zinc/66/62/73/1058666273.db2.gz NIKANTKHPDHPJV-GHJWDPDVSA-N 2 1 315.288 4.421 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cccc(Cl)c1F ZINC001246101783 1058677583 /nfs/dbraw/zinc/67/75/83/1058677583.db2.gz AYTDDAKLUMGGQR-LALPHHSUSA-N 2 1 312.860 4.296 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)ccc1Cl ZINC001246113491 1058683847 /nfs/dbraw/zinc/68/38/47/1058683847.db2.gz BJMNWQDLIHZRFP-SCUASFONSA-N 2 1 313.272 4.317 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246154847 1058698970 /nfs/dbraw/zinc/69/89/70/1058698970.db2.gz ROCNQUAAUFRUCD-HZPDHXFCSA-N 2 1 315.288 4.394 20 0 DIADMP CC[C@@H]1CC([NH2+]Cc2ccc(Cl)cc2Cl)C[C@@H](CC)[NH2+]1 ZINC001246179213 1058721885 /nfs/dbraw/zinc/72/18/85/1058721885.db2.gz DHAYKIQSIGMMGF-ZIAGYGMSSA-N 2 1 315.288 4.392 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246179789 1058728499 /nfs/dbraw/zinc/72/84/99/1058728499.db2.gz RRWXPZVBKIYNPQ-UFYCRDLUSA-N 2 1 312.432 4.360 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246189712 1058729594 /nfs/dbraw/zinc/72/95/94/1058729594.db2.gz DVMIUNLKUVIDSL-ALXJQNPVSA-N 2 1 310.441 4.098 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246185904 1058731820 /nfs/dbraw/zinc/73/18/20/1058731820.db2.gz WEBFENQSQISXQT-YYWHXJBOSA-N 2 1 324.443 4.204 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246189338 1058731999 /nfs/dbraw/zinc/73/19/99/1058731999.db2.gz CCSMZLNHMPTWGW-QUCCMNQESA-N 2 1 324.468 4.345 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246195457 1058737353 /nfs/dbraw/zinc/73/73/53/1058737353.db2.gz OFPLYFVYQQLVBT-SWLSCSKDSA-N 2 1 315.288 4.250 20 0 DIADMP CC1(C)C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246194732 1058739045 /nfs/dbraw/zinc/73/90/45/1058739045.db2.gz XXGGHWHOIHGWRT-KRWDZBQOSA-N 2 1 310.441 4.099 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccc(F)c(Cl)c1 ZINC001246212866 1058743038 /nfs/dbraw/zinc/74/30/38/1058743038.db2.gz OLNFOYFYMXCYKS-KFNAQCHYSA-N 2 1 312.860 4.296 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](C)c2ccc(Cl)c(F)c2)C[C@@H](CC)[NH2+]1 ZINC001246211459 1058743322 /nfs/dbraw/zinc/74/33/22/1058743322.db2.gz JXVXOCUFAOMRAE-MRVWCRGKSA-N 2 1 312.860 4.439 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Cl)c(F)c2)CC[NH2+]1 ZINC001246211731 1058745252 /nfs/dbraw/zinc/74/52/52/1058745252.db2.gz LJJICUHPHKJJOQ-YUELXQCFSA-N 2 1 312.860 4.441 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)c(Cl)c2)CC[NH2+]1 ZINC001246211509 1058745299 /nfs/dbraw/zinc/74/52/99/1058745299.db2.gz KFPIFVQHCVLYSF-YUELXQCFSA-N 2 1 312.860 4.441 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H](C)CCC(C)C)CC[NH2+]1 ZINC001246230857 1058753998 /nfs/dbraw/zinc/75/39/98/1058753998.db2.gz UBEMFJSDSNTTBJ-WDYCEAGBSA-N 2 1 306.469 4.342 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246230903 1058754618 /nfs/dbraw/zinc/75/46/18/1058754618.db2.gz ASERINBTSDFOBV-VDZJLULYSA-N 2 1 306.469 4.486 20 0 DIADMP CCCc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246229813 1058754832 /nfs/dbraw/zinc/75/48/32/1058754832.db2.gz LSOYGQMYXISTMA-LEWJYISDSA-N 2 1 308.469 4.222 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC001246237902 1058762697 /nfs/dbraw/zinc/76/26/97/1058762697.db2.gz JTOCCTFXORDORW-PWRODBHTSA-N 2 1 308.469 4.467 20 0 DIADMP CCCOc1cccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246243811 1058764373 /nfs/dbraw/zinc/76/43/73/1058764373.db2.gz NABBEBHYTGMYED-PZJWPPBQSA-N 2 1 324.468 4.058 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CC(C)(C)C1 ZINC001246250512 1058768023 /nfs/dbraw/zinc/76/80/23/1058768023.db2.gz QAGDARUUWLHZSW-BVBHFADKSA-N 2 1 300.490 4.284 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC(C)(C)C1 ZINC001246250518 1058769016 /nfs/dbraw/zinc/76/90/16/1058769016.db2.gz QAGDARUUWLHZSW-XGXHKWSGSA-N 2 1 300.490 4.284 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@H](C)C2CCCCC2)CC[NH2+]1 ZINC001246252351 1058769795 /nfs/dbraw/zinc/76/97/95/1058769795.db2.gz VNAZQYLRVATTEM-XFQXTVEOSA-N 2 1 318.480 4.486 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)cc(Cl)c1 ZINC001246255272 1058775499 /nfs/dbraw/zinc/77/54/99/1058775499.db2.gz VGJZPNFVNJYKRA-LTTZEQNMSA-N 2 1 313.272 4.317 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001246266710 1058780299 /nfs/dbraw/zinc/78/02/99/1058780299.db2.gz QYOLWRVKKXHAFU-QUIPCFFLSA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccccc1F ZINC001246270296 1058783080 /nfs/dbraw/zinc/78/30/80/1058783080.db2.gz AHFXIDCIBYTLJQ-WBAXXEDZSA-N 2 1 306.469 4.279 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1cc(F)ccc1F ZINC001246270031 1058783427 /nfs/dbraw/zinc/78/34/27/1058783427.db2.gz SSYKCGIWMWSHBE-KRXQYRFLSA-N 2 1 310.432 4.315 20 0 DIADMP CC[C@H]1CC([NH2+]C(C)(C)c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246275587 1058791751 /nfs/dbraw/zinc/79/17/51/1058791751.db2.gz AQICQYRSGGEXOF-HOTGVXAUSA-N 2 1 310.432 4.099 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246279443 1058795208 /nfs/dbraw/zinc/79/52/08/1058795208.db2.gz KESYFXPVONKETK-ZYSHUDEJSA-N 2 1 318.480 4.423 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)c(F)c1 ZINC001246281900 1058798718 /nfs/dbraw/zinc/79/87/18/1058798718.db2.gz ADPBCZQMZACVQD-AZOIQLNYSA-N 2 1 316.395 4.109 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246308384 1058815984 /nfs/dbraw/zinc/81/59/84/1058815984.db2.gz QTBQMXYUXBETKO-YYAJDYIMSA-N 2 1 304.453 4.176 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246307662 1058816441 /nfs/dbraw/zinc/81/64/41/1058816441.db2.gz NADLNIPUCIXZQF-JCGIZDLHSA-N 2 1 304.453 4.033 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(OC)c1 ZINC001246310947 1058821538 /nfs/dbraw/zinc/82/15/38/1058821538.db2.gz AQANMXPWTUPQGX-CEWLAPEOSA-N 2 1 324.468 4.229 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1ccc(F)cc1F ZINC001246317322 1058828172 /nfs/dbraw/zinc/82/81/72/1058828172.db2.gz MPSHBDDHVOYUKX-BASYENTBSA-N 2 1 310.432 4.315 20 0 DIADMP C[C@H](CC1CCCCC1)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246317711 1058828515 /nfs/dbraw/zinc/82/85/15/1058828515.db2.gz XOFAEMYSYJTLON-NSISKUIASA-N 2 1 300.490 4.428 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccc(F)cc1F ZINC001246319355 1058829645 /nfs/dbraw/zinc/82/96/45/1058829645.db2.gz WUSJASIICKWGJW-IAOVAPTHSA-N 2 1 310.432 4.172 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1CCC[NH2+][C@@H]1C ZINC001246324524 1058834151 /nfs/dbraw/zinc/83/41/51/1058834151.db2.gz HMVHYIVWHSVUGD-JBYIUTFZSA-N 2 1 322.496 4.327 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](CC(C)C)c2ccccn2)C[C@H](CC)[NH2+]1 ZINC001246325073 1058839970 /nfs/dbraw/zinc/83/99/70/1058839970.db2.gz IAEAOBJYLPQWSZ-VUHPKUFZSA-N 2 1 303.494 4.068 20 0 DIADMP FC(F)(F)[C@@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246340804 1058849281 /nfs/dbraw/zinc/84/92/81/1058849281.db2.gz LTPOWMVAMJCJNZ-HUUCEWRRSA-N 2 1 318.427 4.010 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+][C@@H](C[NH3+])C(C)(C)C ZINC001246345375 1058857079 /nfs/dbraw/zinc/85/70/79/1058857079.db2.gz MDBRBOFGXJKKSG-ZFWWWQNUSA-N 2 1 312.523 4.033 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246345101 1058857806 /nfs/dbraw/zinc/85/78/06/1058857806.db2.gz UJMQSOCQNGVURP-FGZHOGPDSA-N 2 1 322.496 4.435 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246351175 1058862827 /nfs/dbraw/zinc/86/28/27/1058862827.db2.gz SDMHOFXYABEVGS-JZXOWHBKSA-N 2 1 304.453 4.096 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1(C[NH3+])CCC1 ZINC001246357930 1058864120 /nfs/dbraw/zinc/86/41/20/1058864120.db2.gz WHLCQBWZEABYQH-KRWDZBQOSA-N 2 1 308.469 4.068 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360314 1058869197 /nfs/dbraw/zinc/86/91/97/1058869197.db2.gz FFIXGEIEJPPTFP-YOEHRIQHSA-N 2 1 306.881 4.085 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H]3CCCNc4ccccc43)CC[NH2+]2)cc1 ZINC001246358403 1058869512 /nfs/dbraw/zinc/86/95/12/1058869512.db2.gz PBASCIGZQHQVLF-YYWHXJBOSA-N 2 1 321.468 4.016 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]C2(c3ccccc3F)CCC2)C[C@H](CC)[NH2+]1 ZINC001246368985 1058871904 /nfs/dbraw/zinc/87/19/04/1058871904.db2.gz URPBEKQNQFBSRA-MUJYYYPQSA-N 2 1 304.453 4.104 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C[C@H]1C ZINC001246378886 1058881977 /nfs/dbraw/zinc/88/19/77/1058881977.db2.gz VEWZDUMVMZRVMI-BZUAXINKSA-N 2 1 320.908 4.333 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)CC1CCC1 ZINC001246387503 1058891568 /nfs/dbraw/zinc/89/15/68/1058891568.db2.gz GDLPLHJXQSDEIG-OALUTQOASA-N 2 1 300.490 4.286 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CCCCC2(C)C)CC[NH2+]1 ZINC001246392448 1058898162 /nfs/dbraw/zinc/89/81/62/1058898162.db2.gz DFQCIJAIKDPFRJ-YTQUADARSA-N 2 1 318.480 4.486 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246391739 1058899332 /nfs/dbraw/zinc/89/93/32/1058899332.db2.gz GTWMTAQBQGMWNO-ZYSHUDEJSA-N 2 1 304.453 4.033 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)c1 ZINC001246399164 1058900642 /nfs/dbraw/zinc/90/06/42/1058900642.db2.gz GGOXSOXUGMTYQS-PCCBWWKXSA-N 2 1 324.443 4.360 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C2CC2)c1 ZINC001246399161 1058901598 /nfs/dbraw/zinc/90/15/98/1058901598.db2.gz GGOXSOXUGMTYQS-NJDAHSKKSA-N 2 1 324.443 4.360 20 0 DIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246404311 1058903397 /nfs/dbraw/zinc/90/33/97/1058903397.db2.gz NEVHLTFZUAQLDJ-LHMCCDAXSA-N 3 1 323.569 4.056 20 0 DIADMP CCC(CC)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246404314 1058909064 /nfs/dbraw/zinc/90/90/64/1058909064.db2.gz NEVHLTFZUAQLDJ-ZIKBYYNKSA-N 3 1 323.569 4.056 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246408657 1058910151 /nfs/dbraw/zinc/91/01/51/1058910151.db2.gz VOLOFWJCBVRWMX-FFZOFVMBSA-N 2 1 318.480 4.423 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246408660 1058910768 /nfs/dbraw/zinc/91/07/68/1058910768.db2.gz VOLOFWJCBVRWMX-VDGAXYAQSA-N 2 1 318.480 4.423 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CC(C)(C)CC2CC2)CC[NH2+]1 ZINC001246430069 1058921114 /nfs/dbraw/zinc/92/11/14/1058921114.db2.gz FMCDXEMECSWTCG-MJGOQNOKSA-N 2 1 318.480 4.343 20 0 DIADMP CC1(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246427288 1058922303 /nfs/dbraw/zinc/92/23/03/1058922303.db2.gz KEBDLXVNSFZNMY-IRXDYDNUSA-N 2 1 322.443 4.285 20 0 DIADMP Cc1ccccc1C(C)(C)[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246440507 1058933056 /nfs/dbraw/zinc/93/30/56/1058933056.db2.gz VFUGNOWZQKLZRL-ICSRJNTNSA-N 2 1 308.469 4.313 20 0 DIADMP Clc1ccc([C@H]([NH2+]C2C[C@@H]3C=C[C@H](C2)[NH2+]3)c2ccccc2)cc1 ZINC001246443213 1058934307 /nfs/dbraw/zinc/93/43/07/1058934307.db2.gz MBYQFICPAGUGQT-JIRNRHONSA-N 2 1 324.855 4.078 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246456003 1058942315 /nfs/dbraw/zinc/94/23/15/1058942315.db2.gz JGNVLJDPUFISLF-DLBZAZTESA-N 2 1 316.489 4.191 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cn2)C2CC2)CC[NH2+]1 ZINC001246457555 1058943093 /nfs/dbraw/zinc/94/30/93/1058943093.db2.gz NEMVXBHDDOVKOQ-SOLBZPMBSA-N 2 1 321.896 4.087 20 0 DIADMP CC[C@]1([NH2+][C@@H](C)CCc2ccc(Cl)c(Cl)c2)CC[NH2+]C1 ZINC001246459783 1058944793 /nfs/dbraw/zinc/94/47/93/1058944793.db2.gz GQVWTVFUEJAGMH-LRDDRELGSA-N 2 1 315.288 4.046 20 0 DIADMP CCC[C@@]1(C[NH2+][C@@H](C)Cc2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246457327 1058946062 /nfs/dbraw/zinc/94/60/62/1058946062.db2.gz SIDVSYGUZFVIED-LRDDRELGSA-N 2 1 315.288 4.046 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cc(F)cc(F)c1 ZINC001246460655 1058947859 /nfs/dbraw/zinc/94/78/59/1058947859.db2.gz GLRQWVJNAFSRNT-ZACQAIPSSA-N 2 1 310.432 4.172 20 0 DIADMP Cc1ccc(C2([NH2+][C@H]3CCCC[NH2+]C3)CCC(F)(F)CC2)cc1 ZINC001246462923 1058951015 /nfs/dbraw/zinc/95/10/15/1058951015.db2.gz ZQRSKJBBLLUDRU-KRWDZBQOSA-N 2 1 322.443 4.131 20 0 DIADMP Cc1cccc(C2([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)c1 ZINC001246477963 1058962076 /nfs/dbraw/zinc/96/20/76/1058962076.db2.gz KYEWYHYGBOKTTN-UXHICEINSA-N 2 1 306.453 4.067 20 0 DIADMP FC1(F)C[NH2+]CC[C@H]1CC[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001246490136 1058965936 /nfs/dbraw/zinc/96/59/36/1058965936.db2.gz QFLIYLGJVQNQNM-JKSUJKDBSA-N 2 1 314.464 4.104 20 0 DIADMP FC1(F)C[NH2+]CC[C@@H]1CC[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246491865 1058966654 /nfs/dbraw/zinc/96/66/54/1058966654.db2.gz UVTBFMOMYARCNA-OAHLLOKOSA-N 2 1 314.464 4.104 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H]1CCc2cc(Cl)ccc2C1 ZINC001246498304 1058974028 /nfs/dbraw/zinc/97/40/28/1058974028.db2.gz VTKIWAKHPQDINB-QGZVFWFLSA-N 2 1 308.897 4.085 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H]1CCc2cc(Cl)ccc2C1 ZINC001246498301 1058974174 /nfs/dbraw/zinc/97/41/74/1058974174.db2.gz VTKIWAKHPQDINB-KRWDZBQOSA-N 2 1 308.897 4.085 20 0 DIADMP CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)CC(C)(C)SCc1ccco1 ZINC001246503888 1058974715 /nfs/dbraw/zinc/97/47/15/1058974715.db2.gz MPSBYFRDGUZMEB-CABCVRRESA-N 2 1 312.523 4.033 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246499556 1058974985 /nfs/dbraw/zinc/97/49/85/1058974985.db2.gz LCHQGLPOFTUGLX-SPYBWZPUSA-N 2 1 322.443 4.243 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H](C)Cc1ccc(F)cc1Cl ZINC001246503852 1058975144 /nfs/dbraw/zinc/97/51/44/1058975144.db2.gz NDPWPDJJLFJJMA-ZDUSSCGKSA-N 2 1 314.876 4.297 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H]2CCOc3ccc(Cl)cc32)C[C@@H](CC)[NH2+]1 ZINC001246511567 1058976738 /nfs/dbraw/zinc/97/67/38/1058976738.db2.gz JXLLVJXFZJNFGV-CKEIUWERSA-N 2 1 322.880 4.062 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246520101 1058981707 /nfs/dbraw/zinc/98/17/07/1058981707.db2.gz QSLGHOIKWWARCU-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001246521762 1058983434 /nfs/dbraw/zinc/98/34/34/1058983434.db2.gz FBLSLNXDQIOQEF-FQEVSTJZSA-N 2 1 314.517 4.254 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](C(C)(C)C)C2)c1 ZINC001246536450 1058985949 /nfs/dbraw/zinc/98/59/49/1058985949.db2.gz FNWJYVWOHAYTLA-QYZOEREBSA-N 2 1 300.490 4.299 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530799 1058986917 /nfs/dbraw/zinc/98/69/17/1058986917.db2.gz QFDWRTADPPSBKF-PMACEKPBSA-N 2 1 308.469 4.238 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2cccc(C)c2)C[C@@H](CC)[NH2+]1 ZINC001246536434 1058987272 /nfs/dbraw/zinc/98/72/72/1058987272.db2.gz FLMCZNFNDLESLV-GGPKGHCWSA-N 2 1 300.490 4.441 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(C)c2)C[C@H](CC)[NH2+]1 ZINC001246536436 1058987613 /nfs/dbraw/zinc/98/76/13/1058987613.db2.gz FLMCZNFNDLESLV-NMLBUPMWSA-N 2 1 300.490 4.441 20 0 DIADMP C1CCC2(CC1)CCC[C@H]([N@H+]1CCCC3(CC[NH2+]CC3)C1)C2 ZINC001246523077 1058988081 /nfs/dbraw/zinc/98/80/81/1058988081.db2.gz LYSFLTRAAYREKO-SFHVURJKSA-N 2 1 304.522 4.345 20 0 DIADMP c1ccc([C@H]2CCC[C@@H]([N@H+]3CCCC4(CC[NH2+]CC4)C3)C2)cc1 ZINC001246524890 1058988462 /nfs/dbraw/zinc/98/84/62/1058988462.db2.gz UQWBLPMMJZZKPA-VQTJNVASSA-N 2 1 312.501 4.178 20 0 DIADMP Clc1ccc(C2=CC[N@H+]([C@H]3CC[NH2+]C4(CCC4)C3)CC2)cc1 ZINC001246536604 1058988818 /nfs/dbraw/zinc/98/88/18/1058988818.db2.gz RQKYLHRJKRFGMY-SFHVURJKSA-N 2 1 316.876 4.104 20 0 DIADMP CC(C)(C)C1CC[NH+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246540610 1058991523 /nfs/dbraw/zinc/99/15/23/1058991523.db2.gz BQJYOTDNHGHXSW-RBUKOAKNSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]([NH3+])CC1 ZINC001246541030 1058992014 /nfs/dbraw/zinc/99/20/14/1058992014.db2.gz LKVWGRJSOSFWEJ-NQIIRXRSSA-N 2 1 322.496 4.410 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@@](C)([NH3+])C1 ZINC001246540168 1058993044 /nfs/dbraw/zinc/99/30/44/1058993044.db2.gz LGYMPQCFYLWNAE-BLLLJJGKSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@](C)([NH3+])C1 ZINC001246540168 1058993060 /nfs/dbraw/zinc/99/30/60/1058993060.db2.gz LGYMPQCFYLWNAE-BLLLJJGKSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246542519 1058994158 /nfs/dbraw/zinc/99/41/58/1058994158.db2.gz PUPASPDXWBKVIT-TZMCWYRMSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]([NH3+])CC1 ZINC001246541031 1058995048 /nfs/dbraw/zinc/99/50/48/1058995048.db2.gz LKVWGRJSOSFWEJ-RXVVDRJESA-N 2 1 322.496 4.410 20 0 DIADMP C[C@@H]1CC[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC[C@H]1C[NH3+] ZINC001246555347 1058996855 /nfs/dbraw/zinc/99/68/55/1058996855.db2.gz DTXXRRTVTKHXAH-LMCOJAPRSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246561506 1058998860 /nfs/dbraw/zinc/99/88/60/1058998860.db2.gz USHKDJMYFOIRBJ-UXHICEINSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[N@@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546491 1058999042 /nfs/dbraw/zinc/99/90/42/1058999042.db2.gz KKNPDDGZTFHTFF-PBEJRMEISA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546491 1058999059 /nfs/dbraw/zinc/99/90/59/1058999059.db2.gz KKNPDDGZTFHTFF-PBEJRMEISA-N 2 1 306.453 4.099 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246562260 1059002134 /nfs/dbraw/zinc/00/21/34/1059002134.db2.gz XKLRZRPIHAPGBH-OALUTQOASA-N 2 1 302.506 4.311 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC001246561409 1059003532 /nfs/dbraw/zinc/00/35/32/1059003532.db2.gz SKSXVXSDEOKJQE-BJZITVGISA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCCC[C@@H](C)C2)CC[NH2+]1 ZINC001246561409 1059003550 /nfs/dbraw/zinc/00/35/50/1059003550.db2.gz SKSXVXSDEOKJQE-BJZITVGISA-N 2 1 304.453 4.049 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246565033 1059003591 /nfs/dbraw/zinc/00/35/91/1059003591.db2.gz ZZEDGMQKQAEKGU-MANSERQUSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246561508 1059003742 /nfs/dbraw/zinc/00/37/42/1059003742.db2.gz USHKDJMYFOIRBJ-WOJBJXKFSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[N@H+](C2CCC(Cc3ccccc3)CC2)CCC[C@H]1C[NH3+] ZINC001246563424 1059003829 /nfs/dbraw/zinc/00/38/29/1059003829.db2.gz QUPHXSPJKBOBGW-PPXMBRMGSA-N 2 1 314.517 4.095 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246564508 1059004543 /nfs/dbraw/zinc/00/45/43/1059004543.db2.gz XOIGMZCMAXRNQW-HBMCJLEFSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246564508 1059004566 /nfs/dbraw/zinc/00/45/66/1059004566.db2.gz XOIGMZCMAXRNQW-HBMCJLEFSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246564514 1059004728 /nfs/dbraw/zinc/00/47/28/1059004728.db2.gz XOIGMZCMAXRNQW-NJYVYQBISA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246564514 1059004749 /nfs/dbraw/zinc/00/47/49/1059004749.db2.gz XOIGMZCMAXRNQW-NJYVYQBISA-N 2 1 324.443 4.456 20 0 DIADMP CCCCCC1CCC([N@H+]2CCC(F)(F)[C@H](C[NH3+])C2)CC1 ZINC001246562732 1059005229 /nfs/dbraw/zinc/00/52/29/1059005229.db2.gz ZHUJWWSLKUEKOW-HWOWSKLDSA-N 2 1 302.453 4.041 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246563021 1059007138 /nfs/dbraw/zinc/00/71/38/1059007138.db2.gz NXSGVOUQYGXREV-GPJFCIFZSA-N 2 1 316.464 4.275 20 0 DIADMP [NH3+][C@H]1CC[N@@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@H]1F ZINC001246588332 1059009059 /nfs/dbraw/zinc/00/90/59/1059009059.db2.gz PVGWEWVLUIFPLS-SYNTWQANSA-N 2 1 324.871 4.127 20 0 DIADMP [NH3+][C@H]1CC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@H]1F ZINC001246588332 1059009082 /nfs/dbraw/zinc/00/90/82/1059009082.db2.gz PVGWEWVLUIFPLS-SYNTWQANSA-N 2 1 324.871 4.127 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001246581806 1059010353 /nfs/dbraw/zinc/01/03/53/1059010353.db2.gz AWEMXCGDUDCYMX-ICSRJNTNSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+](C2CCC(c3ccccc3)CC2)CC1 ZINC001246575626 1059010813 /nfs/dbraw/zinc/01/08/13/1059010813.db2.gz KMRMSXRMSQRPDN-MHJFOBGBSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CCc2cc(Cl)ccc2C1)[C@H]1CCC[NH2+]CC1 ZINC001246581822 1059011355 /nfs/dbraw/zinc/01/13/55/1059011355.db2.gz AXIKYMPDXLPYSG-RBUKOAKNSA-N 2 1 320.908 4.050 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001246581146 1059011807 /nfs/dbraw/zinc/01/18/07/1059011807.db2.gz XYNIRYAMOLRCKW-VQTJNVASSA-N 2 1 302.506 4.095 20 0 DIADMP CCC1CC[NH+]([C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CC1 ZINC001246587018 1059012115 /nfs/dbraw/zinc/01/21/15/1059012115.db2.gz DGRPJCXRMGSVBQ-IEBWSBKVSA-N 2 1 304.453 4.049 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001246585008 1059012901 /nfs/dbraw/zinc/01/29/01/1059012901.db2.gz NQDUFWSLGKYUIP-WOJBJXKFSA-N 2 1 302.506 4.239 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1ccc(Cl)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001246590674 1059015642 /nfs/dbraw/zinc/01/56/42/1059015642.db2.gz HQXIBRLCHGPFNJ-CRAIPNDOSA-N 2 1 308.897 4.124 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@H+](C2CCC(Cc3ccccc3)CC2)C1 ZINC001246595937 1059016117 /nfs/dbraw/zinc/01/61/17/1059016117.db2.gz UHEPUGQJVXALOT-XVAXZDLZSA-N 2 1 314.517 4.239 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1C[C@H](C[NH3+])CC[C@H]1C ZINC001246593663 1059018527 /nfs/dbraw/zinc/01/85/27/1059018527.db2.gz SINXNHIFWRBTPP-PMPSAXMXSA-N 2 1 324.534 4.129 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246608937 1059026527 /nfs/dbraw/zinc/02/65/27/1059026527.db2.gz WBYAQCZQDZKYRM-SFTDATJTSA-N 2 1 314.517 4.396 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001246608143 1059027672 /nfs/dbraw/zinc/02/76/72/1059027672.db2.gz SXYSMLALHYCWNE-PKOBYXMFSA-N 2 1 318.530 4.084 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CCC[C@@]4(CCC[NH2+]4)C3)CC2)cc1 ZINC001246619810 1059031997 /nfs/dbraw/zinc/03/19/97/1059031997.db2.gz MMEKGOMZBRQQAF-CBNMVNINSA-N 2 1 312.501 4.006 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001246616285 1059033040 /nfs/dbraw/zinc/03/30/40/1059033040.db2.gz GXMZNHMFKVINSE-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@H+]3CCC[C@]4(CCCC[NH2+]4)C3)C2)cc1 ZINC001246616255 1059033223 /nfs/dbraw/zinc/03/32/23/1059033223.db2.gz UYLYAORUGYELNB-QHAWAJNXSA-N 2 1 312.501 4.321 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001246619857 1059033441 /nfs/dbraw/zinc/03/34/41/1059033441.db2.gz JAAPAMDEOFYISC-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(C2CCC([N@H+]3CCC[C@]4(CCCC[NH2+]4)C3)CC2)cc1 ZINC001246617082 1059034502 /nfs/dbraw/zinc/03/45/02/1059034502.db2.gz XPMBUHQWERUNGU-XVAXZDLZSA-N 2 1 312.501 4.321 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH+]1CCC2(CCC[NH2+]2)CC1 ZINC001246623910 1059036435 /nfs/dbraw/zinc/03/64/35/1059036435.db2.gz MCWKQUXWTHHEFR-AWEZNQCLSA-N 2 1 324.921 4.039 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246634372 1059038863 /nfs/dbraw/zinc/03/88/63/1059038863.db2.gz NASMAGIUNDFHHT-RTWAWAEBSA-N 2 1 314.517 4.396 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001246628651 1059039572 /nfs/dbraw/zinc/03/95/72/1059039572.db2.gz BXTQUYZCOJCCTI-MJGOQNOKSA-N 2 1 318.530 4.084 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CC[C@]2(CC[NH2+]2)C1 ZINC001246633010 1059039654 /nfs/dbraw/zinc/03/96/54/1059039654.db2.gz BJTUQFYBFOSONN-PGRDOPGGSA-N 2 1 320.480 4.035 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@]2(CC[NH2+]2)C1 ZINC001246633010 1059039672 /nfs/dbraw/zinc/03/96/72/1059039672.db2.gz BJTUQFYBFOSONN-PGRDOPGGSA-N 2 1 320.480 4.035 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001246628648 1059041317 /nfs/dbraw/zinc/04/13/17/1059041317.db2.gz BXTQUYZCOJCCTI-HKUYNNGSSA-N 2 1 318.530 4.084 20 0 DIADMP CCCCCC[C@@H](CCC)[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001246637015 1059042395 /nfs/dbraw/zinc/04/23/95/1059042395.db2.gz IJSFZTYPITYBKG-SJORKVTESA-N 2 1 316.480 4.446 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246635519 1059042741 /nfs/dbraw/zinc/04/27/41/1059042741.db2.gz RWGJTUHIYUUUMR-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CCCC[C@]34CC[NH2+]C4)CC2)cc1 ZINC001246643101 1059046657 /nfs/dbraw/zinc/04/66/57/1059046657.db2.gz LXVLZVRJGNLHFS-XVAXZDLZSA-N 2 1 312.501 4.006 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CCC34CC[NH2+]CC4)CC2)cc1 ZINC001246642172 1059048967 /nfs/dbraw/zinc/04/89/67/1059048967.db2.gz KWWDYEQUNAZFAE-UHFFFAOYSA-N 2 1 318.892 4.194 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246643925 1059049156 /nfs/dbraw/zinc/04/91/56/1059049156.db2.gz IAHPRZHFUHXJSB-KXBFYZLASA-N 2 1 320.908 4.125 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246643923 1059049387 /nfs/dbraw/zinc/04/93/87/1059049387.db2.gz IAHPRZHFUHXJSB-DNVCBOLYSA-N 2 1 320.908 4.125 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246644726 1059050030 /nfs/dbraw/zinc/05/00/30/1059050030.db2.gz LKNPBNARFCJGAP-KXBFYZLASA-N 2 1 320.908 4.125 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001246641240 1059050365 /nfs/dbraw/zinc/05/03/65/1059050365.db2.gz CIXLZQSGGYSVMU-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]2C[C@H]1C[C@@H]2[NH3+] ZINC001246657851 1059052935 /nfs/dbraw/zinc/05/29/35/1059052935.db2.gz JWXWLYATCDLWOJ-CJFIXGCPSA-N 2 1 320.480 4.019 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001246651010 1059053782 /nfs/dbraw/zinc/05/37/82/1059053782.db2.gz VOZFMVWRUBTHCN-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001246651006 1059055469 /nfs/dbraw/zinc/05/54/69/1059055469.db2.gz VOZFMVWRUBTHCN-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001246651008 1059055543 /nfs/dbraw/zinc/05/55/43/1059055543.db2.gz VOZFMVWRUBTHCN-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP CC(C)CC[C@H](C)[N@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246675154 1059060221 /nfs/dbraw/zinc/06/02/21/1059060221.db2.gz WHBXALSBHSFGON-CEWLAPEOSA-N 2 1 314.517 4.064 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1C1CCC2(CC[NH2+]CC2)CC1 ZINC001246678595 1059062339 /nfs/dbraw/zinc/06/23/39/1059062339.db2.gz GARFRWAXPFFIJI-HXUWFJFHSA-N 2 1 312.501 4.444 20 0 DIADMP CC1(C)CCC[C@@H]([N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)C1 ZINC001246677301 1059062944 /nfs/dbraw/zinc/06/29/44/1059062944.db2.gz CXMCQUBTFPVEIF-SFHLNBCPSA-N 2 1 312.501 4.034 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)C2)cc1 ZINC001246678038 1059064618 /nfs/dbraw/zinc/06/46/18/1059064618.db2.gz LVBBHYJKDGCPQC-MHTWAQMVSA-N 2 1 312.501 4.034 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)CC1CC[NH2+]CC1 ZINC001246682509 1059065390 /nfs/dbraw/zinc/06/53/90/1059065390.db2.gz VFQMDPXFXKPEEI-HNNXBMFYSA-N 2 1 324.534 4.001 20 0 DIADMP CC(C)CC[C@H](C)[N@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1 ZINC001246679108 1059065687 /nfs/dbraw/zinc/06/56/87/1059065687.db2.gz YSUCYDAOLGCCFY-DFQSSKMNSA-N 2 1 300.490 4.033 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@]3(C2)C[NH2+]CC[C@@H]3F)CC1 ZINC001246687704 1059068756 /nfs/dbraw/zinc/06/87/56/1059068756.db2.gz DWNHXORARDGOAY-BXNZUYAZSA-N 2 1 310.501 4.005 20 0 DIADMP CCCCC[C@@H](C)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246683399 1059070312 /nfs/dbraw/zinc/07/03/12/1059070312.db2.gz JEFDYKRXDPSAJY-RLLQIKCJSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)C1CC[NH2+]CC1 ZINC001246698013 1059070354 /nfs/dbraw/zinc/07/03/54/1059070354.db2.gz VTZCPQIYQFPBSY-SFHVURJKSA-N 2 1 322.496 4.281 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246773334 1059071585 /nfs/dbraw/zinc/07/15/85/1059071585.db2.gz AVFPPWWSSZDIEM-VSKRKVRLSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@@H]2CCC[N@@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246773334 1059071609 /nfs/dbraw/zinc/07/16/09/1059071609.db2.gz AVFPPWWSSZDIEM-VSKRKVRLSA-N 2 1 320.480 4.359 20 0 DIADMP C[N@H+](CCCc1ccccc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246773647 1059073827 /nfs/dbraw/zinc/07/38/27/1059073827.db2.gz CBILMWRGLKMILF-LEWJYISDSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@@H+](CCCc1ccccc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246773647 1059073850 /nfs/dbraw/zinc/07/38/50/1059073850.db2.gz CBILMWRGLKMILF-LEWJYISDSA-N 2 1 308.469 4.044 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H](C[NH3+])C1 ZINC001246779444 1059077799 /nfs/dbraw/zinc/07/77/99/1059077799.db2.gz GYAWZHONPAFBCA-RTBURBONSA-N 2 1 322.496 4.268 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](Cc3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246776767 1059078231 /nfs/dbraw/zinc/07/82/31/1059078231.db2.gz PBJXJCCXALZFOF-BURNTYAHSA-N 2 1 314.517 4.250 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+](C3CCC4(CC[NH2+]CC4)CC3)C2)cc1 ZINC001246781748 1059078517 /nfs/dbraw/zinc/07/85/17/1059078517.db2.gz XWGWSAAKKMIYSR-IBGZPJMESA-N 2 1 312.501 4.178 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246776544 1059078707 /nfs/dbraw/zinc/07/87/07/1059078707.db2.gz OBQCPAYPOHZMAV-UFYCRDLUSA-N 2 1 314.517 4.108 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246783082 1059078970 /nfs/dbraw/zinc/07/89/70/1059078970.db2.gz WEALDFYNMDTOTH-KBWCOIMZSA-N 2 1 312.501 4.444 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783591 1059083499 /nfs/dbraw/zinc/08/34/99/1059083499.db2.gz PKALHRVIAYPQLS-JFNPMQPZSA-N 2 1 304.522 4.054 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCCC[C@@H]2c2ccccc2F)CC[NH2+]1 ZINC001246785593 1059086209 /nfs/dbraw/zinc/08/62/09/1059086209.db2.gz KMGPCVSZJTXMCG-AYOQOUSVSA-N 2 1 304.453 4.129 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(OC)cc2)CC[NH2+]1 ZINC001246788338 1059086987 /nfs/dbraw/zinc/08/69/87/1059086987.db2.gz RDOOVNNCMDODHC-QWFCFKBJSA-N 2 1 316.489 4.143 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+]C2(CCCCC2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783967 1059087282 /nfs/dbraw/zinc/08/72/82/1059087282.db2.gz SEYCFUACIMMLGM-VJJCQHNBSA-N 2 1 316.533 4.342 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2C2CCC3(C[NH2+]C3)CC2)cc1 ZINC001246784152 1059087521 /nfs/dbraw/zinc/08/75/21/1059087521.db2.gz FEVRHNFGOIFRSD-QGZVFWFLSA-N 2 1 304.865 4.009 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(OC)cc2)C[C@H](CC)[NH2+]1 ZINC001246790487 1059090704 /nfs/dbraw/zinc/09/07/04/1059090704.db2.gz WSUSULINNXTGAM-XFKSJGNHSA-N 2 1 316.489 4.141 20 0 DIADMP c1ccc(C[C@@H]2CC[N@@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246791647 1059092722 /nfs/dbraw/zinc/09/27/22/1059092722.db2.gz LKTAXNZUADDJRK-NNWRFLSQSA-N 2 1 320.480 4.044 20 0 DIADMP c1ccc(C[C@@H]2CC[N@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246791647 1059092745 /nfs/dbraw/zinc/09/27/45/1059092745.db2.gz LKTAXNZUADDJRK-NNWRFLSQSA-N 2 1 320.480 4.044 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246789139 1059093234 /nfs/dbraw/zinc/09/32/34/1059093234.db2.gz JFNHZANANMJOBG-WMLDXEAASA-N 2 1 304.865 4.152 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246793085 1059094402 /nfs/dbraw/zinc/09/44/02/1059094402.db2.gz CZXHNJUJWBJAJH-MANSERQUSA-N 2 1 304.453 4.272 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2F)CC[NH2+]1 ZINC001246795135 1059094866 /nfs/dbraw/zinc/09/48/66/1059094866.db2.gz IEGWMVVRRQABNF-GPMSIDNRSA-N 2 1 304.453 4.273 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246792466 1059097248 /nfs/dbraw/zinc/09/72/48/1059097248.db2.gz SRHWZHMOOUYHJH-ZYSHUDEJSA-N 2 1 318.892 4.399 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246792463 1059098063 /nfs/dbraw/zinc/09/80/63/1059098063.db2.gz SRHWZHMOOUYHJH-AYOQOUSVSA-N 2 1 318.892 4.399 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801529 1059100129 /nfs/dbraw/zinc/10/01/29/1059100129.db2.gz IKJGOLGGPVUAOB-PKOBYXMFSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801529 1059100148 /nfs/dbraw/zinc/10/01/48/1059100148.db2.gz IKJGOLGGPVUAOB-PKOBYXMFSA-N 2 1 316.464 4.193 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001246807739 1059100360 /nfs/dbraw/zinc/10/03/60/1059100360.db2.gz QUBGTKRHNLEREN-OPYAIIAOSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001246807739 1059100388 /nfs/dbraw/zinc/10/03/88/1059100388.db2.gz QUBGTKRHNLEREN-OPYAIIAOSA-N 2 1 324.443 4.108 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246798232 1059101047 /nfs/dbraw/zinc/10/10/47/1059101047.db2.gz MTKRCIWLFINNLG-GUDVDZBRSA-N 2 1 304.453 4.273 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1C1CCC2(CC[NH2+]CC2)CC1 ZINC001246801091 1059101330 /nfs/dbraw/zinc/10/13/30/1059101330.db2.gz YROZCBOHJVGDKG-IBGZPJMESA-N 2 1 316.464 4.275 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801521 1059102343 /nfs/dbraw/zinc/10/23/43/1059102343.db2.gz IKJGOLGGPVUAOB-IEBWSBKVSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801521 1059102359 /nfs/dbraw/zinc/10/23/59/1059102359.db2.gz IKJGOLGGPVUAOB-IEBWSBKVSA-N 2 1 316.464 4.193 20 0 DIADMP C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246814319 1059104694 /nfs/dbraw/zinc/10/46/94/1059104694.db2.gz PYFQLAPJFIAXKL-GOSISDBHSA-N 2 1 316.565 4.041 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246807857 1059107166 /nfs/dbraw/zinc/10/71/66/1059107166.db2.gz UEMVSOZRQPQWTA-CTNGQTDRSA-N 2 1 320.480 4.165 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2CCCCCCC2)CC[NH2+]1 ZINC001246815266 1059107460 /nfs/dbraw/zinc/10/74/60/1059107460.db2.gz WVDUCIPTCSPAQV-HKUYNNGSSA-N 2 1 304.453 4.193 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]([NH3+])CC[C@@H]1C ZINC001246818425 1059109247 /nfs/dbraw/zinc/10/92/47/1059109247.db2.gz BYJCSQSGOBORTL-MBNYWOFBSA-N 2 1 315.288 4.126 20 0 DIADMP Clc1ccc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821008 1059109391 /nfs/dbraw/zinc/10/93/91/1059109391.db2.gz HPIUYGROLAEZEM-CHWSQXEVSA-N 2 1 310.894 4.213 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821008 1059109407 /nfs/dbraw/zinc/10/94/07/1059109407.db2.gz HPIUYGROLAEZEM-CHWSQXEVSA-N 2 1 310.894 4.213 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)s1 ZINC001246822561 1059111226 /nfs/dbraw/zinc/11/12/26/1059111226.db2.gz LMHODICGTFFNGD-ZQIUZPCESA-N 2 1 324.921 4.461 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)s1 ZINC001246822560 1059112294 /nfs/dbraw/zinc/11/22/94/1059112294.db2.gz LMHODICGTFFNGD-KEYYUXOJSA-N 2 1 324.921 4.461 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246838744 1059117167 /nfs/dbraw/zinc/11/71/67/1059117167.db2.gz FOEULGLCNSIAMF-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](CC)Cc2ccc(Cl)cc2)C[C@H](CC)[NH2+]1 ZINC001246842892 1059117242 /nfs/dbraw/zinc/11/72/42/1059117242.db2.gz CSYAQOLRDAWTNC-BCDXTJNWSA-N 2 1 308.897 4.471 20 0 DIADMP CCC(CC)[N@H+](CC)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246839492 1059118089 /nfs/dbraw/zinc/11/80/89/1059118089.db2.gz IVBBEBFNTLBYOH-MJGOQNOKSA-N 2 1 306.469 4.438 20 0 DIADMP CCC(CC)[N@@H+](CC)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246839492 1059118102 /nfs/dbraw/zinc/11/81/02/1059118102.db2.gz IVBBEBFNTLBYOH-MJGOQNOKSA-N 2 1 306.469 4.438 20 0 DIADMP c1ccc(CC[N@@H+](Cc2ccccc2)[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246841419 1059118424 /nfs/dbraw/zinc/11/84/24/1059118424.db2.gz RGOIZLXNAHGALO-ZBYYUNFXSA-N 2 1 320.480 4.014 20 0 DIADMP CC1(C)C[C@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC[NH2+]1 ZINC001246842703 1059119182 /nfs/dbraw/zinc/11/91/82/1059119182.db2.gz UUMDGBWNGLNEAU-OAQYLSRUSA-N 2 1 322.496 4.262 20 0 DIADMP COc1ccccc1[C@@H](C)[N@H+](C)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841584 1059119437 /nfs/dbraw/zinc/11/94/37/1059119437.db2.gz UVCSCBMLSLNPRW-SJORKVTESA-N 2 1 316.489 4.143 20 0 DIADMP COc1ccccc1[C@@H](C)[N@@H+](C)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841584 1059119444 /nfs/dbraw/zinc/11/94/44/1059119444.db2.gz UVCSCBMLSLNPRW-SJORKVTESA-N 2 1 316.489 4.143 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246844911 1059123220 /nfs/dbraw/zinc/12/32/20/1059123220.db2.gz DJNFCDSBGJWGHU-PBHICJAKSA-N 2 1 306.881 4.255 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246843038 1059124056 /nfs/dbraw/zinc/12/40/56/1059124056.db2.gz DKZJPKFXMSKNRV-UFYCRDLUSA-N 2 1 300.490 4.033 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@H]3CCC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001246845759 1059124300 /nfs/dbraw/zinc/12/43/00/1059124300.db2.gz NTBKJOLNQQCLDD-UXHICEINSA-N 2 1 312.501 4.178 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+](CC)Cc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246845728 1059124400 /nfs/dbraw/zinc/12/44/00/1059124400.db2.gz NIKQTEZPUZDMKY-MSOLQXFVSA-N 2 1 308.897 4.473 20 0 DIADMP C[C@H]1CC([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)C[C@H](C)[NH2+]1 ZINC001246849514 1059126332 /nfs/dbraw/zinc/12/63/32/1059126332.db2.gz FOKLXLPUWUKJGV-IRXDYDNUSA-N 2 1 324.468 4.440 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@H]3CCC[C@@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC001246847545 1059126617 /nfs/dbraw/zinc/12/66/17/1059126617.db2.gz UBAKEFXYYRLPNH-QHAWAJNXSA-N 2 1 312.501 4.178 20 0 DIADMP Fc1ccc([C@H]2CC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246848189 1059126872 /nfs/dbraw/zinc/12/68/72/1059126872.db2.gz MOWIVDNPIKGPMC-HKUYNNGSSA-N 2 1 316.464 4.070 20 0 DIADMP Fc1ccc([C@H]2CC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246848192 1059127489 /nfs/dbraw/zinc/12/74/89/1059127489.db2.gz MOWIVDNPIKGPMC-PKOBYXMFSA-N 2 1 316.464 4.070 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@H]3CCC[C@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC001246847542 1059127910 /nfs/dbraw/zinc/12/79/10/1059127910.db2.gz UBAKEFXYYRLPNH-HKBOAZHASA-N 2 1 312.501 4.178 20 0 DIADMP Clc1cccc2c1CC[N@@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246850003 1059128092 /nfs/dbraw/zinc/12/80/92/1059128092.db2.gz SSPDSVXJMQNVKZ-MRXNPFEDSA-N 2 1 318.892 4.153 20 0 DIADMP Clc1cccc2c1CC[N@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246850003 1059128104 /nfs/dbraw/zinc/12/81/04/1059128104.db2.gz SSPDSVXJMQNVKZ-MRXNPFEDSA-N 2 1 318.892 4.153 20 0 DIADMP C1C[N@H+]([C@@H]2CC[NH2+]C3(CCCCC3)C2)C[C@@H]1C1CCCCC1 ZINC001246847680 1059128433 /nfs/dbraw/zinc/12/84/33/1059128433.db2.gz KZFSYGSEJUGTSW-RTBURBONSA-N 2 1 304.522 4.344 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]1CC[NH3+] ZINC001246848394 1059128584 /nfs/dbraw/zinc/12/85/84/1059128584.db2.gz UZYKTVRRWZBUSX-NQIIRXRSSA-N 2 1 322.496 4.410 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]2CC[C@@]2([NH3+])C1 ZINC001246849761 1059129286 /nfs/dbraw/zinc/12/92/86/1059129286.db2.gz AYKCAYNDOYBYIO-PIPMEXSNSA-N 2 1 320.480 4.020 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246848836 1059129736 /nfs/dbraw/zinc/12/97/36/1059129736.db2.gz YFZIQVDQJKBCLX-MSOLQXFVSA-N 2 1 306.881 4.084 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246855360 1059131075 /nfs/dbraw/zinc/13/10/75/1059131075.db2.gz XLJVKAUSEIAWPA-SZMVWBNQSA-N 2 1 320.908 4.296 20 0 DIADMP C[N@@H+](C1CCC(C(C)(C)C)CC1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246852635 1059132018 /nfs/dbraw/zinc/13/20/18/1059132018.db2.gz FAMDTTSSTVIYSA-UHFFFAOYSA-N 2 1 306.538 4.445 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+]([C@@H]3CCC4(C3)CC[NH2+]CC4)C2)cc1 ZINC001246855185 1059132280 /nfs/dbraw/zinc/13/22/80/1059132280.db2.gz VXVBADJADFKYNV-SJLPKXTDSA-N 2 1 318.892 4.052 20 0 DIADMP COc1ccc([C@@H](C)[N@@H+](C)[C@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246853635 1059132608 /nfs/dbraw/zinc/13/26/08/1059132608.db2.gz RWXWVKJISNFBDZ-AEFFLSMTSA-N 2 1 316.489 4.143 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246856422 1059133142 /nfs/dbraw/zinc/13/31/42/1059133142.db2.gz ZEVKVFILBFHPNS-QXAKKESOSA-N 2 1 320.908 4.440 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@@H+]3CC[C@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851056 1059133493 /nfs/dbraw/zinc/13/34/93/1059133493.db2.gz YDDPYZRMBWKFKT-HBMCJLEFSA-N 2 1 312.501 4.382 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@H+]3CC[C@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851056 1059133499 /nfs/dbraw/zinc/13/34/99/1059133499.db2.gz YDDPYZRMBWKFKT-HBMCJLEFSA-N 2 1 312.501 4.382 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246851624 1059133662 /nfs/dbraw/zinc/13/36/62/1059133662.db2.gz ZAJYEOCZWAKIKJ-KBRIMQKVSA-N 2 1 308.897 4.500 20 0 DIADMP CC[N@H+](Cc1cccc(F)c1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246858883 1059136787 /nfs/dbraw/zinc/13/67/87/1059136787.db2.gz CULZRHPBVUDLHC-PMACEKPBSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246858883 1059136807 /nfs/dbraw/zinc/13/68/07/1059136807.db2.gz CULZRHPBVUDLHC-PMACEKPBSA-N 2 1 312.432 4.141 20 0 DIADMP CC(C)CCC[C@@H](C)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246864560 1059138737 /nfs/dbraw/zinc/13/87/37/1059138737.db2.gz WIOCDAJGDUWGRZ-GOSISDBHSA-N 2 1 314.517 4.338 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2Cc3ccccc3C(C)(C)C2)C[C@H](CC)[NH2+]1 ZINC001246869519 1059142760 /nfs/dbraw/zinc/14/27/60/1059142760.db2.gz IBDAWFQCBSGXGT-BCDXTJNWSA-N 2 1 300.490 4.089 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCc3ccccc3[C@H]2CC)C[C@H](CC)[NH2+]1 ZINC001246868229 1059142912 /nfs/dbraw/zinc/14/29/12/1059142912.db2.gz RIEDDWLDQZMSCK-DOADOZAASA-N 2 1 300.490 4.305 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246870068 1059142940 /nfs/dbraw/zinc/14/29/40/1059142940.db2.gz YIHZGVZJNTUYEJ-ILWGZMRPSA-N 2 1 320.480 4.489 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246870068 1059142942 /nfs/dbraw/zinc/14/29/42/1059142942.db2.gz YIHZGVZJNTUYEJ-ILWGZMRPSA-N 2 1 320.480 4.489 20 0 DIADMP CC[C@@H]1C[C@@H]([NH+]2CCC(c3ccccc3Cl)CC2)CC[NH2+]1 ZINC001246867777 1059143162 /nfs/dbraw/zinc/14/31/62/1059143162.db2.gz JEAQJMLIBSXQSK-CVEARBPZSA-N 2 1 306.881 4.050 20 0 DIADMP Clc1cccc2c1C[N@H+](C1CCC3(CC[NH2+]CC3)CC1)CC2 ZINC001246868192 1059143351 /nfs/dbraw/zinc/14/33/51/1059143351.db2.gz ARGDSIJHIHTIGY-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP CC[N@H+](Cc1cccs1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246880439 1059145042 /nfs/dbraw/zinc/14/50/42/1059145042.db2.gz DZAPMYPAZLBBSK-FUHWJXTLSA-N 2 1 300.471 4.063 20 0 DIADMP CC[N@@H+](Cc1cccs1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246880439 1059145052 /nfs/dbraw/zinc/14/50/52/1059145052.db2.gz DZAPMYPAZLBBSK-FUHWJXTLSA-N 2 1 300.471 4.063 20 0 DIADMP CC[N@H+](Cc1ccc(OC)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246876081 1059145793 /nfs/dbraw/zinc/14/57/93/1059145793.db2.gz AQZOWKLBRXPDNM-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1ccc(OC)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246876081 1059145797 /nfs/dbraw/zinc/14/57/97/1059145797.db2.gz AQZOWKLBRXPDNM-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246882782 1059148419 /nfs/dbraw/zinc/14/84/19/1059148419.db2.gz NYNAEHLRBURXCH-IUODEOHRSA-N 2 1 315.288 4.344 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246882782 1059148428 /nfs/dbraw/zinc/14/84/28/1059148428.db2.gz NYNAEHLRBURXCH-IUODEOHRSA-N 2 1 315.288 4.344 20 0 DIADMP CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246882784 1059148622 /nfs/dbraw/zinc/14/86/22/1059148622.db2.gz NYNAEHLRBURXCH-WFASDCNBSA-N 2 1 315.288 4.344 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246882784 1059148633 /nfs/dbraw/zinc/14/86/33/1059148633.db2.gz NYNAEHLRBURXCH-WFASDCNBSA-N 2 1 315.288 4.344 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246890226 1059152202 /nfs/dbraw/zinc/15/22/02/1059152202.db2.gz SOQXPUGPXDTBJI-DOTOQJQBSA-N 2 1 316.514 4.220 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246900381 1059158133 /nfs/dbraw/zinc/15/81/33/1059158133.db2.gz IFALTAXKBUEWOS-NDXORKPFSA-N 2 1 323.484 4.227 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246899766 1059160437 /nfs/dbraw/zinc/16/04/37/1059160437.db2.gz GAQMQLZCCBRFGR-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP CCC[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246894055 1059160463 /nfs/dbraw/zinc/16/04/63/1059160463.db2.gz MYPOGBXDSSEEST-QUCCMNQESA-N 2 1 300.490 4.177 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246896683 1059160490 /nfs/dbraw/zinc/16/04/90/1059160490.db2.gz YXLZMSVRMATREF-HXUWFJFHSA-N 2 1 308.469 4.194 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246893106 1059160561 /nfs/dbraw/zinc/16/05/61/1059160561.db2.gz HNNLYHMXCKQRBI-PMACEKPBSA-N 2 1 310.485 4.438 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)C(C)(C)Cc1ccccc1 ZINC001246895777 1059161112 /nfs/dbraw/zinc/16/11/12/1059161112.db2.gz YANVJHZBEJENOJ-ZWKOTPCHSA-N 2 1 302.506 4.106 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](CC)Cc2cccc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246902210 1059162613 /nfs/dbraw/zinc/16/26/13/1059162613.db2.gz BSSRYWCPZWEARB-BCDXTJNWSA-N 2 1 308.897 4.471 20 0 DIADMP CC[C@H]1CC([N@@H+](CC)Cc2cccc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246902212 1059163192 /nfs/dbraw/zinc/16/31/92/1059163192.db2.gz BSSRYWCPZWEARB-IRXDYDNUSA-N 2 1 308.897 4.471 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246901636 1059164285 /nfs/dbraw/zinc/16/42/85/1059164285.db2.gz YRXSZDQTDMQAHA-RCCFBDPRSA-N 2 1 304.453 4.129 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246903059 1059164612 /nfs/dbraw/zinc/16/46/12/1059164612.db2.gz ICZDMFPHOYZHMX-DLBZAZTESA-N 2 1 308.897 4.329 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246903062 1059164769 /nfs/dbraw/zinc/16/47/69/1059164769.db2.gz ICZDMFPHOYZHMX-SJORKVTESA-N 2 1 308.897 4.329 20 0 DIADMP Fc1cccc(F)c1[C@@H]1CCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246903453 1059164832 /nfs/dbraw/zinc/16/48/32/1059164832.db2.gz XWYFPXRZRQACCA-KGYZHSKHSA-N 2 1 320.427 4.024 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246907244 1059166414 /nfs/dbraw/zinc/16/64/14/1059166414.db2.gz UIIAPSOZDPCPIU-WQUXRXDGSA-N 2 1 300.490 4.337 20 0 DIADMP CCCCCC[C@H](CCC)[N@H+]1CC[C@@H]([NH3+])[C@H](C(F)(F)F)C1 ZINC001246941568 1059190097 /nfs/dbraw/zinc/19/00/97/1059190097.db2.gz WHCRDBNOWYYXTP-RRFJBIMHSA-N 2 1 308.432 4.337 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246907733 1059167580 /nfs/dbraw/zinc/16/75/80/1059167580.db2.gz UYEKXOGBOQQVEJ-GOSISDBHSA-N 2 1 322.452 4.053 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2C3CCCC2CCC3)CC[NH2+]1 ZINC001246905479 1059168269 /nfs/dbraw/zinc/16/82/69/1059168269.db2.gz MRLDDMUOWXVYRX-BZWMRVRASA-N 2 1 316.464 4.334 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246905722 1059168508 /nfs/dbraw/zinc/16/85/08/1059168508.db2.gz AZAZIVRUAIHFCM-RTBURBONSA-N 2 1 302.506 4.292 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246906842 1059168535 /nfs/dbraw/zinc/16/85/35/1059168535.db2.gz RUURYNKXDWIJJU-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1F)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246909822 1059170703 /nfs/dbraw/zinc/17/07/03/1059170703.db2.gz QHCKWLDONPTUQZ-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1F)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246911728 1059171810 /nfs/dbraw/zinc/17/18/10/1059171810.db2.gz WQERJDJRYYDTGK-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CCC3(CCC[NH2+]C3)CC2)cc1C ZINC001246910481 1059171883 /nfs/dbraw/zinc/17/18/83/1059171883.db2.gz UIIOMISOKXSLMP-UHFFFAOYSA-N 2 1 300.490 4.048 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C[C@H]1C ZINC001246912099 1059171912 /nfs/dbraw/zinc/17/19/12/1059171912.db2.gz DFNCJBTXGBSGAP-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CCC[C@H]([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C1 ZINC001246911290 1059172029 /nfs/dbraw/zinc/17/20/29/1059172029.db2.gz BFJJHMXYWXEPAS-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246910465 1059172447 /nfs/dbraw/zinc/17/24/47/1059172447.db2.gz UBSONXRETLPHIS-HUUCEWRRSA-N 2 1 306.881 4.255 20 0 DIADMP CCC[N@H+](CC(C)C)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246910726 1059172625 /nfs/dbraw/zinc/17/26/25/1059172625.db2.gz KTVUSIQEUHVMIK-HKUYNNGSSA-N 2 1 306.469 4.295 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246910726 1059172636 /nfs/dbraw/zinc/17/26/36/1059172636.db2.gz KTVUSIQEUHVMIK-HKUYNNGSSA-N 2 1 306.469 4.295 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)[C@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001246921732 1059175210 /nfs/dbraw/zinc/17/52/10/1059175210.db2.gz RQLCQDNQXZLASL-FVELJTHGSA-N 2 1 300.490 4.175 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)[C@@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001246921731 1059175759 /nfs/dbraw/zinc/17/57/59/1059175759.db2.gz RQLCQDNQXZLASL-DCCYDQLOSA-N 2 1 300.490 4.175 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccccc2)C2CCCCCC2)CC1 ZINC001246913409 1059176185 /nfs/dbraw/zinc/17/61/85/1059176185.db2.gz WXYLIALHNSMVSB-UHFFFAOYSA-N 2 1 300.490 4.481 20 0 DIADMP FC(F)(F)c1ccc([C@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246920251 1059177134 /nfs/dbraw/zinc/17/71/34/1059177134.db2.gz DJLMVAKVXNITEG-FCLJQHQZSA-N 2 1 324.390 4.125 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)[C@H](Cc2ccccc2)CC(C)C)CC1 ZINC001246914434 1059177540 /nfs/dbraw/zinc/17/75/40/1059177540.db2.gz CGYOJSONDHDQIX-MHJFOBGBSA-N 2 1 302.506 4.106 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](C)C1CCC([NH2+]C)CC1 ZINC001246924160 1059180991 /nfs/dbraw/zinc/18/09/91/1059180991.db2.gz ZIBMLFTVXRMENS-GPJFCIFZSA-N 2 1 302.506 4.250 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932152 1059181176 /nfs/dbraw/zinc/18/11/76/1059181176.db2.gz FIKCSNOFFDOURJ-SJORKVTESA-N 2 1 318.480 4.001 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246937957 1059184198 /nfs/dbraw/zinc/18/41/98/1059184198.db2.gz KLYUVNGMXUGAPN-YQVWRLOYSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246937957 1059184205 /nfs/dbraw/zinc/18/42/05/1059184205.db2.gz KLYUVNGMXUGAPN-YQVWRLOYSA-N 2 1 304.453 4.192 20 0 DIADMP CCCC[C@@H](C)[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001246936399 1059184604 /nfs/dbraw/zinc/18/46/04/1059184604.db2.gz IIDRXBWNBNMFIH-MRXNPFEDSA-N 2 1 306.469 4.206 20 0 DIADMP CC[C@H]1CC[C@@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246945552 1059187927 /nfs/dbraw/zinc/18/79/27/1059187927.db2.gz ZIOHXRVJSXVBRC-OXJNMPFZSA-N 2 1 318.480 4.206 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c1 ZINC001246944858 1059187974 /nfs/dbraw/zinc/18/79/74/1059187974.db2.gz UGFTUBCFCACFEI-KBWCOIMZSA-N 2 1 312.501 4.363 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246942745 1059189066 /nfs/dbraw/zinc/18/90/66/1059189066.db2.gz IGBPRXFYBFEPGR-ACRUOGEOSA-N 2 1 312.501 4.363 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246944454 1059189402 /nfs/dbraw/zinc/18/94/02/1059189402.db2.gz CDOHABAVAYOCPA-YJBOKZPZSA-N 2 1 320.908 4.473 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246945079 1059189889 /nfs/dbraw/zinc/18/98/89/1059189889.db2.gz FLQBTFZJDXIDQS-DNVCBOLYSA-N 2 1 320.908 4.473 20 0 DIADMP CCC1CCC([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)CC1 ZINC001246945787 1059191161 /nfs/dbraw/zinc/19/11/61/1059191161.db2.gz YCBXSSOJRJWGPD-UHFFFAOYSA-N 2 1 318.480 4.349 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](C(C)C)C2)c1 ZINC001246943551 1059191503 /nfs/dbraw/zinc/19/15/03/1059191503.db2.gz LSKFRQZDTOAXEP-UFYCRDLUSA-N 2 1 300.490 4.217 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001246951598 1059193446 /nfs/dbraw/zinc/19/34/46/1059193446.db2.gz MPJQAFCMOZJXHR-SFHVURJKSA-N 2 1 306.469 4.267 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246950219 1059193789 /nfs/dbraw/zinc/19/37/89/1059193789.db2.gz WAILJPZQLDHZQL-BMGDILEWSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246950219 1059193795 /nfs/dbraw/zinc/19/37/95/1059193795.db2.gz WAILJPZQLDHZQL-BMGDILEWSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)C[N@@H+](C1CC[NH2+]CC1)C1CCc2ccccc2CC1 ZINC001246948006 1059196146 /nfs/dbraw/zinc/19/61/46/1059196146.db2.gz ZJZIIEQVBMLZFF-UHFFFAOYSA-N 2 1 314.517 4.034 20 0 DIADMP CC(C)(C)C[N@@H+]([C@@H]1CC[C@@H](c2ccccc2)C1)C1CC[NH2+]CC1 ZINC001246948126 1059196445 /nfs/dbraw/zinc/19/64/45/1059196445.db2.gz AQJCDLREOSVELP-UYAOXDASSA-N 2 1 314.517 4.423 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246955501 1059198623 /nfs/dbraw/zinc/19/86/23/1059198623.db2.gz MXVYXQMQWCOIFD-OAHLLOKOSA-N 2 1 324.459 4.488 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001246955654 1059199615 /nfs/dbraw/zinc/19/96/15/1059199615.db2.gz MWCTUMFGXZHIMJ-QGZVFWFLSA-N 2 1 306.469 4.267 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956198 1059200294 /nfs/dbraw/zinc/20/02/94/1059200294.db2.gz QRIPJFXTTDHCJL-YOEHRIQHSA-N 2 1 322.443 4.098 20 0 DIADMP Cc1ccc(C[N@@H+](C2CC[NH2+]CC2)C2CCC(C)CC2)c(F)c1 ZINC001246955623 1059201506 /nfs/dbraw/zinc/20/15/06/1059201506.db2.gz MFTUFYNCYRPLOF-UHFFFAOYSA-N 2 1 318.480 4.267 20 0 DIADMP CCCC[C@@H](CC(C)C)[N@H+](Cc1ccncc1)[C@@H]1CCC[NH2+]C1 ZINC001246963449 1059203413 /nfs/dbraw/zinc/20/34/13/1059203413.db2.gz KPIATZLTNRJMHY-VQTJNVASSA-N 2 1 317.521 4.241 20 0 DIADMP CCCC[C@@H](CC(C)C)[N@@H+](Cc1ccncc1)[C@@H]1CCC[NH2+]C1 ZINC001246963449 1059203427 /nfs/dbraw/zinc/20/34/27/1059203427.db2.gz KPIATZLTNRJMHY-VQTJNVASSA-N 2 1 317.521 4.241 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246962308 1059204656 /nfs/dbraw/zinc/20/46/56/1059204656.db2.gz CDKZSPCQKGPXCW-ACRUOGEOSA-N 2 1 314.517 4.380 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@H](C)C1 ZINC001246961259 1059205542 /nfs/dbraw/zinc/20/55/42/1059205542.db2.gz PLJQZTXICMDUFM-YWZLYKJASA-N 2 1 318.480 4.267 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c1C ZINC001246965301 1059210680 /nfs/dbraw/zinc/21/06/80/1059210680.db2.gz HAMHQLPIFUAPKU-RTWAWAEBSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2CC[NH2+][C@@H](C(C)(C)C)C2)c1C ZINC001246970201 1059210977 /nfs/dbraw/zinc/21/09/77/1059210977.db2.gz XYUWFIRFHYMXGK-VQTJNVASSA-N 2 1 314.517 4.435 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1ccc(OC)cc1)C1CC[NH2+]CC1 ZINC001246965524 1059212939 /nfs/dbraw/zinc/21/29/39/1059212939.db2.gz PIMQQUORVOXRQI-KRWDZBQOSA-N 2 1 318.505 4.218 20 0 DIADMP COc1ccc(C[N@@H+]([C@H](C)CCC(C)C)C2CC[NH2+]CC2)cc1 ZINC001246964681 1059213524 /nfs/dbraw/zinc/21/35/24/1059213524.db2.gz ORFCKWFWXXJKMF-QGZVFWFLSA-N 2 1 318.505 4.074 20 0 DIADMP Cc1cccc(C[N@H+]([C@H](C)CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001246976213 1059217054 /nfs/dbraw/zinc/21/70/54/1059217054.db2.gz WJBYJCKFUNEMCQ-NSISKUIASA-N 2 1 300.490 4.256 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246974427 1059217698 /nfs/dbraw/zinc/21/76/98/1059217698.db2.gz ALLVMAXWPFJUAQ-UXHICEINSA-N 2 1 314.517 4.252 20 0 DIADMP C([C@@H]1CCC[NH2+]C1)[N@@H+](C1CC1)C1CCC2(CCCCC2)CC1 ZINC001246972062 1059217737 /nfs/dbraw/zinc/21/77/37/1059217737.db2.gz JDMAEFVMQXQWSM-QGZVFWFLSA-N 2 1 304.522 4.344 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246977927 1059222433 /nfs/dbraw/zinc/22/24/33/1059222433.db2.gz RQFLSNWROUYTIU-FQEVSTJZSA-N 2 1 300.490 4.004 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246976952 1059224309 /nfs/dbraw/zinc/22/43/09/1059224309.db2.gz GREWROPBYJSKLZ-MHTWAQMVSA-N 2 1 314.517 4.108 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246976954 1059224650 /nfs/dbraw/zinc/22/46/50/1059224650.db2.gz GREWROPBYJSKLZ-PLACYPQZSA-N 2 1 314.517 4.108 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2Cc2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246998180 1059227436 /nfs/dbraw/zinc/22/74/36/1059227436.db2.gz BALAGPVWKNZMPJ-YRPNKDGESA-N 2 1 318.480 4.142 20 0 DIADMP c1ccc(C[C@H]2C[C@H]([N@H+]3CCC4(C3)CCCCC4)CC[NH2+]2)cc1 ZINC001246999560 1059228534 /nfs/dbraw/zinc/22/85/34/1059228534.db2.gz QXDAMULSRIXNGY-VQTJNVASSA-N 2 1 312.501 4.006 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC001246993543 1059228705 /nfs/dbraw/zinc/22/87/05/1059228705.db2.gz TZMTUFUOZHUNNA-CZUORRHYSA-N 2 1 314.395 4.230 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC001246993543 1059228723 /nfs/dbraw/zinc/22/87/23/1059228723.db2.gz TZMTUFUOZHUNNA-CZUORRHYSA-N 2 1 314.395 4.230 20 0 DIADMP CCCCCC[C@@H](C)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001246999797 1059229323 /nfs/dbraw/zinc/22/93/23/1059229323.db2.gz BTSYLYGZPNJENT-QGZVFWFLSA-N 2 1 300.490 4.440 20 0 DIADMP CCC[N@@H+](C[C@H]1CC[NH2+]C1)C1CCC(Cc2ccccc2)CC1 ZINC001246986745 1059229554 /nfs/dbraw/zinc/22/95/54/1059229554.db2.gz COLDOTIQNPFVMW-KBWCOIMZSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@@](C)(C[NH3+])C1 ZINC001247001814 1059235260 /nfs/dbraw/zinc/23/52/60/1059235260.db2.gz LLQNPJHRTVRNGP-QAPCUYQASA-N 2 1 324.534 4.131 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247012416 1059242769 /nfs/dbraw/zinc/24/27/69/1059242769.db2.gz DJKBTXXIINKNIV-HNNXBMFYSA-N 2 1 318.530 4.001 20 0 DIADMP CCCC1CCC([NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC1 ZINC001247013658 1059243371 /nfs/dbraw/zinc/24/33/71/1059243371.db2.gz HOUXGKBMMIGDIP-UHFFFAOYSA-N 2 1 312.501 4.440 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1cccc(C)c1)CC(C)C ZINC001559501556 1059289231 /nfs/dbraw/zinc/28/92/31/1059289231.db2.gz NVMUJOJLCFNGIK-UHFFFAOYSA-N 2 1 313.489 4.438 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1cccc(C)c1)CC(C)C ZINC001559501556 1059289239 /nfs/dbraw/zinc/28/92/39/1059289239.db2.gz NVMUJOJLCFNGIK-UHFFFAOYSA-N 2 1 313.489 4.438 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC34CCC(CC3)C4)C2)CC1 ZINC001559508187 1059303032 /nfs/dbraw/zinc/30/30/32/1059303032.db2.gz AKODTXVKMINBEB-IOJLRTSASA-N 2 1 304.522 4.011 20 0 DIADMP C1=C(CC[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)CCCC1 ZINC001559524669 1059319134 /nfs/dbraw/zinc/31/91/34/1059319134.db2.gz MBSHSUUUOGNZBT-HXUWFJFHSA-N 2 1 304.522 4.465 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC001559525070 1059324165 /nfs/dbraw/zinc/32/41/65/1059324165.db2.gz YWWARUVSEDSYEA-HSALFYBXSA-N 2 1 306.538 4.401 20 0 DIADMP CC[C@H](C)C[N@@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001559541084 1059345356 /nfs/dbraw/zinc/34/53/56/1059345356.db2.gz HZNYKIWLDRRZHL-IBGZPJMESA-N 2 1 316.533 4.309 20 0 DIADMP CCc1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001559546520 1059350693 /nfs/dbraw/zinc/35/06/93/1059350693.db2.gz YLFVJEMTHBWLTD-MOPGFXCFSA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001559546520 1059350713 /nfs/dbraw/zinc/35/07/13/1059350713.db2.gz YLFVJEMTHBWLTD-MOPGFXCFSA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001559546520 1059350731 /nfs/dbraw/zinc/35/07/31/1059350731.db2.gz YLFVJEMTHBWLTD-MOPGFXCFSA-N 2 1 314.517 4.335 20 0 DIADMP C[C@@H]1CC[C@H](C)[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001559560583 1059380722 /nfs/dbraw/zinc/38/07/22/1059380722.db2.gz NQSQVLKXXAPLLP-MSOLQXFVSA-N 2 1 300.490 4.293 20 0 DIADMP CC(C)(C)CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594636 1059426898 /nfs/dbraw/zinc/42/68/98/1059426898.db2.gz RXQOYLCICASASE-WOJBJXKFSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594636 1059426909 /nfs/dbraw/zinc/42/69/09/1059426909.db2.gz RXQOYLCICASASE-WOJBJXKFSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594636 1059426915 /nfs/dbraw/zinc/42/69/15/1059426915.db2.gz RXQOYLCICASASE-WOJBJXKFSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCCC(C)(F)F)CC1 ZINC001559596598 1059431803 /nfs/dbraw/zinc/43/18/03/1059431803.db2.gz WLLXFOYHCSUUSV-INIZCTEOSA-N 2 1 316.480 4.398 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CCC1 ZINC001559600546 1059434118 /nfs/dbraw/zinc/43/41/18/1059434118.db2.gz ZWHHKTGUHQNAGA-UHFFFAOYSA-N 2 1 300.490 4.435 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](CC1CCCC1)c1ccccc1 ZINC001559703140 1059528478 /nfs/dbraw/zinc/52/84/78/1059528478.db2.gz NWALICFANBHEID-HXUWFJFHSA-N 2 1 311.473 4.264 20 0 DIADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CCCc1cccc3ccccc31)C2 ZINC001559852653 1059677785 /nfs/dbraw/zinc/67/77/85/1059677785.db2.gz WNKZADBLUOSFOL-QFIPXVFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CCCc1cccc3ccccc31)C2 ZINC001559852653 1059677792 /nfs/dbraw/zinc/67/77/92/1059677792.db2.gz WNKZADBLUOSFOL-QFIPXVFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCCc1cccc3ccccc31)C2 ZINC001559852653 1059677802 /nfs/dbraw/zinc/67/78/02/1059677802.db2.gz WNKZADBLUOSFOL-QFIPXVFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001559875354 1059696149 /nfs/dbraw/zinc/69/61/49/1059696149.db2.gz STBOZQMHKRMADE-JOCHJYFZSA-N 2 1 320.480 4.196 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001559875354 1059696162 /nfs/dbraw/zinc/69/61/62/1059696162.db2.gz STBOZQMHKRMADE-JOCHJYFZSA-N 2 1 320.480 4.196 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001559875354 1059696177 /nfs/dbraw/zinc/69/61/77/1059696177.db2.gz STBOZQMHKRMADE-JOCHJYFZSA-N 2 1 320.480 4.196 20 0 DIADMP CCc1ccc(C)[nH+]c1Nc1ccc(OCCC[NH+](C)C)cc1 ZINC001248403754 1059815242 /nfs/dbraw/zinc/81/52/42/1059815242.db2.gz QXOIJZJVVFOCOH-UHFFFAOYSA-N 2 1 313.445 4.027 20 0 DIADMP CCCC[N@@H+](Cc1scnc1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001560035751 1059846819 /nfs/dbraw/zinc/84/68/19/1059846819.db2.gz FTKJLYFYKAWRIE-UHFFFAOYSA-N 2 1 323.550 4.363 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001560068678 1059881923 /nfs/dbraw/zinc/88/19/23/1059881923.db2.gz FUOVLNGUHFHKGC-YLJYHZDGSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001560068678 1059881941 /nfs/dbraw/zinc/88/19/41/1059881941.db2.gz FUOVLNGUHFHKGC-YLJYHZDGSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001560068676 1059883031 /nfs/dbraw/zinc/88/30/31/1059883031.db2.gz FUOVLNGUHFHKGC-PXNSSMCTSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001560068676 1059883052 /nfs/dbraw/zinc/88/30/52/1059883052.db2.gz FUOVLNGUHFHKGC-PXNSSMCTSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC001560077683 1059891628 /nfs/dbraw/zinc/89/16/28/1059891628.db2.gz UJIJPZDKVNCVAP-HHXXYDBFSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@H]2[C@@H](CC[N@@H+]2C)C1 ZINC001560077683 1059891645 /nfs/dbraw/zinc/89/16/45/1059891645.db2.gz UJIJPZDKVNCVAP-HHXXYDBFSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC001560077683 1059891667 /nfs/dbraw/zinc/89/16/67/1059891667.db2.gz UJIJPZDKVNCVAP-HHXXYDBFSA-N 2 1 300.490 4.071 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1sccc1Cl ZINC001560100284 1059905941 /nfs/dbraw/zinc/90/59/41/1059905941.db2.gz ICIDTQSITFBMLJ-UHFFFAOYSA-N 2 1 300.899 4.099 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001560102183 1059911551 /nfs/dbraw/zinc/91/15/51/1059911551.db2.gz GZFVDMWKPDTOKE-INIZCTEOSA-N 2 1 317.864 4.113 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001560102183 1059911570 /nfs/dbraw/zinc/91/15/70/1059911570.db2.gz GZFVDMWKPDTOKE-INIZCTEOSA-N 2 1 317.864 4.113 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCc2cccc3cccc1c32 ZINC001560161037 1059951862 /nfs/dbraw/zinc/95/18/62/1059951862.db2.gz KADLUIBNRKGBOF-FQEVSTJZSA-N 2 1 319.452 4.402 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1[C@@H](C)c1ccccc1 ZINC001560162774 1059957093 /nfs/dbraw/zinc/95/70/93/1059957093.db2.gz ALIKTNJMIYUTHG-FXAWDEMLSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1[C@@H](C)c1ccccc1 ZINC001560162774 1059957118 /nfs/dbraw/zinc/95/71/18/1059957118.db2.gz ALIKTNJMIYUTHG-FXAWDEMLSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1cc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cs1 ZINC001248803865 1059985531 /nfs/dbraw/zinc/98/55/31/1059985531.db2.gz XKCNQLNHUFLRFP-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1cc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cs1 ZINC001248803865 1059985553 /nfs/dbraw/zinc/98/55/53/1059985553.db2.gz XKCNQLNHUFLRFP-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1cc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cs1 ZINC001248803865 1059985579 /nfs/dbraw/zinc/98/55/79/1059985579.db2.gz XKCNQLNHUFLRFP-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1cc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC001248803865 1059985593 /nfs/dbraw/zinc/98/55/93/1059985593.db2.gz XKCNQLNHUFLRFP-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@@H](C)[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266641 1060036325 /nfs/dbraw/zinc/03/63/25/1060036325.db2.gz LAQRBNBDFWJMEJ-GGPKGHCWSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@@H](C)[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266641 1060036344 /nfs/dbraw/zinc/03/63/44/1060036344.db2.gz LAQRBNBDFWJMEJ-GGPKGHCWSA-N 2 1 302.506 4.136 20 0 DIADMP CC[C@H](C)C[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560269330 1060040945 /nfs/dbraw/zinc/04/09/45/1060040945.db2.gz YKPNMWGFLYGMAW-OKZBNKHCSA-N 2 1 302.506 4.300 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001560272234 1060045616 /nfs/dbraw/zinc/04/56/16/1060045616.db2.gz ZTMXDIYPIBCSTI-ZBFHGGJFSA-N 2 1 304.478 4.064 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC001560272234 1060045641 /nfs/dbraw/zinc/04/56/41/1060045641.db2.gz ZTMXDIYPIBCSTI-ZBFHGGJFSA-N 2 1 304.478 4.064 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1ccc(F)cc1 ZINC001560271180 1060046582 /nfs/dbraw/zinc/04/65/82/1060046582.db2.gz YHIACGXYXBIHLB-DBWMJRBXSA-N 2 1 304.453 4.083 20 0 DIADMP C[C@@H]1CCC[C@@](C[NH2+][C@@H]2CCCc3ccccc3C2)([NH+](C)C)C1 ZINC001560285826 1060062822 /nfs/dbraw/zinc/06/28/22/1060062822.db2.gz JTWJUQGRRWADJO-DUXKGJEZSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC001560325575 1060112852 /nfs/dbraw/zinc/11/28/52/1060112852.db2.gz OGUIMZCCXKZSIJ-IHPCNDPISA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC001560325575 1060112858 /nfs/dbraw/zinc/11/28/58/1060112858.db2.gz OGUIMZCCXKZSIJ-IHPCNDPISA-N 2 1 312.501 4.352 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC001560349503 1060136353 /nfs/dbraw/zinc/13/63/53/1060136353.db2.gz NCCGAWDNHGUZBP-MJGOQNOKSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC001560349503 1060136368 /nfs/dbraw/zinc/13/63/68/1060136368.db2.gz NCCGAWDNHGUZBP-MJGOQNOKSA-N 2 1 314.498 4.229 20 0 DIADMP CC(C)[NH+](CCC[NH2+]C/C=C/c1ccc(F)c(F)c1)C(C)C ZINC001560366522 1060152905 /nfs/dbraw/zinc/15/29/05/1060152905.db2.gz HZAZMAJVBMMXNK-FNORWQNLSA-N 2 1 310.432 4.077 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c(Cl)c1 ZINC001560406814 1060191193 /nfs/dbraw/zinc/19/11/93/1060191193.db2.gz RUXOOPPIPLWNGV-INIZCTEOSA-N 2 1 308.897 4.106 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c(Cl)c1 ZINC001560406814 1060191200 /nfs/dbraw/zinc/19/12/00/1060191200.db2.gz RUXOOPPIPLWNGV-INIZCTEOSA-N 2 1 308.897 4.106 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccccc2SCC)CC1 ZINC001249440553 1060253291 /nfs/dbraw/zinc/25/32/91/1060253291.db2.gz SCDSBXKHTZLQKA-UHFFFAOYSA-N 2 1 320.546 4.495 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccccc2SCC)CC1 ZINC001249440553 1060253315 /nfs/dbraw/zinc/25/33/15/1060253315.db2.gz SCDSBXKHTZLQKA-UHFFFAOYSA-N 2 1 320.546 4.495 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560492365 1060288701 /nfs/dbraw/zinc/28/87/01/1060288701.db2.gz SLCYUJZZBBBGON-ROUUACIJSA-N 2 1 318.549 4.481 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560492365 1060288719 /nfs/dbraw/zinc/28/87/19/1060288719.db2.gz SLCYUJZZBBBGON-ROUUACIJSA-N 2 1 318.549 4.481 20 0 DIADMP CCC(C)(C)[C@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001560531132 1060333324 /nfs/dbraw/zinc/33/33/24/1060333324.db2.gz VFYFUGSQIPWMQL-INIZCTEOSA-N 2 1 320.496 4.247 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3)s2)CC1(C)C ZINC001560542658 1060348653 /nfs/dbraw/zinc/34/86/53/1060348653.db2.gz NKVVCPZPVJVERP-INIZCTEOSA-N 2 1 314.498 4.378 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCc2cccc(-c3ccccc3)c2)CC1(C)C ZINC001560543411 1060350972 /nfs/dbraw/zinc/35/09/72/1060350972.db2.gz SXFUONZVBWXQJG-OAQYLSRUSA-N 2 1 322.496 4.359 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1)[NH+](C)C ZINC001560547158 1060355340 /nfs/dbraw/zinc/35/53/40/1060355340.db2.gz XCWMSARJKPQPTP-HNNXBMFYSA-N 2 1 316.876 4.437 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637356 1060450487 /nfs/dbraw/zinc/45/04/87/1060450487.db2.gz ARRBZVGBDMEHCD-RHSMWYFYSA-N 2 1 306.494 4.048 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637356 1060450500 /nfs/dbraw/zinc/45/05/00/1060450500.db2.gz ARRBZVGBDMEHCD-RHSMWYFYSA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637356 1060450512 /nfs/dbraw/zinc/45/05/12/1060450512.db2.gz ARRBZVGBDMEHCD-RHSMWYFYSA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637356 1060450525 /nfs/dbraw/zinc/45/05/25/1060450525.db2.gz ARRBZVGBDMEHCD-RHSMWYFYSA-N 2 1 306.494 4.048 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)c3ccccc23)C[C@H]1C ZINC001560636978 1060453331 /nfs/dbraw/zinc/45/33/31/1060453331.db2.gz REZVSIVURMFBNB-NVXWUHKLSA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(F)c3ccccc23)C[C@H]1C ZINC001560636978 1060453341 /nfs/dbraw/zinc/45/33/41/1060453341.db2.gz REZVSIVURMFBNB-NVXWUHKLSA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(F)c3ccccc23)C[C@H]1C ZINC001560636978 1060453349 /nfs/dbraw/zinc/45/33/49/1060453349.db2.gz REZVSIVURMFBNB-NVXWUHKLSA-N 2 1 314.448 4.284 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CC2CC[NH+](CC)CC2)o1 ZINC001560647246 1060471281 /nfs/dbraw/zinc/47/12/81/1060471281.db2.gz SXCAXAYZXXNQDE-LPHOPBHVSA-N 2 1 318.505 4.347 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2C[C@H]3CCCC[C@]32c2ccccc2)CC1 ZINC001560670389 1060502658 /nfs/dbraw/zinc/50/26/58/1060502658.db2.gz CAECFEGBULJOPM-RTWAWAEBSA-N 2 1 312.501 4.120 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](CC1CC[NH+](C)CC1)C1CC1 ZINC001560680108 1060523884 /nfs/dbraw/zinc/52/38/84/1060523884.db2.gz LWJJJTDTLYUNHA-CQSZACIVSA-N 2 1 306.881 4.207 20 0 DIADMP C[N@@H+](CCC1CCCCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001560696853 1060544895 /nfs/dbraw/zinc/54/48/95/1060544895.db2.gz FHNLDUSMXYFAOE-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCC1CCCCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001560696853 1060544914 /nfs/dbraw/zinc/54/49/14/1060544914.db2.gz FHNLDUSMXYFAOE-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCC1CCCCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001560696853 1060544930 /nfs/dbraw/zinc/54/49/30/1060544930.db2.gz FHNLDUSMXYFAOE-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)C1(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700934 1060555736 /nfs/dbraw/zinc/55/57/36/1060555736.db2.gz VNYQSPKSDLKLEX-AZUAARDMSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700934 1060555743 /nfs/dbraw/zinc/55/57/43/1060555743.db2.gz VNYQSPKSDLKLEX-AZUAARDMSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700934 1060555746 /nfs/dbraw/zinc/55/57/46/1060555746.db2.gz VNYQSPKSDLKLEX-AZUAARDMSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700934 1060555753 /nfs/dbraw/zinc/55/57/53/1060555753.db2.gz VNYQSPKSDLKLEX-AZUAARDMSA-N 2 1 314.517 4.408 20 0 DIADMP C([NH2+][C@H]1CCCC[C@H]1C1CC1)[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791757 1060652354 /nfs/dbraw/zinc/65/23/54/1060652354.db2.gz QEBHZLVHEFEFKT-AABGKKOBSA-N 2 1 304.522 4.342 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001560804276 1060667021 /nfs/dbraw/zinc/66/70/21/1060667021.db2.gz XYXSYVOMLHFUSE-ZTFGCOKTSA-N 2 1 308.897 4.296 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H](CC)Cc1ccc(Cl)cc1 ZINC001560865087 1060724683 /nfs/dbraw/zinc/72/46/83/1060724683.db2.gz PYCPZTXQERVPSC-YJBOKZPZSA-N 2 1 310.913 4.371 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H](CC)Cc1ccc(Cl)cc1 ZINC001560865087 1060724697 /nfs/dbraw/zinc/72/46/97/1060724697.db2.gz PYCPZTXQERVPSC-YJBOKZPZSA-N 2 1 310.913 4.371 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560865056 1060725563 /nfs/dbraw/zinc/72/55/63/1060725563.db2.gz PDRFTIOMSLXZIB-MSOLQXFVSA-N 2 1 316.533 4.206 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560865056 1060725578 /nfs/dbraw/zinc/72/55/78/1060725578.db2.gz PDRFTIOMSLXZIB-MSOLQXFVSA-N 2 1 316.533 4.206 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001560870759 1060729936 /nfs/dbraw/zinc/72/99/36/1060729936.db2.gz PDUBCOCHTQCGNV-KYJSFNMBSA-N 2 1 308.897 4.294 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001560870759 1060729952 /nfs/dbraw/zinc/72/99/52/1060729952.db2.gz PDUBCOCHTQCGNV-KYJSFNMBSA-N 2 1 308.897 4.294 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901148 1060764404 /nfs/dbraw/zinc/76/44/04/1060764404.db2.gz MEVDVEMKMNWOFD-WLRLJWMZSA-N 2 1 314.517 4.138 20 0 DIADMP C[C@H]1CCC(C)(C)C[C@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901254 1060765121 /nfs/dbraw/zinc/76/51/21/1060765121.db2.gz OMTRDJHCEPGJRW-OJAHFUOMSA-N 2 1 314.517 4.136 20 0 DIADMP C[C@@H]1CCC(C)(C)C[C@@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901253 1060765650 /nfs/dbraw/zinc/76/56/50/1060765650.db2.gz OMTRDJHCEPGJRW-LMCOJAPRSA-N 2 1 314.517 4.136 20 0 DIADMP CC(C)(C)[C@]1(C[NH2+]C2CC=CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001560918580 1060779334 /nfs/dbraw/zinc/77/93/34/1060779334.db2.gz ZATZRIIPYFEMCY-NRFANRHFSA-N 2 1 312.501 4.233 20 0 DIADMP CC(C)(C)[C@]1(C[NH2+][C@H]2C=CCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001560922329 1060786454 /nfs/dbraw/zinc/78/64/54/1060786454.db2.gz RIJSJARKXUMRIO-FPOVZHCZSA-N 2 1 312.501 4.233 20 0 DIADMP Cc1cccc(CC[C@@H](C)[NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC001560937271 1060799024 /nfs/dbraw/zinc/79/90/24/1060799024.db2.gz ACVJFQNRJFQDGJ-QUCCMNQESA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(CC[C@@H](C)[NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC001560937271 1060799036 /nfs/dbraw/zinc/79/90/36/1060799036.db2.gz ACVJFQNRJFQDGJ-QUCCMNQESA-N 2 1 314.517 4.313 20 0 DIADMP Clc1ccc(CC[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)cc1 ZINC001560973052 1060837285 /nfs/dbraw/zinc/83/72/85/1060837285.db2.gz HTECNLSWKKVCIX-LJQANCHMSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1ccc(CC[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)cc1 ZINC001560973052 1060837293 /nfs/dbraw/zinc/83/72/93/1060837293.db2.gz HTECNLSWKKVCIX-LJQANCHMSA-N 2 1 320.908 4.269 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972962 1060838128 /nfs/dbraw/zinc/83/81/28/1060838128.db2.gz DOWCHRWFLZFXIF-OXQOHEQNSA-N 2 1 318.480 4.316 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972962 1060838137 /nfs/dbraw/zinc/83/81/37/1060838137.db2.gz DOWCHRWFLZFXIF-OXQOHEQNSA-N 2 1 318.480 4.316 20 0 DIADMP CC(C)C[C@@H](C)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203037 1060965601 /nfs/dbraw/zinc/96/56/01/1060965601.db2.gz GMRDUMWJNZZQMU-CTNGQTDRSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@@H](C)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203037 1060965623 /nfs/dbraw/zinc/96/56/23/1060965623.db2.gz GMRDUMWJNZZQMU-CTNGQTDRSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@@H](C)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203037 1060965645 /nfs/dbraw/zinc/96/56/45/1060965645.db2.gz GMRDUMWJNZZQMU-CTNGQTDRSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@@H](C)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203037 1060965672 /nfs/dbraw/zinc/96/56/72/1060965672.db2.gz GMRDUMWJNZZQMU-CTNGQTDRSA-N 2 1 314.517 4.409 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@H]1C ZINC001473211383 1060978498 /nfs/dbraw/zinc/97/84/98/1060978498.db2.gz YUJYIQKTESWJGG-VURPSTOHSA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@H]1C ZINC001473211383 1060978524 /nfs/dbraw/zinc/97/85/24/1060978524.db2.gz YUJYIQKTESWJGG-VURPSTOHSA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@H]1C ZINC001473211383 1060978550 /nfs/dbraw/zinc/97/85/50/1060978550.db2.gz YUJYIQKTESWJGG-VURPSTOHSA-N 2 1 314.517 4.375 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC001473211381 1060980907 /nfs/dbraw/zinc/98/09/07/1060980907.db2.gz YUJYIQKTESWJGG-UYWIDEMCSA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC001473211381 1060980922 /nfs/dbraw/zinc/98/09/22/1060980922.db2.gz YUJYIQKTESWJGG-UYWIDEMCSA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC001473211381 1060980933 /nfs/dbraw/zinc/98/09/33/1060980933.db2.gz YUJYIQKTESWJGG-UYWIDEMCSA-N 2 1 314.517 4.375 20 0 DIADMP CC[C@H](C)[C@H](C)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219586 1060995172 /nfs/dbraw/zinc/99/51/72/1060995172.db2.gz KCAMCCIHLRWGNR-MMKMLUHNSA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219586 1060995197 /nfs/dbraw/zinc/99/51/97/1060995197.db2.gz KCAMCCIHLRWGNR-MMKMLUHNSA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219586 1060995223 /nfs/dbraw/zinc/99/52/23/1060995223.db2.gz KCAMCCIHLRWGNR-MMKMLUHNSA-N 2 1 314.517 4.408 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC001473220528 1060995853 /nfs/dbraw/zinc/99/58/53/1060995853.db2.gz WTAYHURTRGRBMN-UYAOXDASSA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC001473220528 1060995875 /nfs/dbraw/zinc/99/58/75/1060995875.db2.gz WTAYHURTRGRBMN-UYAOXDASSA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC001473220528 1060995888 /nfs/dbraw/zinc/99/58/88/1060995888.db2.gz WTAYHURTRGRBMN-UYAOXDASSA-N 2 1 314.517 4.290 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462215792 1061031376 /nfs/dbraw/zinc/03/13/76/1061031376.db2.gz BPJAJHWCEALMOF-SLFFLAALSA-N 2 1 300.490 4.095 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462215792 1061031395 /nfs/dbraw/zinc/03/13/95/1061031395.db2.gz BPJAJHWCEALMOF-SLFFLAALSA-N 2 1 300.490 4.095 20 0 DIADMP CC[C@@H]1CCC[C@H](C[N@@H+](C)CCCN(C)Cc2ccco2)C1 ZINC001462218948 1061034299 /nfs/dbraw/zinc/03/42/99/1061034299.db2.gz MHVZPMHUQGGKBH-MSOLQXFVSA-N 2 1 306.494 4.250 20 0 DIADMP CC(C)SCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462222873 1061038702 /nfs/dbraw/zinc/03/87/02/1061038702.db2.gz XJMWQQQFTJYUAN-IEBWSBKVSA-N 2 1 318.530 4.086 20 0 DIADMP CC(C)SCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462222873 1061038718 /nfs/dbraw/zinc/03/87/18/1061038718.db2.gz XJMWQQQFTJYUAN-IEBWSBKVSA-N 2 1 318.530 4.086 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC001462223429 1061039773 /nfs/dbraw/zinc/03/97/73/1061039773.db2.gz PLTPGIKVEJYQIY-KVSKMBFKSA-N 2 1 320.908 4.440 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC001462223429 1061039787 /nfs/dbraw/zinc/03/97/87/1061039787.db2.gz PLTPGIKVEJYQIY-KVSKMBFKSA-N 2 1 320.908 4.440 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287668 1061058406 /nfs/dbraw/zinc/05/84/06/1061058406.db2.gz VQZKTOAHJKCTDP-KWLWEVDOSA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287668 1061058416 /nfs/dbraw/zinc/05/84/16/1061058416.db2.gz VQZKTOAHJKCTDP-KWLWEVDOSA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287668 1061058427 /nfs/dbraw/zinc/05/84/27/1061058427.db2.gz VQZKTOAHJKCTDP-KWLWEVDOSA-N 2 1 318.549 4.398 20 0 DIADMP CC[C@@H](CCc1ccccc1)[NH2+][C@@H](CC(C)C)C[NH+]1CCCC1 ZINC001462270733 1061064984 /nfs/dbraw/zinc/06/49/84/1061064984.db2.gz XNVWWGBOFNDDIB-SFTDATJTSA-N 2 1 316.533 4.498 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462300114 1061088276 /nfs/dbraw/zinc/08/82/76/1061088276.db2.gz OIMSQWDAYHTORF-YZGWKJHDSA-N 2 1 302.506 4.108 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462300114 1061088288 /nfs/dbraw/zinc/08/82/88/1061088288.db2.gz OIMSQWDAYHTORF-YZGWKJHDSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462301057 1061088891 /nfs/dbraw/zinc/08/88/91/1061088891.db2.gz YOUMUNDMYKTCJQ-YZGWKJHDSA-N 2 1 302.506 4.341 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462301057 1061088901 /nfs/dbraw/zinc/08/89/01/1061088901.db2.gz YOUMUNDMYKTCJQ-YZGWKJHDSA-N 2 1 302.506 4.341 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462306535 1061094575 /nfs/dbraw/zinc/09/45/75/1061094575.db2.gz PIACNGRPOBCMED-YSIASYRMSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462306535 1061094591 /nfs/dbraw/zinc/09/45/91/1061094591.db2.gz PIACNGRPOBCMED-YSIASYRMSA-N 2 1 302.506 4.108 20 0 DIADMP CC(C)CCC[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001473358121 1061111546 /nfs/dbraw/zinc/11/15/46/1061111546.db2.gz PZKYXNRLRKTUMQ-RUYXUALKSA-N 2 1 302.506 4.169 20 0 DIADMP CCCc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001473369600 1061116187 /nfs/dbraw/zinc/11/61/87/1061116187.db2.gz HIXTZTWOJJWQAW-FXAWDEMLSA-N 2 1 314.517 4.382 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H]1C[C@@H](OC(C)C)C1(C)C)C1CCCCC1 ZINC001462408119 1061154415 /nfs/dbraw/zinc/15/44/15/1061154415.db2.gz MHAXTOCVKUHMMM-RTBURBONSA-N 2 1 324.553 4.213 20 0 DIADMP CCc1ccc([C@@H]2CCC[N@@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC001473449076 1061165772 /nfs/dbraw/zinc/16/57/72/1061165772.db2.gz DEUMNDCSRLRRPR-OAQYLSRUSA-N 2 1 314.517 4.304 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001462441618 1061175907 /nfs/dbraw/zinc/17/59/07/1061175907.db2.gz NEAKJAXYARRGFF-YJBOKZPZSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001462441618 1061175913 /nfs/dbraw/zinc/17/59/13/1061175913.db2.gz NEAKJAXYARRGFF-YJBOKZPZSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001462441615 1061176164 /nfs/dbraw/zinc/17/61/64/1061176164.db2.gz NEAKJAXYARRGFF-QAPCUYQASA-N 2 1 320.908 4.268 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001462441615 1061176166 /nfs/dbraw/zinc/17/61/66/1061176166.db2.gz NEAKJAXYARRGFF-QAPCUYQASA-N 2 1 320.908 4.268 20 0 DIADMP CC[C@H](C)[C@H](C)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001473465350 1061176777 /nfs/dbraw/zinc/17/67/77/1061176777.db2.gz OLNHJJIGQCUBDZ-CMKODMSKSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001473465350 1061176786 /nfs/dbraw/zinc/17/67/86/1061176786.db2.gz OLNHJJIGQCUBDZ-CMKODMSKSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001473465350 1061176794 /nfs/dbraw/zinc/17/67/94/1061176794.db2.gz OLNHJJIGQCUBDZ-CMKODMSKSA-N 2 1 300.490 4.019 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462485286 1061203889 /nfs/dbraw/zinc/20/38/89/1061203889.db2.gz HURHGZXNCBLZFQ-MDNKFWRPSA-N 2 1 316.464 4.225 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462485286 1061203906 /nfs/dbraw/zinc/20/39/06/1061203906.db2.gz HURHGZXNCBLZFQ-MDNKFWRPSA-N 2 1 316.464 4.225 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC001462484426 1061205933 /nfs/dbraw/zinc/20/59/33/1061205933.db2.gz XBEDDEKBVUCDLN-SFTDATJTSA-N 2 1 324.512 4.377 20 0 DIADMP CCc1ccc(C[N@@H+](CC[C@H]2CCC[NH+]2C)CC(C)C)cc1 ZINC001473577378 1061267986 /nfs/dbraw/zinc/26/79/86/1061267986.db2.gz GEBXMLKWMQPWRA-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CCc1ccc(C[NH+](CC[C@H]2CCC[N@@H+]2C)CC(C)C)cc1 ZINC001473577378 1061268007 /nfs/dbraw/zinc/26/80/07/1061268007.db2.gz GEBXMLKWMQPWRA-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CCc1ccc(C[NH+](CC[C@H]2CCC[N@H+]2C)CC(C)C)cc1 ZINC001473577378 1061268024 /nfs/dbraw/zinc/26/80/24/1061268024.db2.gz GEBXMLKWMQPWRA-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccc(C)cc1C)CC(C)C ZINC001473577242 1061268866 /nfs/dbraw/zinc/26/88/66/1061268866.db2.gz FCYVPBQPTBAGGE-UHFFFAOYSA-N 2 1 313.489 4.357 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccc(C)cc1C)CC(C)C ZINC001473577242 1061268884 /nfs/dbraw/zinc/26/88/84/1061268884.db2.gz FCYVPBQPTBAGGE-UHFFFAOYSA-N 2 1 313.489 4.357 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+](C[C@@H](C)c2cccc(Cl)c2)CC1 ZINC001462586253 1061277835 /nfs/dbraw/zinc/27/78/35/1061277835.db2.gz PAMBPPBXRBMLMP-MRXNPFEDSA-N 2 1 320.908 4.394 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC001473689952 1061349551 /nfs/dbraw/zinc/34/95/51/1061349551.db2.gz SWUKMZKCIFFIJA-HBGVWJBISA-N 2 1 308.469 4.174 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001473689952 1061349571 /nfs/dbraw/zinc/34/95/71/1061349571.db2.gz SWUKMZKCIFFIJA-HBGVWJBISA-N 2 1 308.469 4.174 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001473689952 1061349590 /nfs/dbraw/zinc/34/95/90/1061349590.db2.gz SWUKMZKCIFFIJA-HBGVWJBISA-N 2 1 308.469 4.174 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1C[C@@]2(C)C[N@H+](C)C[C@@]2(C)C1 ZINC001473689952 1061349606 /nfs/dbraw/zinc/34/96/06/1061349606.db2.gz SWUKMZKCIFFIJA-HBGVWJBISA-N 2 1 308.469 4.174 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1C[C@@]2(C)C[N@@H+](C)C[C@@]2(C)C1 ZINC001473689952 1061349623 /nfs/dbraw/zinc/34/96/23/1061349623.db2.gz SWUKMZKCIFFIJA-HBGVWJBISA-N 2 1 308.469 4.174 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](C[C@@H]2CCC3(CCCCCC3)O2)CC1 ZINC001473695417 1061353367 /nfs/dbraw/zinc/35/33/67/1061353367.db2.gz OBFOFVGPIUFARO-SFHVURJKSA-N 2 1 322.537 4.065 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cccc(C(F)F)c1 ZINC001473749705 1061391089 /nfs/dbraw/zinc/39/10/89/1061391089.db2.gz PGGPDOOSTVBWKX-UHFFFAOYSA-N 2 1 310.432 4.322 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CCSC3CCCCC3)CC2)[nH+]c1C ZINC001473801355 1061414554 /nfs/dbraw/zinc/41/45/54/1061414554.db2.gz CYUZFCKBMBQEND-UHFFFAOYSA-N 2 1 321.534 4.272 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+]Cc1ccccc1C(F)(F)F ZINC001473908751 1061455119 /nfs/dbraw/zinc/45/51/19/1061455119.db2.gz OWPSWCYNSCEKQK-UHFFFAOYSA-N 2 1 316.411 4.307 20 0 DIADMP C[N@@H+](CCC[NH2+]CC(C)(C)c1ccccc1)C1CCCCC1 ZINC001473910116 1061458795 /nfs/dbraw/zinc/45/87/95/1061458795.db2.gz DQRLYFTWRJMAPN-UHFFFAOYSA-N 2 1 302.506 4.208 20 0 DIADMP Cc1ccc(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)cc1 ZINC001473910487 1061459136 /nfs/dbraw/zinc/45/91/36/1061459136.db2.gz RUHIMBCIPJPOQC-UHFFFAOYSA-N 2 1 310.485 4.243 20 0 DIADMP CC[C@@H](C[NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC001473917634 1061465657 /nfs/dbraw/zinc/46/56/57/1061465657.db2.gz JQBLNAFRHREWFO-FQEVSTJZSA-N 2 1 310.485 4.292 20 0 DIADMP CC(C)CCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001473922003 1061470107 /nfs/dbraw/zinc/47/01/07/1061470107.db2.gz VMWPNVQXJZYOIZ-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)CCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001473922003 1061470115 /nfs/dbraw/zinc/47/01/15/1061470115.db2.gz VMWPNVQXJZYOIZ-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP Cc1cccc(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)c1 ZINC001473920942 1061470751 /nfs/dbraw/zinc/47/07/51/1061470751.db2.gz XSLWCBFVEBQCOR-UHFFFAOYSA-N 2 1 310.485 4.243 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC(C)(C)C1 ZINC001473929455 1061477692 /nfs/dbraw/zinc/47/76/92/1061477692.db2.gz IMTXGXDAJCVWSS-FXAWDEMLSA-N 2 1 314.517 4.239 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC(C)(C)C1 ZINC001473929455 1061477702 /nfs/dbraw/zinc/47/77/02/1061477702.db2.gz IMTXGXDAJCVWSS-FXAWDEMLSA-N 2 1 314.517 4.239 20 0 DIADMP Cc1cccc2[nH]c(C[NH2+]CCCC[N@@H+]3CCCC[C@@H]3C)cc21 ZINC001473937028 1061481941 /nfs/dbraw/zinc/48/19/41/1061481941.db2.gz JLDXLHQHSXZTNW-KRWDZBQOSA-N 2 1 313.489 4.221 20 0 DIADMP Cc1cccc2[nH]c(C[NH2+]CCCC[N@@H+]3CCCC[C@H]3C)cc21 ZINC001473937030 1061482846 /nfs/dbraw/zinc/48/28/46/1061482846.db2.gz JLDXLHQHSXZTNW-QGZVFWFLSA-N 2 1 313.489 4.221 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC001473957223 1061500023 /nfs/dbraw/zinc/50/00/23/1061500023.db2.gz MZHMHMOZAJPPTJ-HMXCVIKNSA-N 2 1 314.517 4.424 20 0 DIADMP C[C@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001473957433 1061500107 /nfs/dbraw/zinc/50/01/07/1061500107.db2.gz PAZPZHQCEXTVAH-FXAWDEMLSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001473957433 1061500129 /nfs/dbraw/zinc/50/01/29/1061500129.db2.gz PAZPZHQCEXTVAH-FXAWDEMLSA-N 2 1 314.517 4.034 20 0 DIADMP CC[C@@H](C[NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccccc1 ZINC001473988233 1061530360 /nfs/dbraw/zinc/53/03/60/1061530360.db2.gz GOLANZAXBPNXRP-FQEVSTJZSA-N 2 1 310.485 4.422 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001473987772 1061532273 /nfs/dbraw/zinc/53/22/73/1061532273.db2.gz NDYVIMPFWUBCHP-DFQSSKMNSA-N 2 1 302.506 4.423 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1CC[NH2+]C[C@@H](C)CCc1ccccc1 ZINC001473994697 1061537781 /nfs/dbraw/zinc/53/77/81/1061537781.db2.gz BHESBNWBQDEGQA-AZUAARDMSA-N 2 1 302.506 4.109 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1CC[NH2+]C[C@@H](C)CCc1ccccc1 ZINC001473994697 1061537801 /nfs/dbraw/zinc/53/78/01/1061537801.db2.gz BHESBNWBQDEGQA-AZUAARDMSA-N 2 1 302.506 4.109 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CC[C@@H](C)[C@H](C)C2)c1 ZINC001474015642 1061556474 /nfs/dbraw/zinc/55/64/74/1061556474.db2.gz DFYFBKICDKPOIN-HLIPFELVSA-N 2 1 302.506 4.441 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001474027222 1061566532 /nfs/dbraw/zinc/56/65/32/1061566532.db2.gz CQGSXEBVGUBJRP-HUUCEWRRSA-N 2 1 316.420 4.048 20 0 DIADMP C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001474104658 1061653494 /nfs/dbraw/zinc/65/34/94/1061653494.db2.gz YIGWSSPBWNFAHA-HHXXYDBFSA-N 2 1 300.490 4.163 20 0 DIADMP Cc1ccc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)c(F)c1 ZINC001474118840 1061668304 /nfs/dbraw/zinc/66/83/04/1061668304.db2.gz UQRLLKRKZMCTTR-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCC[C@@H]2c2ccccc2)CC1(C)C ZINC001474159401 1061701111 /nfs/dbraw/zinc/70/11/11/1061701111.db2.gz KDXRIDALGNESRX-GBESFXJTSA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)CC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001474217686 1061775721 /nfs/dbraw/zinc/77/57/21/1061775721.db2.gz ITRUUDVDFOAMJE-MJGOQNOKSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001474217686 1061775737 /nfs/dbraw/zinc/77/57/37/1061775737.db2.gz ITRUUDVDFOAMJE-MJGOQNOKSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3C[C@H]3C3CCCC3)CC2)cc1 ZINC001474301250 1061871259 /nfs/dbraw/zinc/87/12/59/1061871259.db2.gz IIAPFNZYBRSMAP-FPOVZHCZSA-N 2 1 312.501 4.067 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC001474304317 1061874388 /nfs/dbraw/zinc/87/43/88/1061874388.db2.gz OGWCVPPBAFNABI-MRXNPFEDSA-N 2 1 300.446 4.157 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](CC)CC1CC[NH+](CC)CC1 ZINC001474344472 1061948434 /nfs/dbraw/zinc/94/84/34/1061948434.db2.gz LVGJGRAZOIKGRQ-HXUWFJFHSA-N 2 1 302.506 4.062 20 0 DIADMP CC[N@@H+](CC1CC[NH+](C)CC1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001474345312 1061951345 /nfs/dbraw/zinc/95/13/45/1061951345.db2.gz JGJORZIIPSUHHQ-FQEVSTJZSA-N 2 1 320.496 4.057 20 0 DIADMP CC[NH+]1CCC(C[N@H+](Cc2cccc(C)c2)CC(C)C)CC1 ZINC001474361880 1061985319 /nfs/dbraw/zinc/98/53/19/1061985319.db2.gz BSBYTQLAZTXIKS-UHFFFAOYSA-N 2 1 302.506 4.185 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)CC1 ZINC001474362187 1061991799 /nfs/dbraw/zinc/99/17/99/1061991799.db2.gz LQTYTHKACCDYDM-OAQYLSRUSA-N 2 1 312.501 4.260 20 0 DIADMP C[C@@H]1CC[N@@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001474380725 1062024338 /nfs/dbraw/zinc/02/43/38/1062024338.db2.gz AALLARJSTYTKJT-NQIIRXRSSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001474380725 1062024353 /nfs/dbraw/zinc/02/43/53/1062024353.db2.gz AALLARJSTYTKJT-NQIIRXRSSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001474380725 1062024373 /nfs/dbraw/zinc/02/43/73/1062024373.db2.gz AALLARJSTYTKJT-NQIIRXRSSA-N 2 1 314.517 4.267 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCCC[C@H]2c2ccc(C)cc2)CC1 ZINC001474385437 1062034872 /nfs/dbraw/zinc/03/48/72/1062034872.db2.gz FEBBGENUJZUTJE-FQEVSTJZSA-N 2 1 300.490 4.254 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C4CCC5(CC5)CC4)C[C@H]3C2)cc1 ZINC001254449369 1062110635 /nfs/dbraw/zinc/11/06/35/1062110635.db2.gz MMWYWRYJKWQUBS-VQTJNVASSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@@H+](C4CCC5(CC5)CC4)C[C@H]3C2)cc1 ZINC001254449369 1062110642 /nfs/dbraw/zinc/11/06/42/1062110642.db2.gz MMWYWRYJKWQUBS-VQTJNVASSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@H+](C4CCC5(CC5)CC4)C[C@H]3C2)cc1 ZINC001254449369 1062110646 /nfs/dbraw/zinc/11/06/46/1062110646.db2.gz MMWYWRYJKWQUBS-VQTJNVASSA-N 2 1 324.512 4.163 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCC[C@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442458 1062119985 /nfs/dbraw/zinc/11/99/85/1062119985.db2.gz NDCBSTVXBWJBCG-KCQAQPDRSA-N 2 1 310.532 4.090 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCC[C@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442458 1062119996 /nfs/dbraw/zinc/11/99/96/1062119996.db2.gz NDCBSTVXBWJBCG-KCQAQPDRSA-N 2 1 310.532 4.090 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001254492530 1062135401 /nfs/dbraw/zinc/13/54/01/1062135401.db2.gz VLPCQBJRBBIGGG-HMXCVIKNSA-N 2 1 316.533 4.496 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001254492536 1062135610 /nfs/dbraw/zinc/13/56/10/1062135610.db2.gz VLPCQBJRBBIGGG-TYPHKJRUSA-N 2 1 316.533 4.496 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]CCc2ccc(Oc3ccccc3)cc2)CC1 ZINC001254499341 1062141192 /nfs/dbraw/zinc/14/11/92/1062141192.db2.gz DGBVGDAQEVEBPS-IBGZPJMESA-N 2 1 324.468 4.095 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH+]1CCC([N@@H+](C)CC)CC1 ZINC001254497974 1062141778 /nfs/dbraw/zinc/14/17/78/1062141778.db2.gz GHEWLJSSZSZWHK-FQEVSTJZSA-N 2 1 302.506 4.204 20 0 DIADMP C(C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC001459438183 1062144580 /nfs/dbraw/zinc/14/45/80/1062144580.db2.gz MRCQBFCHTOJQNO-RLLQIKCJSA-N 2 1 304.522 4.011 20 0 DIADMP C(C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)[C@@H]1C[C@H]1C1CC1 ZINC001459438187 1062145395 /nfs/dbraw/zinc/14/53/95/1062145395.db2.gz MRCQBFCHTOJQNO-SXLOBPIMSA-N 2 1 304.522 4.011 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]CCC(c2ccccc2)c2ccccc2)CC1 ZINC001254504080 1062146470 /nfs/dbraw/zinc/14/64/70/1062146470.db2.gz SHZQBCKEWDSRJQ-NRFANRHFSA-N 2 1 322.496 4.283 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CCC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC001254510115 1062148140 /nfs/dbraw/zinc/14/81/40/1062148140.db2.gz RXPGPUMDVMCHOW-CVEARBPZSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[N@@H+](C)CC1)c1cc(Cl)cc(Cl)c1 ZINC001254506492 1062150070 /nfs/dbraw/zinc/15/00/70/1062150070.db2.gz SZAHLTQAQYQEQV-ABAIWWIYSA-N 2 1 301.261 4.128 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[N@@H+](C)CC1)c1cc(Cl)cc(Cl)c1 ZINC001254506493 1062151199 /nfs/dbraw/zinc/15/11/99/1062151199.db2.gz SZAHLTQAQYQEQV-IAQYHMDHSA-N 2 1 301.261 4.128 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc3oc4ccccc4c3c2)C1 ZINC001474499281 1062181370 /nfs/dbraw/zinc/18/13/70/1062181370.db2.gz PMPZRUBMKPPIKR-QGZVFWFLSA-N 2 1 322.452 4.406 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC001474503449 1062184647 /nfs/dbraw/zinc/18/46/47/1062184647.db2.gz LVTIMWPUCXRNTP-KRWDZBQOSA-N 2 1 320.908 4.066 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC001474508065 1062190470 /nfs/dbraw/zinc/19/04/70/1062190470.db2.gz HFOBVKDRCFBABM-ZCNNSNEGSA-N 2 1 300.490 4.177 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC001474508065 1062190476 /nfs/dbraw/zinc/19/04/76/1062190476.db2.gz HFOBVKDRCFBABM-ZCNNSNEGSA-N 2 1 300.490 4.177 20 0 DIADMP Cc1cccc([C@H]2CCCC[NH+]2CC[C@H]2CCC[N@@H+]2C)c1C ZINC001459565684 1062210583 /nfs/dbraw/zinc/21/05/83/1062210583.db2.gz RYNORGDGACTJSQ-UYAOXDASSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@H]2CCCC[N@H+]2CC[C@H]2CCC[NH+]2C)c1C ZINC001459565684 1062210595 /nfs/dbraw/zinc/21/05/95/1062210595.db2.gz RYNORGDGACTJSQ-UYAOXDASSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@H]2CCCC[N@@H+]2CC[C@H]2CCC[NH+]2C)c1C ZINC001459565684 1062210614 /nfs/dbraw/zinc/21/06/14/1062210614.db2.gz RYNORGDGACTJSQ-UYAOXDASSA-N 2 1 300.490 4.315 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)[C@@H]1CCc2c1cccc2Cl ZINC001459571127 1062217203 /nfs/dbraw/zinc/21/72/03/1062217203.db2.gz FAELUBCFPQIXBO-KBXCAEBGSA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)[C@@H]1CCc2c1cccc2Cl ZINC001459571127 1062217221 /nfs/dbraw/zinc/21/72/21/1062217221.db2.gz FAELUBCFPQIXBO-KBXCAEBGSA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)[C@@H]1CCc2c1cccc2Cl ZINC001459571127 1062217242 /nfs/dbraw/zinc/21/72/42/1062217242.db2.gz FAELUBCFPQIXBO-KBXCAEBGSA-N 2 1 306.881 4.134 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2c(C)ccc3ccccc32)C1 ZINC001459576692 1062219296 /nfs/dbraw/zinc/21/92/96/1062219296.db2.gz QNBAAIQYUAPBTI-GOSISDBHSA-N 2 1 310.485 4.312 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)CCc1ccsc1 ZINC001474538826 1062229058 /nfs/dbraw/zinc/22/90/58/1062229058.db2.gz WOBDGQMZTUGKSD-AEFFLSMTSA-N 2 1 308.535 4.169 20 0 DIADMP CC1([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCCC1 ZINC001255123144 1062321722 /nfs/dbraw/zinc/32/17/22/1062321722.db2.gz YQLKLBFKSFJXCO-OWZKRDHZSA-N 2 1 312.501 4.494 20 0 DIADMP CCC1CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255137019 1062326268 /nfs/dbraw/zinc/32/62/68/1062326268.db2.gz ORZRFMZIXQVPQS-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(F)CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255135922 1062326334 /nfs/dbraw/zinc/32/63/34/1062326334.db2.gz GDDLYANGLXOSQH-BWTSREIZSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137437 1062327610 /nfs/dbraw/zinc/32/76/10/1062327610.db2.gz RVBHBZSFBCSNFC-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137437 1062327633 /nfs/dbraw/zinc/32/76/33/1062327633.db2.gz RVBHBZSFBCSNFC-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137437 1062327655 /nfs/dbraw/zinc/32/76/55/1062327655.db2.gz RVBHBZSFBCSNFC-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137437 1062327680 /nfs/dbraw/zinc/32/76/80/1062327680.db2.gz RVBHBZSFBCSNFC-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP CCCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255137627 1062328441 /nfs/dbraw/zinc/32/84/41/1062328441.db2.gz ZGBZIHWIUMIMBD-RSPOEFSDSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135361 1062332032 /nfs/dbraw/zinc/33/20/32/1062332032.db2.gz JHVVJXZCNYOSPH-OCMVRUFMSA-N 2 1 312.501 4.206 20 0 DIADMP F[C@H]1CCCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137739 1062332140 /nfs/dbraw/zinc/33/21/40/1062332140.db2.gz WRVICBPYVIVBRS-HAGHYFMRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137739 1062332156 /nfs/dbraw/zinc/33/21/56/1062332156.db2.gz WRVICBPYVIVBRS-HAGHYFMRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137739 1062332170 /nfs/dbraw/zinc/33/21/70/1062332170.db2.gz WRVICBPYVIVBRS-HAGHYFMRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137739 1062332178 /nfs/dbraw/zinc/33/21/78/1062332178.db2.gz WRVICBPYVIVBRS-HAGHYFMRSA-N 2 1 316.464 4.006 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC4(C2)CCCC4)C3)cc1 ZINC001255139114 1062332310 /nfs/dbraw/zinc/33/23/10/1062332310.db2.gz CXYVOPFLRXRYIC-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCCCC24CC4)C3)cc1 ZINC001255148494 1062334918 /nfs/dbraw/zinc/33/49/18/1062334918.db2.gz VOIGJZPLXVKYID-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCCCC24CC4)C3)cc1 ZINC001255148494 1062334945 /nfs/dbraw/zinc/33/49/45/1062334945.db2.gz VOIGJZPLXVKYID-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCCCC24CC4)C3)cc1 ZINC001255148494 1062334960 /nfs/dbraw/zinc/33/49/60/1062334960.db2.gz VOIGJZPLXVKYID-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCCCC24CC4)C3)cc1 ZINC001255148494 1062334990 /nfs/dbraw/zinc/33/49/90/1062334990.db2.gz VOIGJZPLXVKYID-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474616301 1062335741 /nfs/dbraw/zinc/33/57/41/1062335741.db2.gz NJOQOKDYMWGONP-FRYIKTPZSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142603 1062335570 /nfs/dbraw/zinc/33/55/70/1062335570.db2.gz DVNNKXSKKWWTRD-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142603 1062335594 /nfs/dbraw/zinc/33/55/94/1062335594.db2.gz DVNNKXSKKWWTRD-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142603 1062335611 /nfs/dbraw/zinc/33/56/11/1062335611.db2.gz DVNNKXSKKWWTRD-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142603 1062335631 /nfs/dbraw/zinc/33/56/31/1062335631.db2.gz DVNNKXSKKWWTRD-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC4(C2)CCCCC4)C3)cc1 ZINC001255146118 1062338572 /nfs/dbraw/zinc/33/85/72/1062338572.db2.gz CPDJYXLTKKFKGK-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001255142570 1062339777 /nfs/dbraw/zinc/33/97/77/1062339777.db2.gz DTORGCPJPWDLDQ-HNZUOSPBSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001255142570 1062339792 /nfs/dbraw/zinc/33/97/92/1062339792.db2.gz DTORGCPJPWDLDQ-HNZUOSPBSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CC4CCC2CC4)C3)cc1 ZINC001255142570 1062339813 /nfs/dbraw/zinc/33/98/13/1062339813.db2.gz DTORGCPJPWDLDQ-HNZUOSPBSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CC4CCC2CC4)C3)cc1 ZINC001255142570 1062339843 /nfs/dbraw/zinc/33/98/43/1062339843.db2.gz DTORGCPJPWDLDQ-HNZUOSPBSA-N 2 1 310.485 4.056 20 0 DIADMP C[N@@H+](CC1CCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146827 1062340486 /nfs/dbraw/zinc/34/04/86/1062340486.db2.gz JZXYDDCXTLZLHE-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146827 1062340498 /nfs/dbraw/zinc/34/04/98/1062340498.db2.gz JZXYDDCXTLZLHE-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146827 1062340521 /nfs/dbraw/zinc/34/05/21/1062340521.db2.gz JZXYDDCXTLZLHE-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H]1C ZINC001255143026 1062342279 /nfs/dbraw/zinc/34/22/79/1062342279.db2.gz IVUFSZGVWDFFQL-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H]1C ZINC001255143026 1062342302 /nfs/dbraw/zinc/34/23/02/1062342302.db2.gz IVUFSZGVWDFFQL-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H]1C ZINC001255143026 1062342326 /nfs/dbraw/zinc/34/23/26/1062342326.db2.gz IVUFSZGVWDFFQL-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@H]1C ZINC001255143026 1062342350 /nfs/dbraw/zinc/34/23/50/1062342350.db2.gz IVUFSZGVWDFFQL-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001474644812 1062369701 /nfs/dbraw/zinc/36/97/01/1062369701.db2.gz CAHVDHJYFCKHGK-NHCUHLMSSA-N 2 1 314.517 4.109 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001474644813 1062372889 /nfs/dbraw/zinc/37/28/89/1062372889.db2.gz CAHVDHJYFCKHGK-RTWAWAEBSA-N 2 1 314.517 4.109 20 0 DIADMP Cc1oc2ccccc2c1C[N@@H+]1CCCC[C@@H]1[C@H](C)C[NH+](C)C ZINC001474646986 1062373454 /nfs/dbraw/zinc/37/34/54/1062373454.db2.gz JQHPSCNYWFHOGG-DNVCBOLYSA-N 2 1 314.473 4.293 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@H+]1CCCC[C@@H]1[C@@H](C)C[NH+](C)C ZINC001474647166 1062374069 /nfs/dbraw/zinc/37/40/69/1062374069.db2.gz IEQBISBEOCZNGB-MAUKXSAKSA-N 2 1 320.521 4.438 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCCC[C@@H]1[C@@H](C)C[NH+](C)C ZINC001474647166 1062374084 /nfs/dbraw/zinc/37/40/84/1062374084.db2.gz IEQBISBEOCZNGB-MAUKXSAKSA-N 2 1 320.521 4.438 20 0 DIADMP CC1(C)CCC([N@@H+](Cc2ccncc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001255301849 1062384766 /nfs/dbraw/zinc/38/47/66/1062384766.db2.gz VPSIGBSITRUPLQ-IYARVYRRSA-N 2 1 315.505 4.122 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255321731 1062399395 /nfs/dbraw/zinc/39/93/95/1062399395.db2.gz WKLBEGPWMUDVQT-SZMVWBNQSA-N 2 1 306.469 4.476 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001474670578 1062403519 /nfs/dbraw/zinc/40/35/19/1062403519.db2.gz HLUUJHAAYUNQLR-RXVVDRJESA-N 2 1 314.517 4.394 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001474670578 1062403522 /nfs/dbraw/zinc/40/35/22/1062403522.db2.gz HLUUJHAAYUNQLR-RXVVDRJESA-N 2 1 314.517 4.394 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255383321 1062421050 /nfs/dbraw/zinc/42/10/50/1062421050.db2.gz HIXYAQCIAIXSHL-JOCHJYFZSA-N 2 1 322.496 4.393 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255380506 1062423681 /nfs/dbraw/zinc/42/36/81/1062423681.db2.gz KYBYEOKAROUTPI-QFIPXVFZSA-N 2 1 322.496 4.182 20 0 DIADMP FC1(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCCCC1 ZINC001255381552 1062423749 /nfs/dbraw/zinc/42/37/49/1062423749.db2.gz QCEGLAKQOLCMHN-LJQANCHMSA-N 2 1 318.480 4.303 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccc(O)c1 ZINC001255383960 1062424153 /nfs/dbraw/zinc/42/41/53/1062424153.db2.gz QJSTVSBOEDIUGD-XLIONFOSSA-N 2 1 324.468 4.098 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1C ZINC001255380082 1062424277 /nfs/dbraw/zinc/42/42/77/1062424277.db2.gz HJBBFXLXEJGBJG-JOCHJYFZSA-N 2 1 322.496 4.448 20 0 DIADMP CCCC1([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCC1 ZINC001255392874 1062428017 /nfs/dbraw/zinc/42/80/17/1062428017.db2.gz MLUCTAPUTCEYFU-IBGZPJMESA-N 2 1 300.490 4.354 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)nc1 ZINC001255393237 1062428412 /nfs/dbraw/zinc/42/84/12/1062428412.db2.gz MSUHUVPHQQRIMP-AZUAARDMSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)nc1 ZINC001255393237 1062428416 /nfs/dbraw/zinc/42/84/16/1062428416.db2.gz MSUHUVPHQQRIMP-AZUAARDMSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)n1 ZINC001255393366 1062428438 /nfs/dbraw/zinc/42/84/38/1062428438.db2.gz NLOFKQYTVWXDEC-AZUAARDMSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)n1 ZINC001255393366 1062428447 /nfs/dbraw/zinc/42/84/47/1062428447.db2.gz NLOFKQYTVWXDEC-AZUAARDMSA-N 2 1 323.484 4.095 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255390488 1062429448 /nfs/dbraw/zinc/42/94/48/1062429448.db2.gz HYZUXCAWIIJEGK-MOPGFXCFSA-N 2 1 300.490 4.209 20 0 DIADMP FC1(F)CCC[C@@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255394174 1062429855 /nfs/dbraw/zinc/42/98/55/1062429855.db2.gz TUUNTSGERWWIPM-ZWKOTPCHSA-N 2 1 322.443 4.209 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccncc1 ZINC001255392494 1062430057 /nfs/dbraw/zinc/43/00/57/1062430057.db2.gz FMRABEGNBSRIAD-RTWAWAEBSA-N 2 1 323.484 4.177 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@H]3CCCC34CCC4)CC2)cc1 ZINC001255395755 1062431637 /nfs/dbraw/zinc/43/16/37/1062431637.db2.gz CQEDNFDYXZGYFJ-UXHICEINSA-N 2 1 312.501 4.354 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255398782 1062431766 /nfs/dbraw/zinc/43/17/66/1062431766.db2.gz XVFHMFGQHHYZCX-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255398782 1062431775 /nfs/dbraw/zinc/43/17/75/1062431775.db2.gz XVFHMFGQHHYZCX-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255398782 1062431781 /nfs/dbraw/zinc/43/17/81/1062431781.db2.gz XVFHMFGQHHYZCX-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398221 1062433746 /nfs/dbraw/zinc/43/37/46/1062433746.db2.gz ISVCFFODAZWABX-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398221 1062433753 /nfs/dbraw/zinc/43/37/53/1062433753.db2.gz ISVCFFODAZWABX-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398221 1062433762 /nfs/dbraw/zinc/43/37/62/1062433762.db2.gz ISVCFFODAZWABX-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](CCc1ccccc1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255396747 1062434249 /nfs/dbraw/zinc/43/42/49/1062434249.db2.gz BMOSHFOKBQXUFT-JOCHJYFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+](CCc1ccccc1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255396747 1062434265 /nfs/dbraw/zinc/43/42/65/1062434265.db2.gz BMOSHFOKBQXUFT-JOCHJYFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+](CCc1ccccc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255396747 1062434271 /nfs/dbraw/zinc/43/42/71/1062434271.db2.gz BMOSHFOKBQXUFT-JOCHJYFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[C@]1(F)CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255399797 1062435454 /nfs/dbraw/zinc/43/54/54/1062435454.db2.gz ZWCBRJUBSIFQTC-PMACEKPBSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255399797 1062435468 /nfs/dbraw/zinc/43/54/68/1062435468.db2.gz ZWCBRJUBSIFQTC-PMACEKPBSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255399797 1062435481 /nfs/dbraw/zinc/43/54/81/1062435481.db2.gz ZWCBRJUBSIFQTC-PMACEKPBSA-N 2 1 318.480 4.255 20 0 DIADMP CC(C)C1CC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255408146 1062441938 /nfs/dbraw/zinc/44/19/38/1062441938.db2.gz IRAHGNSQQGCUAE-OAQYLSRUSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408379 1062441974 /nfs/dbraw/zinc/44/19/74/1062441974.db2.gz KWFCAWFGQMZBPR-PMACEKPBSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408379 1062441982 /nfs/dbraw/zinc/44/19/82/1062441982.db2.gz KWFCAWFGQMZBPR-PMACEKPBSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408379 1062441991 /nfs/dbraw/zinc/44/19/91/1062441991.db2.gz KWFCAWFGQMZBPR-PMACEKPBSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H](C)C[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255405484 1062442041 /nfs/dbraw/zinc/44/20/41/1062442041.db2.gz NOBSAXOFUHNQDW-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255402430 1062442904 /nfs/dbraw/zinc/44/29/04/1062442904.db2.gz IQLBAFFHSSBUHH-FQEVSTJZSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255402430 1062442923 /nfs/dbraw/zinc/44/29/23/1062442923.db2.gz IQLBAFFHSSBUHH-FQEVSTJZSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255402430 1062442932 /nfs/dbraw/zinc/44/29/32/1062442932.db2.gz IQLBAFFHSSBUHH-FQEVSTJZSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]C2CCC(C(F)(F)F)CC2)C1 ZINC001255507374 1062467385 /nfs/dbraw/zinc/46/73/85/1062467385.db2.gz XGKCTNWAGAKZGU-PJPHBNEVSA-N 2 1 320.443 4.065 20 0 DIADMP Cc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001255668910 1062506103 /nfs/dbraw/zinc/50/61/03/1062506103.db2.gz PDAKIIOOGFGSFO-YQQQUEKLSA-N 2 1 308.469 4.253 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1F ZINC001255668661 1062506671 /nfs/dbraw/zinc/50/66/71/1062506671.db2.gz GVTMAILDJVKQMR-KRWWSPQJSA-N 2 1 308.416 4.021 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)cc(Cl)c1 ZINC001255676469 1062509678 /nfs/dbraw/zinc/50/96/78/1062509678.db2.gz MZUPKRKWVYVLAW-CTRGQFNUSA-N 2 1 310.844 4.145 20 0 DIADMP Cc1ccccc1CC(C)(C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255672706 1062510654 /nfs/dbraw/zinc/51/06/54/1062510654.db2.gz PKSJSIWIBIDQGL-IHWFROFDSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255681515 1062514707 /nfs/dbraw/zinc/51/47/07/1062514707.db2.gz WAOIOAKTFPBMCQ-BXEVVDMOSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255681515 1062514728 /nfs/dbraw/zinc/51/47/28/1062514728.db2.gz WAOIOAKTFPBMCQ-BXEVVDMOSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255681515 1062514748 /nfs/dbraw/zinc/51/47/48/1062514748.db2.gz WAOIOAKTFPBMCQ-BXEVVDMOSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255681515 1062514766 /nfs/dbraw/zinc/51/47/66/1062514766.db2.gz WAOIOAKTFPBMCQ-BXEVVDMOSA-N 2 1 306.881 4.348 20 0 DIADMP C[N@H+](Cc1cccc2ccccc21)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255680447 1062515195 /nfs/dbraw/zinc/51/51/95/1062515195.db2.gz UZMGFCPUMKTISH-YOFSQIOKSA-N 2 1 308.469 4.287 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255680447 1062515218 /nfs/dbraw/zinc/51/52/18/1062515218.db2.gz UZMGFCPUMKTISH-YOFSQIOKSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1cccc2ccccc21)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255680447 1062515242 /nfs/dbraw/zinc/51/52/42/1062515242.db2.gz UZMGFCPUMKTISH-YOFSQIOKSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1cccc2ccccc21)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255680447 1062515263 /nfs/dbraw/zinc/51/52/63/1062515263.db2.gz UZMGFCPUMKTISH-YOFSQIOKSA-N 2 1 308.469 4.287 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255701214 1062525587 /nfs/dbraw/zinc/52/55/87/1062525587.db2.gz SJKXSHMKAMPQSI-SDADXPQNSA-N 2 1 318.427 4.232 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC001459981323 1062545773 /nfs/dbraw/zinc/54/57/73/1062545773.db2.gz YDVZEDKAMIIOQB-NJYVYQBISA-N 2 1 314.517 4.377 20 0 DIADMP CC[C@@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@@H]1C ZINC001459985649 1062548603 /nfs/dbraw/zinc/54/86/03/1062548603.db2.gz NSAYRDHHEZNYON-YLJYHZDGSA-N 2 1 300.490 4.293 20 0 DIADMP CCCC[N@@H+](C)CCC[NH2+][C@@H](C)CSc1ccc(F)cc1 ZINC001255731370 1062554170 /nfs/dbraw/zinc/55/41/70/1062554170.db2.gz KSOMMZVLDKUBAE-HNNXBMFYSA-N 2 1 312.498 4.018 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)CSc2ccc(F)cc2)[C@H](C)C1 ZINC001255737453 1062562098 /nfs/dbraw/zinc/56/20/98/1062562098.db2.gz ICQVTYMHUZDDGX-IIDMSEBBSA-N 2 1 324.509 4.015 20 0 DIADMP CC(C)Cc1ccc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1 ZINC001460018835 1062575975 /nfs/dbraw/zinc/57/59/75/1062575975.db2.gz KJTSAGLHPOZVQB-UHFFFAOYSA-N 2 1 314.517 4.193 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255784833 1062606179 /nfs/dbraw/zinc/60/61/79/1062606179.db2.gz WTHHWXHQQZJGMR-MISYRCLQSA-N 2 1 302.506 4.154 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H](C)Cc2ccc(C)cc2)CC1 ZINC001255795554 1062612686 /nfs/dbraw/zinc/61/26/86/1062612686.db2.gz GZBMSLKPVXKRLS-GOSISDBHSA-N 2 1 302.506 4.122 20 0 DIADMP C[N@H+]1CCC[C@@H]1CCN1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100884 1062637328 /nfs/dbraw/zinc/63/73/28/1062637328.db2.gz XTFCYUHENVAQAW-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100884 1062637343 /nfs/dbraw/zinc/63/73/43/1062637343.db2.gz XTFCYUHENVAQAW-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100884 1062637356 /nfs/dbraw/zinc/63/73/56/1062637356.db2.gz XTFCYUHENVAQAW-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100884 1062637365 /nfs/dbraw/zinc/63/73/65/1062637365.db2.gz XTFCYUHENVAQAW-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100884 1062637374 /nfs/dbraw/zinc/63/73/74/1062637374.db2.gz XTFCYUHENVAQAW-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@H]1CCN1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100891 1062637999 /nfs/dbraw/zinc/63/79/99/1062637999.db2.gz XTFCYUHENVAQAW-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100891 1062638008 /nfs/dbraw/zinc/63/80/08/1062638008.db2.gz XTFCYUHENVAQAW-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100891 1062638016 /nfs/dbraw/zinc/63/80/16/1062638016.db2.gz XTFCYUHENVAQAW-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100891 1062638023 /nfs/dbraw/zinc/63/80/23/1062638023.db2.gz XTFCYUHENVAQAW-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100891 1062638035 /nfs/dbraw/zinc/63/80/35/1062638035.db2.gz XTFCYUHENVAQAW-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](C2CCCCCC2)CC1 ZINC001255894096 1062660122 /nfs/dbraw/zinc/66/01/22/1062660122.db2.gz SDQBDNRQTZWKBS-UHFFFAOYSA-N 2 1 318.480 4.445 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](C2CCCCCC2)CC1 ZINC001255894096 1062660136 /nfs/dbraw/zinc/66/01/36/1062660136.db2.gz SDQBDNRQTZWKBS-UHFFFAOYSA-N 2 1 318.480 4.445 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001255968332 1062672759 /nfs/dbraw/zinc/67/27/59/1062672759.db2.gz XVIJETAKHCBRIV-WBVHZDCISA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001255968332 1062672778 /nfs/dbraw/zinc/67/27/78/1062672778.db2.gz XVIJETAKHCBRIV-WBVHZDCISA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH+]1CCC(c2ccc(F)cc2F)CC1 ZINC001255968521 1062673816 /nfs/dbraw/zinc/67/38/16/1062673816.db2.gz AHURJNKHGDRTGR-OAHLLOKOSA-N 2 1 324.459 4.265 20 0 DIADMP Fc1ccc(-c2ccccc2C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC001256066964 1062691317 /nfs/dbraw/zinc/69/13/17/1062691317.db2.gz BFYPBKPNIHANPF-UHFFFAOYSA-N 2 1 324.443 4.209 20 0 DIADMP Fc1ccc(-c2cccc(C[NH2+]C3CC[NH+](C4CC4)CC3)c2)cc1 ZINC001256072499 1062694302 /nfs/dbraw/zinc/69/43/02/1062694302.db2.gz PNRCPVFNJHVUFN-UHFFFAOYSA-N 2 1 324.443 4.209 20 0 DIADMP c1cc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)cs1 ZINC001256069450 1062695899 /nfs/dbraw/zinc/69/58/99/1062695899.db2.gz DHOFGILRMGEYJR-UHFFFAOYSA-N 2 1 312.482 4.132 20 0 DIADMP C[N@H+](C(c1ccccc1)c1ccccc1)C1CC[NH+](C2CC2)CC1 ZINC001256073325 1062696086 /nfs/dbraw/zinc/69/60/86/1062696086.db2.gz RGJBVFZMDSDOLU-UHFFFAOYSA-N 2 1 320.480 4.335 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)C1CC[NH+](C2CC2)CC1 ZINC001256073325 1062696093 /nfs/dbraw/zinc/69/60/93/1062696093.db2.gz RGJBVFZMDSDOLU-UHFFFAOYSA-N 2 1 320.480 4.335 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H]2CCC[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC001256114019 1062715025 /nfs/dbraw/zinc/71/50/25/1062715025.db2.gz SWLXRLQXTNNHKD-HZEGPAAWSA-N 2 1 314.517 4.421 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)[C@H]1CCC[C@H](c2ccccc2)C1 ZINC001256120021 1062715884 /nfs/dbraw/zinc/71/58/84/1062715884.db2.gz XTIADIQNJJDYRT-PMACEKPBSA-N 2 1 300.490 4.131 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC001256520666 1062843603 /nfs/dbraw/zinc/84/36/03/1062843603.db2.gz RZXMJMFELKSXIP-CNNODRBYSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC001256520666 1062843631 /nfs/dbraw/zinc/84/36/31/1062843631.db2.gz RZXMJMFELKSXIP-CNNODRBYSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@@H+]1Cc1ccccc1 ZINC001256528331 1062844646 /nfs/dbraw/zinc/84/46/46/1062844646.db2.gz ZUMIMXSORHXOEW-MQBSTWLZSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC001256528331 1062844666 /nfs/dbraw/zinc/84/46/66/1062844666.db2.gz ZUMIMXSORHXOEW-MQBSTWLZSA-N 2 1 312.501 4.208 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256527223 1062846285 /nfs/dbraw/zinc/84/62/85/1062846285.db2.gz QSQINPWCTBTCKY-PNYFIKQUSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256527223 1062846302 /nfs/dbraw/zinc/84/63/02/1062846302.db2.gz QSQINPWCTBTCKY-PNYFIKQUSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256524003 1062847436 /nfs/dbraw/zinc/84/74/36/1062847436.db2.gz UJABLMIHCPDBHJ-NJEHNGEPSA-N 2 1 320.480 4.343 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256524003 1062847464 /nfs/dbraw/zinc/84/74/64/1062847464.db2.gz UJABLMIHCPDBHJ-NJEHNGEPSA-N 2 1 320.480 4.343 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528214 1062850024 /nfs/dbraw/zinc/85/00/24/1062850024.db2.gz CMHKPILGQYXBEX-LCLWPZTBSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528214 1062850045 /nfs/dbraw/zinc/85/00/45/1062850045.db2.gz CMHKPILGQYXBEX-LCLWPZTBSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@@H+]1Cc1ccccc1 ZINC001256528332 1062852271 /nfs/dbraw/zinc/85/22/71/1062852271.db2.gz ZUMIMXSORHXOEW-RQUKQETFSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC001256528332 1062852290 /nfs/dbraw/zinc/85/22/90/1062852290.db2.gz ZUMIMXSORHXOEW-RQUKQETFSA-N 2 1 312.501 4.208 20 0 DIADMP CCCC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC001256535197 1062852430 /nfs/dbraw/zinc/85/24/30/1062852430.db2.gz XOHFSUCQOSRBSS-HKUYNNGSSA-N 2 1 300.490 4.352 20 0 DIADMP CCCC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC001256535197 1062852454 /nfs/dbraw/zinc/85/24/54/1062852454.db2.gz XOHFSUCQOSRBSS-HKUYNNGSSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256533364 1062852971 /nfs/dbraw/zinc/85/29/71/1062852971.db2.gz NEWSUKRZJHMKOW-QFBILLFUSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256533364 1062853000 /nfs/dbraw/zinc/85/30/00/1062853000.db2.gz NEWSUKRZJHMKOW-QFBILLFUSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256533362 1062853785 /nfs/dbraw/zinc/85/37/85/1062853785.db2.gz NEWSUKRZJHMKOW-LPHOPBHVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256533362 1062853805 /nfs/dbraw/zinc/85/38/05/1062853805.db2.gz NEWSUKRZJHMKOW-LPHOPBHVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536237 1062854677 /nfs/dbraw/zinc/85/46/77/1062854677.db2.gz JTJSVHLEPHIOOL-PXNSSMCTSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536237 1062854699 /nfs/dbraw/zinc/85/46/99/1062854699.db2.gz JTJSVHLEPHIOOL-PXNSSMCTSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@](C)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536783 1062855545 /nfs/dbraw/zinc/85/55/45/1062855545.db2.gz FUWSAOWHRUPILU-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@](C)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536783 1062855551 /nfs/dbraw/zinc/85/55/51/1062855551.db2.gz FUWSAOWHRUPILU-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC[C@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536783 1062855574 /nfs/dbraw/zinc/85/55/74/1062855574.db2.gz FUWSAOWHRUPILU-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC[C@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536783 1062855599 /nfs/dbraw/zinc/85/55/99/1062855599.db2.gz FUWSAOWHRUPILU-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC[C@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256536874 1062857616 /nfs/dbraw/zinc/85/76/16/1062857616.db2.gz GXCTWAHDZDMERA-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC[C@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256536874 1062857641 /nfs/dbraw/zinc/85/76/41/1062857641.db2.gz GXCTWAHDZDMERA-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536874 1062857667 /nfs/dbraw/zinc/85/76/67/1062857667.db2.gz GXCTWAHDZDMERA-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536874 1062857688 /nfs/dbraw/zinc/85/76/88/1062857688.db2.gz GXCTWAHDZDMERA-RLLQIKCJSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256538285 1062860529 /nfs/dbraw/zinc/86/05/29/1062860529.db2.gz SSYGNVZSZSNRMH-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256538285 1062860550 /nfs/dbraw/zinc/86/05/50/1062860550.db2.gz SSYGNVZSZSNRMH-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540451 1062861487 /nfs/dbraw/zinc/86/14/87/1062861487.db2.gz HVDHOEZXGDYQRL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256540451 1062861514 /nfs/dbraw/zinc/86/15/14/1062861514.db2.gz HVDHOEZXGDYQRL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540451 1062861538 /nfs/dbraw/zinc/86/15/38/1062861538.db2.gz HVDHOEZXGDYQRL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540451 1062861561 /nfs/dbraw/zinc/86/15/61/1062861561.db2.gz HVDHOEZXGDYQRL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP CCC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256541494 1062864982 /nfs/dbraw/zinc/86/49/82/1062864982.db2.gz MBXOEXORHYDGEQ-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP CCC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256541494 1062865003 /nfs/dbraw/zinc/86/50/03/1062865003.db2.gz MBXOEXORHYDGEQ-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256550763 1062867047 /nfs/dbraw/zinc/86/70/47/1062867047.db2.gz NPTUYUPDWOPAOE-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256550763 1062867073 /nfs/dbraw/zinc/86/70/73/1062867073.db2.gz NPTUYUPDWOPAOE-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550763 1062867097 /nfs/dbraw/zinc/86/70/97/1062867097.db2.gz NPTUYUPDWOPAOE-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550763 1062867121 /nfs/dbraw/zinc/86/71/21/1062867121.db2.gz NPTUYUPDWOPAOE-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC[C@@H](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256543947 1062870906 /nfs/dbraw/zinc/87/09/06/1062870906.db2.gz WAPBXEWJLSDUHC-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC[C@@H](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256543947 1062870924 /nfs/dbraw/zinc/87/09/24/1062870924.db2.gz WAPBXEWJLSDUHC-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543947 1062870948 /nfs/dbraw/zinc/87/09/48/1062870948.db2.gz WAPBXEWJLSDUHC-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543947 1062870966 /nfs/dbraw/zinc/87/09/66/1062870966.db2.gz WAPBXEWJLSDUHC-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548949 1062871206 /nfs/dbraw/zinc/87/12/06/1062871206.db2.gz CSUAKBICHMBMCY-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548949 1062871229 /nfs/dbraw/zinc/87/12/29/1062871229.db2.gz CSUAKBICHMBMCY-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548949 1062871258 /nfs/dbraw/zinc/87/12/58/1062871258.db2.gz CSUAKBICHMBMCY-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548949 1062871280 /nfs/dbraw/zinc/87/12/80/1062871280.db2.gz CSUAKBICHMBMCY-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC3(C2)CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256553996 1062877535 /nfs/dbraw/zinc/87/75/35/1062877535.db2.gz MYZHTRJUKJNYGK-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC3(C2)CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256553996 1062877555 /nfs/dbraw/zinc/87/75/55/1062877555.db2.gz MYZHTRJUKJNYGK-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256553834 1062877650 /nfs/dbraw/zinc/87/76/50/1062877650.db2.gz LALJGDQKNHFJPR-ICSRJNTNSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256553834 1062877672 /nfs/dbraw/zinc/87/76/72/1062877672.db2.gz LALJGDQKNHFJPR-ICSRJNTNSA-N 2 1 300.490 4.306 20 0 DIADMP CC(C)C1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256556124 1062885091 /nfs/dbraw/zinc/88/50/91/1062885091.db2.gz XFBYDWRSJYOQJG-WIYYLYMNSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256556124 1062885116 /nfs/dbraw/zinc/88/51/16/1062885116.db2.gz XFBYDWRSJYOQJG-WIYYLYMNSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+](Cc2ccccc2)C2CCC2)CC1 ZINC001256576264 1062897674 /nfs/dbraw/zinc/89/76/74/1062897674.db2.gz CUJAJQSTPLDKQN-UHFFFAOYSA-N 2 1 300.490 4.304 20 0 DIADMP C[N@@H+](CCc1ccccc1Cl)C1CC[NH+](C(C)(C)C)CC1 ZINC001256573266 1062899468 /nfs/dbraw/zinc/89/94/68/1062899468.db2.gz FWPVIBSBJJQUAS-UHFFFAOYSA-N 2 1 308.897 4.077 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccccc2F)CC1 ZINC001256573278 1062900759 /nfs/dbraw/zinc/90/07/59/1062900759.db2.gz GDYCNAYMHZNPFA-GOSISDBHSA-N 2 1 304.453 4.226 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccccc2F)CC1 ZINC001256573278 1062900784 /nfs/dbraw/zinc/90/07/84/1062900784.db2.gz GDYCNAYMHZNPFA-GOSISDBHSA-N 2 1 304.453 4.226 20 0 DIADMP C[C@H]1C[N@H+](C2CC[NH+](Cc3ccccc3)CC2)CCC[C@@H]1C ZINC001256604826 1062914831 /nfs/dbraw/zinc/91/48/31/1062914831.db2.gz WZSCQUBPWSXCOD-ROUUACIJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H]1C[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)CCC[C@@H]1C ZINC001256604826 1062914853 /nfs/dbraw/zinc/91/48/53/1062914853.db2.gz WZSCQUBPWSXCOD-ROUUACIJSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CCCC4(CCCC4)C3)CC2)cc1 ZINC001256605123 1062915768 /nfs/dbraw/zinc/91/57/68/1062915768.db2.gz BRZJPCNUJNRDPB-UHFFFAOYSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CCCC4(CCCC4)C3)CC2)cc1 ZINC001256605123 1062915791 /nfs/dbraw/zinc/91/57/91/1062915791.db2.gz BRZJPCNUJNRDPB-UHFFFAOYSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CC[C@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001256613738 1062917001 /nfs/dbraw/zinc/91/70/01/1062917001.db2.gz SSQUASZNDQHUEF-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)CC1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CCC(F)(F)CC1 ZINC001256619437 1062917773 /nfs/dbraw/zinc/91/77/73/1062917773.db2.gz ZLWWFHBACKIGRJ-MQVJKMGUSA-N 2 1 314.464 4.195 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CCC[C@@H]4CCCC[C@H]43)CC2)cc1 ZINC001256611711 1062918954 /nfs/dbraw/zinc/91/89/54/1062918954.db2.gz ULYGJOXMERUVQB-PZJWPPBQSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CCC[C@@H]4CCCC[C@H]43)CC2)cc1 ZINC001256611711 1062918979 /nfs/dbraw/zinc/91/89/79/1062918979.db2.gz ULYGJOXMERUVQB-PZJWPPBQSA-N 2 1 312.501 4.306 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[NH+](CC[C@H]2CCC[N@H+]2C)CC1 ZINC001460578547 1062922504 /nfs/dbraw/zinc/92/25/04/1062922504.db2.gz DRTAJOYXUIOUIR-GOSISDBHSA-N 2 1 318.892 4.222 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[NH+](CC[C@H]2CCC[N@@H+]2C)CC1 ZINC001460578547 1062922526 /nfs/dbraw/zinc/92/25/26/1062922526.db2.gz DRTAJOYXUIOUIR-GOSISDBHSA-N 2 1 318.892 4.222 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[N@H+](CC[C@H]2CCC[NH+]2C)CC1 ZINC001460578547 1062922545 /nfs/dbraw/zinc/92/25/45/1062922545.db2.gz DRTAJOYXUIOUIR-GOSISDBHSA-N 2 1 318.892 4.222 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[N@@H+](CC[C@H]2CCC[NH+]2C)CC1 ZINC001460578547 1062922572 /nfs/dbraw/zinc/92/25/72/1062922572.db2.gz DRTAJOYXUIOUIR-GOSISDBHSA-N 2 1 318.892 4.222 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1ccc(F)cc1)C1CCCCC1 ZINC001460627056 1062945543 /nfs/dbraw/zinc/94/55/43/1062945543.db2.gz NPNHBNUCKMQNJJ-IBGZPJMESA-N 2 1 315.436 4.013 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](CCc1ccccc1)CCC(C)(C)C ZINC001460698004 1062997489 /nfs/dbraw/zinc/99/74/89/1062997489.db2.gz ZONOGKHGIJGKFR-UHFFFAOYSA-N 2 1 313.489 4.172 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](CCc1ccccc1)CCC(C)(C)C ZINC001460698004 1062997517 /nfs/dbraw/zinc/99/75/17/1062997517.db2.gz ZONOGKHGIJGKFR-UHFFFAOYSA-N 2 1 313.489 4.172 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2[C@H]2CCC[N@H+](C3CCCC3)C2)c1 ZINC001256894849 1063029166 /nfs/dbraw/zinc/02/91/66/1063029166.db2.gz NFQBCPQBLUVWCA-BEFAXECRSA-N 2 1 311.473 4.241 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@H]2CCC[N@H+](C3CCCC3)C2)c1 ZINC001256894853 1063029204 /nfs/dbraw/zinc/02/92/04/1063029204.db2.gz NFQBCPQBLUVWCA-KXBFYZLASA-N 2 1 311.473 4.241 20 0 DIADMP CC1(C[NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904338 1063034263 /nfs/dbraw/zinc/03/42/63/1063034263.db2.gz HBUAPIHOLUHQMI-HNNXBMFYSA-N 2 1 314.464 4.199 20 0 DIADMP CC1(C[NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904338 1063034281 /nfs/dbraw/zinc/03/42/81/1063034281.db2.gz HBUAPIHOLUHQMI-HNNXBMFYSA-N 2 1 314.464 4.199 20 0 DIADMP C[C@H]([NH3+])c1cn([C@@H]2CCC[N@H+](C3CCCC3)C2)c2ccccc12 ZINC001256909958 1063049173 /nfs/dbraw/zinc/04/91/73/1063049173.db2.gz VIYXEGLFCHWXBR-DOTOQJQBSA-N 2 1 311.473 4.241 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3ccc(Cl)cc3C)CC2)[nH+]c1C ZINC001460786367 1063057883 /nfs/dbraw/zinc/05/78/83/1063057883.db2.gz JDBMXFCUOAMVBC-UHFFFAOYSA-N 2 1 317.864 4.368 20 0 DIADMP c1csc(-c2ccc(C[NH2+]CCC[NH+]3CCCCC3)cc2)c1 ZINC001461003739 1063180547 /nfs/dbraw/zinc/18/05/47/1063180547.db2.gz AYBUGKBFQLABAX-UHFFFAOYSA-N 2 1 314.498 4.381 20 0 DIADMP CCCc1cccc(C[NH2+]CCC[N@@H+](C)Cc2ccccc2)c1 ZINC001461004077 1063180620 /nfs/dbraw/zinc/18/06/20/1063180620.db2.gz FXLYBXRTINGBMX-UHFFFAOYSA-N 2 1 310.485 4.251 20 0 DIADMP CC[NH+](CC)[C@@H](C[NH2+][C@@H]1CCOC2(CCCCC2)C1)CC(C)C ZINC001461029121 1063198645 /nfs/dbraw/zinc/19/86/45/1063198645.db2.gz IZCMFSFRMFBSQJ-RTBURBONSA-N 2 1 324.553 4.214 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001257321294 1063203748 /nfs/dbraw/zinc/20/37/48/1063203748.db2.gz ZWTXVJVGHBROJY-SJLPKXTDSA-N 2 1 304.478 4.145 20 0 DIADMP CCC[C@H](C)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257324571 1063208168 /nfs/dbraw/zinc/20/81/68/1063208168.db2.gz PMXGCSLTMCDJGO-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001257324571 1063208184 /nfs/dbraw/zinc/20/81/84/1063208184.db2.gz PMXGCSLTMCDJGO-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001257324571 1063208206 /nfs/dbraw/zinc/20/82/06/1063208206.db2.gz PMXGCSLTMCDJGO-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]CC3(C)CCC3)cc2)C1 ZINC001461043811 1063210698 /nfs/dbraw/zinc/21/06/98/1063210698.db2.gz IVWFLXOMCTZMGI-KRWDZBQOSA-N 2 1 300.490 4.198 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]CC2(C)CCC2)C1 ZINC001461049415 1063213672 /nfs/dbraw/zinc/21/36/72/1063213672.db2.gz NUCBYLWYKVGAEN-HDICACEKSA-N 2 1 314.517 4.444 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001461051716 1063217424 /nfs/dbraw/zinc/21/74/24/1063217424.db2.gz LQZKYFLEEJGFTK-WIYYLYMNSA-N 2 1 314.517 4.036 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001461051715 1063219861 /nfs/dbraw/zinc/21/98/61/1063219861.db2.gz LQZKYFLEEJGFTK-RXVVDRJESA-N 2 1 314.517 4.036 20 0 DIADMP CCCCCC[C@@H](C)N(c1cc(C)[nH+]c(C)n1)C1CC[NH2+]CC1 ZINC001257370979 1063237453 /nfs/dbraw/zinc/23/74/53/1063237453.db2.gz AJEGXIOIATUBEM-MRXNPFEDSA-N 2 1 318.509 4.011 20 0 DIADMP CCCCCC[C@H](C)N(c1cc(C)[nH+]c(C)n1)C1CC[NH2+]CC1 ZINC001257370978 1063238114 /nfs/dbraw/zinc/23/81/14/1063238114.db2.gz AJEGXIOIATUBEM-INIZCTEOSA-N 2 1 318.509 4.011 20 0 DIADMP CCC[C@H](C)CC[C@@H](C)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001257471398 1063293396 /nfs/dbraw/zinc/29/33/96/1063293396.db2.gz NOZSHMXTKOBQKF-DLBZAZTESA-N 3 1 313.574 4.067 20 0 DIADMP CCC[C@H](C)CC[C@H](C)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001257480292 1063299408 /nfs/dbraw/zinc/29/94/08/1063299408.db2.gz CZGZCGKCVCQPAV-CMKODMSKSA-N 2 1 324.553 4.167 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257505191 1063314767 /nfs/dbraw/zinc/31/47/67/1063314767.db2.gz ALUQAJCNJKOWFP-BHIYHBOVSA-N 2 1 303.494 4.122 20 0 DIADMP CCCCC[C@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001257517060 1063325345 /nfs/dbraw/zinc/32/53/45/1063325345.db2.gz QQXRPYZQKQELDB-SFHVURJKSA-N 2 1 314.517 4.478 20 0 DIADMP CCCCC[C@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001257517060 1063325355 /nfs/dbraw/zinc/32/53/55/1063325355.db2.gz QQXRPYZQKQELDB-SFHVURJKSA-N 2 1 314.517 4.478 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257517694 1063327618 /nfs/dbraw/zinc/32/76/18/1063327618.db2.gz ZGLUAUDWBFXSHS-UYAOXDASSA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@@H](C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257517694 1063327639 /nfs/dbraw/zinc/32/76/39/1063327639.db2.gz ZGLUAUDWBFXSHS-UYAOXDASSA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@@H](C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257517694 1063327660 /nfs/dbraw/zinc/32/76/60/1063327660.db2.gz ZGLUAUDWBFXSHS-UYAOXDASSA-N 2 1 302.506 4.409 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc(F)c2)CC1 ZINC001461202990 1063330064 /nfs/dbraw/zinc/33/00/64/1063330064.db2.gz AYJQESVUOZMVJG-MRXNPFEDSA-N 2 1 312.432 4.141 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(Cl)cc1Cl ZINC001461229779 1063348435 /nfs/dbraw/zinc/34/84/35/1063348435.db2.gz FUZLGFJZPDPFAZ-UHFFFAOYSA-N 2 1 312.244 4.068 20 0 DIADMP CC(C)OC1CCC([N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)CC1 ZINC001257882728 1063421684 /nfs/dbraw/zinc/42/16/84/1063421684.db2.gz YXDQNWOMZJVBBG-HDYDNRTBSA-N 2 1 322.537 4.063 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCCC[C@H]2c2ccccc2)CC1 ZINC001258012584 1063462440 /nfs/dbraw/zinc/46/24/40/1063462440.db2.gz ZTGZRBMZQYKXQQ-FQEVSTJZSA-N 2 1 300.490 4.334 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCC[C@H]2c2cccc(F)c2)CC1 ZINC001258014389 1063463228 /nfs/dbraw/zinc/46/32/28/1063463228.db2.gz ILKSBTJPSWHPLV-IBGZPJMESA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@H]2c2cccc(F)c2)CC1 ZINC001258014389 1063463236 /nfs/dbraw/zinc/46/32/36/1063463236.db2.gz ILKSBTJPSWHPLV-IBGZPJMESA-N 2 1 304.453 4.083 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001473169868 1063473209 /nfs/dbraw/zinc/47/32/09/1063473209.db2.gz HXYLIHAFACVFAX-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001473169868 1063473217 /nfs/dbraw/zinc/47/32/17/1063473217.db2.gz HXYLIHAFACVFAX-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001473169868 1063473225 /nfs/dbraw/zinc/47/32/25/1063473225.db2.gz HXYLIHAFACVFAX-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP CCSc1ccccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001473176172 1063482077 /nfs/dbraw/zinc/48/20/77/1063482077.db2.gz TVBCCLNRTOTMSD-SFHVURJKSA-N 2 1 318.530 4.249 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001473176172 1063482090 /nfs/dbraw/zinc/48/20/90/1063482090.db2.gz TVBCCLNRTOTMSD-SFHVURJKSA-N 2 1 318.530 4.249 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258062910 1063489999 /nfs/dbraw/zinc/48/99/99/1063489999.db2.gz QRSDBKTXZYYHQP-RDGPPVDQSA-N 2 1 324.553 4.198 20 0 DIADMP CC(C)=CCC[C@H](C)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258086146 1063511542 /nfs/dbraw/zinc/51/15/42/1063511542.db2.gz SQSJVWPLHFEHHR-IHPCNDPISA-N 2 1 315.505 4.288 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCCCc2ccc(F)cc2)CC1(C)C ZINC001461450961 1063511973 /nfs/dbraw/zinc/51/19/73/1063511973.db2.gz TYEYSOQDKDYCIB-SFHVURJKSA-N 2 1 306.469 4.001 20 0 DIADMP CC(C)=CCC[C@H](C)[NH+]1C[C@@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001258089295 1063514506 /nfs/dbraw/zinc/51/45/06/1063514506.db2.gz SQONFWYXQNCCIM-BZSNNMDCSA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)=CCC[C@H](C)[NH+]1C[C@H]2C[NH+](Cc3cccs3)C[C@@H]2C1 ZINC001258089299 1063515735 /nfs/dbraw/zinc/51/57/35/1063515735.db2.gz SQONFWYXQNCCIM-RCCFBDPRSA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)c1ccccc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001461463735 1063523306 /nfs/dbraw/zinc/52/33/06/1063523306.db2.gz YGVMCKUGNSSXPT-HXUWFJFHSA-N 2 1 322.496 4.422 20 0 DIADMP C[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C[C@@H]1C ZINC001258141257 1063530977 /nfs/dbraw/zinc/53/09/77/1063530977.db2.gz WZZJFEBGICQYOO-MOPGFXCFSA-N 2 1 314.517 4.062 20 0 DIADMP C[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C[C@@H]1C ZINC001258141257 1063530998 /nfs/dbraw/zinc/53/09/98/1063530998.db2.gz WZZJFEBGICQYOO-MOPGFXCFSA-N 2 1 314.517 4.062 20 0 DIADMP CCC[N@H+](CC(C)C)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258148465 1063531372 /nfs/dbraw/zinc/53/13/72/1063531372.db2.gz JMFLSWLNTKQTGV-UHFFFAOYSA-N 2 1 302.506 4.062 20 0 DIADMP CCC[N@@H+](CC(C)C)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258148465 1063531390 /nfs/dbraw/zinc/53/13/90/1063531390.db2.gz JMFLSWLNTKQTGV-UHFFFAOYSA-N 2 1 302.506 4.062 20 0 DIADMP C[C@H]1C[N@H+](C2CC[NH+](CCc3ccccc3)CC2)CCC[C@@H]1C ZINC001258141258 1063533073 /nfs/dbraw/zinc/53/30/73/1063533073.db2.gz WZZJFEBGICQYOO-OALUTQOASA-N 2 1 314.517 4.062 20 0 DIADMP C[C@H]1C[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)CCC[C@@H]1C ZINC001258141258 1063533092 /nfs/dbraw/zinc/53/30/92/1063533092.db2.gz WZZJFEBGICQYOO-OALUTQOASA-N 2 1 314.517 4.062 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001461488536 1063534835 /nfs/dbraw/zinc/53/48/35/1063534835.db2.gz SLCYUJZZBBBGON-QZTJIDSGSA-N 2 1 318.549 4.481 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001461488536 1063534853 /nfs/dbraw/zinc/53/48/53/1063534853.db2.gz SLCYUJZZBBBGON-QZTJIDSGSA-N 2 1 318.549 4.481 20 0 DIADMP C[C@@H]1CC([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C[C@@H](C)C1 ZINC001258160120 1063534846 /nfs/dbraw/zinc/53/48/46/1063534846.db2.gz JSCJGLXWXGEXJA-GJZGRUSLSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C[C@@H](C)C1 ZINC001258160123 1063534944 /nfs/dbraw/zinc/53/49/44/1063534944.db2.gz JSCJGLXWXGEXJA-ZSHCYNCHSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@H]1CC([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C[C@H](C)C1 ZINC001258155359 1063535749 /nfs/dbraw/zinc/53/57/49/1063535749.db2.gz DEJYECZJKONQDX-HUUCEWRRSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@H]1CC([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C[C@H](C)C1 ZINC001258160122 1063535987 /nfs/dbraw/zinc/53/59/87/1063535987.db2.gz JSCJGLXWXGEXJA-HUUCEWRRSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C[C@@H](C)C1 ZINC001258167249 1063539349 /nfs/dbraw/zinc/53/93/49/1063539349.db2.gz HYCPLRVTBQGVGS-IZZBFERCSA-N 2 1 314.517 4.265 20 0 DIADMP CSCC[C@@H](C)[N@@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258213235 1063562699 /nfs/dbraw/zinc/56/26/99/1063562699.db2.gz YWPOQKCASBOQGF-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP CSCC[C@@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258212955 1063563750 /nfs/dbraw/zinc/56/37/50/1063563750.db2.gz WZODDAFYCIXMJL-ZTFGCOKTSA-N 2 1 324.509 4.039 20 0 DIADMP CSCC[C@@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258209741 1063564155 /nfs/dbraw/zinc/56/41/55/1063564155.db2.gz SJCWRPRLBNGNIG-DJIMGWMZSA-N 2 1 324.509 4.039 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)C1 ZINC001258280478 1063584138 /nfs/dbraw/zinc/58/41/38/1063584138.db2.gz WDIIZOIBLJVAPH-KRWDZBQOSA-N 2 1 304.453 4.044 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1ccc(F)c(C)c1)C1CCCCC1 ZINC001461615355 1063613158 /nfs/dbraw/zinc/61/31/58/1063613158.db2.gz IESPONRAINRIPL-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1ccc(F)c(C)c1)C1CCCCC1 ZINC001461615355 1063613172 /nfs/dbraw/zinc/61/31/72/1063613172.db2.gz IESPONRAINRIPL-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH2+][C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC001258327688 1063613382 /nfs/dbraw/zinc/61/33/82/1063613382.db2.gz OYYNMPNLOWHKKB-RDJZCZTQSA-N 2 1 312.567 4.151 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH2+][C@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC001258327688 1063613390 /nfs/dbraw/zinc/61/33/90/1063613390.db2.gz OYYNMPNLOWHKKB-RDJZCZTQSA-N 2 1 312.567 4.151 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cccc(Oc3ccccc3)c2)C1 ZINC001461642491 1063630566 /nfs/dbraw/zinc/63/05/66/1063630566.db2.gz PXMLWGSJJBAVAM-IBGZPJMESA-N 2 1 324.468 4.300 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001461663098 1063644747 /nfs/dbraw/zinc/64/47/47/1063644747.db2.gz MWUSYXJXGRTWLX-INIZCTEOSA-N 2 1 320.908 4.114 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461663098 1063644753 /nfs/dbraw/zinc/64/47/53/1063644753.db2.gz MWUSYXJXGRTWLX-INIZCTEOSA-N 2 1 320.908 4.114 20 0 DIADMP CCCCC[C@H](CC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258433260 1063649519 /nfs/dbraw/zinc/64/95/19/1063649519.db2.gz WPNXDDLJODELTI-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP CCCCC[C@@H](CC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258433501 1063649941 /nfs/dbraw/zinc/64/99/41/1063649941.db2.gz GJFUMEYBFVMAHR-GOSISDBHSA-N 2 1 306.469 4.434 20 0 DIADMP CCCCC[C@H](CC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258433445 1063650169 /nfs/dbraw/zinc/65/01/69/1063650169.db2.gz FZYLIBALKPFRRE-INIZCTEOSA-N 2 1 306.469 4.434 20 0 DIADMP CCCCC[C@@H](CC)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258440332 1063654651 /nfs/dbraw/zinc/65/46/51/1063654651.db2.gz PIOLCOUWGMYZOD-MSOLQXFVSA-N 2 1 324.553 4.357 20 0 DIADMP CCCCC[C@@H](CC)N(c1cc(C)[nH+]c(C)n1)C1CC[NH2+]CC1 ZINC001258448239 1063658725 /nfs/dbraw/zinc/65/87/25/1063658725.db2.gz SLDCSUQRNRVXEK-QGZVFWFLSA-N 2 1 318.509 4.011 20 0 DIADMP c1ccc(C[C@@]2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)C=CCCC2)cc1 ZINC001461688086 1063658783 /nfs/dbraw/zinc/65/87/83/1063658783.db2.gz VKCCGNVGYMEWIA-BHIFYINESA-N 2 1 324.512 4.172 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2CCC(C)(C)C2)CC1 ZINC001258604916 1063705902 /nfs/dbraw/zinc/70/59/02/1063705902.db2.gz MAPLQCVMWXWUGO-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001258605360 1063706235 /nfs/dbraw/zinc/70/62/35/1063706235.db2.gz HMGQDKNNQAXSSF-GOSISDBHSA-N 2 1 316.489 4.146 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2CCC(C)(C)C2)CC1 ZINC001258609555 1063707040 /nfs/dbraw/zinc/70/70/40/1063707040.db2.gz WMBGCQCONUZGER-LJQANCHMSA-N 2 1 318.480 4.301 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@@H]2CCC(C)(C)C2)CC1 ZINC001258609555 1063707051 /nfs/dbraw/zinc/70/70/51/1063707051.db2.gz WMBGCQCONUZGER-LJQANCHMSA-N 2 1 318.480 4.301 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258607567 1063709222 /nfs/dbraw/zinc/70/92/22/1063709222.db2.gz LTKWFIIUEHMANJ-FQEVSTJZSA-N 2 1 312.501 4.088 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258607567 1063709231 /nfs/dbraw/zinc/70/92/31/1063709231.db2.gz LTKWFIIUEHMANJ-FQEVSTJZSA-N 2 1 312.501 4.088 20 0 DIADMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCC(C)(C)C1 ZINC001258607119 1063709403 /nfs/dbraw/zinc/70/94/03/1063709403.db2.gz GMHWFKGHHQRKIR-HXUWFJFHSA-N 2 1 314.517 4.409 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258652445 1063726480 /nfs/dbraw/zinc/72/64/80/1063726480.db2.gz VXPCSYHXPQHBOB-YSTOQKLRSA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258652445 1063726493 /nfs/dbraw/zinc/72/64/93/1063726493.db2.gz VXPCSYHXPQHBOB-YSTOQKLRSA-N 2 1 300.490 4.003 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC(C)(C)C1 ZINC001258693243 1063755620 /nfs/dbraw/zinc/75/56/20/1063755620.db2.gz VPUDQJOMVKNLTP-CRAIPNDOSA-N 2 1 318.480 4.290 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC(C)(C)C1 ZINC001258693245 1063756148 /nfs/dbraw/zinc/75/61/48/1063756148.db2.gz VPUDQJOMVKNLTP-QAPCUYQASA-N 2 1 318.480 4.290 20 0 DIADMP CC[C@@H]1CCC[C@H](C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC001461861764 1063756314 /nfs/dbraw/zinc/75/63/14/1063756314.db2.gz LQKUMYBUKQEPRC-DOADOZAASA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001461861764 1063756329 /nfs/dbraw/zinc/75/63/29/1063756329.db2.gz LQKUMYBUKQEPRC-DOADOZAASA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001461861764 1063756342 /nfs/dbraw/zinc/75/63/42/1063756342.db2.gz LQKUMYBUKQEPRC-DOADOZAASA-N 2 1 304.522 4.152 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H]2C[C@@H](C)CC(C)(C)C2)CC1 ZINC001258697401 1063758507 /nfs/dbraw/zinc/75/85/07/1063758507.db2.gz PSWACLCLNOLRNO-WBVHZDCISA-N 2 1 315.505 4.144 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC001461864112 1063758447 /nfs/dbraw/zinc/75/84/47/1063758447.db2.gz KAWOSKHUIWHSFQ-YLJYHZDGSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC001461864112 1063758456 /nfs/dbraw/zinc/75/84/56/1063758456.db2.gz KAWOSKHUIWHSFQ-YLJYHZDGSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC001461864112 1063758467 /nfs/dbraw/zinc/75/84/67/1063758467.db2.gz KAWOSKHUIWHSFQ-YLJYHZDGSA-N 2 1 302.506 4.015 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001258706570 1063764545 /nfs/dbraw/zinc/76/45/45/1063764545.db2.gz SOMROJNIJSWLMJ-LJQANCHMSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001258741899 1063790471 /nfs/dbraw/zinc/79/04/71/1063790471.db2.gz PYEOYLQIMNIFBA-OAHLLOKOSA-N 2 1 320.908 4.255 20 0 DIADMP CC(C)C[N@@H+]([C@@H](C)Cc1cccc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258744945 1063795990 /nfs/dbraw/zinc/79/59/90/1063795990.db2.gz WITCKUWOATVBCL-SNRMKQJTSA-N 2 1 322.924 4.499 20 0 DIADMP CCCC[C@H](CCC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258762036 1063807815 /nfs/dbraw/zinc/80/78/15/1063807815.db2.gz SJHSUUQJTSJMGA-KRWDZBQOSA-N 2 1 303.494 4.288 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001258781809 1063818513 /nfs/dbraw/zinc/81/85/13/1063818513.db2.gz FWRFSGHBBXKETO-ICSRJNTNSA-N 2 1 316.533 4.498 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258782279 1063818719 /nfs/dbraw/zinc/81/87/19/1063818719.db2.gz NRYPCOKCEWFCST-NVXWUHKLSA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258785868 1063825017 /nfs/dbraw/zinc/82/50/17/1063825017.db2.gz JNSTXIVMDFMNGE-LEAZDLGRSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258791543 1063827802 /nfs/dbraw/zinc/82/78/02/1063827802.db2.gz BYHWMGWXDGRRMW-WBVHZDCISA-N 2 1 303.494 4.144 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258791513 1063827976 /nfs/dbraw/zinc/82/79/76/1063827976.db2.gz SKRLGNPNDINTJT-BZSNNMDCSA-N 2 1 324.553 4.213 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813195 1063843657 /nfs/dbraw/zinc/84/36/57/1063843657.db2.gz PMFHFHMSEQFIQI-XLNTUCKNSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@H]1CCC[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001258813786 1063843796 /nfs/dbraw/zinc/84/37/96/1063843796.db2.gz SRJMWEACVRRFRK-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@]2(C)CCCS2)CC1 ZINC001461966304 1063844979 /nfs/dbraw/zinc/84/49/79/1063844979.db2.gz QBJFUJULRMKQCW-MJGOQNOKSA-N 2 1 324.578 4.249 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814424 1063845685 /nfs/dbraw/zinc/84/56/85/1063845685.db2.gz OUTWLISENFFLHT-XLNTUCKNSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258826998 1063849933 /nfs/dbraw/zinc/84/99/33/1063849933.db2.gz NYOOVQVMFBEHNT-DYESRHJHSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258826998 1063849947 /nfs/dbraw/zinc/84/99/47/1063849947.db2.gz NYOOVQVMFBEHNT-DYESRHJHSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@@H]1CCC[C@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258825450 1063851716 /nfs/dbraw/zinc/85/17/16/1063851716.db2.gz CUXKEZDWYUWFQL-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825450 1063851728 /nfs/dbraw/zinc/85/17/28/1063851728.db2.gz CUXKEZDWYUWFQL-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825450 1063851737 /nfs/dbraw/zinc/85/17/37/1063851737.db2.gz CUXKEZDWYUWFQL-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258828772 1063852510 /nfs/dbraw/zinc/85/25/10/1063852510.db2.gz QUNFEFFENBAASN-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258828772 1063852517 /nfs/dbraw/zinc/85/25/17/1063852517.db2.gz QUNFEFFENBAASN-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258828772 1063852534 /nfs/dbraw/zinc/85/25/34/1063852534.db2.gz QUNFEFFENBAASN-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001258827728 1063853928 /nfs/dbraw/zinc/85/39/28/1063853928.db2.gz UOQJGBQZCMMQAS-RLLQIKCJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258827728 1063853931 /nfs/dbraw/zinc/85/39/31/1063853931.db2.gz UOQJGBQZCMMQAS-RLLQIKCJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258827728 1063853944 /nfs/dbraw/zinc/85/39/44/1063853944.db2.gz UOQJGBQZCMMQAS-RLLQIKCJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001258827726 1063854446 /nfs/dbraw/zinc/85/44/46/1063854446.db2.gz UOQJGBQZCMMQAS-HOJAQTOUSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258827726 1063854462 /nfs/dbraw/zinc/85/44/62/1063854462.db2.gz UOQJGBQZCMMQAS-HOJAQTOUSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258827726 1063854468 /nfs/dbraw/zinc/85/44/68/1063854468.db2.gz UOQJGBQZCMMQAS-HOJAQTOUSA-N 2 1 300.490 4.019 20 0 DIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+](C(CC(C)C)CC(C)C)CC1 ZINC001258834994 1063858174 /nfs/dbraw/zinc/85/81/74/1063858174.db2.gz KDNQLZLPUOCGNO-IBGZPJMESA-N 2 1 324.553 4.022 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccccc1-c1ccccc1 ZINC000479683653 1063879872 /nfs/dbraw/zinc/87/98/72/1063879872.db2.gz FPLOCRCKYZFXDN-UHFFFAOYSA-N 2 1 308.469 4.175 20 0 DIADMP C[C@H](CC[NH2+]C1C[C@H](C)C[C@@H](C)C1)[N@@H+](C)Cc1ccccc1 ZINC000379641169 1063984195 /nfs/dbraw/zinc/98/41/95/1063984195.db2.gz CUILQDOWKUXLHS-KZNAEPCWSA-N 2 1 302.506 4.311 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(Cl)s1)[N@H+](C)Cc1ccccc1 ZINC000379618929 1063984390 /nfs/dbraw/zinc/98/43/90/1063984390.db2.gz AYBPSMXWLSKAJM-AWEZNQCLSA-N 2 1 322.905 4.402 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(Cl)s1)[N@@H+](C)Cc1ccccc1 ZINC000379618929 1063984396 /nfs/dbraw/zinc/98/43/96/1063984396.db2.gz AYBPSMXWLSKAJM-AWEZNQCLSA-N 2 1 322.905 4.402 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379638980 1063984594 /nfs/dbraw/zinc/98/45/94/1063984594.db2.gz VFCXYQNJNHMBOK-GCJKJVERSA-N 2 1 322.496 4.392 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379638980 1063984604 /nfs/dbraw/zinc/98/46/04/1063984604.db2.gz VFCXYQNJNHMBOK-GCJKJVERSA-N 2 1 322.496 4.392 20 0 DIADMP CC(C)C([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000379624636 1063985502 /nfs/dbraw/zinc/98/55/02/1063985502.db2.gz DQIPEKOYAWBRCA-MJGOQNOKSA-N 2 1 302.506 4.310 20 0 DIADMP CC(C)C([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000379624636 1063985509 /nfs/dbraw/zinc/98/55/09/1063985509.db2.gz DQIPEKOYAWBRCA-MJGOQNOKSA-N 2 1 302.506 4.310 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(O)cc1 ZINC000379632714 1063985542 /nfs/dbraw/zinc/98/55/42/1063985542.db2.gz NXWSTYVOOKDHRQ-ZWOKBUDYSA-N 2 1 324.468 4.096 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(O)cc1 ZINC000379632714 1063985546 /nfs/dbraw/zinc/98/55/46/1063985546.db2.gz NXWSTYVOOKDHRQ-ZWOKBUDYSA-N 2 1 324.468 4.096 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC000379654965 1063986968 /nfs/dbraw/zinc/98/69/68/1063986968.db2.gz KKZFJMZLDJOABJ-SIKLNZKXSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC000379654965 1063986981 /nfs/dbraw/zinc/98/69/81/1063986981.db2.gz KKZFJMZLDJOABJ-SIKLNZKXSA-N 2 1 322.496 4.446 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc2cc[nH]c2c1)[N@@H+](C)Cc1ccccc1 ZINC000379652946 1063987602 /nfs/dbraw/zinc/98/76/02/1063987602.db2.gz YMWPDQPAPDRXEA-QGZVFWFLSA-N 2 1 321.468 4.168 20 0 DIADMP C[C@@H](CC[NH2+]CC1CCCCCC1)[N@@H+](C)Cc1ccccc1 ZINC000379654523 1063988066 /nfs/dbraw/zinc/98/80/66/1063988066.db2.gz ISBIRIDHPXYVNP-SFHVURJKSA-N 2 1 302.506 4.457 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000381310629 1063991960 /nfs/dbraw/zinc/99/19/60/1063991960.db2.gz NROZXSNYZUWQOG-FUMNGEBKSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@]1(C[NH2+]C/C=C/c2ccccc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000383360915 1064002322 /nfs/dbraw/zinc/00/23/22/1064002322.db2.gz SRQZMWMUIOLKCD-SYZXBLONSA-N 2 1 320.480 4.202 20 0 DIADMP CCCC[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390717783 1064167546 /nfs/dbraw/zinc/16/75/46/1064167546.db2.gz YOMRJMYMLWCROF-IEBWSBKVSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390717783 1064167551 /nfs/dbraw/zinc/16/75/51/1064167551.db2.gz YOMRJMYMLWCROF-IEBWSBKVSA-N 2 1 302.506 4.455 20 0 DIADMP CCC(CC)(CC)C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000391176854 1064180082 /nfs/dbraw/zinc/18/00/82/1064180082.db2.gz HAWIUUHYDUAEJL-UHFFFAOYSA-N 2 1 302.506 4.457 20 0 DIADMP Cc1ccc(C[N@@H+]2C[C@@H]3CC[NH+](C4CCCC4)CC[C@@H]3C2)cc1 ZINC001279198077 1064336961 /nfs/dbraw/zinc/33/69/61/1064336961.db2.gz DWQYSEDXJISRDD-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP Cc1ccc(C[NH+]2C[C@@H]3CC[N@H+](C4CCCC4)CC[C@@H]3C2)cc1 ZINC001279198077 1064336974 /nfs/dbraw/zinc/33/69/74/1064336974.db2.gz DWQYSEDXJISRDD-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP Cc1ccc(C[NH+]2C[C@@H]3CC[N@@H+](C4CCCC4)CC[C@@H]3C2)cc1 ZINC001279198077 1064336994 /nfs/dbraw/zinc/33/69/94/1064336994.db2.gz DWQYSEDXJISRDD-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP C[N@H+]1CCC[C@]2(CCC[NH+](CCCc3cccc(Cl)c3)C2)C1 ZINC001279632871 1064361916 /nfs/dbraw/zinc/36/19/16/1064361916.db2.gz RMEAENCGAOMWDJ-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CCC[N@H+](CCCc3cccc(Cl)c3)C2)C1 ZINC001279632871 1064361925 /nfs/dbraw/zinc/36/19/25/1064361925.db2.gz RMEAENCGAOMWDJ-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CCC[N@@H+](CCCc3cccc(Cl)c3)C2)C1 ZINC001279632871 1064361928 /nfs/dbraw/zinc/36/19/28/1064361928.db2.gz RMEAENCGAOMWDJ-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+]1CCC[C@]2(CCC[NH+](Cc3ccc4cccccc3-4)C2)C1 ZINC001279694409 1064364338 /nfs/dbraw/zinc/36/43/38/1064364338.db2.gz YEDJNYMMBSIAHJ-NRFANRHFSA-N 2 1 308.469 4.099 20 0 DIADMP C[NH+]1CCC[C@]2(CCC[N@H+](Cc3ccc4cccccc3-4)C2)C1 ZINC001279694409 1064364356 /nfs/dbraw/zinc/36/43/56/1064364356.db2.gz YEDJNYMMBSIAHJ-NRFANRHFSA-N 2 1 308.469 4.099 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(C)c(F)c2)CC1 ZINC001307420197 1065380577 /nfs/dbraw/zinc/38/05/77/1065380577.db2.gz BGJFYSXYJWFGMN-UHFFFAOYSA-N 2 1 306.469 4.078 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@H](C[N@H+](C)CC1CC1)c1ccccc1 ZINC001307421960 1065382959 /nfs/dbraw/zinc/38/29/59/1065382959.db2.gz LFGZDEAUFKWFFD-JOCHJYFZSA-N 2 1 322.496 4.244 20 0 DIADMP C[NH+](C[C@@H](C[N@H+](C)Cc1ccccc1)c1ccccc1)CC1CC1 ZINC001307421960 1065382967 /nfs/dbraw/zinc/38/29/67/1065382967.db2.gz LFGZDEAUFKWFFD-JOCHJYFZSA-N 2 1 322.496 4.244 20 0 DIADMP C[NH+](C[C@@H](C[N@@H+](C)Cc1ccccc1)c1ccccc1)CC1CC1 ZINC001307421960 1065382981 /nfs/dbraw/zinc/38/29/81/1065382981.db2.gz LFGZDEAUFKWFFD-JOCHJYFZSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC001307433858 1065393046 /nfs/dbraw/zinc/39/30/46/1065393046.db2.gz LSARWBWKLIZZOJ-TZMCWYRMSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CC[C@H]1CCC[NH+]1C ZINC001307433858 1065393052 /nfs/dbraw/zinc/39/30/52/1065393052.db2.gz LSARWBWKLIZZOJ-TZMCWYRMSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@H]1CCC[N@@H+]1C ZINC001307433858 1065393086 /nfs/dbraw/zinc/39/30/86/1065393086.db2.gz LSARWBWKLIZZOJ-TZMCWYRMSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@H]1CCC[N@H+]1C ZINC001307433858 1065393095 /nfs/dbraw/zinc/39/30/95/1065393095.db2.gz LSARWBWKLIZZOJ-TZMCWYRMSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001307440435 1065401373 /nfs/dbraw/zinc/40/13/73/1065401373.db2.gz MMVWIPQEEKDCAR-GOSISDBHSA-N 2 1 300.490 4.295 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCC3CCCC3)C2)CC1 ZINC001307440341 1065401428 /nfs/dbraw/zinc/40/14/28/1065401428.db2.gz JRLYEUGCASNPLB-HXUWFJFHSA-N 2 1 306.538 4.401 20 0 DIADMP CCc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC001307440533 1065401591 /nfs/dbraw/zinc/40/15/91/1065401591.db2.gz OVJPEMFLFSGEHG-OAQYLSRUSA-N 2 1 314.517 4.193 20 0 DIADMP CCc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC001307440533 1065401595 /nfs/dbraw/zinc/40/15/95/1065401595.db2.gz OVJPEMFLFSGEHG-OAQYLSRUSA-N 2 1 314.517 4.193 20 0 DIADMP CCc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC001307440532 1065401880 /nfs/dbraw/zinc/40/18/80/1065401880.db2.gz OVJPEMFLFSGEHG-NRFANRHFSA-N 2 1 314.517 4.193 20 0 DIADMP CCc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1 ZINC001307440532 1065401886 /nfs/dbraw/zinc/40/18/86/1065401886.db2.gz OVJPEMFLFSGEHG-NRFANRHFSA-N 2 1 314.517 4.193 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001307455202 1065411193 /nfs/dbraw/zinc/41/11/93/1065411193.db2.gz HNWIWFYJPBJTQB-RXVVDRJESA-N 2 1 312.501 4.262 20 0 DIADMP CC(C)Cc1ccc([C@H]([NH2+]CC[C@H]2CCC[N@H+]2C)C2CC2)cc1 ZINC001307614336 1065518114 /nfs/dbraw/zinc/51/81/14/1065518114.db2.gz GEYZCXBTFBNKQH-RTWAWAEBSA-N 2 1 314.517 4.410 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@H](CC1CCCC1)c1ccccc1 ZINC001307634477 1065530398 /nfs/dbraw/zinc/53/03/98/1065530398.db2.gz GRZLIUCWSODFLN-WOJBJXKFSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@H]([NH2+]CC1CCC2(CC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001307670763 1065553134 /nfs/dbraw/zinc/55/31/34/1065553134.db2.gz SYQCNGBCJFUODY-WMZOPIPTSA-N 2 1 304.522 4.199 20 0 DIADMP CC[NH+](CC)CCC[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC001307716566 1065581743 /nfs/dbraw/zinc/58/17/43/1065581743.db2.gz VXIFFNAMPRNEEW-UHFFFAOYSA-N 2 1 315.288 4.304 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CC(C)(C)CCc2ccccc21 ZINC001307715713 1065581938 /nfs/dbraw/zinc/58/19/38/1065581938.db2.gz MIGFPELKJKOKRE-LJQANCHMSA-N 2 1 311.473 4.275 20 0 DIADMP CCc1ccccc1CC[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC001307785469 1065620033 /nfs/dbraw/zinc/62/00/33/1065620033.db2.gz LYEVSFOLZILHQJ-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H]([C@H]2CCCC2(C)C)C1 ZINC001307867093 1065660355 /nfs/dbraw/zinc/66/03/55/1065660355.db2.gz FAJJUNWNJWTEKZ-ZWKOTPCHSA-N 2 1 303.494 4.120 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H]([C@H]2CCCC2(C)C)C1 ZINC001307867093 1065660357 /nfs/dbraw/zinc/66/03/57/1065660357.db2.gz FAJJUNWNJWTEKZ-ZWKOTPCHSA-N 2 1 303.494 4.120 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H]([C@@H]2CCCC2(C)C)C1 ZINC001307867088 1065660432 /nfs/dbraw/zinc/66/04/32/1065660432.db2.gz FAJJUNWNJWTEKZ-MSOLQXFVSA-N 2 1 303.494 4.120 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H]([C@@H]2CCCC2(C)C)C1 ZINC001307867088 1065660440 /nfs/dbraw/zinc/66/04/40/1065660440.db2.gz FAJJUNWNJWTEKZ-MSOLQXFVSA-N 2 1 303.494 4.120 20 0 DIADMP CC(C)c1ccc([C@@H](C)[N@@H+]2C[C@@]3(C)C[NH+](C)C[C@@]3(C)C2)cc1 ZINC001307979325 1065709362 /nfs/dbraw/zinc/70/93/62/1065709362.db2.gz WVBKUUJKJFGWCU-AHRSYUTCSA-N 2 1 300.490 4.145 20 0 DIADMP CC(C)c1ccc([C@@H](C)[N@H+]2C[C@@]3(C)C[NH+](C)C[C@@]3(C)C2)cc1 ZINC001307979325 1065709374 /nfs/dbraw/zinc/70/93/74/1065709374.db2.gz WVBKUUJKJFGWCU-AHRSYUTCSA-N 2 1 300.490 4.145 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2C[C@@]3(C)C[N@H+](C)C[C@@]3(C)C2)cc1 ZINC001307979325 1065709391 /nfs/dbraw/zinc/70/93/91/1065709391.db2.gz WVBKUUJKJFGWCU-AHRSYUTCSA-N 2 1 300.490 4.145 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2C[C@@]3(C)C[N@@H+](C)C[C@@]3(C)C2)cc1 ZINC001307979325 1065709408 /nfs/dbraw/zinc/70/94/08/1065709408.db2.gz WVBKUUJKJFGWCU-AHRSYUTCSA-N 2 1 300.490 4.145 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2C[C@@H]2CCCC[C@H]2C)CC1 ZINC001308001738 1065719243 /nfs/dbraw/zinc/71/92/43/1065719243.db2.gz HCWHZUOJADDBPY-AABGKKOBSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1C[C@H]2CN(Cc3ccccc3)C[C@@]2(C)C1 ZINC001308058703 1065744517 /nfs/dbraw/zinc/74/45/17/1065744517.db2.gz DIPPOIDCJLXASR-BWAGFHJFSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308058703 1065744534 /nfs/dbraw/zinc/74/45/34/1065744534.db2.gz DIPPOIDCJLXASR-BWAGFHJFSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308058703 1065744544 /nfs/dbraw/zinc/74/45/44/1065744544.db2.gz DIPPOIDCJLXASR-BWAGFHJFSA-N 2 1 320.480 4.202 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(c2ccccc2)c2ccccc2)CC1(C)C ZINC001308179077 1065791730 /nfs/dbraw/zinc/79/17/30/1065791730.db2.gz HZMLUVUJTKKRTG-HXUWFJFHSA-N 2 1 322.496 4.281 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCCc2ccccc2C1)Cc1ccccc1 ZINC001308187118 1065797313 /nfs/dbraw/zinc/79/73/13/1065797313.db2.gz RVMJZLANDJJGDP-JOCHJYFZSA-N 2 1 322.496 4.046 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@@H](C(C)(C)C)CC1 ZINC001308196607 1065803643 /nfs/dbraw/zinc/80/36/43/1065803643.db2.gz DKMYCKQTJBXFKY-KBAYOESNSA-N 2 1 305.510 4.412 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC001308198797 1065806659 /nfs/dbraw/zinc/80/66/59/1065806659.db2.gz CMICIKVXHSYGPS-MBOZVWFJSA-N 2 1 300.490 4.197 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC001308202406 1065808889 /nfs/dbraw/zinc/80/88/89/1065808889.db2.gz HGJNKYATUWZDOB-IBGZPJMESA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cn1 ZINC001308203236 1065812913 /nfs/dbraw/zinc/81/29/13/1065812913.db2.gz MUYXAVCXZMUBJQ-GOSISDBHSA-N 2 1 317.521 4.024 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CC(C)(C)C[C@H]2C)CC1 ZINC001308205696 1065814188 /nfs/dbraw/zinc/81/41/88/1065814188.db2.gz AXEMPJSBDXXSQS-XLIONFOSSA-N 2 1 314.517 4.374 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001308206383 1065815085 /nfs/dbraw/zinc/81/50/85/1065815085.db2.gz XFHNKMOQCVWCFD-WGMWDUQUSA-N 2 1 312.501 4.128 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+]CC(C)(C)c2ccccc2)([NH+](C)C)C1 ZINC001308219103 1065826776 /nfs/dbraw/zinc/82/67/76/1065826776.db2.gz QVNCDYUQUMMBDP-XLIONFOSSA-N 2 1 302.506 4.064 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC1(C)C ZINC001308238621 1065844777 /nfs/dbraw/zinc/84/47/77/1065844777.db2.gz WCIUQFFVQHNCHF-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC1(C)C ZINC001308238621 1065844799 /nfs/dbraw/zinc/84/47/99/1065844799.db2.gz WCIUQFFVQHNCHF-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP CC[C@@H](C)[N@H+](C)CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240762 1065846570 /nfs/dbraw/zinc/84/65/70/1065846570.db2.gz ZATYSSUWRCXPFS-QZTJIDSGSA-N 2 1 318.549 4.483 20 0 DIADMP CC[C@@H](C)[N@@H+](C)CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240762 1065846579 /nfs/dbraw/zinc/84/65/79/1065846579.db2.gz ZATYSSUWRCXPFS-QZTJIDSGSA-N 2 1 318.549 4.483 20 0 DIADMP CC[C@H](C)[N@H+](C)CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240761 1065847411 /nfs/dbraw/zinc/84/74/11/1065847411.db2.gz ZATYSSUWRCXPFS-MSOLQXFVSA-N 2 1 318.549 4.483 20 0 DIADMP CC[C@H](C)[N@@H+](C)CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240761 1065847422 /nfs/dbraw/zinc/84/74/22/1065847422.db2.gz ZATYSSUWRCXPFS-MSOLQXFVSA-N 2 1 318.549 4.483 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc(F)cc2)CC1 ZINC001308271334 1065870785 /nfs/dbraw/zinc/87/07/85/1065870785.db2.gz OOQQWRLTEUNBTJ-INIZCTEOSA-N 2 1 312.432 4.141 20 0 DIADMP CCN(c1ccccc1)c1ccc(C[NH2+]CCC[NH+]2CCC2)cc1 ZINC001308358569 1065938063 /nfs/dbraw/zinc/93/80/63/1065938063.db2.gz ITSICDFTLAWDGK-UHFFFAOYSA-N 2 1 323.484 4.030 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]CCCC[N@H+](C)C2CC2)c1Cl ZINC001308427818 1065981193 /nfs/dbraw/zinc/98/11/93/1065981193.db2.gz NLBNBJOKPZHTMS-UHFFFAOYSA-N 2 1 315.288 4.266 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001308455623 1066000781 /nfs/dbraw/zinc/00/07/81/1066000781.db2.gz AYHAHKFNNLXNDD-FRYIKTPZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC001308455623 1066000786 /nfs/dbraw/zinc/00/07/86/1066000786.db2.gz AYHAHKFNNLXNDD-FRYIKTPZSA-N 2 1 314.517 4.454 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC[C@@]1(C)CC1(F)F ZINC001308469193 1066009095 /nfs/dbraw/zinc/00/90/95/1066009095.db2.gz QTEFQQYSJZZWPC-SFHVURJKSA-N 2 1 324.459 4.170 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001308469699 1066009846 /nfs/dbraw/zinc/00/98/46/1066009846.db2.gz RVDZWQYYKWFNHH-ICSRJNTNSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001308469699 1066009854 /nfs/dbraw/zinc/00/98/54/1066009854.db2.gz RVDZWQYYKWFNHH-ICSRJNTNSA-N 2 1 314.517 4.252 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001308589570 1066102933 /nfs/dbraw/zinc/10/29/33/1066102933.db2.gz HBCCEMCRJPGIPU-ACRUOGEOSA-N 2 1 318.549 4.423 20 0 DIADMP CC(C)[C@@H](C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1ccccc1 ZINC001308597513 1066109035 /nfs/dbraw/zinc/10/90/35/1066109035.db2.gz CHGHOZBUFBGCKH-PZJWPPBQSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@@H](C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597513 1066109039 /nfs/dbraw/zinc/10/90/39/1066109039.db2.gz CHGHOZBUFBGCKH-PZJWPPBQSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@@H](C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597513 1066109041 /nfs/dbraw/zinc/10/90/41/1066109041.db2.gz CHGHOZBUFBGCKH-PZJWPPBQSA-N 2 1 314.517 4.090 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C1CCC1 ZINC001308634299 1066129277 /nfs/dbraw/zinc/12/92/77/1066129277.db2.gz DGOASYGZTKDGFJ-VRXWPRPYSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]([NH2+]Cc1coc2ccccc12)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001308681812 1066154038 /nfs/dbraw/zinc/15/40/38/1066154038.db2.gz XFAAPSGKQOIGQB-HZPDHXFCSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@@H]([NH2+]C1CCC2(CCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001308682047 1066154153 /nfs/dbraw/zinc/15/41/53/1066154153.db2.gz KCQDSAZLUSFWTQ-IAGOWNOFSA-N 2 1 304.522 4.342 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2cccc(CC3CCC3)c2)CC1 ZINC001308690341 1066182329 /nfs/dbraw/zinc/18/23/29/1066182329.db2.gz YEVASYWYGQIBNV-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP Cc1scc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1C ZINC001308743358 1066218638 /nfs/dbraw/zinc/21/86/38/1066218638.db2.gz UYYDWOKTFTXYFJ-UHFFFAOYSA-N 2 1 302.487 4.059 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CCC[C@@H](CC)C1 ZINC001308743502 1066218904 /nfs/dbraw/zinc/21/89/04/1066218904.db2.gz IUGJKJHMDYDPBV-QZTJIDSGSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CCC[C@@H](CC)C1 ZINC001308743502 1066218912 /nfs/dbraw/zinc/21/89/12/1066218912.db2.gz IUGJKJHMDYDPBV-QZTJIDSGSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CCC[C@@H](CC)C1 ZINC001308743501 1066219937 /nfs/dbraw/zinc/21/99/37/1066219937.db2.gz IUGJKJHMDYDPBV-MSOLQXFVSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CCC[C@@H](CC)C1 ZINC001308743501 1066219954 /nfs/dbraw/zinc/21/99/54/1066219954.db2.gz IUGJKJHMDYDPBV-MSOLQXFVSA-N 2 1 305.510 4.374 20 0 DIADMP CC/C=C/C[NH2+]C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001308782448 1066256257 /nfs/dbraw/zinc/25/62/57/1066256257.db2.gz NYQMHSHHLIXBOZ-ISPXXFMDSA-N 2 1 314.517 4.481 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H](C)Cc1ccccc1SC ZINC001308797831 1066276391 /nfs/dbraw/zinc/27/63/91/1066276391.db2.gz JRMINLANEQJWCY-HZPDHXFCSA-N 2 1 308.535 4.050 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H](C)Cc1ccccc1SC ZINC001308797831 1066276403 /nfs/dbraw/zinc/27/64/03/1066276403.db2.gz JRMINLANEQJWCY-HZPDHXFCSA-N 2 1 308.535 4.050 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@H]3CC[C@H]3C3CC3)C2)cc1 ZINC001308803495 1066279855 /nfs/dbraw/zinc/27/98/55/1066279855.db2.gz VXMJHOJVYDNSKX-GIVPXCGWSA-N 2 1 312.501 4.067 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC001308823348 1066299032 /nfs/dbraw/zinc/29/90/32/1066299032.db2.gz NXWVMIUEPCWYTK-QFBILLFUSA-N 2 1 320.908 4.440 20 0 DIADMP CC(C)CCCC[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308930312 1066405419 /nfs/dbraw/zinc/40/54/19/1066405419.db2.gz IRORFLVMSDEOMM-LEWJYISDSA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)CCCC[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308930312 1066405425 /nfs/dbraw/zinc/40/54/25/1066405425.db2.gz IRORFLVMSDEOMM-LEWJYISDSA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)CCCC[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308930312 1066405430 /nfs/dbraw/zinc/40/54/30/1066405430.db2.gz IRORFLVMSDEOMM-LEWJYISDSA-N 2 1 314.517 4.267 20 0 DIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1cc(C)ccc1OC ZINC000091728009 193098104 /nfs/dbraw/zinc/09/81/04/193098104.db2.gz DXWCGHLITCULOP-SFHVURJKSA-N 2 1 315.461 4.030 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2csc(C)c2)c1 ZINC000297968051 132042930 /nfs/dbraw/zinc/04/29/30/132042930.db2.gz ZRLKZXQFTYWWHB-OAHLLOKOSA-N 2 1 302.487 4.359 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000521333987 331546274 /nfs/dbraw/zinc/54/62/74/331546274.db2.gz VBFKXNMZGDVYBJ-KNTRCKAVSA-N 2 1 320.480 4.344 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)c2ccsc2S1 ZINC000130250966 332023677 /nfs/dbraw/zinc/02/36/77/332023677.db2.gz OCOADFDDTOEWPT-ZFWWWQNUSA-N 2 1 310.532 4.139 20 0 DIADMP CCc1ccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C(C)C)cc1 ZINC000409447391 332032798 /nfs/dbraw/zinc/03/27/98/332032798.db2.gz GYXWQMUNNHDWMY-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+]2CCC([NH+](C)C)CC2)c1 ZINC000091670574 332110197 /nfs/dbraw/zinc/11/01/97/332110197.db2.gz AGZBPCWMIHICOM-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(-c3ccccn3)c2)CC1 ZINC000092165700 332114121 /nfs/dbraw/zinc/11/41/21/332114121.db2.gz FXTMJIGTZMSFTD-UHFFFAOYSA-N 2 1 323.484 4.055 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000394272457 332207519 /nfs/dbraw/zinc/20/75/19/332207519.db2.gz AILNCKUMBOROOZ-MJGOQNOKSA-N 2 1 314.498 4.311 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000536476876 332250676 /nfs/dbraw/zinc/25/06/76/332250676.db2.gz WFIUDOJWXYGFNZ-WOJBJXKFSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000536476876 332250678 /nfs/dbraw/zinc/25/06/78/332250678.db2.gz WFIUDOJWXYGFNZ-WOJBJXKFSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1nccn1CCC[N@H+]1CCCC[C@@H]1CCc1ccccc1 ZINC000536484720 332251590 /nfs/dbraw/zinc/25/15/90/332251590.db2.gz HEMDGFOFYQQYGZ-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@@H]1CCc1ccccc1 ZINC000536484720 332251591 /nfs/dbraw/zinc/25/15/91/332251591.db2.gz HEMDGFOFYQQYGZ-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@@H]1CCc1ccccc1 ZINC000536484720 332251592 /nfs/dbraw/zinc/25/15/92/332251592.db2.gz HEMDGFOFYQQYGZ-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000559740474 332278375 /nfs/dbraw/zinc/27/83/75/332278375.db2.gz FXDXYYDPTCHRPU-VXKWHMMOSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000559740474 332278376 /nfs/dbraw/zinc/27/83/76/332278376.db2.gz FXDXYYDPTCHRPU-VXKWHMMOSA-N 2 1 322.496 4.271 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCCC2CCCC2)C[C@H]1c1ccccc1 ZINC000559737143 332278645 /nfs/dbraw/zinc/27/86/45/332278645.db2.gz VLRMZYCFFJHERZ-PMACEKPBSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCC2CCCC2)C[C@H]1c1ccccc1 ZINC000559737143 332278646 /nfs/dbraw/zinc/27/86/46/332278646.db2.gz VLRMZYCFFJHERZ-PMACEKPBSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCC2CCCC2)C[C@H]1c1ccccc1 ZINC000559737185 332278656 /nfs/dbraw/zinc/27/86/56/332278656.db2.gz VLRMZYCFFJHERZ-UXHICEINSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCC2CCCC2)C[C@H]1c1ccccc1 ZINC000559737185 332278657 /nfs/dbraw/zinc/27/86/57/332278657.db2.gz VLRMZYCFFJHERZ-UXHICEINSA-N 2 1 300.490 4.382 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559866674 332287276 /nfs/dbraw/zinc/28/72/76/332287276.db2.gz WMMSQNWQRLMICT-LEAZDLGRSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559866674 332287277 /nfs/dbraw/zinc/28/72/77/332287277.db2.gz WMMSQNWQRLMICT-LEAZDLGRSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)=CCC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000559903235 332292155 /nfs/dbraw/zinc/29/21/55/332292155.db2.gz KXDNDEYSTRPJLW-UHFFFAOYSA-N 2 1 300.490 4.376 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCC2(C)C)C[N@H+]1Cc1ccccc1 ZINC000560244837 332322902 /nfs/dbraw/zinc/32/29/02/332322902.db2.gz OYSKWAIXCGXWGP-QRQLOZEOSA-N 2 1 300.490 4.065 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000560581281 332364436 /nfs/dbraw/zinc/36/44/36/332364436.db2.gz HETBLGDHZAPHFW-LMPOIIKSSA-N 2 1 320.443 4.208 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000560581281 332364437 /nfs/dbraw/zinc/36/44/37/332364437.db2.gz HETBLGDHZAPHFW-LMPOIIKSSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1)c1c[nH+]ccc1N ZINC000562958867 332652237 /nfs/dbraw/zinc/65/22/37/332652237.db2.gz ZAVOKRZAANEIQH-BJJXKVORSA-N 2 1 315.848 4.134 20 0 DIADMP CC(C)Oc1cccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000518765686 333029874 /nfs/dbraw/zinc/02/98/74/333029874.db2.gz XIRKQTCWYOVPGP-GOSISDBHSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1 ZINC000462676947 333072520 /nfs/dbraw/zinc/07/25/20/333072520.db2.gz ORFXGDZJLUWPKO-FUHIMQAGSA-N 2 1 300.490 4.339 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)C1 ZINC000462676958 333072559 /nfs/dbraw/zinc/07/25/59/333072559.db2.gz ORFXGDZJLUWPKO-UWVAXJGDSA-N 2 1 300.490 4.339 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C/c2ccc(Cl)cc2)[C@H](C)C1 ZINC000526056643 333095950 /nfs/dbraw/zinc/09/59/50/333095950.db2.gz CWSTUIHTTUWWCI-IJVDXJMESA-N 2 1 306.881 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C/c2ccc(Cl)cc2)[C@H](C)C1 ZINC000526056643 333095952 /nfs/dbraw/zinc/09/59/52/333095952.db2.gz CWSTUIHTTUWWCI-IJVDXJMESA-N 2 1 306.881 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C/c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000526056644 333096012 /nfs/dbraw/zinc/09/60/12/333096012.db2.gz CWSTUIHTTUWWCI-PWSDSBMBSA-N 2 1 306.881 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C/c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000526056644 333096013 /nfs/dbraw/zinc/09/60/13/333096013.db2.gz CWSTUIHTTUWWCI-PWSDSBMBSA-N 2 1 306.881 4.015 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)o1 ZINC000177979970 333133927 /nfs/dbraw/zinc/13/39/27/333133927.db2.gz WSVOLPGQDFPXDD-MRXNPFEDSA-N 2 1 300.446 4.279 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccsc1 ZINC000178012702 333134494 /nfs/dbraw/zinc/13/44/94/333134494.db2.gz DMUVPTYNDPHVOM-OAHLLOKOSA-N 2 1 302.487 4.439 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C[C@@H](C)c1cccc(Cl)c1 ZINC000188017351 333156659 /nfs/dbraw/zinc/15/66/59/333156659.db2.gz HEKRRJBYFCMTAL-CQSZACIVSA-N 2 1 305.853 4.018 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@H](c3ccccc3)C3CC3)C2)cc1 ZINC000310101975 333219333 /nfs/dbraw/zinc/21/93/33/333219333.db2.gz YDNOYVGEEWFNBN-SIKLNZKXSA-N 2 1 320.480 4.249 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594413 333305128 /nfs/dbraw/zinc/30/51/28/333305128.db2.gz HAIOQRIHOJEBKE-MOPGFXCFSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594413 333305129 /nfs/dbraw/zinc/30/51/29/333305129.db2.gz HAIOQRIHOJEBKE-MOPGFXCFSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1CC[C@@H]1CCC[NH+]1C ZINC000502693374 333305353 /nfs/dbraw/zinc/30/53/53/333305353.db2.gz HYRRMAQKQHQDRX-XUVXKRRUSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[NH+]1CC[C@@H]1CCC[N@@H+]1C ZINC000502693374 333305355 /nfs/dbraw/zinc/30/53/55/333305355.db2.gz HYRRMAQKQHQDRX-XUVXKRRUSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[NH+]1CC[C@@H]1CCC[N@H+]1C ZINC000502693374 333305357 /nfs/dbraw/zinc/30/53/57/333305357.db2.gz HYRRMAQKQHQDRX-XUVXKRRUSA-N 2 1 300.490 4.129 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000221916613 333379732 /nfs/dbraw/zinc/37/97/32/333379732.db2.gz CUFXLWKFEBEPQF-HNNXBMFYSA-N 2 1 312.910 4.197 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000221916613 333379733 /nfs/dbraw/zinc/37/97/33/333379733.db2.gz CUFXLWKFEBEPQF-HNNXBMFYSA-N 2 1 312.910 4.197 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000221918579 333379925 /nfs/dbraw/zinc/37/99/25/333379925.db2.gz FELGBRVTMAPJAQ-CYBMUJFWSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000221918579 333379926 /nfs/dbraw/zinc/37/99/26/333379926.db2.gz FELGBRVTMAPJAQ-CYBMUJFWSA-N 2 1 302.384 4.086 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2ccc(F)cc2)CC1 ZINC000521428792 333382052 /nfs/dbraw/zinc/38/20/52/333382052.db2.gz UWHWBRAHENQWER-MRXNPFEDSA-N 2 1 306.469 4.331 20 0 DIADMP C[C@H]([NH2+]CC1CCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390800888 333394412 /nfs/dbraw/zinc/39/44/12/333394412.db2.gz ORZBQRLSFPUEOF-FXAWDEMLSA-N 2 1 300.490 4.067 20 0 DIADMP CC[N@H+](Cc1cnc(C2CCCCC2)s1)[C@H]1CCC[NH2+]CC1 ZINC000567872311 333395352 /nfs/dbraw/zinc/39/53/52/333395352.db2.gz CRXFHSSBUYFHNN-INIZCTEOSA-N 2 1 321.534 4.155 20 0 DIADMP CC[N@@H+](Cc1cnc(C2CCCCC2)s1)[C@H]1CCC[NH2+]CC1 ZINC000567872311 333395354 /nfs/dbraw/zinc/39/53/54/333395354.db2.gz CRXFHSSBUYFHNN-INIZCTEOSA-N 2 1 321.534 4.155 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000414062015 333889118 /nfs/dbraw/zinc/88/91/18/333889118.db2.gz CFRAADIPOABJNF-AEFFLSMTSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1nc([C@@H](C)NCc2cccc(C[N@H+](C)C(C)C)c2)cs1 ZINC000269436598 334001419 /nfs/dbraw/zinc/00/14/19/334001419.db2.gz RDMNYCCHKIGVHT-CQSZACIVSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cs1 ZINC000269436598 334001420 /nfs/dbraw/zinc/00/14/20/334001420.db2.gz RDMNYCCHKIGVHT-CQSZACIVSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cs1 ZINC000269436598 334001421 /nfs/dbraw/zinc/00/14/21/334001421.db2.gz RDMNYCCHKIGVHT-CQSZACIVSA-N 2 1 317.502 4.143 20 0 DIADMP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2csc(Cl)c2Cl)cc1 ZINC000414806392 334104388 /nfs/dbraw/zinc/10/43/88/334104388.db2.gz BRHAQDBQLDOYSA-SECBINFHSA-N 2 1 315.269 4.364 20 0 DIADMP Cc1cc(F)c(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(Cl)c1 ZINC000414808359 334104979 /nfs/dbraw/zinc/10/49/79/334104979.db2.gz FFQPNRTYJUVMOG-GFCCVEGCSA-N 2 1 306.812 4.097 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000415082617 334272074 /nfs/dbraw/zinc/27/20/74/334272074.db2.gz DFDUIRHMFDEKIB-SRVKXCTJSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000295116589 334218842 /nfs/dbraw/zinc/21/88/42/334218842.db2.gz WVUIAPUABFIGIA-AJPMMYPTSA-N 2 1 306.881 4.047 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415095232 334280975 /nfs/dbraw/zinc/28/09/75/334280975.db2.gz YZBXZZXJXHLRAI-ZQYQINFJSA-N 2 1 306.453 4.003 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H]3CCSc4ccccc43)CC[NH2+]2)cc1 ZINC000415098532 334281205 /nfs/dbraw/zinc/28/12/05/334281205.db2.gz FMLWEEQLIFEJKQ-WDSOQIARSA-N 2 1 324.493 4.306 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@H]3CCSc4ccccc43)CC[NH2+]2)cc1 ZINC000415098529 334281228 /nfs/dbraw/zinc/28/12/28/334281228.db2.gz FMLWEEQLIFEJKQ-NEWSRXKRSA-N 2 1 324.493 4.306 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC000415097813 334281274 /nfs/dbraw/zinc/28/12/74/334281274.db2.gz DNVUOXWTVCEBMD-TYPHKJRUSA-N 2 1 306.453 4.147 20 0 DIADMP Cc1ccccc1C1(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC000415098513 334281311 /nfs/dbraw/zinc/28/13/11/334281311.db2.gz FJXOKUXBPQZIIU-PZJWPPBQSA-N 2 1 320.480 4.110 20 0 DIADMP Clc1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000415104252 334282732 /nfs/dbraw/zinc/28/27/32/334282732.db2.gz KYEIAMHQBWKUSE-NUEKZKHPSA-N 2 1 313.272 4.004 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117072 334284022 /nfs/dbraw/zinc/28/40/22/334284022.db2.gz FWALRRLGILVVJB-ZOCIIQOWSA-N 2 1 314.860 4.484 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2C)CC1 ZINC000531955084 334306526 /nfs/dbraw/zinc/30/65/26/334306526.db2.gz CXQNLCBQRLPEER-YLJYHZDGSA-N 2 1 300.490 4.128 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCC1 ZINC000531962009 334312604 /nfs/dbraw/zinc/31/26/04/334312604.db2.gz GNWDZAOZKUBCTA-IIDMSEBBSA-N 2 1 320.908 4.080 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC000531957757 334313941 /nfs/dbraw/zinc/31/39/41/334313941.db2.gz FDXDLQVMZOMESF-QUCCMNQESA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000534908382 334345617 /nfs/dbraw/zinc/34/56/17/334345617.db2.gz JIMXKEDKEJMDNU-HRAATJIYSA-N 2 1 312.501 4.261 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(Cl)s2)CC1 ZINC000535067752 334363260 /nfs/dbraw/zinc/36/32/60/334363260.db2.gz GGBXOTNRUHALDW-UHFFFAOYSA-N 2 1 314.926 4.345 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164626403 334635169 /nfs/dbraw/zinc/63/51/69/334635169.db2.gz QLYLBTYOMYBFAS-OAHLLOKOSA-N 2 1 317.502 4.435 20 0 DIADMP Cc1[nH+]ccn1CCCCNc1cc(C)[nH+]c2ccc(F)cc12 ZINC000127219274 334874927 /nfs/dbraw/zinc/87/49/27/334874927.db2.gz LTJUZZFSOXPOHA-UHFFFAOYSA-N 2 1 312.392 4.080 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000344169740 335226874 /nfs/dbraw/zinc/22/68/74/335226874.db2.gz MOJCAGOJERCWSY-OXQOHEQNSA-N 2 1 311.473 4.349 20 0 DIADMP C[C@@H](NCc1cccc(-n2ccnc2)c1)c1cccc(F)c1F ZINC000345186968 335306236 /nfs/dbraw/zinc/30/62/36/335306236.db2.gz OGHKLPMEJDBCOH-CYBMUJFWSA-N 2 1 313.351 4.001 20 0 DIADMP Clc1ccc([C@H](CC2CC2)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000345695407 335342669 /nfs/dbraw/zinc/34/26/69/335342669.db2.gz PUPYTLYPVKDTPF-IBGZPJMESA-N 2 1 318.892 4.398 20 0 DIADMP Clc1ccc([C@H](CC2CC2)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000345719156 335345652 /nfs/dbraw/zinc/34/56/52/335345652.db2.gz LFIUBWOIOOUJSM-OTWHNJEPSA-N 2 1 318.892 4.398 20 0 DIADMP Cc1[nH+]ccn1CCN(Cc1c(Cl)cccc1Cl)C1CC1 ZINC000346314533 335399293 /nfs/dbraw/zinc/39/92/93/335399293.db2.gz RMFAUOPEAFXZEE-UHFFFAOYSA-N 2 1 324.255 4.163 20 0 DIADMP CC[C@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccccc1OC ZINC000346865865 335443975 /nfs/dbraw/zinc/44/39/75/335443975.db2.gz ONLCXHLBUBAZSP-AEFFLSMTSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)c1cc(Cl)cc(Cl)c1 ZINC000480628430 336035171 /nfs/dbraw/zinc/03/51/71/336035171.db2.gz XWQZVYDKZLWDNS-XZJROXQQSA-N 2 1 313.272 4.271 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2cc(C)ccc2C)C1 ZINC000324089071 336079881 /nfs/dbraw/zinc/07/98/81/336079881.db2.gz JCNZAESMXZYPIE-DENIHFKCSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](C)CC[C@H]1c1ccccc1 ZINC000352799812 336238593 /nfs/dbraw/zinc/23/85/93/336238593.db2.gz GMCUYFMCXDUXIE-PXNSSMCTSA-N 2 1 311.473 4.445 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](C)CC[C@H]1c1ccccc1 ZINC000352799812 336238594 /nfs/dbraw/zinc/23/85/94/336238594.db2.gz GMCUYFMCXDUXIE-PXNSSMCTSA-N 2 1 311.473 4.445 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1cnc(C(C)C)s1 ZINC000532328865 336240654 /nfs/dbraw/zinc/24/06/54/336240654.db2.gz BJBREXVSCALJHV-DOTOQJQBSA-N 2 1 323.550 4.257 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC(C2CC2)C2CC2)cc1 ZINC000532537072 336255185 /nfs/dbraw/zinc/25/51/85/336255185.db2.gz SLFBXFUIUKAJLY-CQSZACIVSA-N 2 1 309.457 4.268 20 0 DIADMP C[NH+](C)[C@@H](CNc1cc[nH+]c2ccc(Cl)cc12)c1ccco1 ZINC000301252120 336296845 /nfs/dbraw/zinc/29/68/45/336296845.db2.gz DLWWHAFBZUQNHP-INIZCTEOSA-N 2 1 315.804 4.196 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000514100253 336332168 /nfs/dbraw/zinc/33/21/68/336332168.db2.gz URYANVYHCKICLF-VDGAXYAQSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@H+]1CCC[C@@H](CNc2cc[nH+]c3cc(C(F)(F)F)ccc23)C1 ZINC000301993307 336341998 /nfs/dbraw/zinc/34/19/98/336341998.db2.gz RCKLYTZBTXGOSK-LBPRGKRZSA-N 2 1 323.362 4.007 20 0 DIADMP Cc1[nH+]c2ccccc2c(NCCc2cn3c([nH+]2)CCCC3)c1C ZINC000302667446 336364174 /nfs/dbraw/zinc/36/41/74/336364174.db2.gz MYNPOSAKEINCLR-UHFFFAOYSA-N 2 1 320.440 4.039 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc2cccc(F)c2o1 ZINC000355729870 336520296 /nfs/dbraw/zinc/52/02/96/336520296.db2.gz GMDNOSSDXYDJDW-ZDUSSCGKSA-N 2 1 315.392 4.208 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000361378145 336754329 /nfs/dbraw/zinc/75/43/29/336754329.db2.gz QOCGATYISZWIIX-AZUAARDMSA-N 2 1 322.452 4.037 20 0 DIADMP CCC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccccc1 ZINC000361508821 336760143 /nfs/dbraw/zinc/76/01/43/336760143.db2.gz QBMDYRKPMGKUCF-FQEVSTJZSA-N 2 1 323.484 4.490 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCOc3ccc(Cl)cc32)C1 ZINC000361968183 336780381 /nfs/dbraw/zinc/78/03/81/336780381.db2.gz ZFKRFVQHFIMTAW-BFYDXBDKSA-N 2 1 322.880 4.016 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000193507893 337033203 /nfs/dbraw/zinc/03/32/03/337033203.db2.gz RDUWNCQZPVINSP-HUUCEWRRSA-N 2 1 312.457 4.130 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000193507893 337033205 /nfs/dbraw/zinc/03/32/05/337033205.db2.gz RDUWNCQZPVINSP-HUUCEWRRSA-N 2 1 312.457 4.130 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000193507905 337033210 /nfs/dbraw/zinc/03/32/10/337033210.db2.gz RDUWNCQZPVINSP-LSDHHAIUSA-N 2 1 312.457 4.130 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000193507905 337033211 /nfs/dbraw/zinc/03/32/11/337033211.db2.gz RDUWNCQZPVINSP-LSDHHAIUSA-N 2 1 312.457 4.130 20 0 DIADMP c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000377566800 337055358 /nfs/dbraw/zinc/05/53/58/337055358.db2.gz XNGXAWYLAJPYFL-ALLBUHFWSA-N 2 1 323.484 4.152 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2ccsc2S1 ZINC000178254909 337161702 /nfs/dbraw/zinc/16/17/02/337161702.db2.gz KNIMAKFTAXKBPE-LRDDRELGSA-N 2 1 322.543 4.138 20 0 DIADMP c1cc2[nH+]ccc(NCC3CCN(c4cc[nH+]cc4)CC3)c2s1 ZINC000180045157 337173382 /nfs/dbraw/zinc/17/33/82/337173382.db2.gz DOIUVXCDTJICPJ-UHFFFAOYSA-N 2 1 324.453 4.020 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000180404247 337174146 /nfs/dbraw/zinc/17/41/46/337174146.db2.gz LOKQKHSMDMSRDT-ZDUSSCGKSA-N 2 1 309.523 4.098 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000183190150 337190347 /nfs/dbraw/zinc/19/03/47/337190347.db2.gz RWEBBSUFGBSQKJ-POAQFYNOSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1 ZINC000184359357 337197985 /nfs/dbraw/zinc/19/79/85/337197985.db2.gz BOJKLUJXMUCKAI-MSOLQXFVSA-N 2 1 323.484 4.266 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H](CC)c1ccccc1 ZINC000583171227 337251541 /nfs/dbraw/zinc/25/15/41/337251541.db2.gz YVMJCKSFZOPQDG-SFHVURJKSA-N 2 1 313.489 4.351 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H](CC)c1ccccc1 ZINC000583171227 337251542 /nfs/dbraw/zinc/25/15/42/337251542.db2.gz YVMJCKSFZOPQDG-SFHVURJKSA-N 2 1 313.489 4.351 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C)nc2C)cc1 ZINC000187439759 337266001 /nfs/dbraw/zinc/26/60/01/337266001.db2.gz OHWAYGSGCCFZLW-OAHLLOKOSA-N 2 1 320.440 4.043 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCC1CCCC1 ZINC000398181620 337309105 /nfs/dbraw/zinc/30/91/05/337309105.db2.gz XDCNRFRWVDBHIW-FXAWDEMLSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCC1CCCC1 ZINC000398181620 337309106 /nfs/dbraw/zinc/30/91/06/337309106.db2.gz XDCNRFRWVDBHIW-FXAWDEMLSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000583782639 337332601 /nfs/dbraw/zinc/33/26/01/337332601.db2.gz VDUCYPWTNDEVLO-LMRVLLHPSA-N 2 1 308.432 4.062 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000583782639 337332602 /nfs/dbraw/zinc/33/26/02/337332602.db2.gz VDUCYPWTNDEVLO-LMRVLLHPSA-N 2 1 308.432 4.062 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2cccc(F)c2)CC1 ZINC000520791674 337390930 /nfs/dbraw/zinc/39/09/30/337390930.db2.gz WEYQMEARWYEWKJ-MRXNPFEDSA-N 2 1 306.469 4.331 20 0 DIADMP CCCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](CC)CC)C2)cc1 ZINC000580415244 337399564 /nfs/dbraw/zinc/39/95/64/337399564.db2.gz NKFKRKXEWDRMRU-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[N@H+]2CC[C@H](C[NH+](CC)CC)C2)cc1 ZINC000580415244 337399565 /nfs/dbraw/zinc/39/95/65/337399565.db2.gz NKFKRKXEWDRMRU-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1sc2ccccc2c1Cl ZINC000420370943 337500082 /nfs/dbraw/zinc/50/00/82/337500082.db2.gz WFXSMGMIUWHDRB-CQSZACIVSA-N 2 1 308.878 4.032 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000247015218 337556934 /nfs/dbraw/zinc/55/69/34/337556934.db2.gz KNOYUVLQHJDDDB-AEGPPILISA-N 2 1 309.523 4.098 20 0 DIADMP C[NH2+]CCC1CC[NH+](Cc2csc(C3CCCCC3)n2)CC1 ZINC000261997293 337614032 /nfs/dbraw/zinc/61/40/32/337614032.db2.gz OFLFVHMWRVSVLQ-UHFFFAOYSA-N 2 1 321.534 4.012 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(C)c1 ZINC000422706855 337683689 /nfs/dbraw/zinc/68/36/89/337683689.db2.gz GFJISOUOLJXFFH-HFSMHLIXSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)c1C ZINC000422734060 337684589 /nfs/dbraw/zinc/68/45/89/337684589.db2.gz CCAUROIRNSCWQF-WOJBJXKFSA-N 2 1 319.452 4.328 20 0 DIADMP C[C@@H](C[NH2+][C@H](C)c1c[nH+]ccc1N)c1c(Cl)cccc1Cl ZINC000422885981 337690008 /nfs/dbraw/zinc/69/00/08/337690008.db2.gz ZTUURHIDCGXSQN-WDEREUQCSA-N 2 1 324.255 4.255 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1cc2cc(Cl)ccc2o1 ZINC000537297137 337929193 /nfs/dbraw/zinc/92/91/93/337929193.db2.gz PINLUPKPNWKONW-CYBMUJFWSA-N 2 1 306.837 4.223 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1cc(C)ccc1OC ZINC000537884986 337964415 /nfs/dbraw/zinc/96/44/15/337964415.db2.gz VKXGQZCUWDHTDI-LJQANCHMSA-N 2 1 318.505 4.165 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000315017357 337979273 /nfs/dbraw/zinc/97/92/73/337979273.db2.gz KTMRRMOTEISDTA-KBPBESRZSA-N 2 1 323.550 4.132 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)[C@H]1C ZINC000516198401 338007212 /nfs/dbraw/zinc/00/72/12/338007212.db2.gz QGGWMHPNRBEQOC-LWASTNQWSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)[C@H]1C ZINC000516198401 338007213 /nfs/dbraw/zinc/00/72/13/338007213.db2.gz QGGWMHPNRBEQOC-LWASTNQWSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1ccoc1C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000426294156 338025124 /nfs/dbraw/zinc/02/51/24/338025124.db2.gz SOZZMWNDPXXRHO-UHFFFAOYSA-N 2 1 312.457 4.121 20 0 DIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CCCc2sc(Cl)cc21 ZINC000426303124 338025749 /nfs/dbraw/zinc/02/57/49/338025749.db2.gz LJIGHHPMFOCYHJ-HBJVGIJOSA-N 2 1 312.910 4.097 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CCCc2sc(Cl)cc21 ZINC000426303124 338025750 /nfs/dbraw/zinc/02/57/50/338025750.db2.gz LJIGHHPMFOCYHJ-HBJVGIJOSA-N 2 1 312.910 4.097 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000429537012 338083331 /nfs/dbraw/zinc/08/33/31/338083331.db2.gz GEBMYCCXSMQCLX-QGZVFWFLSA-N 2 1 306.519 4.103 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000429537012 338083332 /nfs/dbraw/zinc/08/33/32/338083332.db2.gz GEBMYCCXSMQCLX-QGZVFWFLSA-N 2 1 306.519 4.103 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000433320564 338192079 /nfs/dbraw/zinc/19/20/79/338192079.db2.gz SKIJDYLMWAQCQW-QGZVFWFLSA-N 2 1 306.881 4.005 20 0 DIADMP Clc1cccc([C@@H]2CC[N@@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000433320564 338192080 /nfs/dbraw/zinc/19/20/80/338192080.db2.gz SKIJDYLMWAQCQW-QGZVFWFLSA-N 2 1 306.881 4.005 20 0 DIADMP C[C@H]1CCC[C@@H](C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)C1 ZINC000434672136 338223020 /nfs/dbraw/zinc/22/30/20/338223020.db2.gz XUMZAEHVHSZTGR-DLBZAZTESA-N 2 1 315.505 4.225 20 0 DIADMP C(=C/c1ccccc1)\C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434674942 338223053 /nfs/dbraw/zinc/22/30/53/338223053.db2.gz JLEBRAGTDXEAHK-RMKNXTFCSA-N 2 1 321.468 4.112 20 0 DIADMP Cc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1C ZINC000434675851 338223201 /nfs/dbraw/zinc/22/32/01/338223201.db2.gz NUNIPBOKZLAVOT-UHFFFAOYSA-N 2 1 323.484 4.216 20 0 DIADMP CCC(C)(C)CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434682478 338223275 /nfs/dbraw/zinc/22/32/75/338223275.db2.gz ABFYRSURBRXZKZ-UHFFFAOYSA-N 2 1 303.494 4.225 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)C1 ZINC000436228247 338262560 /nfs/dbraw/zinc/26/25/60/338262560.db2.gz AYKZXFWQKZUQCE-HBMCJLEFSA-N 2 1 314.517 4.108 20 0 DIADMP CC1(C)CCc2ccccc2[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C1 ZINC000436302852 338267596 /nfs/dbraw/zinc/26/75/96/338267596.db2.gz ABXHOQKDAIVJIY-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155593014 338294973 /nfs/dbraw/zinc/29/49/73/338294973.db2.gz YNRJBSYZDHVHSR-LQWHRVPQSA-N 2 1 322.496 4.279 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155593014 338294974 /nfs/dbraw/zinc/29/49/74/338294974.db2.gz YNRJBSYZDHVHSR-LQWHRVPQSA-N 2 1 322.496 4.279 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)[C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437593471 338315485 /nfs/dbraw/zinc/31/54/85/338315485.db2.gz NXHBUJXHKVDYHX-SFTDATJTSA-N 2 1 314.517 4.301 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)[C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437593471 338315486 /nfs/dbraw/zinc/31/54/86/338315486.db2.gz NXHBUJXHKVDYHX-SFTDATJTSA-N 2 1 314.517 4.301 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437786845 338321565 /nfs/dbraw/zinc/32/15/65/338321565.db2.gz PEUBGAXNEKAISO-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000437786845 338321566 /nfs/dbraw/zinc/32/15/66/338321566.db2.gz PEUBGAXNEKAISO-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[NH+](C)[C@H](C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)C1CCCCC1 ZINC000438075902 338330097 /nfs/dbraw/zinc/33/00/97/338330097.db2.gz CACZIVZYACGPIZ-OWCLPIDISA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000438089947 338330867 /nfs/dbraw/zinc/33/08/67/338330867.db2.gz XWIJEJLGJKHANH-SJORKVTESA-N 2 1 306.469 4.001 20 0 DIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438215239 338336777 /nfs/dbraw/zinc/33/67/77/338336777.db2.gz YRXXRZVCVGJKPE-NPJQDHAYSA-N 2 1 320.443 4.064 20 0 DIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438215239 338336778 /nfs/dbraw/zinc/33/67/78/338336778.db2.gz YRXXRZVCVGJKPE-NPJQDHAYSA-N 2 1 320.443 4.064 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439313832 338366838 /nfs/dbraw/zinc/36/68/38/338366838.db2.gz DXOLNCZBKWKNDC-YLJYHZDGSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439313832 338366839 /nfs/dbraw/zinc/36/68/39/338366839.db2.gz DXOLNCZBKWKNDC-YLJYHZDGSA-N 2 1 311.473 4.240 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc21 ZINC000459507267 339033214 /nfs/dbraw/zinc/03/32/14/339033214.db2.gz QUPRKSGQLLZVJG-KKSFZXQISA-N 2 1 312.501 4.130 20 0 DIADMP c1ccc([C@H]2CCCC[C@H]2C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459568142 339036362 /nfs/dbraw/zinc/03/63/62/339036362.db2.gz JFYCAKIJWQXLSM-GHTZIAJQSA-N 2 1 312.501 4.177 20 0 DIADMP C[C@@H](CCc1ccc(Cl)s1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459723576 339044334 /nfs/dbraw/zinc/04/43/34/339044334.db2.gz AECILRUJFIDFOA-UONOGXRCSA-N 2 1 314.926 4.044 20 0 DIADMP CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000462356020 339076580 /nfs/dbraw/zinc/07/65/80/339076580.db2.gz CNZRDQKRLOSIJD-DOTOQJQBSA-N 2 1 315.436 4.378 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000462672794 339083803 /nfs/dbraw/zinc/08/38/03/339083803.db2.gz GGKFJBZUFYNFFI-HLIPFELVSA-N 2 1 300.490 4.197 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000462842932 339093910 /nfs/dbraw/zinc/09/39/10/339093910.db2.gz SXNITHCLPISKIW-YOUFYPILSA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000462842931 339093914 /nfs/dbraw/zinc/09/39/14/339093914.db2.gz SXNITHCLPISKIW-XODKDNOYSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911833 339097696 /nfs/dbraw/zinc/09/76/96/339097696.db2.gz PACFSWWGAAYBKV-JXFKEZNVSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911833 339097697 /nfs/dbraw/zinc/09/76/97/339097697.db2.gz PACFSWWGAAYBKV-JXFKEZNVSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911833 339097698 /nfs/dbraw/zinc/09/76/98/339097698.db2.gz PACFSWWGAAYBKV-JXFKEZNVSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911833 339097699 /nfs/dbraw/zinc/09/76/99/339097699.db2.gz PACFSWWGAAYBKV-JXFKEZNVSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(F)cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000463133407 339106712 /nfs/dbraw/zinc/10/67/12/339106712.db2.gz YEKQRLQELKSBOK-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(F)cc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000463133407 339106713 /nfs/dbraw/zinc/10/67/13/339106713.db2.gz YEKQRLQELKSBOK-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP CC1(C)CCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463187530 339108487 /nfs/dbraw/zinc/10/84/87/339108487.db2.gz CELLNMYVTQIKJL-IBGZPJMESA-N 2 1 318.480 4.001 20 0 DIADMP CC(C)(C[NH2+]CC1CCC(C(F)(F)F)CC1)[NH+]1CCCCC1 ZINC000466448049 339204985 /nfs/dbraw/zinc/20/49/85/339204985.db2.gz GTKRYHXBGAHHGM-UHFFFAOYSA-N 2 1 320.443 4.209 20 0 DIADMP CC(C)[NH+](CC[NH2+]CC1CCC(C(F)(F)F)CC1)C(C)C ZINC000466457774 339205734 /nfs/dbraw/zinc/20/57/34/339205734.db2.gz TWZZMUCLPLRTTH-UHFFFAOYSA-N 2 1 308.432 4.064 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466464009 339206110 /nfs/dbraw/zinc/20/61/10/339206110.db2.gz PUXZAQXNFQDZEQ-FHERZECASA-N 2 1 320.443 4.209 20 0 DIADMP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]CC[NH+](C(C)C)C(C)C)C1 ZINC000467306453 339230917 /nfs/dbraw/zinc/23/09/17/339230917.db2.gz BDFLVGJGTXCVCC-RBUKOAKNSA-N 2 1 317.521 4.125 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]C2CC(c3ccc(F)c(Cl)c3)C2)[C@H](C)C1 ZINC000467434320 339238347 /nfs/dbraw/zinc/23/83/47/339238347.db2.gz UTPIDUNBYXEZLU-UEPHZPRCSA-N 2 1 324.871 4.045 20 0 DIADMP CCCCOc1ccccc1CN(C)[C@@H]1CC[N@@H+](CC)[C@H](C)C1 ZINC000468393117 339261618 /nfs/dbraw/zinc/26/16/18/339261618.db2.gz RUPHDEMKOOSRAB-IEBWSBKVSA-N 2 1 318.505 4.170 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CCC2)[C@H](C)C1 ZINC000468987385 339276904 /nfs/dbraw/zinc/27/69/04/339276904.db2.gz NOORDSFKQZLZJL-CRAIPNDOSA-N 2 1 320.908 4.082 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469744232 339297470 /nfs/dbraw/zinc/29/74/70/339297470.db2.gz ZIYIVLUSPSCYHX-ZWKOTPCHSA-N 2 1 316.832 4.339 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000469789523 339300234 /nfs/dbraw/zinc/30/02/34/339300234.db2.gz YRSLHODBPSEVGN-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000469789523 339300235 /nfs/dbraw/zinc/30/02/35/339300235.db2.gz YRSLHODBPSEVGN-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@@H]1CCC[NH2+]C1 ZINC000469876120 339303406 /nfs/dbraw/zinc/30/34/06/339303406.db2.gz QERHTLHTPJJYNW-SJLPKXTDSA-N 2 1 314.498 4.311 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000470354693 339317930 /nfs/dbraw/zinc/31/79/30/339317930.db2.gz RPJQRCXVTQGIHS-HOTGVXAUSA-N 2 1 308.897 4.154 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470975078 339333581 /nfs/dbraw/zinc/33/35/81/339333581.db2.gz MHJQPVKHPUAHBV-QFBILLFUSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470975078 339333582 /nfs/dbraw/zinc/33/35/82/339333582.db2.gz MHJQPVKHPUAHBV-QFBILLFUSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470975078 339333583 /nfs/dbraw/zinc/33/35/83/339333583.db2.gz MHJQPVKHPUAHBV-QFBILLFUSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470975078 339333584 /nfs/dbraw/zinc/33/35/84/339333584.db2.gz MHJQPVKHPUAHBV-QFBILLFUSA-N 2 1 320.908 4.455 20 0 DIADMP Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CC[C@@H]2CCCC[NH+]2C)C1 ZINC000472579395 339374179 /nfs/dbraw/zinc/37/41/79/339374179.db2.gz OIJOUPHNOFVDCW-QRVBRYPASA-N 2 1 300.490 4.047 20 0 DIADMP C[C@H](C[NH+]1CCCCCC1)[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000474056569 339399654 /nfs/dbraw/zinc/39/96/54/339399654.db2.gz LNJFVMTVPZZJPS-HUUCEWRRSA-N 2 1 302.453 4.055 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1cc(F)ccc1F)C(C)C ZINC000479080417 339527205 /nfs/dbraw/zinc/52/72/05/339527205.db2.gz RORLXAJANOXPCN-FZKQIMNGSA-N 2 1 321.415 4.093 20 0 DIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(c2cccc(Cl)c2)CC1 ZINC000483111063 339652023 /nfs/dbraw/zinc/65/20/23/339652023.db2.gz OZIZAIIDESDJSH-UHFFFAOYSA-N 2 1 317.864 4.115 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCC(C)(C)C[C@H]3C)CC2)[nH+]c1 ZINC000483500155 339667297 /nfs/dbraw/zinc/66/72/97/339667297.db2.gz GIPLXCHLIOMRFS-SJLPKXTDSA-N 2 1 315.505 4.163 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000494460605 339950095 /nfs/dbraw/zinc/95/00/95/339950095.db2.gz ZYPAUZIIUWEUKB-KBXCAEBGSA-N 2 1 306.519 4.189 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499143302 340031021 /nfs/dbraw/zinc/03/10/21/340031021.db2.gz SZCYOCOQTWQIPV-RQXATKFSSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000499149247 340031058 /nfs/dbraw/zinc/03/10/58/340031058.db2.gz SSQNDJQVROLEAC-MLZLACJZSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCCNc1cc[nH+]c2cc(F)ccc12 ZINC000500466599 340059755 /nfs/dbraw/zinc/05/97/55/340059755.db2.gz LKLRNPYTGSAQQL-HNNXBMFYSA-N 2 1 315.436 4.440 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCCNc2cc[nH+]c3cc(F)ccc23)C1 ZINC000500472638 340059948 /nfs/dbraw/zinc/05/99/48/340059948.db2.gz XXAZUQYYVRVHKS-HNNXBMFYSA-N 2 1 315.436 4.298 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000500651302 340064452 /nfs/dbraw/zinc/06/44/52/340064452.db2.gz MYVMAZZHXTXNSV-MSOLQXFVSA-N 2 1 303.494 4.167 20 0 DIADMP Cc1cccc([C@H](C)[N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000501018177 340072413 /nfs/dbraw/zinc/07/24/13/340072413.db2.gz DGOVLDIHUKFRNU-SFHVURJKSA-N 2 1 323.484 4.299 20 0 DIADMP Cc1cc([C@H](C)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476757 340105296 /nfs/dbraw/zinc/10/52/96/340105296.db2.gz YUJSEDINBYZPEV-ZOBUZTSGSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)oc1C ZINC000502476757 340105297 /nfs/dbraw/zinc/10/52/97/340105297.db2.gz YUJSEDINBYZPEV-ZOBUZTSGSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476757 340105298 /nfs/dbraw/zinc/10/52/98/340105298.db2.gz YUJSEDINBYZPEV-ZOBUZTSGSA-N 2 1 304.478 4.200 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000502687884 340110544 /nfs/dbraw/zinc/11/05/44/340110544.db2.gz SDGVETWHGQTZOL-XUVXKRRUSA-N 2 1 300.490 4.195 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](CCc1ccccc1)CC(C)C ZINC000502721691 340112270 /nfs/dbraw/zinc/11/22/70/340112270.db2.gz JHJCQIXIVKWDHS-UHFFFAOYSA-N 2 1 313.489 4.172 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](CCc1ccccc1)CC(C)C ZINC000502721691 340112271 /nfs/dbraw/zinc/11/22/71/340112271.db2.gz JHJCQIXIVKWDHS-UHFFFAOYSA-N 2 1 313.489 4.172 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2)C(C)(C)C1 ZINC000503096411 340120947 /nfs/dbraw/zinc/12/09/47/340120947.db2.gz QQDDDYSTTANNCF-LJQANCHMSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2)C(C)(C)C1 ZINC000503096411 340120948 /nfs/dbraw/zinc/12/09/48/340120948.db2.gz QQDDDYSTTANNCF-LJQANCHMSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000503370049 340126499 /nfs/dbraw/zinc/12/64/99/340126499.db2.gz DNZANBUJKBUXJT-RDTXWAMCSA-N 2 1 317.864 4.150 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476026 340195251 /nfs/dbraw/zinc/19/52/51/340195251.db2.gz ZXNWTSMERIFAPW-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476026 340195252 /nfs/dbraw/zinc/19/52/52/340195252.db2.gz ZXNWTSMERIFAPW-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1cccc(F)c1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506476026 340195253 /nfs/dbraw/zinc/19/52/53/340195253.db2.gz ZXNWTSMERIFAPW-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1cccc(F)c1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506476026 340195254 /nfs/dbraw/zinc/19/52/54/340195254.db2.gz ZXNWTSMERIFAPW-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc3[nH]ccc32)CC1 ZINC000506890759 340203285 /nfs/dbraw/zinc/20/32/85/340203285.db2.gz LMVMFZAGWWCFTP-UHFFFAOYSA-N 2 1 313.489 4.112 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(C3CCC3)cc2)CC1 ZINC000507097860 340207186 /nfs/dbraw/zinc/20/71/86/340207186.db2.gz KSWSZIVTTRQLAH-UHFFFAOYSA-N 2 1 300.490 4.259 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000507833114 340233630 /nfs/dbraw/zinc/23/36/30/340233630.db2.gz JVMKAWRNQNBKSY-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000507833114 340233631 /nfs/dbraw/zinc/23/36/31/340233631.db2.gz JVMKAWRNQNBKSY-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP CCCC1(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000508694121 340250919 /nfs/dbraw/zinc/25/09/19/340250919.db2.gz FCKWORVDOXGGSE-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508711787 340251324 /nfs/dbraw/zinc/25/13/24/340251324.db2.gz PEJUFHLPHGOLLH-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC(C)(C)C1 ZINC000302796083 340282226 /nfs/dbraw/zinc/28/22/26/340282226.db2.gz UUTSSOHFFCVTHG-FXAWDEMLSA-N 2 1 314.517 4.455 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC000509956821 340283871 /nfs/dbraw/zinc/28/38/71/340283871.db2.gz JBALPZRVGJHPQI-FFZOFVMBSA-N 2 1 311.473 4.144 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1 ZINC000509972289 340284277 /nfs/dbraw/zinc/28/42/77/340284277.db2.gz NZCJFXKEGNEDMX-WOJBJXKFSA-N 2 1 311.473 4.288 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000303071921 340300307 /nfs/dbraw/zinc/30/03/07/340300307.db2.gz PIDXGJWZBOEWOI-CQSZACIVSA-N 2 1 324.871 4.348 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000303071919 340300348 /nfs/dbraw/zinc/30/03/48/340300348.db2.gz PIDXGJWZBOEWOI-AWEZNQCLSA-N 2 1 324.871 4.348 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CC[C@@H]2C2CCC2)CC1 ZINC000510665145 340305655 /nfs/dbraw/zinc/30/56/55/340305655.db2.gz BOONOUODWJEZQK-HBGVWJBISA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]2C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000510680282 340306347 /nfs/dbraw/zinc/30/63/47/340306347.db2.gz HVGJNZYZEAPEIA-OTNPHJDUSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]2C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000510680282 340306348 /nfs/dbraw/zinc/30/63/48/340306348.db2.gz HVGJNZYZEAPEIA-OTNPHJDUSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]2C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000510680286 340306405 /nfs/dbraw/zinc/30/64/05/340306405.db2.gz HVGJNZYZEAPEIA-RZXSNQJFSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H]2C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000510680286 340306406 /nfs/dbraw/zinc/30/64/06/340306406.db2.gz HVGJNZYZEAPEIA-RZXSNQJFSA-N 2 1 312.501 4.208 20 0 DIADMP FCCC[C@H]1CCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000510715998 340307823 /nfs/dbraw/zinc/30/78/23/340307823.db2.gz DRTPUUHGTHESMS-UYAOXDASSA-N 2 1 318.480 4.159 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CCC2)[C@H]1c1cccs1 ZINC000510739046 340308993 /nfs/dbraw/zinc/30/89/93/340308993.db2.gz SIYNZJBQNNKGIU-NTDBWNAOSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CCC2)[C@H]1c1cccs1 ZINC000510739046 340308994 /nfs/dbraw/zinc/30/89/94/340308994.db2.gz SIYNZJBQNNKGIU-NTDBWNAOSA-N 2 1 318.530 4.299 20 0 DIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511017645 340318357 /nfs/dbraw/zinc/31/83/57/340318357.db2.gz RLWDPFBLRAVUHU-HSALFYBXSA-N 2 1 318.480 4.017 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(SC(C)C)cc2)CC1 ZINC000511139973 340322283 /nfs/dbraw/zinc/32/22/83/340322283.db2.gz DVAAWFOLFUMPIA-UHFFFAOYSA-N 2 1 320.546 4.493 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(C)C)cc2)C[C@H]1C ZINC000511148507 340322343 /nfs/dbraw/zinc/32/23/43/340322343.db2.gz YYBKRDBGUFJTQA-SJLPKXTDSA-N 2 1 320.546 4.492 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(C)C)cc2)C[C@@H]1C ZINC000511148505 340322409 /nfs/dbraw/zinc/32/24/09/340322409.db2.gz YYBKRDBGUFJTQA-FUHWJXTLSA-N 2 1 320.546 4.492 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000511162699 340323052 /nfs/dbraw/zinc/32/30/52/340323052.db2.gz SFGRUQBKILBDQW-PKOBYXMFSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC000511162699 340323053 /nfs/dbraw/zinc/32/30/53/340323053.db2.gz SFGRUQBKILBDQW-PKOBYXMFSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC000511162699 340323054 /nfs/dbraw/zinc/32/30/54/340323054.db2.gz SFGRUQBKILBDQW-PKOBYXMFSA-N 2 1 318.530 4.103 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc2occc2c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000511912622 340342808 /nfs/dbraw/zinc/34/28/08/340342808.db2.gz QQDAWKQUWGXIEJ-QAPCUYQASA-N 2 1 312.457 4.175 20 0 DIADMP CCCCC1CCC(C[NH2+]Cc2ncc(C[NH+](C)C)s2)CC1 ZINC000512084675 340348127 /nfs/dbraw/zinc/34/81/27/340348127.db2.gz XZKNQZGHWZJCAW-UHFFFAOYSA-N 2 1 323.550 4.291 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cccc(F)c2F)C1 ZINC000512194457 340351894 /nfs/dbraw/zinc/35/18/94/340351894.db2.gz LAKGLADFDFJXGT-HZPDHXFCSA-N 2 1 322.443 4.051 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cccc(F)c2F)C1 ZINC000512194455 340351957 /nfs/dbraw/zinc/35/19/57/340351957.db2.gz LAKGLADFDFJXGT-CVEARBPZSA-N 2 1 322.443 4.051 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000512328517 340357315 /nfs/dbraw/zinc/35/73/15/340357315.db2.gz BERYSFOXDJAMRO-CMKODMSKSA-N 2 1 323.484 4.033 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C(C3CCC3)C3CCC3)CC2)cc1 ZINC000304301924 340362903 /nfs/dbraw/zinc/36/29/03/340362903.db2.gz ITGXRHMHUMTOJL-UHFFFAOYSA-N 2 1 312.501 4.209 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)c(F)c2)c1 ZINC000173387782 340363944 /nfs/dbraw/zinc/36/39/44/340363944.db2.gz XYCPEDULBYIVFS-CQSZACIVSA-N 2 1 318.411 4.267 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000173388722 340364032 /nfs/dbraw/zinc/36/40/32/340364032.db2.gz IESXJZHEBZRHFF-JKSUJKDBSA-N 2 1 306.519 4.180 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2ccc(Cl)cc2)C1 ZINC000513003896 340387860 /nfs/dbraw/zinc/38/78/60/340387860.db2.gz LLVOUCVJOJJARX-JMPLCFMRSA-N 2 1 306.881 4.065 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000513127911 340394372 /nfs/dbraw/zinc/39/43/72/340394372.db2.gz MIWFUQGQJBHREK-JWTNVVGKSA-N 2 1 318.530 4.244 20 0 DIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1csc(Cl)c1 ZINC000230408192 340620002 /nfs/dbraw/zinc/62/00/02/340620002.db2.gz QVHCQNLKTJEZRO-QWHCGFSZSA-N 2 1 300.899 4.174 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000037140799 340762816 /nfs/dbraw/zinc/76/28/16/340762816.db2.gz QDAAYTCEMRHUSG-GOSISDBHSA-N 2 1 306.881 4.398 20 0 DIADMP C[C@@H](C[NH2+][C@H]1C[C@H](C)Sc2sccc21)C[NH+]1CCCCC1 ZINC000130371311 341019995 /nfs/dbraw/zinc/01/99/95/341019995.db2.gz LKYQFWROZYGJBH-DZKIICNBSA-N 2 1 324.559 4.385 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)s2)C1 ZINC000543600114 341050483 /nfs/dbraw/zinc/05/04/83/341050483.db2.gz BKPQJXRMJQJSMD-HOTGVXAUSA-N 2 1 314.498 4.408 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+](C(C)(C)C)CC2)C2CCC2)o1 ZINC000543600967 341050572 /nfs/dbraw/zinc/05/05/72/341050572.db2.gz CSPUOPYZVMNWSE-GOSISDBHSA-N 2 1 304.478 4.282 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707156 341054536 /nfs/dbraw/zinc/05/45/36/341054536.db2.gz BYJZGAHKVIXKLK-DNVCBOLYSA-N 2 1 314.473 4.451 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707156 341054537 /nfs/dbraw/zinc/05/45/37/341054537.db2.gz BYJZGAHKVIXKLK-DNVCBOLYSA-N 2 1 314.473 4.451 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCc3ccsc3)C2)CC1 ZINC000543956186 341064216 /nfs/dbraw/zinc/06/42/16/341064216.db2.gz CBZVEQFVJGIMHJ-IBGZPJMESA-N 2 1 320.546 4.125 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCc2ccsc2)C1 ZINC000543960086 341064298 /nfs/dbraw/zinc/06/42/98/341064298.db2.gz SFCMYOMHOSAAHA-MJGOQNOKSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCc2ccsc2)C1 ZINC000543960086 341064299 /nfs/dbraw/zinc/06/42/99/341064299.db2.gz SFCMYOMHOSAAHA-MJGOQNOKSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCc2ccsc2)C1 ZINC000543960086 341064300 /nfs/dbraw/zinc/06/43/00/341064300.db2.gz SFCMYOMHOSAAHA-MJGOQNOKSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@H](Cc1ccsc1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000544010201 341066308 /nfs/dbraw/zinc/06/63/08/341066308.db2.gz ZMJBUEPCJOCTGO-IEBWSBKVSA-N 2 1 320.546 4.123 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000131219332 341066624 /nfs/dbraw/zinc/06/66/24/341066624.db2.gz QLPYIFJPWRNFGN-YZGWKJHDSA-N 2 1 300.490 4.033 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142034 341072036 /nfs/dbraw/zinc/07/20/36/341072036.db2.gz IHFWTZMFVHBZJZ-MJGOQNOKSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142034 341072037 /nfs/dbraw/zinc/07/20/37/341072037.db2.gz IHFWTZMFVHBZJZ-MJGOQNOKSA-N 2 1 318.892 4.278 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H]2CCc3ccc(Cl)cc32)CC1 ZINC000544146475 341072384 /nfs/dbraw/zinc/07/23/84/341072384.db2.gz RQEWVSSHMKQBPL-IBGZPJMESA-N 2 1 320.908 4.380 20 0 DIADMP CCCCC[C@H]1CCC[N@H+]1Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000544347079 341077170 /nfs/dbraw/zinc/07/71/70/341077170.db2.gz DNERIOVYASZKFC-SFHVURJKSA-N 2 1 312.461 4.120 20 0 DIADMP CCC(CC)(C[NH2+][C@H](C)[C@@H]1CCCO1)[NH2+][C@H](C)c1ccccc1 ZINC000544355441 341077850 /nfs/dbraw/zinc/07/78/50/341077850.db2.gz GHRGNFZZQDCFDG-LMMKCTJWSA-N 2 1 318.505 4.053 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]C(c1ccccc1C)c1ccccc1C ZINC000544895629 341097934 /nfs/dbraw/zinc/09/79/34/341097934.db2.gz JHCQYWGACHOXAW-UHFFFAOYSA-N 2 1 319.452 4.188 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000131832981 341112525 /nfs/dbraw/zinc/11/25/25/341112525.db2.gz VNXVRJCMXNJUGZ-NQIIRXRSSA-N 2 1 322.496 4.281 20 0 DIADMP CCCCOCCC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000132028768 341115125 /nfs/dbraw/zinc/11/51/25/341115125.db2.gz JVXYAAYTHRAXOE-MRXNPFEDSA-N 2 1 315.461 4.038 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+]C3CC[NH+](C4CC4)CC3)c2)cc1 ZINC000073381029 341115943 /nfs/dbraw/zinc/11/59/43/341115943.db2.gz ODQBDCLNMRCASV-UHFFFAOYSA-N 2 1 322.452 4.195 20 0 DIADMP Cc1ccc([C@H](N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc2)cc1 ZINC000133947732 341202352 /nfs/dbraw/zinc/20/23/52/341202352.db2.gz PSAWBKZVMPEDJM-DUXKGJEZSA-N 2 1 308.469 4.157 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CCN(C)[C@H](C)C2)c2ccccc2)cc1 ZINC000133947732 341202353 /nfs/dbraw/zinc/20/23/53/341202353.db2.gz PSAWBKZVMPEDJM-DUXKGJEZSA-N 2 1 308.469 4.157 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547399208 341211285 /nfs/dbraw/zinc/21/12/85/341211285.db2.gz NUKYIRQBPWBWKZ-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000237601698 341216464 /nfs/dbraw/zinc/21/64/64/341216464.db2.gz CPZQVZPGUOAQQD-OXJNMPFZSA-N 2 1 312.457 4.190 20 0 DIADMP C[C@H]([NH2+]C1CCC(F)(F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547827888 341235722 /nfs/dbraw/zinc/23/57/22/341235722.db2.gz XKCBKJBUKKILDY-RDJZCZTQSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154533 341249850 /nfs/dbraw/zinc/24/98/50/341249850.db2.gz ABLJTDIIFPXQCF-ZULIPRJHSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481936 341263201 /nfs/dbraw/zinc/26/32/01/341263201.db2.gz VPYZXKJICQIKDI-SZMVWBNQSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCC[C@H]3C[C@H]32)C[N@H+]1Cc1ccccc1 ZINC000548884884 341279832 /nfs/dbraw/zinc/27/98/32/341279832.db2.gz BJMWMVYEYUOVOO-RQSWOZRGSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245453176 341294947 /nfs/dbraw/zinc/29/49/47/341294947.db2.gz FHVSVSVNERQYDM-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000549613285 341299048 /nfs/dbraw/zinc/29/90/48/341299048.db2.gz CXINAQDYMHWCOL-ZFMNYDKASA-N 2 1 314.517 4.136 20 0 DIADMP Fc1ccccc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245701855 341310567 /nfs/dbraw/zinc/31/05/67/341310567.db2.gz LTXDZLCSJFRGHI-OWZKRDHZSA-N 2 1 324.443 4.111 20 0 DIADMP Fc1ccccc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245701855 341310568 /nfs/dbraw/zinc/31/05/68/341310568.db2.gz LTXDZLCSJFRGHI-OWZKRDHZSA-N 2 1 324.443 4.111 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550619951 341319673 /nfs/dbraw/zinc/31/96/73/341319673.db2.gz RIRHYKSHPUFVPZ-VBSBHUPXSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550619951 341319674 /nfs/dbraw/zinc/31/96/74/341319674.db2.gz RIRHYKSHPUFVPZ-VBSBHUPXSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000550624691 341319786 /nfs/dbraw/zinc/31/97/86/341319786.db2.gz XTRLYDFMHGNYTP-YYWHXJBOSA-N 2 1 308.469 4.481 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000550624691 341319787 /nfs/dbraw/zinc/31/97/87/341319787.db2.gz XTRLYDFMHGNYTP-YYWHXJBOSA-N 2 1 308.469 4.481 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550662007 341320818 /nfs/dbraw/zinc/32/08/18/341320818.db2.gz NBRWTKYWAZEIIN-FCHUYYIVSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550662007 341320819 /nfs/dbraw/zinc/32/08/19/341320819.db2.gz NBRWTKYWAZEIIN-FCHUYYIVSA-N 2 1 322.496 4.271 20 0 DIADMP C[C@@H](C1CC1)[NH+](C)Cc1cccc(C[N@H+](C)[C@@H](C)C2CC2)c1 ZINC000550681197 341321341 /nfs/dbraw/zinc/32/13/41/341321341.db2.gz LXMZJRUNIPVFQF-HOTGVXAUSA-N 2 1 300.490 4.147 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550700135 341321550 /nfs/dbraw/zinc/32/15/50/341321550.db2.gz BZSCFZINPAZSCZ-FNAHDJPLSA-N 2 1 320.480 4.043 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550700135 341321551 /nfs/dbraw/zinc/32/15/51/341321551.db2.gz BZSCFZINPAZSCZ-FNAHDJPLSA-N 2 1 320.480 4.043 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550700286 341321581 /nfs/dbraw/zinc/32/15/81/341321581.db2.gz CUQSOSKJPHUAGK-COPCDDAFSA-N 2 1 320.480 4.407 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550700286 341321582 /nfs/dbraw/zinc/32/15/82/341321582.db2.gz CUQSOSKJPHUAGK-COPCDDAFSA-N 2 1 320.480 4.407 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000550700137 341321663 /nfs/dbraw/zinc/32/16/63/341321663.db2.gz BZSCFZINPAZSCZ-MBDNFAEBSA-N 2 1 320.480 4.043 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000550700137 341321664 /nfs/dbraw/zinc/32/16/64/341321664.db2.gz BZSCFZINPAZSCZ-MBDNFAEBSA-N 2 1 320.480 4.043 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2CCC(F)(F)CC2)C[C@H]1c1ccccc1 ZINC000550797655 341323317 /nfs/dbraw/zinc/32/33/17/341323317.db2.gz UHOKGAJAZWSBNK-MSOLQXFVSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2CCC(F)(F)CC2)C[C@H]1c1ccccc1 ZINC000550797655 341323318 /nfs/dbraw/zinc/32/33/18/341323318.db2.gz UHOKGAJAZWSBNK-MSOLQXFVSA-N 2 1 322.443 4.237 20 0 DIADMP CC1=CC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931759 341327090 /nfs/dbraw/zinc/32/70/90/341327090.db2.gz UUHILTRPIGJGDA-UXHICEINSA-N 2 1 312.501 4.376 20 0 DIADMP CC1=CC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931759 341327091 /nfs/dbraw/zinc/32/70/91/341327091.db2.gz UUHILTRPIGJGDA-UXHICEINSA-N 2 1 312.501 4.376 20 0 DIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551010300 341329183 /nfs/dbraw/zinc/32/91/83/341329183.db2.gz ZRXOXWKIQNTPGD-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000551010300 341329184 /nfs/dbraw/zinc/32/91/84/341329184.db2.gz ZRXOXWKIQNTPGD-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3F)C[C@@H]1c1ccccc1 ZINC000551013900 341329201 /nfs/dbraw/zinc/32/92/01/341329201.db2.gz FWVJYMCBRAXJHM-ORYQWCPZSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3F)C[C@@H]1c1ccccc1 ZINC000551013900 341329202 /nfs/dbraw/zinc/32/92/02/341329202.db2.gz FWVJYMCBRAXJHM-ORYQWCPZSA-N 2 1 324.443 4.238 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551015336 341329346 /nfs/dbraw/zinc/32/93/46/341329346.db2.gz WIGJQRVVOAVOLD-BWAGFHJFSA-N 2 1 322.496 4.351 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551015336 341329347 /nfs/dbraw/zinc/32/93/47/341329347.db2.gz WIGJQRVVOAVOLD-BWAGFHJFSA-N 2 1 322.496 4.351 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(C3CC3)c2)C1 ZINC000551030145 341329714 /nfs/dbraw/zinc/32/97/14/341329714.db2.gz YHTYDGUWUKKAFE-DLBZAZTESA-N 2 1 300.490 4.335 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551083648 341331086 /nfs/dbraw/zinc/33/10/86/341331086.db2.gz KIJLJIPUOOOWKP-LDQXTDLNSA-N 2 1 323.484 4.130 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551083648 341331087 /nfs/dbraw/zinc/33/10/87/341331087.db2.gz KIJLJIPUOOOWKP-LDQXTDLNSA-N 2 1 323.484 4.130 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2C2CCCCC2)C[C@H]1c1ccccc1 ZINC000551086015 341331200 /nfs/dbraw/zinc/33/12/00/341331200.db2.gz LOIINUSQXGIERH-BURNTYAHSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2C2CCCCC2)C[C@H]1c1ccccc1 ZINC000551086015 341331201 /nfs/dbraw/zinc/33/12/01/341331201.db2.gz LOIINUSQXGIERH-BURNTYAHSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@H]1c1ccccc1 ZINC000551176743 341333172 /nfs/dbraw/zinc/33/31/72/341333172.db2.gz CTWBOECGXNFULL-CABCVRRESA-N 2 1 314.395 4.000 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@H]1c1ccccc1 ZINC000551176743 341333173 /nfs/dbraw/zinc/33/31/73/341333173.db2.gz CTWBOECGXNFULL-CABCVRRESA-N 2 1 314.395 4.000 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000551301046 341337717 /nfs/dbraw/zinc/33/77/17/341337717.db2.gz CLLLDDLZMPQYRU-CEXWTWQISA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000551301046 341337718 /nfs/dbraw/zinc/33/77/18/341337718.db2.gz CLLLDDLZMPQYRU-CEXWTWQISA-N 2 1 300.490 4.238 20 0 DIADMP FCCCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000551700450 341349311 /nfs/dbraw/zinc/34/93/11/341349311.db2.gz ZAADFSBCHIBMAI-VQTJNVASSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2)c2cccs2)CC[N@@H+]1C ZINC000246541663 341353374 /nfs/dbraw/zinc/35/33/74/341353374.db2.gz VZNIFLYHZMXPRX-BPQIPLTHSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2)c2cccs2)CC[N@H+]1C ZINC000246541663 341353375 /nfs/dbraw/zinc/35/33/75/341353375.db2.gz VZNIFLYHZMXPRX-BPQIPLTHSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccco1 ZINC000246847437 341357856 /nfs/dbraw/zinc/35/78/56/341357856.db2.gz CKHFNKNBCVPSDI-IAGOWNOFSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccoc1 ZINC000247048987 341360238 /nfs/dbraw/zinc/36/02/38/341360238.db2.gz MCDXQJCUKWWSNN-PFRQMTDMSA-N 2 1 312.457 4.087 20 0 DIADMP C[C@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccoc1 ZINC000247048987 341360239 /nfs/dbraw/zinc/36/02/39/341360239.db2.gz MCDXQJCUKWWSNN-PFRQMTDMSA-N 2 1 312.457 4.087 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cnc3ccsc3c2)C1 ZINC000247149041 341361573 /nfs/dbraw/zinc/36/15/73/341361573.db2.gz WXABMYMWGHVBJY-HUUCEWRRSA-N 2 1 317.502 4.067 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000552043366 341364513 /nfs/dbraw/zinc/36/45/13/341364513.db2.gz JXQHRKXDGAWYNZ-UXPWSPDFSA-N 2 1 300.490 4.236 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000552251059 341381366 /nfs/dbraw/zinc/38/13/66/341381366.db2.gz JMIIKAXCOYODHA-MUQADHOPSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000552251059 341381367 /nfs/dbraw/zinc/38/13/67/341381367.db2.gz JMIIKAXCOYODHA-MUQADHOPSA-N 2 1 306.519 4.155 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3ccc(C)cc3C)CC2)[nH+]c1 ZINC000163511974 341699272 /nfs/dbraw/zinc/69/92/72/341699272.db2.gz GEXKCLUDONIOPM-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+][C@H](C)c1nccc2ccccc21 ZINC000574086884 341748086 /nfs/dbraw/zinc/74/80/86/341748086.db2.gz RZQBEJMOJVYZEK-QGZVFWFLSA-N 2 1 313.489 4.398 20 0 DIADMP C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)o1 ZINC000192710331 341883055 /nfs/dbraw/zinc/88/30/55/341883055.db2.gz WRAUAARUSKCDKT-OXJNMPFZSA-N 2 1 324.468 4.289 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@H]2C[C@@H](C)Sc3sccc32)CC1 ZINC000336835696 521007533 /nfs/dbraw/zinc/00/75/33/521007533.db2.gz ATAPEOYKROYVEQ-ZBFHGGJFSA-N 2 1 324.559 4.385 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)CC1 ZINC000336835695 521008768 /nfs/dbraw/zinc/00/87/68/521008768.db2.gz ATAPEOYKROYVEQ-GDBMZVCRSA-N 2 1 324.559 4.385 20 0 DIADMP C[C@H](C[NH2+][C@H]1C[C@@H](C)Sc2sccc21)C[NH+]1CCCCC1 ZINC000336839955 524504698 /nfs/dbraw/zinc/50/46/98/524504698.db2.gz LKYQFWROZYGJBH-FMKPAKJESA-N 2 1 324.559 4.385 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1csc(Cl)c1 ZINC000191328260 525401746 /nfs/dbraw/zinc/40/17/46/525401746.db2.gz SGKWQQFSWAVJEE-GFCCVEGCSA-N 2 1 312.910 4.459 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccccn1 ZINC000158640234 525439949 /nfs/dbraw/zinc/43/99/49/525439949.db2.gz SGLKHLSZNUEKDO-ROUUACIJSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000158651415 525462837 /nfs/dbraw/zinc/46/28/37/525462837.db2.gz FOHQHSLNNYYOSI-MSOLQXFVSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000158651415 525462842 /nfs/dbraw/zinc/46/28/42/525462842.db2.gz FOHQHSLNNYYOSI-MSOLQXFVSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccncc1 ZINC000266423632 525537721 /nfs/dbraw/zinc/53/77/21/525537721.db2.gz BJHBSFUDZHRFDQ-QZTJIDSGSA-N 2 1 323.484 4.164 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1F ZINC000178699478 526060316 /nfs/dbraw/zinc/06/03/16/526060316.db2.gz FKTSOLCNEWGKQV-CHWSQXEVSA-N 2 1 321.465 4.039 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000338015054 527422578 /nfs/dbraw/zinc/42/25/78/527422578.db2.gz VQUPFRAOJSPOGT-LLVKDONJSA-N 2 1 312.244 4.239 20 0 DIADMP CC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1cccc(C)c1 ZINC000286222808 535805648 /nfs/dbraw/zinc/80/56/48/535805648.db2.gz SMDJAXGOAKDUNR-LJQANCHMSA-N 2 1 320.440 4.125 20 0 DIADMP CCCCCOc1ccc(C[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)cc1 ZINC000319960745 1035577464 /nfs/dbraw/zinc/57/74/64/1035577464.db2.gz BBBOFWDSKZXBLS-IBGZPJMESA-N 2 1 318.505 4.076 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC ZINC000643546509 1035592751 /nfs/dbraw/zinc/59/27/51/1035592751.db2.gz PRJVGYHYVMNCAX-GDBMZVCRSA-N 2 1 322.880 4.064 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1F ZINC000643547314 1035603468 /nfs/dbraw/zinc/60/34/68/1035603468.db2.gz CQRMCWOBABUDKS-SWLSCSKDSA-N 2 1 310.844 4.195 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(-c2ccccc2)s1 ZINC000530460131 1035622660 /nfs/dbraw/zinc/62/26/60/1035622660.db2.gz GSZUSKDNLGOGRL-CQSZACIVSA-N 2 1 311.454 4.042 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ccccc2C)CC1 ZINC001167078743 1035806912 /nfs/dbraw/zinc/80/69/12/1035806912.db2.gz UBPVLSNUTIWUDT-SFHVURJKSA-N 2 1 302.506 4.500 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(c2ccccc2C)CC1 ZINC000179426141 1035874112 /nfs/dbraw/zinc/87/41/12/1035874112.db2.gz ZOXBQEGHAMRHGR-UHFFFAOYSA-N 2 1 311.473 4.160 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1 ZINC000339682890 1035914375 /nfs/dbraw/zinc/91/43/75/1035914375.db2.gz MSEQVWOXHCIPBU-LSDHHAIUSA-N 2 1 317.502 4.290 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000314916512 1035930050 /nfs/dbraw/zinc/93/00/50/1035930050.db2.gz MLUXUGMOIVXOOP-RLLQIKCJSA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)CCC2 ZINC000535621408 1035978436 /nfs/dbraw/zinc/97/84/36/1035978436.db2.gz LRBSBKWVWZSXHQ-JXFKEZNVSA-N 2 1 300.490 4.119 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094739 1036032934 /nfs/dbraw/zinc/03/29/34/1036032934.db2.gz DYSVGNIALINBBH-AVRDEDQJSA-N 2 1 320.480 4.158 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094739 1036032957 /nfs/dbraw/zinc/03/29/57/1036032957.db2.gz DYSVGNIALINBBH-AVRDEDQJSA-N 2 1 320.480 4.158 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094720 1036034182 /nfs/dbraw/zinc/03/41/82/1036034182.db2.gz DYSVGNIALINBBH-PGRDOPGGSA-N 2 1 320.480 4.158 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094720 1036034197 /nfs/dbraw/zinc/03/41/97/1036034197.db2.gz DYSVGNIALINBBH-PGRDOPGGSA-N 2 1 320.480 4.158 20 0 DIADMP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(Cl)o1 ZINC000037488901 1036087386 /nfs/dbraw/zinc/08/73/86/1036087386.db2.gz OWYYSLLISCHVAP-UHFFFAOYSA-N 2 1 306.837 4.065 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]CCC3CCCCC3)CC2)cc1 ZINC000107788605 1036221370 /nfs/dbraw/zinc/22/13/70/1036221370.db2.gz YRJPNVIXVSYTTN-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001648802468 1036374487 /nfs/dbraw/zinc/37/44/87/1036374487.db2.gz JYUJPCVAWVJCLJ-FUHIMQAGSA-N 2 1 302.506 4.441 20 0 DIADMP Clc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000237678520 1036396276 /nfs/dbraw/zinc/39/62/76/1036396276.db2.gz GRPXKVXKDLMUGY-UHFFFAOYSA-N 2 1 306.881 4.227 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C2CCCCCC2)CC1 ZINC000237729458 1036401719 /nfs/dbraw/zinc/40/17/19/1036401719.db2.gz RDOXOEZIDYHJCY-UHFFFAOYSA-N 2 1 300.490 4.272 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CC(C)(C)C[C@H]1C ZINC001648805487 1036409210 /nfs/dbraw/zinc/40/92/10/1036409210.db2.gz SHNPVQRVTZUMSZ-VQIMIIECSA-N 2 1 302.506 4.441 20 0 DIADMP C1C[C@H]2C[C@@H]([NH2+]C3CCC(C4CCCCC4)CC3)CC[N@H+]2C1 ZINC000683471382 1036422483 /nfs/dbraw/zinc/42/24/83/1036422483.db2.gz HBSFVDZUHOCTJO-GUMHCPJTSA-N 2 1 304.522 4.342 20 0 DIADMP C1C[C@@H]2C[C@H]([NH2+]C3CCC(C4CCCCC4)CC3)CC[N@H+]2C1 ZINC000683471383 1036423033 /nfs/dbraw/zinc/42/30/33/1036423033.db2.gz HBSFVDZUHOCTJO-NTFDOXNWSA-N 2 1 304.522 4.342 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000324627464 1036426958 /nfs/dbraw/zinc/42/69/58/1036426958.db2.gz PSOPVDBIFBAKOW-KKSFZXQISA-N 2 1 318.464 4.220 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cccc3ccoc32)C1 ZINC001648811618 1036494172 /nfs/dbraw/zinc/49/41/72/1036494172.db2.gz RSRSUIKTGWPPPX-CALCHBBNSA-N 2 1 314.473 4.281 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@@H](C)SC2)CC1 ZINC000655715597 1036499276 /nfs/dbraw/zinc/49/92/76/1036499276.db2.gz MHNAUUORDCBPHQ-JTDSTZFVSA-N 2 1 318.530 4.086 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(-c2ccccc2)o1 ZINC000121518157 1036582293 /nfs/dbraw/zinc/58/22/93/1036582293.db2.gz WFSWBLWHKTXKKB-CVEARBPZSA-N 2 1 323.440 4.438 20 0 DIADMP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174580 1036630487 /nfs/dbraw/zinc/63/04/87/1036630487.db2.gz ATKKUKQASXQGRR-VXGBXAGGSA-N 2 1 308.878 4.114 20 0 DIADMP C[C@@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174580 1036630496 /nfs/dbraw/zinc/63/04/96/1036630496.db2.gz ATKKUKQASXQGRR-VXGBXAGGSA-N 2 1 308.878 4.114 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000340467250 1036679695 /nfs/dbraw/zinc/67/96/95/1036679695.db2.gz ZGNJAISZWGTOQD-HNNXBMFYSA-N 2 1 324.472 4.019 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000291420301 1036939704 /nfs/dbraw/zinc/93/97/04/1036939704.db2.gz HTVGEZYWIFALSJ-INIZCTEOSA-N 2 1 324.255 4.010 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000580103890 1036955055 /nfs/dbraw/zinc/95/50/55/1036955055.db2.gz UFRQDWGWBXAHHG-LEWJYISDSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000580103890 1036955068 /nfs/dbraw/zinc/95/50/68/1036955068.db2.gz UFRQDWGWBXAHHG-LEWJYISDSA-N 2 1 308.469 4.044 20 0 DIADMP CCCC(CCC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398022338 1037085066 /nfs/dbraw/zinc/08/50/66/1037085066.db2.gz KQBBNHXVXALLQB-YLJYHZDGSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC(CCC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398022338 1037085084 /nfs/dbraw/zinc/08/50/84/1037085084.db2.gz KQBBNHXVXALLQB-YLJYHZDGSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398041108 1037108084 /nfs/dbraw/zinc/10/80/84/1037108084.db2.gz RWVJKFRAKGYXJQ-WSTZPKSXSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398041108 1037108092 /nfs/dbraw/zinc/10/80/92/1037108092.db2.gz RWVJKFRAKGYXJQ-WSTZPKSXSA-N 2 1 302.506 4.455 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398039726 1037108835 /nfs/dbraw/zinc/10/88/35/1037108835.db2.gz RHVJBVBOFDXTKA-LNXHZJMOSA-N 2 1 300.490 4.065 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398039726 1037108839 /nfs/dbraw/zinc/10/88/39/1037108839.db2.gz RHVJBVBOFDXTKA-LNXHZJMOSA-N 2 1 300.490 4.065 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000580500976 1037170056 /nfs/dbraw/zinc/17/00/56/1037170056.db2.gz GXQKKLZJEJKSBV-WLYUNCDWSA-N 2 1 308.432 4.065 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000580500976 1037170064 /nfs/dbraw/zinc/17/00/64/1037170064.db2.gz GXQKKLZJEJKSBV-WLYUNCDWSA-N 2 1 308.432 4.065 20 0 DIADMP CC(C)C1(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC001204543515 1037207270 /nfs/dbraw/zinc/20/72/70/1037207270.db2.gz RGKMFVIUBRWSMS-UHFFFAOYSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C[C@H]1C ZINC000398227122 1037296052 /nfs/dbraw/zinc/29/60/52/1037296052.db2.gz YIEOCDFQGJHQAK-AJGRXUDCSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C[C@H]1C ZINC000398227122 1037296072 /nfs/dbraw/zinc/29/60/72/1037296072.db2.gz YIEOCDFQGJHQAK-AJGRXUDCSA-N 2 1 314.517 4.311 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[N@@H+]2CC2CCCC2)cc1 ZINC000656401155 1037442909 /nfs/dbraw/zinc/44/29/09/1037442909.db2.gz AJYIUYCMKSMVPX-CBPXPLCBSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2CC2CCCC2)cc1 ZINC000656401155 1037442915 /nfs/dbraw/zinc/44/29/15/1037442915.db2.gz AJYIUYCMKSMVPX-CBPXPLCBSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2CC2CCCC2)cc1 ZINC000656401155 1037442923 /nfs/dbraw/zinc/44/29/23/1037442923.db2.gz AJYIUYCMKSMVPX-CBPXPLCBSA-N 2 1 324.512 4.019 20 0 DIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cc4ccccc4s3)C2)CC1 ZINC000581515832 1037704081 /nfs/dbraw/zinc/70/40/81/1037704081.db2.gz KSFBGHPUHMWRMU-QGZVFWFLSA-N 2 1 314.498 4.065 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477558 1037886343 /nfs/dbraw/zinc/88/63/43/1037886343.db2.gz GHEOGMNNRANONF-XLIONFOSSA-N 2 1 311.473 4.134 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477558 1037886358 /nfs/dbraw/zinc/88/63/58/1037886358.db2.gz GHEOGMNNRANONF-XLIONFOSSA-N 2 1 311.473 4.134 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)s1 ZINC000090402691 1037905370 /nfs/dbraw/zinc/90/53/70/1037905370.db2.gz KDIQDRSFEJQMLG-AWEZNQCLSA-N 2 1 317.502 4.143 20 0 DIADMP CCCC[C@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(OC)cc1 ZINC000341796738 1038270015 /nfs/dbraw/zinc/27/00/15/1038270015.db2.gz JEKXZKZYGLUGAL-MJGOQNOKSA-N 2 1 304.478 4.000 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](CC(C)C)c1ccc(Cl)cc1 ZINC000341878231 1038308559 /nfs/dbraw/zinc/30/85/59/1038308559.db2.gz MJVJVVFTENZQJU-QGZVFWFLSA-N 2 1 305.853 4.222 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)C1 ZINC000535777956 1038333315 /nfs/dbraw/zinc/33/33/15/1038333315.db2.gz HMEXUGOXLVQFCW-KBPBESRZSA-N 2 1 312.860 4.250 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc(C)sc1C ZINC000623854927 1038475834 /nfs/dbraw/zinc/47/58/34/1038475834.db2.gz MOQAMLBEMSBKKA-SFHVURJKSA-N 2 1 306.519 4.423 20 0 DIADMP C[C@H]1c2ccc(F)cc2CC[N@@H+]1Cc1ccc(-n2ccnc2)cc1 ZINC000606449231 1038603688 /nfs/dbraw/zinc/60/36/88/1038603688.db2.gz QTPNEGSZCVIRQQ-HNNXBMFYSA-N 2 1 321.399 4.131 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468235174 1038661612 /nfs/dbraw/zinc/66/16/12/1038661612.db2.gz OVKXWAXHNFZCCT-BEFAXECRSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468235174 1038661614 /nfs/dbraw/zinc/66/16/14/1038661614.db2.gz OVKXWAXHNFZCCT-BEFAXECRSA-N 2 1 318.892 4.278 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCC(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000647252555 1038683252 /nfs/dbraw/zinc/68/32/52/1038683252.db2.gz JWCKPVHJFPTVEH-OQUMVOOASA-N 2 1 318.480 4.157 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCC(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000647252555 1038683258 /nfs/dbraw/zinc/68/32/58/1038683258.db2.gz JWCKPVHJFPTVEH-OQUMVOOASA-N 2 1 318.480 4.157 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC001167599813 1038761073 /nfs/dbraw/zinc/76/10/73/1038761073.db2.gz ZSCLTQRZXWFYOP-LJQANCHMSA-N 2 1 322.496 4.312 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001167599813 1038761081 /nfs/dbraw/zinc/76/10/81/1038761081.db2.gz ZSCLTQRZXWFYOP-LJQANCHMSA-N 2 1 322.496 4.312 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001167599813 1038761090 /nfs/dbraw/zinc/76/10/90/1038761090.db2.gz ZSCLTQRZXWFYOP-LJQANCHMSA-N 2 1 322.496 4.312 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000608061573 1038761772 /nfs/dbraw/zinc/76/17/72/1038761772.db2.gz ZBDFHWPUAVWLRR-CZUORRHYSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000608061573 1038761775 /nfs/dbraw/zinc/76/17/75/1038761775.db2.gz ZBDFHWPUAVWLRR-CZUORRHYSA-N 2 1 318.461 4.127 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H](C)Cn2cc[nH+]c2C)C2CCCC2)o1 ZINC000342801233 1038804595 /nfs/dbraw/zinc/80/45/95/1038804595.db2.gz CKUAGWPMIATGFD-AUUYWEPGSA-N 2 1 315.461 4.250 20 0 DIADMP C(=C/C[N@H+]1CCC[C@@H]2CCC[C@@H]21)\C[NH+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564644 1038884672 /nfs/dbraw/zinc/88/46/72/1038884672.db2.gz QAJOHXAQOOHVRW-NOXBIZALSA-N 2 1 302.506 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000342856617 1038920597 /nfs/dbraw/zinc/92/05/97/1038920597.db2.gz GDQPALGELJMLSD-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000342856617 1038920607 /nfs/dbraw/zinc/92/06/07/1038920607.db2.gz GDQPALGELJMLSD-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000342862801 1038926807 /nfs/dbraw/zinc/92/68/07/1038926807.db2.gz DHEQUGCHKWOBTA-AWEZNQCLSA-N 2 1 317.864 4.461 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000342862801 1038926826 /nfs/dbraw/zinc/92/68/26/1038926826.db2.gz DHEQUGCHKWOBTA-AWEZNQCLSA-N 2 1 317.864 4.461 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C1CC1)C1CC(c2ccccc2C)C1 ZINC000342858859 1038927517 /nfs/dbraw/zinc/92/75/17/1038927517.db2.gz HBCFNVHQYKHYRR-UHFFFAOYSA-N 2 1 323.484 4.301 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C1CC1)C1CC(c2ccccc2C)C1 ZINC000342858859 1038927527 /nfs/dbraw/zinc/92/75/27/1038927527.db2.gz HBCFNVHQYKHYRR-UHFFFAOYSA-N 2 1 323.484 4.301 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC000657713590 1039068400 /nfs/dbraw/zinc/06/84/00/1039068400.db2.gz HYOUPXQSGBUVDX-FGZHOGPDSA-N 2 1 320.480 4.187 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH+]2CCC(Cc3ccccc3)CC2)c2ccccc21 ZINC000261618823 1039089292 /nfs/dbraw/zinc/08/92/92/1039089292.db2.gz BWTIBKQWHXCFSB-NHCUHLMSSA-N 2 1 306.453 4.086 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150766373 1039148314 /nfs/dbraw/zinc/14/83/14/1039148314.db2.gz IKJHXOPAXCPEIA-QGZVFWFLSA-N 2 1 318.464 4.174 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000539499530 1039272179 /nfs/dbraw/zinc/27/21/79/1039272179.db2.gz GVAXIUWQDQAHJV-YJBOKZPZSA-N 2 1 306.469 4.234 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)CC[N@@H+]1C ZINC000539558578 1039288433 /nfs/dbraw/zinc/28/84/33/1039288433.db2.gz KOBOZIKTTJWHMK-YYAJDYIMSA-N 2 1 312.501 4.359 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)CC[N@H+]1C ZINC000539558578 1039288445 /nfs/dbraw/zinc/28/84/45/1039288445.db2.gz KOBOZIKTTJWHMK-YYAJDYIMSA-N 2 1 312.501 4.359 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2o1 ZINC000539556431 1039290667 /nfs/dbraw/zinc/29/06/67/1039290667.db2.gz DUQVTMLOMOQIPR-YWZLYKJASA-N 2 1 312.457 4.204 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2o1 ZINC000539556429 1039291264 /nfs/dbraw/zinc/29/12/64/1039291264.db2.gz DUQVTMLOMOQIPR-MGPUTAFESA-N 2 1 312.457 4.204 20 0 DIADMP Cc1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)o1 ZINC000539900231 1039385740 /nfs/dbraw/zinc/38/57/40/1039385740.db2.gz OOTNQRYRKVKIQD-PZJWPPBQSA-N 2 1 324.468 4.075 20 0 DIADMP Cc1ccncc1[C@@H](C)[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000540083031 1039415682 /nfs/dbraw/zinc/41/56/82/1039415682.db2.gz IJYQOLCMYPJEIP-QZTJIDSGSA-N 2 1 323.484 4.266 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C)c1ccc(Cl)cc1 ZINC000540189084 1039441111 /nfs/dbraw/zinc/44/11/11/1039441111.db2.gz WUNXEYHDASXHFD-RUAUHYFQSA-N 2 1 320.908 4.355 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000540302065 1039468502 /nfs/dbraw/zinc/46/85/02/1039468502.db2.gz ORQHNXITOZOUTE-INIZCTEOSA-N 2 1 324.255 4.239 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C ZINC000540521497 1039512332 /nfs/dbraw/zinc/51/23/32/1039512332.db2.gz RHFWTQKAQHQZNE-MORSLUCNSA-N 2 1 317.864 4.222 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000540653103 1039535371 /nfs/dbraw/zinc/53/53/71/1039535371.db2.gz QWGOEGDTNKNSCC-OXJNMPFZSA-N 2 1 314.473 4.451 20 0 DIADMP C[C@@H](C[NH2+]CC1=CC[N@@H+](C)CC1)Cc1ccc(C(C)(C)C)cc1 ZINC000540644940 1039537997 /nfs/dbraw/zinc/53/79/97/1039537997.db2.gz STIJCKLIMOZZEG-QGZVFWFLSA-N 2 1 314.517 4.014 20 0 DIADMP C[C@@H](CC[NH2+][C@H]1CCSc2c(F)cccc21)[NH+]1CCCCC1 ZINC000346872544 1039579511 /nfs/dbraw/zinc/57/95/11/1039579511.db2.gz NJLRNIHTVCPBPT-YOEHRIQHSA-N 2 1 322.493 4.217 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCCC[C@@H]2c2ccccc2Cl)CC1 ZINC000657823902 1039587301 /nfs/dbraw/zinc/58/73/01/1039587301.db2.gz PYRVQSMELVHRBH-SJLPKXTDSA-N 2 1 306.881 4.050 20 0 DIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)C1CCC([NH3+])CC1 ZINC000091844695 1039628402 /nfs/dbraw/zinc/62/84/02/1039628402.db2.gz WHSXRIMEODUQTI-UHFFFAOYSA-N 2 1 318.408 4.000 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349807 1039672568 /nfs/dbraw/zinc/67/25/68/1039672568.db2.gz UMWDSZBXNIVXFE-DNVCBOLYSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349807 1039672574 /nfs/dbraw/zinc/67/25/74/1039672574.db2.gz UMWDSZBXNIVXFE-DNVCBOLYSA-N 2 1 318.892 4.135 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+](CC(C)C)CC2)C2CCC2)o1 ZINC000541746622 1039731953 /nfs/dbraw/zinc/73/19/53/1039731953.db2.gz KHBNVXIQCUPDOK-LJQANCHMSA-N 2 1 304.478 4.139 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(C)oc2C)c1 ZINC000278765122 1039758549 /nfs/dbraw/zinc/75/85/49/1039758549.db2.gz OUOUGWHHDPUKLP-HNNXBMFYSA-N 2 1 300.446 4.199 20 0 DIADMP C(=C/[C@@H]1CCCCC[N@@H+]1CCC[NH+]1CCCC1)\c1cccs1 ZINC000542134551 1039798788 /nfs/dbraw/zinc/79/87/88/1039798788.db2.gz RSYYTUJEYVTNSI-ZGKFYVQTSA-N 2 1 318.530 4.492 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccnc1 ZINC000091261553 1039836671 /nfs/dbraw/zinc/83/66/71/1039836671.db2.gz SGKVZNWSEWHGRZ-OAQYLSRUSA-N 2 1 323.484 4.033 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](c2ccccc2OC)C2CCCC2)CC1 ZINC000091265302 1039839352 /nfs/dbraw/zinc/83/93/52/1039839352.db2.gz TUAPWPVYMTZDJY-FQEVSTJZSA-N 2 1 316.489 4.000 20 0 DIADMP Cc1cc2cc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)oc2cc1C ZINC000092072996 1039868116 /nfs/dbraw/zinc/86/81/16/1039868116.db2.gz OWJRVCFUIHQBNX-OAHLLOKOSA-N 2 1 309.413 4.152 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCSCC2)CC1 ZINC000657890625 1040042034 /nfs/dbraw/zinc/04/20/34/1040042034.db2.gz WFHURZDIOINQOU-AEFFLSMTSA-N 2 1 318.530 4.087 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCc3ccccc3CC2)C1 ZINC001648921156 1040053095 /nfs/dbraw/zinc/05/30/95/1040053095.db2.gz QOGJPVYOGLMBPA-QGZVFWFLSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCc3ccccc3CC2)C1 ZINC001648921156 1040053111 /nfs/dbraw/zinc/05/31/11/1040053111.db2.gz QOGJPVYOGLMBPA-QGZVFWFLSA-N 2 1 314.517 4.034 20 0 DIADMP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CCCCn1cc[nH+]c1C ZINC000657892413 1040080545 /nfs/dbraw/zinc/08/05/45/1040080545.db2.gz YQTJJRBWQSQVOI-SFHVURJKSA-N 2 1 319.880 4.236 20 0 DIADMP CCCC[C@H](CC)C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309546286 1040083697 /nfs/dbraw/zinc/08/36/97/1040083697.db2.gz BTNLSWBNGBVDDR-SFHVURJKSA-N 2 1 302.506 4.457 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000309573697 1040085191 /nfs/dbraw/zinc/08/51/91/1040085191.db2.gz DVOWEMRHWZRVLO-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC000309689064 1040088542 /nfs/dbraw/zinc/08/85/42/1040088542.db2.gz CITBNXRSTJCGNY-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309763117 1040093519 /nfs/dbraw/zinc/09/35/19/1040093519.db2.gz FHVIPDVUWZCXHC-FUHWJXTLSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000309868444 1040097084 /nfs/dbraw/zinc/09/70/84/1040097084.db2.gz QEZNLJWKXUKLJW-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)C(C)(C)C(F)F)[N@@H+](C)Cc1ccccc1 ZINC000657900927 1040099281 /nfs/dbraw/zinc/09/92/81/1040099281.db2.gz UPDGAVBJZBTWQX-GJZGRUSLSA-N 2 1 312.448 4.166 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309920837 1040100332 /nfs/dbraw/zinc/10/03/32/1040100332.db2.gz QQECRDPRORAZAK-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000309991085 1040102735 /nfs/dbraw/zinc/10/27/35/1040102735.db2.gz ZYAZUOOEKFOPGZ-AZUAARDMSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+]C3CCCCCC3)C2)cc1 ZINC000062426746 1040103464 /nfs/dbraw/zinc/10/34/64/1040103464.db2.gz ZJYPQWHANXJPRS-IBGZPJMESA-N 2 1 300.490 4.211 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000062426827 1040105132 /nfs/dbraw/zinc/10/51/32/1040105132.db2.gz NRVGJKGEFVAGAK-OAQYLSRUSA-N 2 1 322.496 4.305 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310080406 1040106763 /nfs/dbraw/zinc/10/67/63/1040106763.db2.gz IUPZTYZXKGEZJJ-YADHBBJMSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309708970 1040209585 /nfs/dbraw/zinc/20/95/85/1040209585.db2.gz IPPYKABIAARNQS-VQIMIIECSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1)C(C)(C)C(F)F ZINC000658001983 1040262937 /nfs/dbraw/zinc/26/29/37/1040262937.db2.gz DXXLICPPFRVXBH-HIFRSBDPSA-N 2 1 302.453 4.053 20 0 DIADMP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319475 1040419105 /nfs/dbraw/zinc/41/91/05/1040419105.db2.gz BZNBMSVMIPPNCZ-HKUYNNGSSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319475 1040419111 /nfs/dbraw/zinc/41/91/11/1040419111.db2.gz BZNBMSVMIPPNCZ-HKUYNNGSSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@H](C[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310216161 1040454050 /nfs/dbraw/zinc/45/40/50/1040454050.db2.gz VXUFANWVSJZGIG-KNQAVFIVSA-N 2 1 322.496 4.292 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C[C@@H](c2ccccc2)C1 ZINC000323308527 1040520619 /nfs/dbraw/zinc/52/06/19/1040520619.db2.gz FBCADAHGPGBHRP-ZULIPRJHSA-N 2 1 312.501 4.033 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753452 1040722621 /nfs/dbraw/zinc/72/26/21/1040722621.db2.gz WMRNPDMSBCLVKI-FUHWJXTLSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753452 1040722636 /nfs/dbraw/zinc/72/26/36/1040722636.db2.gz WMRNPDMSBCLVKI-FUHWJXTLSA-N 2 1 314.498 4.311 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309729513 1040724183 /nfs/dbraw/zinc/72/41/83/1040724183.db2.gz ONSYXNKVUHAMOK-VAMGGRTRSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000309770704 1040726520 /nfs/dbraw/zinc/72/65/20/1040726520.db2.gz HLESTOZNMPBWKV-JENIJYKNSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000414169227 1040949139 /nfs/dbraw/zinc/94/91/39/1040949139.db2.gz AWLDWWNNLFBNOP-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccncc2)c1 ZINC000414183158 1040967178 /nfs/dbraw/zinc/96/71/78/1040967178.db2.gz NPOIBAQUFSCXDM-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000414188370 1040973448 /nfs/dbraw/zinc/97/34/48/1040973448.db2.gz QPABJJCHHNGHIZ-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000613491323 1041004428 /nfs/dbraw/zinc/00/44/28/1041004428.db2.gz OIQKAKIXXPHVGV-DHZHZOJOSA-N 2 1 300.490 4.144 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]CCCC2CCCCC2)cn1 ZINC000809607457 1041192709 /nfs/dbraw/zinc/19/27/09/1041192709.db2.gz AAXIRCPWYNXIMJ-UHFFFAOYSA-N 2 1 312.461 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H](C[NH3+])C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC000423261123 1041211169 /nfs/dbraw/zinc/21/11/69/1041211169.db2.gz JBYJXNHVNIJLBP-QTISTPMNSA-N 2 1 320.443 4.241 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc[nH+]cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000301567222 1041246596 /nfs/dbraw/zinc/24/65/96/1041246596.db2.gz WQOTXYWSLCYTAK-ZBFHGGJFSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc[nH+]cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301567222 1041246610 /nfs/dbraw/zinc/24/66/10/1041246610.db2.gz WQOTXYWSLCYTAK-ZBFHGGJFSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@@H]1C[C@@H](Nc2nc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000301900374 1041255342 /nfs/dbraw/zinc/25/53/42/1041255342.db2.gz YZTWYLBVJXQJNG-WBVHZDCISA-N 2 1 320.440 4.028 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331150 1041272782 /nfs/dbraw/zinc/27/27/82/1041272782.db2.gz RKNBBPCJSVXWNK-AZUAARDMSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331150 1041272793 /nfs/dbraw/zinc/27/27/93/1041272793.db2.gz RKNBBPCJSVXWNK-AZUAARDMSA-N 2 1 323.484 4.035 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC001170594892 1041296337 /nfs/dbraw/zinc/29/63/37/1041296337.db2.gz YPOXSMFFTHONCO-OAQYLSRUSA-N 2 1 314.517 4.292 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1 ZINC001170594892 1041296347 /nfs/dbraw/zinc/29/63/47/1041296347.db2.gz YPOXSMFFTHONCO-OAQYLSRUSA-N 2 1 314.517 4.292 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC001170594892 1041296359 /nfs/dbraw/zinc/29/63/59/1041296359.db2.gz YPOXSMFFTHONCO-OAQYLSRUSA-N 2 1 314.517 4.292 20 0 DIADMP COc1cc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc2ccccc21 ZINC000924593137 1041340329 /nfs/dbraw/zinc/34/03/29/1041340329.db2.gz VVONZHKGINDPRS-OAHLLOKOSA-N 2 1 324.468 4.126 20 0 DIADMP CC1(C)CCC[C@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001203208315 1041369134 /nfs/dbraw/zinc/36/91/34/1041369134.db2.gz QXCPYCUAKGPVOY-IBGZPJMESA-N 2 1 314.517 4.457 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309689188 1041400230 /nfs/dbraw/zinc/40/02/30/1041400230.db2.gz CJOHQDDVUDPQNF-VAMGGRTRSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000659946059 1041554696 /nfs/dbraw/zinc/55/46/96/1041554696.db2.gz ZKJVALAHMIXLRF-UXHICEINSA-N 2 1 312.501 4.057 20 0 DIADMP CSc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)o1 ZINC000641712907 1041627094 /nfs/dbraw/zinc/62/70/94/1041627094.db2.gz QAGCMBWVUHKBBO-UHFFFAOYSA-N 2 1 318.486 4.132 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417313714 1041656570 /nfs/dbraw/zinc/65/65/70/1041656570.db2.gz WTDILZDMHKUBGO-VSZNYVQBSA-N 2 1 320.546 4.198 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417323104 1041658166 /nfs/dbraw/zinc/65/81/66/1041658166.db2.gz NYOOEJMGGYJIBD-XLAORIBOSA-N 2 1 320.546 4.342 20 0 DIADMP CC1(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000813789654 1041731248 /nfs/dbraw/zinc/73/12/48/1041731248.db2.gz ADNAYDFMGIRQHO-IHWFROFDSA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](c1cccnc1)C1CCCCC1 ZINC000652137353 1041844773 /nfs/dbraw/zinc/84/47/73/1041844773.db2.gz IFIHQBHWBWAIOI-LJQANCHMSA-N 2 1 303.494 4.023 20 0 DIADMP c1cc(C[N@H+]2CCC[C@H](C3CC3)C2)ccc1C[NH+]1CCCCC1 ZINC001170783177 1041945814 /nfs/dbraw/zinc/94/58/14/1041945814.db2.gz MYHUAZYWVAOFQC-NRFANRHFSA-N 2 1 312.501 4.295 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2C)c1 ZINC000815576140 1041966026 /nfs/dbraw/zinc/96/60/26/1041966026.db2.gz KMYSBKZJRWMOFD-MRXNPFEDSA-N 2 1 314.448 4.437 20 0 DIADMP CC[N@@H+](CCCN[C@H](C)c1cnccc1C)C1CCCCC1 ZINC000652238227 1041978896 /nfs/dbraw/zinc/97/88/96/1041978896.db2.gz YNRQDSGONQMUFZ-QGZVFWFLSA-N 2 1 303.494 4.085 20 0 DIADMP CC[N@H+](CCC[NH2+][C@H](C)c1cnccc1C)C1CCCCC1 ZINC000652238227 1041978905 /nfs/dbraw/zinc/97/89/05/1041978905.db2.gz YNRQDSGONQMUFZ-QGZVFWFLSA-N 2 1 303.494 4.085 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H](C)c1cnccc1C)C1CCCCC1 ZINC000652238227 1041978911 /nfs/dbraw/zinc/97/89/11/1041978911.db2.gz YNRQDSGONQMUFZ-QGZVFWFLSA-N 2 1 303.494 4.085 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000164617228 1042024902 /nfs/dbraw/zinc/02/49/02/1042024902.db2.gz QQXPYVIRMGGPSU-LBPRGKRZSA-N 2 1 309.816 4.115 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)C2)cc1 ZINC000663344060 1042125965 /nfs/dbraw/zinc/12/59/65/1042125965.db2.gz NHZAZFMBYZZHMX-CEWLAPEOSA-N 2 1 312.501 4.034 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2cccc(Cl)c2C1 ZINC001170896766 1042146071 /nfs/dbraw/zinc/14/60/71/1042146071.db2.gz IZXIBQBFBGYLRV-DOTOQJQBSA-N 2 1 320.908 4.051 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463778 1042176399 /nfs/dbraw/zinc/17/63/99/1042176399.db2.gz BKHWIFSGHHROOR-XLIONFOSSA-N 2 1 316.489 4.141 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463778 1042176404 /nfs/dbraw/zinc/17/64/04/1042176404.db2.gz BKHWIFSGHHROOR-XLIONFOSSA-N 2 1 316.489 4.141 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000663467867 1042179561 /nfs/dbraw/zinc/17/95/61/1042179561.db2.gz IIWHWGPSNWGEEJ-SESVDKBCSA-N 2 1 312.501 4.034 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC000663471806 1042184817 /nfs/dbraw/zinc/18/48/17/1042184817.db2.gz YKQUEFLJEFNRTA-ZBFHGGJFSA-N 2 1 306.519 4.083 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001167824169 1042210317 /nfs/dbraw/zinc/21/03/17/1042210317.db2.gz CAYUANQAYIAKCD-VQIMIIECSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1ccc(OC)cc1 ZINC001167824686 1042212159 /nfs/dbraw/zinc/21/21/59/1042212159.db2.gz FKLPNUNJFKCPHY-FXAWDEMLSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC001167825811 1042214589 /nfs/dbraw/zinc/21/45/89/1042214589.db2.gz KUDZRFNSQBHYKS-QUCCMNQESA-N 2 1 302.506 4.377 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC001167825815 1042215007 /nfs/dbraw/zinc/21/50/07/1042215007.db2.gz KUWLLUMRIJJBAP-IRXDYDNUSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001167825929 1042215875 /nfs/dbraw/zinc/21/58/75/1042215875.db2.gz LTDQSRBLXGWODO-AZUAARDMSA-N 2 1 302.506 4.062 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001167826925 1042217075 /nfs/dbraw/zinc/21/70/75/1042217075.db2.gz RZZFHKPAFLYNGE-HKUYNNGSSA-N 2 1 303.494 4.119 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)CCc1cccc(Cl)c1 ZINC001167827163 1042218594 /nfs/dbraw/zinc/21/85/94/1042218594.db2.gz UGBGBGDDUFSTNX-MRXNPFEDSA-N 2 1 310.913 4.325 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cc(-c3ccccc3)cs2)C1 ZINC000314957800 1042226277 /nfs/dbraw/zinc/22/62/77/1042226277.db2.gz UGZHTVKVZLXZCC-MRXNPFEDSA-N 2 1 314.498 4.235 20 0 DIADMP C[C@H](CCN(C)Cc1cccs1)[N@@H+](C)Cc1cccs1 ZINC000431606433 1042230669 /nfs/dbraw/zinc/23/06/69/1042230669.db2.gz UODLMKWSPASQKW-CQSZACIVSA-N 2 1 308.516 4.152 20 0 DIADMP C[C@H](CC[N@H+](C)Cc1cccs1)N(C)Cc1cccs1 ZINC000431606433 1042230676 /nfs/dbraw/zinc/23/06/76/1042230676.db2.gz UODLMKWSPASQKW-CQSZACIVSA-N 2 1 308.516 4.152 20 0 DIADMP C[C@H](CC[N@@H+](C)Cc1cccs1)N(C)Cc1cccs1 ZINC000431606433 1042230683 /nfs/dbraw/zinc/23/06/83/1042230683.db2.gz UODLMKWSPASQKW-CQSZACIVSA-N 2 1 308.516 4.152 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001167836791 1042248468 /nfs/dbraw/zinc/24/84/68/1042248468.db2.gz HICOUKIBERYTLC-SFHVURJKSA-N 2 1 300.490 4.286 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001167836359 1042248496 /nfs/dbraw/zinc/24/84/96/1042248496.db2.gz YMJCAPOKMQFQTQ-PXNSSMCTSA-N 2 1 320.496 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](CC)Cc1cccc(OC)c1 ZINC001167838093 1042249345 /nfs/dbraw/zinc/24/93/45/1042249345.db2.gz PUWDUYZVBDPXBX-QGZVFWFLSA-N 2 1 306.494 4.028 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@H](C)c1ccc(OC)cc1 ZINC001167838036 1042249778 /nfs/dbraw/zinc/24/97/78/1042249778.db2.gz PAIZIAFCNYUGAU-IAGOWNOFSA-N 2 1 306.494 4.199 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@@H](C)Cc1ccccc1OC ZINC001167840368 1042253120 /nfs/dbraw/zinc/25/31/20/1042253120.db2.gz FQPXWJWUBNFJOZ-ROUUACIJSA-N 2 1 320.521 4.069 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001167840669 1042254387 /nfs/dbraw/zinc/25/43/87/1042254387.db2.gz HGEDGWXGEDJIJX-KURKYZTESA-N 2 1 300.490 4.084 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Cl)cc(Cl)c1 ZINC000278969912 1042255304 /nfs/dbraw/zinc/25/53/04/1042255304.db2.gz NKBFMTBCZRJIIH-RYUDHWBXSA-N 2 1 324.255 4.103 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@H]34)cc2)cc1 ZINC000319790210 1042260339 /nfs/dbraw/zinc/26/03/39/1042260339.db2.gz HWZSPVVOBGDYPN-LEWJYISDSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@H]34)cc2)cc1 ZINC000319790210 1042260340 /nfs/dbraw/zinc/26/03/40/1042260340.db2.gz HWZSPVVOBGDYPN-LEWJYISDSA-N 2 1 306.453 4.070 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(-c2ccccc2)o1 ZINC000279054415 1042265956 /nfs/dbraw/zinc/26/59/56/1042265956.db2.gz YKFVJQDECBGCLG-HZPDHXFCSA-N 2 1 321.424 4.056 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(-c2ccccc2)o1 ZINC000279054420 1042266408 /nfs/dbraw/zinc/26/64/08/1042266408.db2.gz YKFVJQDECBGCLG-JKSUJKDBSA-N 2 1 321.424 4.056 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(-c2ccccc2)o1 ZINC000279054405 1042266598 /nfs/dbraw/zinc/26/65/98/1042266598.db2.gz YKFVJQDECBGCLG-CVEARBPZSA-N 2 1 321.424 4.056 20 0 DIADMP CC(C)Oc1ccccc1CNCCC[N@@H+](C)C1CCCCC1 ZINC000390948029 1042279062 /nfs/dbraw/zinc/27/90/62/1042279062.db2.gz QLFQKHFCFKDQFJ-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)Oc1ccccc1C[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000390948029 1042279065 /nfs/dbraw/zinc/27/90/65/1042279065.db2.gz QLFQKHFCFKDQFJ-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)Oc1ccccc1C[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000390948029 1042279070 /nfs/dbraw/zinc/27/90/70/1042279070.db2.gz QLFQKHFCFKDQFJ-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CCSc3ccc(F)cc32)CC(C)(C)[NH2+]1 ZINC000162694961 1042294352 /nfs/dbraw/zinc/29/43/52/1042294352.db2.gz IGHCGWVGWBHLDL-OAHLLOKOSA-N 2 1 322.493 4.261 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+](C(C)C)CC1)CCS2 ZINC000187316607 1042311185 /nfs/dbraw/zinc/31/11/85/1042311185.db2.gz QBFVNTZNMPQSFF-GOSISDBHSA-N 2 1 318.530 4.303 20 0 DIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc2ccccc2n1 ZINC000178344957 1042314150 /nfs/dbraw/zinc/31/41/50/1042314150.db2.gz NMECXXOQWWSJHB-AWEZNQCLSA-N 2 1 311.473 4.195 20 0 DIADMP COc1ccc2cc([C@@H](C)[NH2+]C3CC[NH+](C4CC4)CC3)ccc2c1 ZINC000122857205 1042338115 /nfs/dbraw/zinc/33/81/15/1042338115.db2.gz MGDBQMNVROZFPU-OAHLLOKOSA-N 2 1 324.468 4.126 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2CCC(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000647252554 1042405933 /nfs/dbraw/zinc/40/59/33/1042405933.db2.gz JWCKPVHJFPTVEH-KTLDDFEXSA-N 2 1 318.480 4.157 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2CCC(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000647252554 1042405936 /nfs/dbraw/zinc/40/59/36/1042405936.db2.gz JWCKPVHJFPTVEH-KTLDDFEXSA-N 2 1 318.480 4.157 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cccnc1 ZINC000246492352 1042420733 /nfs/dbraw/zinc/42/07/33/1042420733.db2.gz AKWPYYRYABEFRY-ZWKOTPCHSA-N 2 1 323.484 4.164 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)Cc1ccccn1 ZINC000411318116 1042438606 /nfs/dbraw/zinc/43/86/06/1042438606.db2.gz PKJNGVISTGPVPD-UHFFFAOYSA-N 2 1 323.484 4.090 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@H]34)c2)cc1 ZINC000614328410 1042466714 /nfs/dbraw/zinc/46/67/14/1042466714.db2.gz BUMTXLOOSOZDRT-LEWJYISDSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@H]34)c2)cc1 ZINC000614328410 1042466716 /nfs/dbraw/zinc/46/67/16/1042466716.db2.gz BUMTXLOOSOZDRT-LEWJYISDSA-N 2 1 306.453 4.070 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204727598 1042505917 /nfs/dbraw/zinc/50/59/17/1042505917.db2.gz FAFTUNBCTZLIIP-SFHVURJKSA-N 2 1 324.553 4.074 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]Cc2ccccc2)C[N@H+]1Cc1ccccc1 ZINC000513511155 1042549454 /nfs/dbraw/zinc/54/94/54/1042549454.db2.gz HTZKHNVVQVDPEE-RXVVDRJESA-N 2 1 308.469 4.077 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327637 1042598937 /nfs/dbraw/zinc/59/89/37/1042598937.db2.gz LPPWLPUPEJWZDO-IRXDYDNUSA-N 2 1 318.464 4.078 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000420312485 1042598954 /nfs/dbraw/zinc/59/89/54/1042598954.db2.gz HTJSZZRVPGTDRF-DFNIBXOVSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000420312485 1042598957 /nfs/dbraw/zinc/59/89/57/1042598957.db2.gz HTJSZZRVPGTDRF-DFNIBXOVSA-N 2 1 322.452 4.194 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc(C3CC3)c2)c1 ZINC000421331178 1042630599 /nfs/dbraw/zinc/63/05/99/1042630599.db2.gz ZIFUYQUZOJLBCB-UHFFFAOYSA-N 2 1 308.469 4.306 20 0 DIADMP COc1cc(Cl)ccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000421824526 1042653772 /nfs/dbraw/zinc/65/37/72/1042653772.db2.gz JEOJBIJGLULIIO-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP COc1cc(Cl)ccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000421824526 1042653776 /nfs/dbraw/zinc/65/37/76/1042653776.db2.gz JEOJBIJGLULIIO-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccncc1Cl ZINC000421834371 1042655159 /nfs/dbraw/zinc/65/51/59/1042655159.db2.gz CDTWWUMCIWDNKX-KKUMJFAQSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccncc1Cl ZINC000421834371 1042655161 /nfs/dbraw/zinc/65/51/61/1042655161.db2.gz CDTWWUMCIWDNKX-KKUMJFAQSA-N 2 1 321.896 4.039 20 0 DIADMP Clc1ccc([C@@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000422766874 1042689941 /nfs/dbraw/zinc/68/99/41/1042689941.db2.gz QIZLLZIUWQJMTH-OALUTQOASA-N 2 1 314.860 4.161 20 0 DIADMP COc1ccc([C@H]([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C(C)C)cc1 ZINC000422791796 1042690910 /nfs/dbraw/zinc/69/09/10/1042690910.db2.gz VFDHUTNVBCVIKU-VAMGGRTRSA-N 2 1 310.441 4.127 20 0 DIADMP CC[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(Cl)s1 ZINC000423190282 1042700716 /nfs/dbraw/zinc/70/07/16/1042700716.db2.gz QWJYJFAZKQRHDS-CQSZACIVSA-N 2 1 323.893 4.017 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C[NH3+])CC(C)C ZINC000423262366 1042701852 /nfs/dbraw/zinc/70/18/52/1042701852.db2.gz METOPKXUQHUEKE-XJKSGUPXSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000423278617 1042705235 /nfs/dbraw/zinc/70/52/35/1042705235.db2.gz RAOYISKBWYJECZ-BBRMVZONSA-N 2 1 317.502 4.061 20 0 DIADMP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000423325860 1042706972 /nfs/dbraw/zinc/70/69/72/1042706972.db2.gz JWIWLIANJPDBFL-XHDPSFHLSA-N 2 1 301.261 4.034 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423401243 1042710598 /nfs/dbraw/zinc/71/05/98/1042710598.db2.gz XBMRJBCZAFHFCG-QLFBSQMISA-N 2 1 300.446 4.095 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000423401247 1042710839 /nfs/dbraw/zinc/71/08/39/1042710839.db2.gz XBMRJBCZAFHFCG-SOUVJXGZSA-N 2 1 300.446 4.095 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423505929 1042715740 /nfs/dbraw/zinc/71/57/40/1042715740.db2.gz IEHWUPIQBMMSLR-GOEBONIOSA-N 2 1 317.502 4.397 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423505931 1042715754 /nfs/dbraw/zinc/71/57/54/1042715754.db2.gz IEHWUPIQBMMSLR-HOCLYGCPSA-N 2 1 317.502 4.397 20 0 DIADMP COc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319163 1042733689 /nfs/dbraw/zinc/73/36/89/1042733689.db2.gz RTXRWHGJTZLCSA-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c(Cl)c1 ZINC000424319163 1042733692 /nfs/dbraw/zinc/73/36/92/1042733692.db2.gz RTXRWHGJTZLCSA-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319163 1042733695 /nfs/dbraw/zinc/73/36/95/1042733695.db2.gz RTXRWHGJTZLCSA-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC000424379870 1042738966 /nfs/dbraw/zinc/73/89/66/1042738966.db2.gz VYQCXARILJSMGT-CWFSZBLJSA-N 2 1 324.468 4.283 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]C2CCC(C)(c3ccccc3)CC2)C1 ZINC000514692807 1042787572 /nfs/dbraw/zinc/78/75/72/1042787572.db2.gz FHFZPBJVWVXEKJ-PELRDEGISA-N 2 1 314.517 4.207 20 0 DIADMP Cc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000515395681 1042817798 /nfs/dbraw/zinc/81/77/98/1042817798.db2.gz VKVPMUBJTANDEI-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP COCCC1(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)CCCCC1 ZINC000436267111 1042832162 /nfs/dbraw/zinc/83/21/62/1042832162.db2.gz BUQPBWYADMHNPE-LJQANCHMSA-N 2 1 324.553 4.075 20 0 DIADMP COCCC1(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)CCCCC1 ZINC000436272196 1042833511 /nfs/dbraw/zinc/83/35/11/1042833511.db2.gz SKQZSMLZFUSGNW-LJQANCHMSA-N 2 1 324.553 4.218 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000516826785 1042855940 /nfs/dbraw/zinc/85/59/40/1042855940.db2.gz HLMZPQKVOMIABL-OXQOHEQNSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000516826785 1042855948 /nfs/dbraw/zinc/85/59/48/1042855948.db2.gz HLMZPQKVOMIABL-OXQOHEQNSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934353 1042876418 /nfs/dbraw/zinc/87/64/18/1042876418.db2.gz BJQRKFQFQIOWSG-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934353 1042876423 /nfs/dbraw/zinc/87/64/23/1042876423.db2.gz BJQRKFQFQIOWSG-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CSc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000517536398 1042885777 /nfs/dbraw/zinc/88/57/77/1042885777.db2.gz DNYZDVJSIDROJO-CALCHBBNSA-N 2 1 320.546 4.256 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)CCc2ccccc2)CC1 ZINC000519224138 1042940025 /nfs/dbraw/zinc/94/00/25/1042940025.db2.gz PWTHIDARNMMMEH-LJQANCHMSA-N 2 1 316.533 4.452 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cccc(F)c1 ZINC001167971494 1042963952 /nfs/dbraw/zinc/96/39/52/1042963952.db2.gz WJOSVEHWBSUSCU-NXEWRWPSSA-N 2 1 316.464 4.272 20 0 DIADMP c1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc(C2CC2)c1 ZINC001167974384 1042966733 /nfs/dbraw/zinc/96/67/33/1042966733.db2.gz YTJMCAPGWODUAQ-SEJPIABJSA-N 2 1 310.485 4.059 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1F ZINC001167981612 1042975154 /nfs/dbraw/zinc/97/51/54/1042975154.db2.gz BQBLTUHCQCWLGF-AQXGTKIOSA-N 2 1 316.464 4.190 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000383399539 1042988429 /nfs/dbraw/zinc/98/84/29/1042988429.db2.gz NRVGJKGEFVAGAK-NRFANRHFSA-N 2 1 322.496 4.305 20 0 DIADMP CC1=CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000519783894 1043003356 /nfs/dbraw/zinc/00/33/56/1043003356.db2.gz XMCAXIKJWNTBTP-UDEWTMQYSA-N 2 1 310.485 4.270 20 0 DIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccccc1C(F)(F)F ZINC000441359848 1043038657 /nfs/dbraw/zinc/03/86/57/1043038657.db2.gz VHNCBSMKKLYLGS-HNNXBMFYSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccccc1C(F)(F)F ZINC000441359848 1043038661 /nfs/dbraw/zinc/03/86/61/1043038661.db2.gz VHNCBSMKKLYLGS-HNNXBMFYSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1ccccc1C(F)(F)F ZINC000441359848 1043038667 /nfs/dbraw/zinc/03/86/67/1043038667.db2.gz VHNCBSMKKLYLGS-HNNXBMFYSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1ccccc1C(F)(F)F ZINC000441359848 1043038670 /nfs/dbraw/zinc/03/86/70/1043038670.db2.gz VHNCBSMKKLYLGS-HNNXBMFYSA-N 2 1 314.395 4.012 20 0 DIADMP CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323083 1043041253 /nfs/dbraw/zinc/04/12/53/1043041253.db2.gz JDXHDXRZSWSZET-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323083 1043041257 /nfs/dbraw/zinc/04/12/57/1043041257.db2.gz JDXHDXRZSWSZET-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323083 1043041261 /nfs/dbraw/zinc/04/12/61/1043041261.db2.gz JDXHDXRZSWSZET-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323083 1043041263 /nfs/dbraw/zinc/04/12/63/1043041263.db2.gz JDXHDXRZSWSZET-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323083 1043041264 /nfs/dbraw/zinc/04/12/64/1043041264.db2.gz JDXHDXRZSWSZET-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441402716 1043042918 /nfs/dbraw/zinc/04/29/18/1043042918.db2.gz BGGQCZNGVAFSAL-SPYBWZPUSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441402716 1043042921 /nfs/dbraw/zinc/04/29/21/1043042921.db2.gz BGGQCZNGVAFSAL-SPYBWZPUSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441402716 1043042927 /nfs/dbraw/zinc/04/29/27/1043042927.db2.gz BGGQCZNGVAFSAL-SPYBWZPUSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441402716 1043042930 /nfs/dbraw/zinc/04/29/30/1043042930.db2.gz BGGQCZNGVAFSAL-SPYBWZPUSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441393801 1043043471 /nfs/dbraw/zinc/04/34/71/1043043471.db2.gz IAZCJCNFQGTFDD-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441393801 1043043478 /nfs/dbraw/zinc/04/34/78/1043043478.db2.gz IAZCJCNFQGTFDD-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441393801 1043043487 /nfs/dbraw/zinc/04/34/87/1043043487.db2.gz IAZCJCNFQGTFDD-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441393801 1043043492 /nfs/dbraw/zinc/04/34/92/1043043492.db2.gz IAZCJCNFQGTFDD-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP CCN(Cc1ccccc1F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167994790 1043066460 /nfs/dbraw/zinc/06/64/60/1043066460.db2.gz OXBHGBYFAPSELU-DFNIBXOVSA-N 2 1 316.464 4.053 20 0 DIADMP CC[N@H+](Cc1ccccc1F)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994790 1043066471 /nfs/dbraw/zinc/06/64/71/1043066471.db2.gz OXBHGBYFAPSELU-DFNIBXOVSA-N 2 1 316.464 4.053 20 0 DIADMP CC[N@@H+](Cc1ccccc1F)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994790 1043066483 /nfs/dbraw/zinc/06/64/83/1043066483.db2.gz OXBHGBYFAPSELU-DFNIBXOVSA-N 2 1 316.464 4.053 20 0 DIADMP CC[NH+](Cc1ccccc1F)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167994790 1043066498 /nfs/dbraw/zinc/06/64/98/1043066498.db2.gz OXBHGBYFAPSELU-DFNIBXOVSA-N 2 1 316.464 4.053 20 0 DIADMP CC[NH+](Cc1ccccc1F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167994790 1043066509 /nfs/dbraw/zinc/06/65/09/1043066509.db2.gz OXBHGBYFAPSELU-DFNIBXOVSA-N 2 1 316.464 4.053 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC(N1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001167994654 1043069333 /nfs/dbraw/zinc/06/93/33/1043069333.db2.gz IZEZTRSPNUNICN-XEOGZFBHSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001167994654 1043069346 /nfs/dbraw/zinc/06/93/46/1043069346.db2.gz IZEZTRSPNUNICN-XEOGZFBHSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001167994654 1043069352 /nfs/dbraw/zinc/06/93/52/1043069352.db2.gz IZEZTRSPNUNICN-XEOGZFBHSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@@H+]1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001167994654 1043069359 /nfs/dbraw/zinc/06/93/59/1043069359.db2.gz IZEZTRSPNUNICN-XEOGZFBHSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@H+]1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001167994654 1043069368 /nfs/dbraw/zinc/06/93/68/1043069368.db2.gz IZEZTRSPNUNICN-XEOGZFBHSA-N 2 1 302.506 4.046 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2ccc3ccccc3n2)CC1 ZINC000177837057 1043113116 /nfs/dbraw/zinc/11/31/16/1043113116.db2.gz RORNSOMILXBHLA-INIZCTEOSA-N 2 1 311.473 4.006 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc3ccccc3n2)CC1 ZINC000178117842 1043121976 /nfs/dbraw/zinc/12/19/76/1043121976.db2.gz GGDHLOAXSYRUSW-INIZCTEOSA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)nc1 ZINC000179135649 1043142474 /nfs/dbraw/zinc/14/24/74/1043142474.db2.gz WSZYFGRKSSEYSL-AWEZNQCLSA-N 2 1 321.896 4.183 20 0 DIADMP c1cc2cccc3c2c(c1)CC[C@H]3[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000866236814 1043163612 /nfs/dbraw/zinc/16/36/12/1043163612.db2.gz FJBAOKDZGAXUEM-WSTZPKSXSA-N 2 1 306.453 4.044 20 0 DIADMP c1cc2cccc3c2c(c1)CC[C@H]3[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000866236796 1043164351 /nfs/dbraw/zinc/16/43/51/1043164351.db2.gz FJBAOKDZGAXUEM-CMKODMSKSA-N 2 1 306.453 4.044 20 0 DIADMP Cc1cncc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000184284194 1043180292 /nfs/dbraw/zinc/18/02/92/1043180292.db2.gz RXIYMHITRODXRD-SFHVURJKSA-N 2 1 323.484 4.014 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000184322594 1043183376 /nfs/dbraw/zinc/18/33/76/1043183376.db2.gz WSOSCOSJJJVAKT-QGZVFWFLSA-N 2 1 311.473 4.081 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000427610539 1043243418 /nfs/dbraw/zinc/24/34/18/1043243418.db2.gz VHSPOAGBURPGIW-PXNSSMCTSA-N 2 1 300.490 4.158 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005080 1043243639 /nfs/dbraw/zinc/24/36/39/1043243639.db2.gz FLSFIWPQTJTLHH-QQXMDYFESA-N 2 1 318.480 4.298 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCCCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005056 1043243878 /nfs/dbraw/zinc/24/38/78/1043243878.db2.gz FFTZUFIUXBFWMK-XEMDLRDOSA-N 2 1 300.490 4.350 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccncc1 ZINC000268937003 1043344912 /nfs/dbraw/zinc/34/49/12/1043344912.db2.gz YYDPBEATZDFNQU-WMQCIHAUSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)nc1 ZINC000270483625 1043388744 /nfs/dbraw/zinc/38/87/44/1043388744.db2.gz KWSCKOMTTJFSFL-CABCVRRESA-N 2 1 309.885 4.040 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)nc1 ZINC000270483633 1043388801 /nfs/dbraw/zinc/38/88/01/1043388801.db2.gz KWSCKOMTTJFSFL-HUUCEWRRSA-N 2 1 309.885 4.040 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2SC)CC1 ZINC000442786186 1043418822 /nfs/dbraw/zinc/41/88/22/1043418822.db2.gz SSVKIWGYIYAXKF-OAHLLOKOSA-N 2 1 306.519 4.324 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C ZINC000442853839 1043444074 /nfs/dbraw/zinc/44/40/74/1043444074.db2.gz JXXKCWLRCUVMDF-NHYWBVRUSA-N 2 1 322.905 4.293 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CC[C@H]2C2CC2)C[N@H+]1Cc1ccccc1 ZINC000558252599 1043474477 /nfs/dbraw/zinc/47/44/77/1043474477.db2.gz QCWGTAUAMOPBII-GKBFQHABSA-N 2 1 312.501 4.065 20 0 DIADMP CC[N@@H+](Cc1ccc(C)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000349006720 1043487122 /nfs/dbraw/zinc/48/71/22/1043487122.db2.gz MEFONAVCQVJWHG-UHFFFAOYSA-N 2 1 302.487 4.140 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(Cl)cs1 ZINC000349125535 1043493722 /nfs/dbraw/zinc/49/37/22/1043493722.db2.gz FAHFJEZVBFQOSF-UHFFFAOYSA-N 2 1 311.882 4.073 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(Cl)cs1 ZINC000349125535 1043493764 /nfs/dbraw/zinc/49/37/64/1043493764.db2.gz FAHFJEZVBFQOSF-UHFFFAOYSA-N 2 1 311.882 4.073 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000349143480 1043494114 /nfs/dbraw/zinc/49/41/14/1043494114.db2.gz BLJFHSIKTMZFHB-DOTOQJQBSA-N 2 1 315.461 4.074 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000349143480 1043494118 /nfs/dbraw/zinc/49/41/18/1043494118.db2.gz BLJFHSIKTMZFHB-DOTOQJQBSA-N 2 1 315.461 4.074 20 0 DIADMP C[C@H]([NH2+]C1CCC2(CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000558408768 1043503586 /nfs/dbraw/zinc/50/35/86/1043503586.db2.gz HIBIVTOWSQAAOI-PKOBYXMFSA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)C[C@@H](C[NH2+]C[C@H]1CC[N@H+](C(C)C)C1)c1ccccc1 ZINC000558419432 1043505129 /nfs/dbraw/zinc/50/51/29/1043505129.db2.gz WNGFWBSGQKOWMW-QUCCMNQESA-N 2 1 302.506 4.136 20 0 DIADMP CN(Cc1cc(Cl)cc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000558417492 1043507086 /nfs/dbraw/zinc/50/70/86/1043507086.db2.gz CGAQEYJHOHFFJL-XYPWUTKMSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558417492 1043507094 /nfs/dbraw/zinc/50/70/94/1043507094.db2.gz CGAQEYJHOHFFJL-XYPWUTKMSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000558417492 1043507104 /nfs/dbraw/zinc/50/71/04/1043507104.db2.gz CGAQEYJHOHFFJL-XYPWUTKMSA-N 2 1 313.272 4.050 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000349403050 1043508439 /nfs/dbraw/zinc/50/84/39/1043508439.db2.gz BHHLKZBQQDEAGJ-PMACEKPBSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000349403050 1043508448 /nfs/dbraw/zinc/50/84/48/1043508448.db2.gz BHHLKZBQQDEAGJ-PMACEKPBSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCCc2c(Cl)cccc21 ZINC000349463211 1043508511 /nfs/dbraw/zinc/50/85/11/1043508511.db2.gz SLZYUCDZGRQZFI-SCLBCKFNSA-N 2 1 317.864 4.148 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000558699627 1043576072 /nfs/dbraw/zinc/57/60/72/1043576072.db2.gz XWZGMHKTFXEUKH-DQLDELGASA-N 2 1 324.468 4.190 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)c1 ZINC001143592112 1043578140 /nfs/dbraw/zinc/57/81/40/1043578140.db2.gz PJLACYXNQCOFRX-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP Cc1cc(F)cc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)c1 ZINC001143592112 1043578147 /nfs/dbraw/zinc/57/81/47/1043578147.db2.gz PJLACYXNQCOFRX-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1csc(Cl)c1 ZINC000191350897 1043583742 /nfs/dbraw/zinc/58/37/42/1043583742.db2.gz DYNCFFFAOODPHH-LLVKDONJSA-N 2 1 300.899 4.315 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1csc2ccccc12 ZINC000926542201 1043597390 /nfs/dbraw/zinc/59/73/90/1043597390.db2.gz PYONKXMXBBUKPE-AVOUXACISA-N 2 1 300.471 4.177 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926574762 1043600830 /nfs/dbraw/zinc/60/08/30/1043600830.db2.gz YFLBRURADFTTGO-VXGBXAGGSA-N 2 1 320.424 4.149 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccoc1 ZINC000353520278 1043613635 /nfs/dbraw/zinc/61/36/35/1043613635.db2.gz NSNUCZBSCJOTOF-PKOBYXMFSA-N 2 1 306.494 4.467 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccoc1 ZINC000353520278 1043613639 /nfs/dbraw/zinc/61/36/39/1043613639.db2.gz NSNUCZBSCJOTOF-PKOBYXMFSA-N 2 1 306.494 4.467 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@@H+]1Cc1ccccc1 ZINC000353581345 1043620831 /nfs/dbraw/zinc/62/08/31/1043620831.db2.gz YWQYXLVGOBUPIA-OXQOHEQNSA-N 2 1 321.468 4.424 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@H+]1Cc1ccccc1 ZINC000353581345 1043620835 /nfs/dbraw/zinc/62/08/35/1043620835.db2.gz YWQYXLVGOBUPIA-OXQOHEQNSA-N 2 1 321.468 4.424 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cnc(C3CCCC3)s2)C[C@H]1C ZINC000353747998 1043639559 /nfs/dbraw/zinc/63/95/59/1043639559.db2.gz BZSGADMNRAVMHG-ZBFHGGJFSA-N 2 1 321.534 4.105 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(-c3ccccn3)c2)C[C@H]1C ZINC000353748371 1043640789 /nfs/dbraw/zinc/64/07/89/1043640789.db2.gz RKCBLQPRPCECCY-XLIONFOSSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@H]1C ZINC000353748371 1043640794 /nfs/dbraw/zinc/64/07/94/1043640794.db2.gz RKCBLQPRPCECCY-XLIONFOSSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@H]1C ZINC000353748371 1043640802 /nfs/dbraw/zinc/64/08/02/1043640802.db2.gz RKCBLQPRPCECCY-XLIONFOSSA-N 2 1 323.484 4.053 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000191492353 1043645728 /nfs/dbraw/zinc/64/57/28/1043645728.db2.gz UNRZBDYTIIJYRQ-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000191492353 1043645738 /nfs/dbraw/zinc/64/57/38/1043645738.db2.gz UNRZBDYTIIJYRQ-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCS[C@H](C)C2)cc1 ZINC000927032943 1043669870 /nfs/dbraw/zinc/66/98/70/1043669870.db2.gz QVVVGRBXTDRFPO-KEYYUXOJSA-N 2 1 315.486 4.115 20 0 DIADMP C[C@H]1C[C@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@@H+]1Cc1ccccc1 ZINC000354546269 1043705946 /nfs/dbraw/zinc/70/59/46/1043705946.db2.gz UEWMYFKFMMAWPL-OXJNMPFZSA-N 2 1 321.468 4.035 20 0 DIADMP C[C@H]1C[C@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@H+]1Cc1ccccc1 ZINC000354546269 1043705959 /nfs/dbraw/zinc/70/59/59/1043705959.db2.gz UEWMYFKFMMAWPL-OXJNMPFZSA-N 2 1 321.468 4.035 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@H]1CCN(C)[C@@H](C)C1)c1ccccc1 ZINC000474284511 1043722506 /nfs/dbraw/zinc/72/25/06/1043722506.db2.gz RLMVJOBHLZGMOV-SXLOBPIMSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284511 1043722517 /nfs/dbraw/zinc/72/25/17/1043722517.db2.gz RLMVJOBHLZGMOV-SXLOBPIMSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284511 1043722530 /nfs/dbraw/zinc/72/25/30/1043722530.db2.gz RLMVJOBHLZGMOV-SXLOBPIMSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284511 1043722546 /nfs/dbraw/zinc/72/25/46/1043722546.db2.gz RLMVJOBHLZGMOV-SXLOBPIMSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284511 1043722555 /nfs/dbraw/zinc/72/25/55/1043722555.db2.gz RLMVJOBHLZGMOV-SXLOBPIMSA-N 2 1 302.506 4.231 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC3(CCC3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168031744 1043728551 /nfs/dbraw/zinc/72/85/51/1043728551.db2.gz DUYNVEQRARWOEC-IZZQQSIFSA-N 2 1 312.501 4.350 20 0 DIADMP CSC(C)(C)C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877064927 1043740326 /nfs/dbraw/zinc/74/03/26/1043740326.db2.gz GFQRWGTUMZPKLB-FUHWJXTLSA-N 2 1 318.530 4.086 20 0 DIADMP CSC(C)(C)C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877064927 1043740335 /nfs/dbraw/zinc/74/03/35/1043740335.db2.gz GFQRWGTUMZPKLB-FUHWJXTLSA-N 2 1 318.530 4.086 20 0 DIADMP C[NH+](C)CC1(C[NH2+][C@@H]2CCSc3ccc(F)cc32)CCCC1 ZINC000355057822 1043741794 /nfs/dbraw/zinc/74/17/94/1043741794.db2.gz FPUBFNXWCGOSCR-MRXNPFEDSA-N 2 1 322.493 4.074 20 0 DIADMP C[NH+](C)CC1(C[NH2+][C@H]2CCSc3ccc(F)cc32)CCCC1 ZINC000355057818 1043742827 /nfs/dbraw/zinc/74/28/27/1043742827.db2.gz FPUBFNXWCGOSCR-INIZCTEOSA-N 2 1 322.493 4.074 20 0 DIADMP CC[C@@H](C)[C@H](C)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000777692464 1043755624 /nfs/dbraw/zinc/75/56/24/1043755624.db2.gz BZOTWRHXBACIJD-SJORKVTESA-N 2 1 317.521 4.311 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470719 1043790059 /nfs/dbraw/zinc/79/00/59/1043790059.db2.gz AXGGNPGMCHYGBH-SBJFKYEJSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470719 1043790076 /nfs/dbraw/zinc/79/00/76/1043790076.db2.gz AXGGNPGMCHYGBH-SBJFKYEJSA-N 2 1 324.921 4.110 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C[C@@H](CC(C)C)c1ccccc1 ZINC000474469949 1043793391 /nfs/dbraw/zinc/79/33/91/1043793391.db2.gz INRGJZNNLGGFJA-FXAWDEMLSA-N 2 1 313.489 4.247 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C[C@H](CC(C)C)c1ccccc1 ZINC000474469950 1043793410 /nfs/dbraw/zinc/79/34/10/1043793410.db2.gz INRGJZNNLGGFJA-PXNSSMCTSA-N 2 1 313.489 4.247 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)[C@@H](C)c1ccc(Cl)cc1 ZINC000474470064 1043793792 /nfs/dbraw/zinc/79/37/92/1043793792.db2.gz DKVSOTDOFPBLKP-NONVJHHQSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)[C@@H](C)c1ccc(Cl)cc1 ZINC000474470064 1043793799 /nfs/dbraw/zinc/79/37/99/1043793799.db2.gz DKVSOTDOFPBLKP-NONVJHHQSA-N 2 1 306.881 4.048 20 0 DIADMP CC(C)C[C@H](C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000474476231 1043794762 /nfs/dbraw/zinc/79/47/62/1043794762.db2.gz OSCJKLHRUHPKMP-HSALFYBXSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474480132 1043797200 /nfs/dbraw/zinc/79/72/00/1043797200.db2.gz YXPZHGMCYSRGRO-VYDRJRHOSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@@H]1CC([NH+]2CCC(F)(F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039244 1043853580 /nfs/dbraw/zinc/85/35/80/1043853580.db2.gz CMFSTBDKGOGBHR-HZPDHXFCSA-N 2 1 322.443 4.159 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@](C)(F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039730 1043855757 /nfs/dbraw/zinc/85/57/57/1043855757.db2.gz HUFSMARPTDJDEY-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@](C)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039730 1043855770 /nfs/dbraw/zinc/85/57/70/1043855770.db2.gz HUFSMARPTDJDEY-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039730 1043855788 /nfs/dbraw/zinc/85/57/88/1043855788.db2.gz HUFSMARPTDJDEY-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@](C)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039730 1043855805 /nfs/dbraw/zinc/85/58/05/1043855805.db2.gz HUFSMARPTDJDEY-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H]2C)C[C@H](C)N1Cc1ccccc1 ZINC001168039447 1043858046 /nfs/dbraw/zinc/85/80/46/1043858046.db2.gz DXCSZUIHVDYIBG-GNBUJSLZSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H]2C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039447 1043858058 /nfs/dbraw/zinc/85/80/58/1043858058.db2.gz DXCSZUIHVDYIBG-GNBUJSLZSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@H]2C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039447 1043858071 /nfs/dbraw/zinc/85/80/71/1043858071.db2.gz DXCSZUIHVDYIBG-GNBUJSLZSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@H]2C)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039447 1043858081 /nfs/dbraw/zinc/85/80/81/1043858081.db2.gz DXCSZUIHVDYIBG-GNBUJSLZSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@H]2C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039447 1043858098 /nfs/dbraw/zinc/85/80/98/1043858098.db2.gz DXCSZUIHVDYIBG-GNBUJSLZSA-N 2 1 300.490 4.302 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC[C@H]2CCCC2(F)F)CC1 ZINC000878523166 1043899142 /nfs/dbraw/zinc/89/91/42/1043899142.db2.gz ZBHCTRHABLSBJH-OAHLLOKOSA-N 2 1 324.415 4.059 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)C1CCC(C(F)(F)F)CC1 ZINC000453420136 1043914979 /nfs/dbraw/zinc/91/49/79/1043914979.db2.gz ZGKPJYJGGMJFHJ-NFOMZHRRSA-N 2 1 320.443 4.208 20 0 DIADMP CC(C)[C@@H]1CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000561315285 1043925883 /nfs/dbraw/zinc/92/58/83/1043925883.db2.gz XQEMMFNEASVSTO-KKURMSBHSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000474806635 1043925976 /nfs/dbraw/zinc/92/59/76/1043925976.db2.gz GDDRLUSOVJEQAA-BWEGXRIZSA-N 2 1 320.908 4.437 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000474806635 1043925982 /nfs/dbraw/zinc/92/59/82/1043925982.db2.gz GDDRLUSOVJEQAA-BWEGXRIZSA-N 2 1 320.908 4.437 20 0 DIADMP CC(C)C[N@@H+](CCCCC(F)(F)F)CC1CC[NH+](C)CC1 ZINC000879704702 1043980816 /nfs/dbraw/zinc/98/08/16/1043980816.db2.gz UAZBCIKOWYNLRJ-UHFFFAOYSA-N 2 1 308.432 4.019 20 0 DIADMP CC(C)(C)[C@H]1CC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000562020255 1044048954 /nfs/dbraw/zinc/04/89/54/1044048954.db2.gz VHQDHOYDZOFSQT-VQTJNVASSA-N 2 1 314.517 4.108 20 0 DIADMP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000562020253 1044049353 /nfs/dbraw/zinc/04/93/53/1044049353.db2.gz VHQDHOYDZOFSQT-PMACEKPBSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC23CCCC3)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168048177 1044078553 /nfs/dbraw/zinc/07/85/53/1044078553.db2.gz UJELKQUDAMCCDI-QZTJIDSGSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC23CCCC3)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168048177 1044078567 /nfs/dbraw/zinc/07/85/67/1044078567.db2.gz UJELKQUDAMCCDI-QZTJIDSGSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000798934239 1044088360 /nfs/dbraw/zinc/08/83/60/1044088360.db2.gz CMEOUGMQRDYWBY-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2ncc(C)s2)CC1)CC(C)C ZINC000358744100 1044097392 /nfs/dbraw/zinc/09/73/92/1044097392.db2.gz MEFMNDVGIFOADA-UHFFFAOYSA-N 2 1 323.550 4.032 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2cnc(C)s2)CC1)CC(C)C ZINC000358733063 1044097772 /nfs/dbraw/zinc/09/77/72/1044097772.db2.gz AECCIGLWDVNLJK-UHFFFAOYSA-N 2 1 323.550 4.032 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000359427002 1044166709 /nfs/dbraw/zinc/16/67/09/1044166709.db2.gz FSOPHWMYGVMMPT-PBHICJAKSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000359427002 1044166714 /nfs/dbraw/zinc/16/67/14/1044166714.db2.gz FSOPHWMYGVMMPT-PBHICJAKSA-N 2 1 322.493 4.217 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2Cc3ccccc32)cc1 ZINC000346979022 1044178597 /nfs/dbraw/zinc/17/85/97/1044178597.db2.gz WXQBGKCSZNWRBI-DNVCBOLYSA-N 2 1 317.436 4.171 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444187479 1044233682 /nfs/dbraw/zinc/23/36/82/1044233682.db2.gz APFWMLUOKGPRFX-LPHOPBHVSA-N 2 1 304.453 4.085 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444187479 1044233696 /nfs/dbraw/zinc/23/36/96/1044233696.db2.gz APFWMLUOKGPRFX-LPHOPBHVSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@H]1CC([N@@H+]2CCC(C)(C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053339 1044260806 /nfs/dbraw/zinc/26/08/06/1044260806.db2.gz NVJZFQDAHHKPCI-IRXDYDNUSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@H]1CC([N@H+]2CCC(C)(C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053339 1044260819 /nfs/dbraw/zinc/26/08/19/1044260819.db2.gz NVJZFQDAHHKPCI-IRXDYDNUSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C2CCCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168053584 1044262054 /nfs/dbraw/zinc/26/20/54/1044262054.db2.gz PIOFTAFIQYYJCP-XEMDLRDOSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C2CCCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168053584 1044262071 /nfs/dbraw/zinc/26/20/71/1044262071.db2.gz PIOFTAFIQYYJCP-XEMDLRDOSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C2CCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053584 1044262086 /nfs/dbraw/zinc/26/20/86/1044262086.db2.gz PIOFTAFIQYYJCP-XEMDLRDOSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C2CCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053584 1044262102 /nfs/dbraw/zinc/26/21/02/1044262102.db2.gz PIOFTAFIQYYJCP-XEMDLRDOSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168054713 1044263549 /nfs/dbraw/zinc/26/35/49/1044263549.db2.gz TUPWDHORMGWSNK-HNJRGHQBSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H]1CCC[N@@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054713 1044263558 /nfs/dbraw/zinc/26/35/58/1044263558.db2.gz TUPWDHORMGWSNK-HNJRGHQBSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054713 1044263571 /nfs/dbraw/zinc/26/35/71/1044263571.db2.gz TUPWDHORMGWSNK-HNJRGHQBSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054713 1044263585 /nfs/dbraw/zinc/26/35/85/1044263585.db2.gz TUPWDHORMGWSNK-HNJRGHQBSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054713 1044263594 /nfs/dbraw/zinc/26/35/94/1044263594.db2.gz TUPWDHORMGWSNK-HNJRGHQBSA-N 2 1 300.490 4.302 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cccc(-c2ccccc2)c1 ZINC000237417472 1044275407 /nfs/dbraw/zinc/27/54/07/1044275407.db2.gz CSURXRDAIQRDMJ-KRWDZBQOSA-N 2 1 319.452 4.284 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2[C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000475133916 1044284174 /nfs/dbraw/zinc/28/41/74/1044284174.db2.gz ZAOUGMQZBWHCLF-WOJBJXKFSA-N 2 1 312.501 4.057 20 0 DIADMP C[C@H]1C[N@@H+]([C@@H]2C[C@@H](C)N(Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056845 1044288552 /nfs/dbraw/zinc/28/85/52/1044288552.db2.gz JEBNIVQYUFXMQX-FTEYMNFISA-N 2 1 312.501 4.302 20 0 DIADMP C[C@H]1C[N@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056845 1044288567 /nfs/dbraw/zinc/28/85/67/1044288567.db2.gz JEBNIVQYUFXMQX-FTEYMNFISA-N 2 1 312.501 4.302 20 0 DIADMP C[C@H]1C[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056845 1044288580 /nfs/dbraw/zinc/28/85/80/1044288580.db2.gz JEBNIVQYUFXMQX-FTEYMNFISA-N 2 1 312.501 4.302 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056845 1044288596 /nfs/dbraw/zinc/28/85/96/1044288596.db2.gz JEBNIVQYUFXMQX-FTEYMNFISA-N 2 1 312.501 4.302 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056845 1044288612 /nfs/dbraw/zinc/28/86/12/1044288612.db2.gz JEBNIVQYUFXMQX-FTEYMNFISA-N 2 1 312.501 4.302 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](c2cccnc2)C2CCC2)c1 ZINC000360840030 1044317143 /nfs/dbraw/zinc/31/71/43/1044317143.db2.gz KOINENWYWAJVQA-NRFANRHFSA-N 2 1 323.484 4.164 20 0 DIADMP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]CCn1cc[nH+]c1C ZINC000360948399 1044335317 /nfs/dbraw/zinc/33/53/17/1044335317.db2.gz RYXAPYUWALGFGE-OAHLLOKOSA-N 2 1 323.893 4.005 20 0 DIADMP Cc1ccccc1C[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475276527 1044339718 /nfs/dbraw/zinc/33/97/18/1044339718.db2.gz PBXGJPVAXGJSAL-TZIWHRDSSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000361079552 1044357769 /nfs/dbraw/zinc/35/77/69/1044357769.db2.gz LIQNLEKCCVDCSH-OXQOHEQNSA-N 2 1 316.489 4.014 20 0 DIADMP C[NH+](C)[C@H](CNc1cc[nH+]c2ccsc21)c1ccsc1 ZINC000361161886 1044366911 /nfs/dbraw/zinc/36/69/11/1044366911.db2.gz OQCMSTMUZSMXTA-CQSZACIVSA-N 2 1 303.456 4.073 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1nccc2ccccc21 ZINC000564439939 1044380231 /nfs/dbraw/zinc/38/02/31/1044380231.db2.gz XBXHUUBVFVBXJD-INIZCTEOSA-N 2 1 311.473 4.007 20 0 DIADMP CCc1[nH+]ccn1[C@@H]1CCCN(c2nccc3c(C)cccc32)C1 ZINC000564893834 1044407995 /nfs/dbraw/zinc/40/79/95/1044407995.db2.gz WJIWMQCGEWPZBW-MRXNPFEDSA-N 2 1 320.440 4.144 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000565257137 1044423527 /nfs/dbraw/zinc/42/35/27/1044423527.db2.gz DGLSJXGIAZJXIQ-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000565257137 1044423545 /nfs/dbraw/zinc/42/35/45/1044423545.db2.gz DGLSJXGIAZJXIQ-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000565257137 1044423551 /nfs/dbraw/zinc/42/35/51/1044423551.db2.gz DGLSJXGIAZJXIQ-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000565257137 1044423556 /nfs/dbraw/zinc/42/35/56/1044423556.db2.gz DGLSJXGIAZJXIQ-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000565257137 1044423563 /nfs/dbraw/zinc/42/35/63/1044423563.db2.gz DGLSJXGIAZJXIQ-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@H](C[NH2+][C@H]1CCSc2c(F)cccc21)C[NH+]1CCCCC1 ZINC000336851129 1044439003 /nfs/dbraw/zinc/43/90/03/1044439003.db2.gz HEJVQPTZEDRUFD-PBHICJAKSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cccnc1 ZINC000112527834 1044443420 /nfs/dbraw/zinc/44/34/20/1044443420.db2.gz VGCXFVPZZFQMLI-ROUUACIJSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1cscc1C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000565744574 1044454359 /nfs/dbraw/zinc/45/43/59/1044454359.db2.gz WYHLGICAXSCJCJ-AEFFLSMTSA-N 2 1 314.498 4.057 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+](C)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000566429078 1044491289 /nfs/dbraw/zinc/49/12/89/1044491289.db2.gz PGVHTOUSPNESNS-WOJBJXKFSA-N 2 1 311.473 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+](C)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000566429078 1044491295 /nfs/dbraw/zinc/49/12/95/1044491295.db2.gz PGVHTOUSPNESNS-WOJBJXKFSA-N 2 1 311.473 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+](C)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000566429077 1044492329 /nfs/dbraw/zinc/49/23/29/1044492329.db2.gz PGVHTOUSPNESNS-VQTJNVASSA-N 2 1 311.473 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+](C)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000566429077 1044492332 /nfs/dbraw/zinc/49/23/32/1044492332.db2.gz PGVHTOUSPNESNS-VQTJNVASSA-N 2 1 311.473 4.011 20 0 DIADMP c1ccc(-c2ccc(C[NH2+]C3CC([NH+]4CCCCC4)C3)cc2)cc1 ZINC000475548068 1044492921 /nfs/dbraw/zinc/49/29/21/1044492921.db2.gz AGKPSCGJKFFOTK-UHFFFAOYSA-N 2 1 320.480 4.460 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000121431887 1044526125 /nfs/dbraw/zinc/52/61/25/1044526125.db2.gz RIKXXPQGGLWCST-OLZOCXBDSA-N 2 1 320.506 4.067 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148032 1044546362 /nfs/dbraw/zinc/54/63/62/1044546362.db2.gz AMPOZOSMWRJRCS-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148032 1044546377 /nfs/dbraw/zinc/54/63/77/1044546377.db2.gz AMPOZOSMWRJRCS-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148032 1044546392 /nfs/dbraw/zinc/54/63/92/1044546392.db2.gz AMPOZOSMWRJRCS-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148032 1044546403 /nfs/dbraw/zinc/54/64/03/1044546403.db2.gz AMPOZOSMWRJRCS-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3cccs3)cc2)C1 ZINC000444634448 1044578969 /nfs/dbraw/zinc/57/89/69/1044578969.db2.gz AZLWVLVVIWRLCT-KRWDZBQOSA-N 2 1 314.498 4.189 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCC(C)(F)F)cc1 ZINC000296003267 1044582470 /nfs/dbraw/zinc/58/24/70/1044582470.db2.gz LBHWQPVQPNYMDV-ZDUSSCGKSA-N 2 1 307.388 4.267 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3cccs3)cc2)CC1 ZINC000444638525 1044588809 /nfs/dbraw/zinc/58/88/09/1044588809.db2.gz JDEPOMGMQPNRKY-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CC1 ZINC000444638525 1044588826 /nfs/dbraw/zinc/58/88/26/1044588826.db2.gz JDEPOMGMQPNRKY-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000567966219 1044594369 /nfs/dbraw/zinc/59/43/69/1044594369.db2.gz VAAXMJSJRFJESL-QVOMUQBLSA-N 2 1 320.443 4.064 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC000444672235 1044597032 /nfs/dbraw/zinc/59/70/32/1044597032.db2.gz YXZXFQKYAFEGEM-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315276 1044600433 /nfs/dbraw/zinc/60/04/33/1044600433.db2.gz JQJNSEYCOPNHHC-MSOLQXFVSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315276 1044600439 /nfs/dbraw/zinc/60/04/39/1044600439.db2.gz JQJNSEYCOPNHHC-MSOLQXFVSA-N 2 1 318.480 4.331 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2CCc2ccccc2)C1 ZINC000568140567 1044606328 /nfs/dbraw/zinc/60/63/28/1044606328.db2.gz PLUMYDNNCZCHLX-QHAWAJNXSA-N 2 1 314.517 4.108 20 0 DIADMP Cc1ccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524052 1044631686 /nfs/dbraw/zinc/63/16/86/1044631686.db2.gz PTEOVRIGOPEVHR-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524052 1044631690 /nfs/dbraw/zinc/63/16/90/1044631690.db2.gz PTEOVRIGOPEVHR-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524052 1044631695 /nfs/dbraw/zinc/63/16/95/1044631695.db2.gz PTEOVRIGOPEVHR-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000568524052 1044631703 /nfs/dbraw/zinc/63/17/03/1044631703.db2.gz PTEOVRIGOPEVHR-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H](C)c1c[nH+]ccc1N)CCC2 ZINC000568499885 1044631888 /nfs/dbraw/zinc/63/18/88/1044631888.db2.gz SXENGBGFEAGPLE-JLTOFOAXSA-N 2 1 309.457 4.346 20 0 DIADMP CC[C@H](c1ccc(F)cc1F)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000523442177 1044638296 /nfs/dbraw/zinc/63/82/96/1044638296.db2.gz ONOZKYGOYFXDGF-LJQANCHMSA-N 2 1 324.459 4.468 20 0 DIADMP C[N@H+]1CC[C@@H](NC2(c3ccccc3F)CC2)C[C@@H]1c1ccccc1 ZINC000569013756 1044666317 /nfs/dbraw/zinc/66/63/17/1044666317.db2.gz NHPJRUREBHJMNG-YLJYHZDGSA-N 2 1 324.443 4.240 20 0 DIADMP CN1CC[C@@H]([NH2+]C2(c3ccccc3F)CC2)C[C@@H]1c1ccccc1 ZINC000569013756 1044666330 /nfs/dbraw/zinc/66/63/30/1044666330.db2.gz NHPJRUREBHJMNG-YLJYHZDGSA-N 2 1 324.443 4.240 20 0 DIADMP C[C@@H]1CC[C@@H]1[NH2+]CC1([N@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233201 1044670555 /nfs/dbraw/zinc/67/05/55/1044670555.db2.gz NYRSJIOLMACFBO-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CC[C@@H]1[NH2+]CC1([N@@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233201 1044670562 /nfs/dbraw/zinc/67/05/62/1044670562.db2.gz NYRSJIOLMACFBO-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CC/C=C\c3ccccc3)CC2)[nH+]c1C ZINC000886660868 1044677404 /nfs/dbraw/zinc/67/74/04/1044677404.db2.gz HSNZFMCMTNOOMJ-POHAHGRESA-N 2 1 309.457 4.309 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000367905629 1044756932 /nfs/dbraw/zinc/75/69/32/1044756932.db2.gz ABKQPOJYOJTXOE-INIZCTEOSA-N 2 1 303.475 4.116 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000367905629 1044756947 /nfs/dbraw/zinc/75/69/47/1044756947.db2.gz ABKQPOJYOJTXOE-INIZCTEOSA-N 2 1 303.475 4.116 20 0 DIADMP CC1=C[C@H](C)C[C@H](C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000570764252 1044780985 /nfs/dbraw/zinc/78/09/85/1044780985.db2.gz FUUOQKUUVOMZCO-WZGPROSRSA-N 2 1 304.522 4.221 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000571096809 1044797779 /nfs/dbraw/zinc/79/77/79/1044797779.db2.gz UBGOKCKHXHXZGU-GBESFXJTSA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000571096809 1044797793 /nfs/dbraw/zinc/79/77/93/1044797793.db2.gz UBGOKCKHXHXZGU-GBESFXJTSA-N 2 1 317.521 4.126 20 0 DIADMP CSC1(C[NH2+]CC2([NH2+][C@@H](C)c3ccccc3)CCCC2)CC1 ZINC000571842912 1044828706 /nfs/dbraw/zinc/82/87/06/1044828706.db2.gz YSFVKPVKOJZNNM-INIZCTEOSA-N 2 1 318.530 4.135 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000573112787 1044892928 /nfs/dbraw/zinc/89/29/28/1044892928.db2.gz LHEQHEVEPFUIFZ-FGZHOGPDSA-N 2 1 320.480 4.297 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000573112787 1044892946 /nfs/dbraw/zinc/89/29/46/1044892946.db2.gz LHEQHEVEPFUIFZ-FGZHOGPDSA-N 2 1 320.480 4.297 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000573112785 1044894019 /nfs/dbraw/zinc/89/40/19/1044894019.db2.gz LHEQHEVEPFUIFZ-FCHUYYIVSA-N 2 1 320.480 4.297 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000573112785 1044894044 /nfs/dbraw/zinc/89/40/44/1044894044.db2.gz LHEQHEVEPFUIFZ-FCHUYYIVSA-N 2 1 320.480 4.297 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1cnn(C2CCCC2)c1)C(C)C ZINC000337485623 1044908225 /nfs/dbraw/zinc/90/82/25/1044908225.db2.gz SGERTUNDDGXFHD-KRWDZBQOSA-N 2 1 320.525 4.158 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000574178587 1044943674 /nfs/dbraw/zinc/94/36/74/1044943674.db2.gz LBNHFCZYFRONRK-LEWJYISDSA-N 2 1 320.480 4.143 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000574178587 1044943698 /nfs/dbraw/zinc/94/36/98/1044943698.db2.gz LBNHFCZYFRONRK-LEWJYISDSA-N 2 1 320.480 4.143 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC000574761760 1044969694 /nfs/dbraw/zinc/96/96/94/1044969694.db2.gz NIECAVKKWCNAMN-AEFFLSMTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC000574761760 1044969712 /nfs/dbraw/zinc/96/97/12/1044969712.db2.gz NIECAVKKWCNAMN-AEFFLSMTSA-N 2 1 300.490 4.208 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC)CC2)cc1 ZINC000575337126 1044995005 /nfs/dbraw/zinc/99/50/05/1044995005.db2.gz BULSITBGTYTLND-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000575336984 1044995443 /nfs/dbraw/zinc/99/54/43/1044995443.db2.gz XJYSPCXZYMUARJ-ZACQAIPSSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000575336984 1044995456 /nfs/dbraw/zinc/99/54/56/1044995456.db2.gz XJYSPCXZYMUARJ-ZACQAIPSSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000575336984 1044995477 /nfs/dbraw/zinc/99/54/77/1044995477.db2.gz XJYSPCXZYMUARJ-ZACQAIPSSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@H](c1ccccn1)[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411427400 1045005051 /nfs/dbraw/zinc/00/50/51/1045005051.db2.gz UHFRVCUZQBRCBJ-GOSISDBHSA-N 2 1 323.484 4.261 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1Cl ZINC000575974960 1045024132 /nfs/dbraw/zinc/02/41/32/1045024132.db2.gz IKQLMGAGHPODOI-YCPHGPKFSA-N 2 1 324.896 4.261 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3s2)C1 ZINC000446745820 1045029197 /nfs/dbraw/zinc/02/91/97/1045029197.db2.gz QODODCCLVLIPED-LSDHHAIUSA-N 2 1 302.487 4.284 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000446755214 1045031764 /nfs/dbraw/zinc/03/17/64/1045031764.db2.gz YZQBRTQUSXEYNY-UTKZUKDTSA-N 2 1 312.501 4.300 20 0 DIADMP Cc1nccn1CCCC[N@H+]1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000411976861 1045039860 /nfs/dbraw/zinc/03/98/60/1045039860.db2.gz FEVXJIPEXQDPIT-HXUWFJFHSA-N 2 1 323.484 4.241 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000411976861 1045039873 /nfs/dbraw/zinc/03/98/73/1045039873.db2.gz FEVXJIPEXQDPIT-HXUWFJFHSA-N 2 1 323.484 4.241 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000411976861 1045039883 /nfs/dbraw/zinc/03/98/83/1045039883.db2.gz FEVXJIPEXQDPIT-HXUWFJFHSA-N 2 1 323.484 4.241 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccnc1Cl ZINC000158572183 1045040696 /nfs/dbraw/zinc/04/06/96/1045040696.db2.gz HUJPGXWVINHVOE-XHSDSOJGSA-N 2 1 323.912 4.144 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@@H](C)C[C@H](c2ccccc2)C1)c1c[nH+]ccc1N ZINC000576576077 1045066669 /nfs/dbraw/zinc/06/66/69/1045066669.db2.gz GQWKZPTYWDWXMD-LAQRGFTBSA-N 2 1 309.457 4.117 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC2CCCCC2)C3)cc1 ZINC000447512186 1045139896 /nfs/dbraw/zinc/13/98/96/1045139896.db2.gz OWCILOAQTVORGU-WKCHPHFGSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H]1CCN(C)[C@H](C)C1 ZINC000447560357 1045149718 /nfs/dbraw/zinc/14/97/18/1045149718.db2.gz VQPZZNMRXNXQAO-YCPHGPKFSA-N 2 1 314.395 4.061 20 0 DIADMP C[C@H](CC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000447726447 1045167478 /nfs/dbraw/zinc/16/74/78/1045167478.db2.gz FUXOEBRQHQBPMG-QUCCMNQESA-N 2 1 300.490 4.131 20 0 DIADMP C[C@@H](CC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000447726445 1045167717 /nfs/dbraw/zinc/16/77/17/1045167717.db2.gz FUXOEBRQHQBPMG-AZUAARDMSA-N 2 1 300.490 4.131 20 0 DIADMP C[C@H](CC[NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccc1 ZINC000447822217 1045178343 /nfs/dbraw/zinc/17/83/43/1045178343.db2.gz PCOMNXWAAUOCSZ-RTBURBONSA-N 2 1 302.506 4.424 20 0 DIADMP CCC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ncccc1Cl ZINC000924949521 1045214409 /nfs/dbraw/zinc/21/44/09/1045214409.db2.gz GUUJUNVBQKVFBX-BBRMVZONSA-N 2 1 320.868 4.007 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192205 1045219210 /nfs/dbraw/zinc/21/92/10/1045219210.db2.gz HELATJLJCACYNZ-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192205 1045219220 /nfs/dbraw/zinc/21/92/20/1045219220.db2.gz HELATJLJCACYNZ-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1c(C)oc2ccccc21 ZINC000925133217 1045228844 /nfs/dbraw/zinc/22/88/44/1045228844.db2.gz KQJISTGDAYFLBV-CQSZACIVSA-N 2 1 311.429 4.377 20 0 DIADMP CCC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ncccc1Cl ZINC000925133991 1045228992 /nfs/dbraw/zinc/22/89/92/1045228992.db2.gz ODKUTQOUHCOKDZ-INIZCTEOSA-N 2 1 320.868 4.151 20 0 DIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)ccn1 ZINC000527639081 1045242744 /nfs/dbraw/zinc/24/27/44/1045242744.db2.gz AZMOXPSZJAETJG-SFHVURJKSA-N 2 1 323.484 4.054 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000527637704 1045243397 /nfs/dbraw/zinc/24/33/97/1045243397.db2.gz OAJXVUIWTBPZHX-SXLOBPIMSA-N 2 1 312.501 4.177 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)C(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000697101663 1045310609 /nfs/dbraw/zinc/31/06/09/1045310609.db2.gz PNYJELRJUWJHNV-DOTOQJQBSA-N 2 1 324.459 4.311 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3CC[N@H+](C)C[C@H]3C)CCCC2)c(C)c1 ZINC000579383094 1045311856 /nfs/dbraw/zinc/31/18/56/1045311856.db2.gz GJSCYQJTSRQVHJ-UYAOXDASSA-N 2 1 314.517 4.045 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1cccnc1 ZINC000449068717 1045343350 /nfs/dbraw/zinc/34/33/50/1045343350.db2.gz UOSIZPPXCGPXRE-MRXNPFEDSA-N 2 1 317.521 4.411 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000449072686 1045344400 /nfs/dbraw/zinc/34/44/00/1045344400.db2.gz GGMVMRQIGJAAMX-GOSISDBHSA-N 2 1 320.480 4.236 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)cs1 ZINC000449106629 1045347224 /nfs/dbraw/zinc/34/72/24/1045347224.db2.gz MXWGHDKRCPPTCS-OAHLLOKOSA-N 2 1 320.527 4.120 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)cs1 ZINC000449106629 1045347231 /nfs/dbraw/zinc/34/72/31/1045347231.db2.gz MXWGHDKRCPPTCS-OAHLLOKOSA-N 2 1 320.527 4.120 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449107422 1045347926 /nfs/dbraw/zinc/34/79/26/1045347926.db2.gz MJVGKVUYEGGTTB-GOSISDBHSA-N 2 1 315.848 4.071 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000449093710 1045348977 /nfs/dbraw/zinc/34/89/77/1045348977.db2.gz XEQWXHLYOJEQPY-FUHWJXTLSA-N 2 1 317.864 4.161 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)Cc2coc3ccccc23)C1 ZINC000449129631 1045350216 /nfs/dbraw/zinc/35/02/16/1045350216.db2.gz DABVCRFRUPCUBS-IAGOWNOFSA-N 2 1 314.473 4.074 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000449175088 1045355001 /nfs/dbraw/zinc/35/50/01/1045355001.db2.gz QGBZZODTQZNLPC-HKUYNNGSSA-N 2 1 308.469 4.234 20 0 DIADMP C[C@H]([NH2+]Cc1cccc2ccoc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000449234783 1045363486 /nfs/dbraw/zinc/36/34/86/1045363486.db2.gz RDAGPYDPLLXMSO-MAUKXSAKSA-N 2 1 312.457 4.175 20 0 DIADMP Cc1csc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000449478447 1045398797 /nfs/dbraw/zinc/39/87/97/1045398797.db2.gz KIIPPXJOQOBCAD-AEFFLSMTSA-N 2 1 314.498 4.057 20 0 DIADMP Cc1csc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000449482512 1045400659 /nfs/dbraw/zinc/40/06/59/1045400659.db2.gz YOQWDZVDZVSUIJ-CQSZACIVSA-N 2 1 311.454 4.401 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000119242490 1045411357 /nfs/dbraw/zinc/41/13/57/1045411357.db2.gz WUWXLOJDOXZOLL-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000119242490 1045411361 /nfs/dbraw/zinc/41/13/61/1045411361.db2.gz WUWXLOJDOXZOLL-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000449559634 1045413943 /nfs/dbraw/zinc/41/39/43/1045413943.db2.gz CHUMOLWNVUBJJX-UMQXSMKFSA-N 2 1 300.490 4.003 20 0 DIADMP c1ccc([C@@H]2CCCC[C@@H]2C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000449691824 1045427358 /nfs/dbraw/zinc/42/73/58/1045427358.db2.gz YOBYITDHNOWSDY-CGXNFDGLSA-N 2 1 312.501 4.177 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449730663 1045430991 /nfs/dbraw/zinc/43/09/91/1045430991.db2.gz FXCVSICUDUJXBJ-QAPCUYQASA-N 2 1 306.881 4.050 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cnc(C)cc2C)cc1 ZINC000449734811 1045431749 /nfs/dbraw/zinc/43/17/49/1045431749.db2.gz OIOFIGQGKLAFAE-MRXNPFEDSA-N 2 1 320.440 4.043 20 0 DIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000449778533 1045436433 /nfs/dbraw/zinc/43/64/33/1045436433.db2.gz WPAFEZGPQTXVTA-LULLPPNCSA-N 2 1 318.892 4.193 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC000449780709 1045437721 /nfs/dbraw/zinc/43/77/21/1045437721.db2.gz ZAGJFVPOXMULGF-MAUKXSAKSA-N 2 1 306.881 4.050 20 0 DIADMP C[C@H](NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714732 1045574818 /nfs/dbraw/zinc/57/48/18/1045574818.db2.gz AKISXLIYDAREOV-HKUYNNGSSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714732 1045574827 /nfs/dbraw/zinc/57/48/27/1045574827.db2.gz AKISXLIYDAREOV-HKUYNNGSSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714732 1045574839 /nfs/dbraw/zinc/57/48/39/1045574839.db2.gz AKISXLIYDAREOV-HKUYNNGSSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000720184278 1045578213 /nfs/dbraw/zinc/57/82/13/1045578213.db2.gz MQOZFDKKTXYBIP-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC000720184278 1045578222 /nfs/dbraw/zinc/57/82/22/1045578222.db2.gz MQOZFDKKTXYBIP-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC/C=C/c1ccccc1 ZINC000450861550 1045581007 /nfs/dbraw/zinc/58/10/07/1045581007.db2.gz YULIRQCBTLRJIV-KPKJPENVSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC/C=C/c1ccccc1 ZINC000450861550 1045581011 /nfs/dbraw/zinc/58/10/11/1045581011.db2.gz YULIRQCBTLRJIV-KPKJPENVSA-N 2 1 311.473 4.261 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000450892582 1045589990 /nfs/dbraw/zinc/58/99/90/1045589990.db2.gz FAEXWIBMZOLILY-NRFANRHFSA-N 2 1 319.452 4.107 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000450892582 1045589998 /nfs/dbraw/zinc/58/99/98/1045589998.db2.gz FAEXWIBMZOLILY-NRFANRHFSA-N 2 1 319.452 4.107 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)[C@H](CC(F)(F)F)C[C@@H]1C ZINC000451146804 1045632596 /nfs/dbraw/zinc/63/25/96/1045632596.db2.gz NCODJRGGPNUIGV-GUTXKFCHSA-N 2 1 317.399 4.023 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)[C@H](CC(F)(F)F)C[C@@H]1C ZINC000451146804 1045632604 /nfs/dbraw/zinc/63/26/04/1045632604.db2.gz NCODJRGGPNUIGV-GUTXKFCHSA-N 2 1 317.399 4.023 20 0 DIADMP Clc1ccc(/C=C\C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334956 1045646533 /nfs/dbraw/zinc/64/65/33/1045646533.db2.gz KIHZZHZWIWSGDY-SIEMBAAWSA-N 2 1 318.892 4.304 20 0 DIADMP Clc1ccc(/C=C\C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334956 1045646541 /nfs/dbraw/zinc/64/65/41/1045646541.db2.gz KIHZZHZWIWSGDY-SIEMBAAWSA-N 2 1 318.892 4.304 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666054 1045706904 /nfs/dbraw/zinc/70/69/04/1045706904.db2.gz SNKRRJUKDULZFX-OCCSQVGLSA-N 2 1 315.288 4.298 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666054 1045706916 /nfs/dbraw/zinc/70/69/16/1045706916.db2.gz SNKRRJUKDULZFX-OCCSQVGLSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666054 1045706927 /nfs/dbraw/zinc/70/69/27/1045706927.db2.gz SNKRRJUKDULZFX-OCCSQVGLSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@H]1C ZINC000530666054 1045706939 /nfs/dbraw/zinc/70/69/39/1045706939.db2.gz SNKRRJUKDULZFX-OCCSQVGLSA-N 2 1 315.288 4.298 20 0 DIADMP CCCC[N@H+](CCCCn1cc[nH+]c1C)[C@@H]1CCCC[C@H]1OC ZINC000451650241 1045707931 /nfs/dbraw/zinc/70/79/31/1045707931.db2.gz JZGBJZKGAVTITB-RTBURBONSA-N 2 1 321.509 4.031 20 0 DIADMP CCCC[N@@H+](CCCCn1cc[nH+]c1C)[C@@H]1CCCC[C@H]1OC ZINC000451650241 1045707944 /nfs/dbraw/zinc/70/79/44/1045707944.db2.gz JZGBJZKGAVTITB-RTBURBONSA-N 2 1 321.509 4.031 20 0 DIADMP CC(C)[N@H+](C)CC1CC[NH+]([C@@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000530869222 1045744840 /nfs/dbraw/zinc/74/48/40/1045744840.db2.gz YXLRUWLKBULYSP-HNNXBMFYSA-N 2 1 321.509 4.085 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000530869222 1045744854 /nfs/dbraw/zinc/74/48/54/1045744854.db2.gz YXLRUWLKBULYSP-HNNXBMFYSA-N 2 1 321.509 4.085 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000451971042 1045758710 /nfs/dbraw/zinc/75/87/10/1045758710.db2.gz MNDUNZLFFNGDJT-GOSISDBHSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1ccc(F)cc1F ZINC000451971042 1045758721 /nfs/dbraw/zinc/75/87/21/1045758721.db2.gz MNDUNZLFFNGDJT-GOSISDBHSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)s1 ZINC000631706516 1045906866 /nfs/dbraw/zinc/90/68/66/1045906866.db2.gz GTWKHJWTSLEKOC-KEYYUXOJSA-N 2 1 321.534 4.145 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)s1 ZINC000631706564 1045907310 /nfs/dbraw/zinc/90/73/10/1045907310.db2.gz IDXJOJNYYSBTKT-JKIFEVAISA-N 2 1 321.534 4.145 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)s1 ZINC000631706515 1045907942 /nfs/dbraw/zinc/90/79/42/1045907942.db2.gz GTWKHJWTSLEKOC-JKIFEVAISA-N 2 1 321.534 4.145 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc2c(c1)CCCC2 ZINC000531725282 1045914030 /nfs/dbraw/zinc/91/40/30/1045914030.db2.gz WXABEDHTPCTNLJ-INIZCTEOSA-N 2 1 311.473 4.201 20 0 DIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)c1ccncc1 ZINC000453065878 1045916022 /nfs/dbraw/zinc/91/60/22/1045916022.db2.gz VTVKFLJZRSIBJT-FQEVSTJZSA-N 2 1 311.473 4.163 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1csc2ccccc12 ZINC000754733974 1045919923 /nfs/dbraw/zinc/91/99/23/1045919923.db2.gz DRNJZZFUSVGBOA-CABCVRRESA-N 2 1 302.487 4.426 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1csc2ccccc12 ZINC000754733984 1045921732 /nfs/dbraw/zinc/92/17/32/1045921732.db2.gz DRNJZZFUSVGBOA-LSDHHAIUSA-N 2 1 302.487 4.426 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1csc2ccccc12 ZINC000754740787 1045923669 /nfs/dbraw/zinc/92/36/69/1045923669.db2.gz UCNCWZPNDBIXML-UONOGXRCSA-N 2 1 313.470 4.393 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H](C3CC3)C3CCC3)C2)c1 ZINC000453099759 1045948757 /nfs/dbraw/zinc/94/87/57/1045948757.db2.gz ZGQJFNLCNSWQIK-BEFAXECRSA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H](C3CC3)C3CCC3)C2)c1 ZINC000453099759 1045948771 /nfs/dbraw/zinc/94/87/71/1045948771.db2.gz ZGQJFNLCNSWQIK-BEFAXECRSA-N 2 1 318.530 4.128 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453227804 1045995623 /nfs/dbraw/zinc/99/56/23/1045995623.db2.gz FYHAEJLUOSOMRX-NNZMDNLPSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)(F)F ZINC000453301320 1046021129 /nfs/dbraw/zinc/02/11/29/1046021129.db2.gz XVGKGYUYASHIIV-ODIFPOPNSA-N 2 1 310.432 4.063 20 0 DIADMP Cc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CCCC2)o1 ZINC000453336021 1046041782 /nfs/dbraw/zinc/04/17/82/1046041782.db2.gz FHBICVOVQOEPLH-PHSGOXPASA-N 2 1 302.462 4.034 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CCCC2)o1 ZINC000453336021 1046041807 /nfs/dbraw/zinc/04/18/07/1046041807.db2.gz FHBICVOVQOEPLH-PHSGOXPASA-N 2 1 302.462 4.034 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1F ZINC000453349632 1046051099 /nfs/dbraw/zinc/05/10/99/1046051099.db2.gz LRVXMPDVFMZRRM-MUSFGAPCSA-N 2 1 324.871 4.391 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1F ZINC000453349632 1046051115 /nfs/dbraw/zinc/05/11/15/1046051115.db2.gz LRVXMPDVFMZRRM-MUSFGAPCSA-N 2 1 324.871 4.391 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753818 1046060523 /nfs/dbraw/zinc/06/05/23/1046060523.db2.gz UGOGPCWDGAWWSG-QJPTWQEYSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753818 1046060532 /nfs/dbraw/zinc/06/05/32/1046060532.db2.gz UGOGPCWDGAWWSG-QJPTWQEYSA-N 2 1 318.408 4.044 20 0 DIADMP Cc1ccc([C@H]2CCC[C@H]2[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000453386178 1046062842 /nfs/dbraw/zinc/06/28/42/1046062842.db2.gz AFQZJYYDQZTYOP-WOJBJXKFSA-N 2 1 300.490 4.095 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453377774 1046073583 /nfs/dbraw/zinc/07/35/83/1046073583.db2.gz ZANYFZRSKZAPTP-WZYMTQMTSA-N 2 1 304.503 4.074 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453377677 1046073777 /nfs/dbraw/zinc/07/37/77/1046073777.db2.gz YWMSCHZNTRCRGP-UXDRXVOSSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC000453380656 1046075195 /nfs/dbraw/zinc/07/51/95/1046075195.db2.gz BAIUSEWANWJOHZ-AETAKHFUSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC000453380656 1046075209 /nfs/dbraw/zinc/07/52/09/1046075209.db2.gz BAIUSEWANWJOHZ-AETAKHFUSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000453404278 1046077360 /nfs/dbraw/zinc/07/73/60/1046077360.db2.gz PKYMZOQSHHPDKL-CYBMUJFWSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(-c2ccncc2)c1 ZINC000453405344 1046077919 /nfs/dbraw/zinc/07/79/19/1046077919.db2.gz QJJHGMNRMOTWGH-KRWDZBQOSA-N 2 1 323.484 4.274 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453410806 1046079828 /nfs/dbraw/zinc/07/98/28/1046079828.db2.gz VHQPVUFCOQDZFD-HNNXBMFYSA-N 2 1 300.446 4.266 20 0 DIADMP C[C@@H](CCc1ccc(Cl)s1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453395300 1046083821 /nfs/dbraw/zinc/08/38/21/1046083821.db2.gz HQDYELGYPZFBMW-ZDUSSCGKSA-N 2 1 314.926 4.187 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000532220090 1046116417 /nfs/dbraw/zinc/11/64/17/1046116417.db2.gz QFPMKQGCKYZCOR-MRXNPFEDSA-N 2 1 321.424 4.335 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000532246938 1046120814 /nfs/dbraw/zinc/12/08/14/1046120814.db2.gz HSCHXRUVRWIORX-IIDMSEBBSA-N 2 1 322.924 4.227 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000532235994 1046123023 /nfs/dbraw/zinc/12/30/23/1046123023.db2.gz TYCIDHLEFXOAOJ-XLMAVXFVSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000532235994 1046123031 /nfs/dbraw/zinc/12/30/31/1046123031.db2.gz TYCIDHLEFXOAOJ-XLMAVXFVSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccccc1Cl ZINC000903055738 1046151195 /nfs/dbraw/zinc/15/11/95/1046151195.db2.gz KMTQHNDDBGYNRE-WPXLMEDKSA-N 2 1 304.865 4.148 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccccc1Cl ZINC000903055738 1046151207 /nfs/dbraw/zinc/15/12/07/1046151207.db2.gz KMTQHNDDBGYNRE-WPXLMEDKSA-N 2 1 304.865 4.148 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069630 1046155399 /nfs/dbraw/zinc/15/53/99/1046155399.db2.gz IPVYBLVPJGBSGD-NWDGAFQWSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069630 1046155402 /nfs/dbraw/zinc/15/54/02/1046155402.db2.gz IPVYBLVPJGBSGD-NWDGAFQWSA-N 2 1 320.424 4.149 20 0 DIADMP Cc1[nH]c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)cc2c1C ZINC000903081144 1046159549 /nfs/dbraw/zinc/15/95/49/1046159549.db2.gz SVPOWQINBYNJLJ-JLYLLQBASA-N 2 1 323.484 4.032 20 0 DIADMP CCSc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903216778 1046195835 /nfs/dbraw/zinc/19/58/35/1046195835.db2.gz IKNXKHHJKZWTGP-ZNXRZULTSA-N 2 1 316.514 4.046 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2Cc3cccc(C)c3C2)cc1 ZINC001138545156 1046218628 /nfs/dbraw/zinc/21/86/28/1046218628.db2.gz SJHWVDBIHYWBQE-UHFFFAOYSA-N 2 1 303.409 4.005 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2Cc3cccc(C)c3C2)cc1 ZINC001138545156 1046218640 /nfs/dbraw/zinc/21/86/40/1046218640.db2.gz SJHWVDBIHYWBQE-UHFFFAOYSA-N 2 1 303.409 4.005 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCC3(C2)CCCCC3)cc1 ZINC001138551521 1046226138 /nfs/dbraw/zinc/22/61/38/1046226138.db2.gz JYYULUSGTBPIPY-UHFFFAOYSA-N 2 1 309.457 4.337 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC001138551521 1046226155 /nfs/dbraw/zinc/22/61/55/1046226155.db2.gz JYYULUSGTBPIPY-UHFFFAOYSA-N 2 1 309.457 4.337 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccc(F)cc4)cc3)C2)C1 ZINC001138684282 1046266918 /nfs/dbraw/zinc/26/69/18/1046266918.db2.gz DXCZAGIXGASPNB-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP c1csc(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000638280806 1046308350 /nfs/dbraw/zinc/30/83/50/1046308350.db2.gz KIZAJAOBJHHQQV-QFBILLFUSA-N 2 1 312.482 4.206 20 0 DIADMP c1csc(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000638280806 1046308365 /nfs/dbraw/zinc/30/83/65/1046308365.db2.gz KIZAJAOBJHHQQV-QFBILLFUSA-N 2 1 312.482 4.206 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000638762127 1046339916 /nfs/dbraw/zinc/33/99/16/1046339916.db2.gz BEAIDWWRKPPPFJ-RYRKJORJSA-N 2 1 320.427 4.132 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000638762127 1046339924 /nfs/dbraw/zinc/33/99/24/1046339924.db2.gz BEAIDWWRKPPPFJ-RYRKJORJSA-N 2 1 320.427 4.132 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639215458 1046370926 /nfs/dbraw/zinc/37/09/26/1046370926.db2.gz BEGRFKKSIKVVKP-AEFFLSMTSA-N 2 1 322.443 4.380 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639215458 1046370930 /nfs/dbraw/zinc/37/09/30/1046370930.db2.gz BEGRFKKSIKVVKP-AEFFLSMTSA-N 2 1 322.443 4.380 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639215463 1046371099 /nfs/dbraw/zinc/37/10/99/1046371099.db2.gz BEGRFKKSIKVVKP-WMZOPIPTSA-N 2 1 322.443 4.380 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639215463 1046371112 /nfs/dbraw/zinc/37/11/12/1046371112.db2.gz BEGRFKKSIKVVKP-WMZOPIPTSA-N 2 1 322.443 4.380 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639215459 1046372219 /nfs/dbraw/zinc/37/22/19/1046372219.db2.gz BEGRFKKSIKVVKP-FUHWJXTLSA-N 2 1 322.443 4.380 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639215459 1046372234 /nfs/dbraw/zinc/37/22/34/1046372234.db2.gz BEGRFKKSIKVVKP-FUHWJXTLSA-N 2 1 322.443 4.380 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cc2ccccc2o1 ZINC001139064439 1046372580 /nfs/dbraw/zinc/37/25/80/1046372580.db2.gz BCZADGLSKFUPTC-ROUUACIJSA-N 2 1 312.457 4.272 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639273779 1046377436 /nfs/dbraw/zinc/37/74/36/1046377436.db2.gz NOWQGEFQMAWYPT-AFYVEPGGSA-N 2 1 322.452 4.093 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639273779 1046377445 /nfs/dbraw/zinc/37/74/45/1046377445.db2.gz NOWQGEFQMAWYPT-AFYVEPGGSA-N 2 1 322.452 4.093 20 0 DIADMP CC1CCC([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)CC1 ZINC001168219088 1046431303 /nfs/dbraw/zinc/43/13/03/1046431303.db2.gz DNKZBRXHDUBFFU-DQVLVPHSSA-N 2 1 312.501 4.163 20 0 DIADMP CC1CCC([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)CC1 ZINC001168219088 1046431310 /nfs/dbraw/zinc/43/13/10/1046431310.db2.gz DNKZBRXHDUBFFU-DQVLVPHSSA-N 2 1 312.501 4.163 20 0 DIADMP CC1CCC([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)CC1 ZINC001168219088 1046431313 /nfs/dbraw/zinc/43/13/13/1046431313.db2.gz DNKZBRXHDUBFFU-DQVLVPHSSA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)Cc1ccc(-n2ccnc2)cc1 ZINC001139357727 1046436706 /nfs/dbraw/zinc/43/67/06/1046436706.db2.gz HMAGTMINRVENEQ-UHFFFAOYSA-N 2 1 305.425 4.283 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000781428091 1046444724 /nfs/dbraw/zinc/44/47/24/1046444724.db2.gz ZNLIGNIKFJYZRA-CDXJDZJCSA-N 2 1 312.501 4.225 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cnc2ccccc2c1 ZINC001137282805 1046461269 /nfs/dbraw/zinc/46/12/69/1046461269.db2.gz MFBLZJIBLCXQJE-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cnc2ccccc2c1 ZINC001137282805 1046461277 /nfs/dbraw/zinc/46/12/77/1046461277.db2.gz MFBLZJIBLCXQJE-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cnc2ccccc2c1 ZINC001137282805 1046461284 /nfs/dbraw/zinc/46/12/84/1046461284.db2.gz MFBLZJIBLCXQJE-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1CCc1ccccc1 ZINC000125478920 1046468741 /nfs/dbraw/zinc/46/87/41/1046468741.db2.gz YKQOLGHRVVJABL-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000125478920 1046468748 /nfs/dbraw/zinc/46/87/48/1046468748.db2.gz YKQOLGHRVVJABL-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP c1ccc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000677236830 1046475119 /nfs/dbraw/zinc/47/51/19/1046475119.db2.gz VFGBCEMMIVTKIJ-VQTJNVASSA-N 2 1 312.501 4.105 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000126492111 1046476368 /nfs/dbraw/zinc/47/63/68/1046476368.db2.gz MJMWZAFFQQDUJU-WWTUQBGBSA-N 2 1 321.534 4.241 20 0 DIADMP CCCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC)cc1 ZINC000677241667 1046476366 /nfs/dbraw/zinc/47/63/66/1046476366.db2.gz RVZXKFSKFWJTGN-HBFSDRIKSA-N 2 1 316.489 4.143 20 0 DIADMP c1ccc(C2CCC(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000677240026 1046476892 /nfs/dbraw/zinc/47/68/92/1046476892.db2.gz DESSBGODUADGLT-BOWFFMLLSA-N 2 1 312.501 4.177 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C(C)(C)C)c1 ZINC000677240731 1046477246 /nfs/dbraw/zinc/47/72/46/1046477246.db2.gz JDCLZKVMQXDUBH-QYZOEREBSA-N 2 1 300.490 4.299 20 0 DIADMP c1ccc(-c2cccc(CC[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)c2)cc1 ZINC000677239873 1046477267 /nfs/dbraw/zinc/47/72/67/1046477267.db2.gz NKUAGEGYBRNWMX-YADHBBJMSA-N 2 1 320.480 4.113 20 0 DIADMP CCSc1ccccc1C[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206606090 1046490142 /nfs/dbraw/zinc/49/01/42/1046490142.db2.gz CUGUFZXVRCWCRW-QGZVFWFLSA-N 2 1 306.519 4.151 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2cccnc2)cc1)C1CCN(C)CC1 ZINC001139645123 1046493577 /nfs/dbraw/zinc/49/35/77/1046493577.db2.gz BRROFFKCNGFBLS-UHFFFAOYSA-N 2 1 323.484 4.053 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1cccc2ccccc21 ZINC000536607356 1046522464 /nfs/dbraw/zinc/52/24/64/1046522464.db2.gz UAGHNYBVZHGNLA-MRXNPFEDSA-N 2 1 307.441 4.428 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1cccc2ccccc21 ZINC000536607356 1046522472 /nfs/dbraw/zinc/52/24/72/1046522472.db2.gz UAGHNYBVZHGNLA-MRXNPFEDSA-N 2 1 307.441 4.428 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000677753729 1046523621 /nfs/dbraw/zinc/52/36/21/1046523621.db2.gz PHFABJASGLKEAM-SVFBPWRDSA-N 2 1 312.501 4.404 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)CCc1cccc(C)c1 ZINC001140027806 1046573214 /nfs/dbraw/zinc/57/32/14/1046573214.db2.gz BQPANBNWEHPMOS-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)CCc1cccc(C)c1 ZINC001140027806 1046573223 /nfs/dbraw/zinc/57/32/23/1046573223.db2.gz BQPANBNWEHPMOS-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(-c2ccc(F)cc2)s1 ZINC000642339476 1046599200 /nfs/dbraw/zinc/59/92/00/1046599200.db2.gz KSTKOXUVBMWJRO-UHFFFAOYSA-N 2 1 320.477 4.374 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000678425756 1046636384 /nfs/dbraw/zinc/63/63/84/1046636384.db2.gz CMTMRPNQXZKZMJ-AYBZRNKSSA-N 2 1 315.505 4.084 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000678425866 1046636396 /nfs/dbraw/zinc/63/63/96/1046636396.db2.gz DACNYBVDSIEUQI-ABSDTBQOSA-N 2 1 315.505 4.084 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)n1 ZINC000678427509 1046638275 /nfs/dbraw/zinc/63/82/75/1046638275.db2.gz LISBRRSUFDLJMM-KRWDZBQOSA-N 2 1 315.505 4.146 20 0 DIADMP CC[NH+](CC)C1CC[NH+](Cc2ccccc2-c2cccnc2)CC1 ZINC001140317230 1046651717 /nfs/dbraw/zinc/65/17/17/1046651717.db2.gz JDEFMEYMNHQJKN-UHFFFAOYSA-N 2 1 323.484 4.055 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000678594009 1046667254 /nfs/dbraw/zinc/66/72/54/1046667254.db2.gz TUHAIVJRRXFYDH-HWDJUHOGSA-N 2 1 318.892 4.254 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC000643468958 1046667827 /nfs/dbraw/zinc/66/78/27/1046667827.db2.gz RLYWEBNSIMGIQY-CEWLAPEOSA-N 2 1 306.453 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000643546022 1046671232 /nfs/dbraw/zinc/67/12/32/1046671232.db2.gz HDAQXWNOEDBKOV-NHYWBVRUSA-N 2 1 313.272 4.319 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]([C@@H]3CCc4cc(Cl)ccc43)C2)CC1 ZINC000796057348 1046708456 /nfs/dbraw/zinc/70/84/56/1046708456.db2.gz NMVCBJWYYQVHMW-GOSISDBHSA-N 2 1 318.892 4.135 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC000533425948 1046721517 /nfs/dbraw/zinc/72/15/17/1046721517.db2.gz ULILGJMEJOZVMI-MOPGFXCFSA-N 2 1 300.490 4.091 20 0 DIADMP CC(C)[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000797110259 1046791746 /nfs/dbraw/zinc/79/17/46/1046791746.db2.gz HDWLYAVWXDAZLF-XVLXNVKGSA-N 2 1 320.908 4.294 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000645465511 1046792853 /nfs/dbraw/zinc/79/28/53/1046792853.db2.gz IGNMSPUUIYCLOY-SFTDATJTSA-N 2 1 312.501 4.451 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc(O)cc2)cc1 ZINC000679392644 1046836186 /nfs/dbraw/zinc/83/61/86/1046836186.db2.gz DDBOFYLUMCGBMT-KRWDZBQOSA-N 2 1 324.468 4.056 20 0 DIADMP CCC[NH+]1CCC([NH2+]Cc2ccccc2Oc2ccccc2)CC1 ZINC000679468860 1046844624 /nfs/dbraw/zinc/84/46/24/1046844624.db2.gz RZIIAVOVZWHIPZ-UHFFFAOYSA-N 2 1 324.468 4.443 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000290017032 1046871346 /nfs/dbraw/zinc/87/13/46/1046871346.db2.gz CAQRHZPCIVKQNP-UYAOXDASSA-N 2 1 323.484 4.035 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)n1 ZINC000679722960 1046894689 /nfs/dbraw/zinc/89/46/89/1046894689.db2.gz IPHRXUDSQJXMLI-SZMVWBNQSA-N 2 1 315.505 4.002 20 0 DIADMP Cc1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c(Cl)c1 ZINC001140798799 1046904447 /nfs/dbraw/zinc/90/44/47/1046904447.db2.gz VESKTZBNQGMYNY-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1c[nH]c2cc[nH+]cc12 ZINC001140802804 1046908168 /nfs/dbraw/zinc/90/81/68/1046908168.db2.gz FFUUKSQBYHYFLU-IBGZPJMESA-N 2 1 309.388 4.429 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1c[nH]c2cc[nH+]cc12 ZINC001140802804 1046908177 /nfs/dbraw/zinc/90/81/77/1046908177.db2.gz FFUUKSQBYHYFLU-IBGZPJMESA-N 2 1 309.388 4.429 20 0 DIADMP CCCN1CCC([NH2+][C@H](C)c2sc(C(C)C)nc2C)CC1 ZINC000161600118 1046908621 /nfs/dbraw/zinc/90/86/21/1046908621.db2.gz BVAODPDWRDHNLE-CYBMUJFWSA-N 2 1 309.523 4.100 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2sc(C(C)C)nc2C)CC1 ZINC000161600118 1046908633 /nfs/dbraw/zinc/90/86/33/1046908633.db2.gz BVAODPDWRDHNLE-CYBMUJFWSA-N 2 1 309.523 4.100 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[NH+]1CCC2(CCc3ccccc32)CC1 ZINC001140801038 1046908926 /nfs/dbraw/zinc/90/89/26/1046908926.db2.gz ABBACHJKPGLDLD-UHFFFAOYSA-N 2 1 317.436 4.043 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001140805103 1046909376 /nfs/dbraw/zinc/90/93/76/1046909376.db2.gz RSLYZLJYFVQZBU-KRWDZBQOSA-N 2 1 305.425 4.333 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001140805103 1046909383 /nfs/dbraw/zinc/90/93/83/1046909383.db2.gz RSLYZLJYFVQZBU-KRWDZBQOSA-N 2 1 305.425 4.333 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@@H+]2Cc2c[nH]c3cc[nH+]cc23)cc1 ZINC001140807351 1046910976 /nfs/dbraw/zinc/91/09/76/1046910976.db2.gz VZVGSUHFKQFEJG-HXUWFJFHSA-N 2 1 321.424 4.299 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2Cc2c[nH]c3cc[nH+]cc23)cc1 ZINC001140807351 1046910986 /nfs/dbraw/zinc/91/09/86/1046910986.db2.gz VZVGSUHFKQFEJG-HXUWFJFHSA-N 2 1 321.424 4.299 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C[C@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176188 1046948945 /nfs/dbraw/zinc/94/89/45/1046948945.db2.gz XTTFUOCSTOXDPA-AZUAARDMSA-N 2 1 310.485 4.130 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C[C@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176188 1046948952 /nfs/dbraw/zinc/94/89/52/1046948952.db2.gz XTTFUOCSTOXDPA-AZUAARDMSA-N 2 1 310.485 4.130 20 0 DIADMP C[C@@H](CC[NH2+]C1CCC(F)(F)CC1)[N@@H+](C)Cc1ccccc1 ZINC000647188725 1046952424 /nfs/dbraw/zinc/95/24/24/1046952424.db2.gz GSTFPUSFJREIOD-HNNXBMFYSA-N 2 1 310.432 4.065 20 0 DIADMP C(CCC[N@H+]1CCC[C@H]1C1CC1)CC[NH+]1CCC[C@H]1C1CC1 ZINC000729814712 1046960770 /nfs/dbraw/zinc/96/07/70/1046960770.db2.gz UOZMXDDOXPJAKB-PMACEKPBSA-N 2 1 304.522 4.296 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(F)c1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000680401127 1046979170 /nfs/dbraw/zinc/97/91/70/1046979170.db2.gz DGWJEMGFJAPTGG-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(F)c1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000680401127 1046979181 /nfs/dbraw/zinc/97/91/81/1046979181.db2.gz DGWJEMGFJAPTGG-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]C2(c3cccc(F)c3)CCC2)CC1 ZINC000647331088 1046979726 /nfs/dbraw/zinc/97/97/26/1046979726.db2.gz UJGJVHGEJGREQK-UHFFFAOYSA-N 2 1 304.453 4.057 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C2CCCC2)o1 ZINC000680461176 1046984918 /nfs/dbraw/zinc/98/49/18/1046984918.db2.gz HHWGLGIGLKQPFQ-JENIJYKNSA-N 2 1 302.462 4.036 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)o1 ZINC000680461176 1046984923 /nfs/dbraw/zinc/98/49/23/1046984923.db2.gz HHWGLGIGLKQPFQ-JENIJYKNSA-N 2 1 302.462 4.036 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccc4ccccc4c3)C2)CC1 ZINC000798957026 1046993446 /nfs/dbraw/zinc/99/34/46/1046993446.db2.gz JAUPYHGMSBZISC-UHFFFAOYSA-N 2 1 308.469 4.148 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccc(-c4ccccc4)o3)C2)CC1 ZINC000798957665 1046993487 /nfs/dbraw/zinc/99/34/87/1046993487.db2.gz KSLSTPKQQDNKSK-UHFFFAOYSA-N 2 1 324.468 4.254 20 0 DIADMP c1sc(C[N@@H+](C2CC2)C2CC[NH2+]CC2)cc1-c1ccccc1 ZINC000647483028 1047001590 /nfs/dbraw/zinc/00/15/90/1047001590.db2.gz SCZHXMAMGVAVMZ-UHFFFAOYSA-N 2 1 312.482 4.132 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(SCC)cc2)C1 ZINC000533783163 1047019035 /nfs/dbraw/zinc/01/90/35/1047019035.db2.gz FNKZBCNDHOWFBO-CVEARBPZSA-N 2 1 306.519 4.181 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c(C)c2)CC1 ZINC001141237638 1047059188 /nfs/dbraw/zinc/05/91/88/1047059188.db2.gz VEFXXGJZJMPTBJ-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c(C)c2)CC1 ZINC001141237638 1047059200 /nfs/dbraw/zinc/05/92/00/1047059200.db2.gz VEFXXGJZJMPTBJ-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379646202 1047089919 /nfs/dbraw/zinc/08/99/19/1047089919.db2.gz DYZRNPAXOPNIHS-UGKGYDQZSA-N 2 1 322.496 4.262 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379646202 1047089931 /nfs/dbraw/zinc/08/99/31/1047089931.db2.gz DYZRNPAXOPNIHS-UGKGYDQZSA-N 2 1 322.496 4.262 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000379646258 1047091138 /nfs/dbraw/zinc/09/11/38/1047091138.db2.gz FBDVJWMAZBOWSF-YTQPIUFNSA-N 2 1 300.490 4.208 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000379646258 1047091154 /nfs/dbraw/zinc/09/11/54/1047091154.db2.gz FBDVJWMAZBOWSF-YTQPIUFNSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379640715 1047092615 /nfs/dbraw/zinc/09/26/15/1047092615.db2.gz CCJVSHSZFWCPOF-LQWHRVPQSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379640715 1047092629 /nfs/dbraw/zinc/09/26/29/1047092629.db2.gz CCJVSHSZFWCPOF-LQWHRVPQSA-N 2 1 308.469 4.390 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658308 1047093700 /nfs/dbraw/zinc/09/37/00/1047093700.db2.gz VYZLLGXZDDANJT-AFYVEPGGSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658308 1047093715 /nfs/dbraw/zinc/09/37/15/1047093715.db2.gz VYZLLGXZDDANJT-AFYVEPGGSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1ccsc1)[N@H+](C)Cc1ccccc1 ZINC000379641845 1047094189 /nfs/dbraw/zinc/09/41/89/1047094189.db2.gz YPIMXLVTGUOUTA-CVEARBPZSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1ccsc1)[N@@H+](C)Cc1ccccc1 ZINC000379641845 1047094204 /nfs/dbraw/zinc/09/42/04/1047094204.db2.gz YPIMXLVTGUOUTA-CVEARBPZSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657679 1047096433 /nfs/dbraw/zinc/09/64/33/1047096433.db2.gz UJABLMIHCPDBHJ-RMFZZGRPSA-N 2 1 320.480 4.343 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657084 1047096540 /nfs/dbraw/zinc/09/65/40/1047096540.db2.gz RPSSLXHAGOVGMP-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657084 1047096554 /nfs/dbraw/zinc/09/65/54/1047096554.db2.gz RPSSLXHAGOVGMP-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000379657465 1047098141 /nfs/dbraw/zinc/09/81/41/1047098141.db2.gz SVFCJXXPPKTYAY-NEWSRXKRSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC000379657465 1047098154 /nfs/dbraw/zinc/09/81/54/1047098154.db2.gz SVFCJXXPPKTYAY-NEWSRXKRSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000536825774 1047104617 /nfs/dbraw/zinc/10/46/17/1047104617.db2.gz JMEGZNUQXAIPJN-JENIJYKNSA-N 2 1 312.457 4.231 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000536833851 1047105738 /nfs/dbraw/zinc/10/57/38/1047105738.db2.gz PCDFTIQNBPXGRO-KZNAEPCWSA-N 2 1 320.546 4.246 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000536833851 1047105743 /nfs/dbraw/zinc/10/57/43/1047105743.db2.gz PCDFTIQNBPXGRO-KZNAEPCWSA-N 2 1 320.546 4.246 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]C(C2CC2)C2CC2)C[N@H+]1Cc1ccccc1 ZINC000536831472 1047113576 /nfs/dbraw/zinc/11/35/76/1047113576.db2.gz IUODFVSOGYCWRU-SJLPKXTDSA-N 2 1 312.501 4.065 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](CCc1ccccc1)C(C)C ZINC000536861265 1047114997 /nfs/dbraw/zinc/11/49/97/1047114997.db2.gz BULIYNRWAYFOHJ-FXAWDEMLSA-N 2 1 313.489 4.075 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccccc1Oc1ccccc1 ZINC000537053159 1047134895 /nfs/dbraw/zinc/13/48/95/1047134895.db2.gz FQFCPGPTLIWOEN-INIZCTEOSA-N 2 1 321.424 4.335 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC001116387294 1047135796 /nfs/dbraw/zinc/13/57/96/1047135796.db2.gz DVCTYMQGVKUUAR-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H]2CCc3ccccc32)CC1 ZINC000681663101 1047138262 /nfs/dbraw/zinc/13/82/62/1047138262.db2.gz XKBXIVMPVINRGH-HXUWFJFHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3c(Cl)cccc32)C1 ZINC001116565042 1047156584 /nfs/dbraw/zinc/15/65/84/1047156584.db2.gz FXPOJBISSBAVGV-KDOFPFPSSA-N 2 1 306.881 4.039 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000537292830 1047159994 /nfs/dbraw/zinc/15/99/94/1047159994.db2.gz QJGLWCUJPSXACU-AWEZNQCLSA-N 2 1 319.408 4.442 20 0 DIADMP CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537305884 1047162851 /nfs/dbraw/zinc/16/28/51/1047162851.db2.gz BNOMRVMSOHNRAU-LJQANCHMSA-N 2 1 320.908 4.149 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCc2ccccc21 ZINC000682068986 1047167487 /nfs/dbraw/zinc/16/74/87/1047167487.db2.gz BIQPSGOEALLWSS-SIKLNZKXSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCc2ccccc21 ZINC000682068986 1047167495 /nfs/dbraw/zinc/16/74/95/1047167495.db2.gz BIQPSGOEALLWSS-SIKLNZKXSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCc2ccccc21 ZINC000682068986 1047167499 /nfs/dbraw/zinc/16/74/99/1047167499.db2.gz BIQPSGOEALLWSS-SIKLNZKXSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(C(F)(F)F)cc1 ZINC000682649210 1047210715 /nfs/dbraw/zinc/21/07/15/1047210715.db2.gz GJBDPBMBFWBLCL-BBRMVZONSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC12CCCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000682734770 1047218787 /nfs/dbraw/zinc/21/87/87/1047218787.db2.gz ZRKDPXXMVSBTMY-SXLOBPIMSA-N 2 1 312.501 4.209 20 0 DIADMP CCCCc1ccc([C@@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC001168284400 1047288226 /nfs/dbraw/zinc/28/82/26/1047288226.db2.gz IOZSKZMUVHFFKG-FQEVSTJZSA-N 2 1 313.489 4.292 20 0 DIADMP C[C@H](C[NH2+][C@H](C)c1ccc(-c2ccccc2)cn1)C[NH+]1CCCC1 ZINC000651682227 1047321983 /nfs/dbraw/zinc/32/19/83/1047321983.db2.gz QMGZIHZYDQVIMQ-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCCC34CCCC4)C2)cc1 ZINC000328123264 1047328935 /nfs/dbraw/zinc/32/89/35/1047328935.db2.gz RXBFXLUIQDRLBF-UXHICEINSA-N 2 1 312.501 4.211 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cccnc2)C2CCCCC2)C1 ZINC000652142777 1047344348 /nfs/dbraw/zinc/34/43/48/1047344348.db2.gz BICWZFMLXGVVLC-PXNSSMCTSA-N 2 1 315.505 4.025 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cccnc2)C2CCCCC2)C1 ZINC000652142779 1047344532 /nfs/dbraw/zinc/34/45/32/1047344532.db2.gz BICWZFMLXGVVLC-YLJYHZDGSA-N 2 1 315.505 4.025 20 0 DIADMP CC[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533398 1047345515 /nfs/dbraw/zinc/34/55/15/1047345515.db2.gz TYKHPPZOPQZFBB-MLGOLLRUSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533398 1047345524 /nfs/dbraw/zinc/34/55/24/1047345524.db2.gz TYKHPPZOPQZFBB-MLGOLLRUSA-N 2 1 315.288 4.376 20 0 DIADMP C[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1cc(F)c(Cl)cc1Cl ZINC000044532758 1047346153 /nfs/dbraw/zinc/34/61/53/1047346153.db2.gz GRKFDIBUFBSHLL-WDEREUQCSA-N 2 1 319.251 4.125 20 0 DIADMP [NH3+]CCC[N@@H+](C1CCCCC1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255691168 1047422798 /nfs/dbraw/zinc/42/27/98/1047422798.db2.gz WWAHWXLPXJXEDG-DZGCQCFKSA-N 2 1 306.416 4.091 20 0 DIADMP [NH3+]CCC[N@@H+](C1CCCCC1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255691175 1047422820 /nfs/dbraw/zinc/42/28/20/1047422820.db2.gz WWAHWXLPXJXEDG-ZFWWWQNUSA-N 2 1 306.416 4.091 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)C3CCN(C)CC3)cc2)cc1 ZINC001142299814 1047424177 /nfs/dbraw/zinc/42/41/77/1047424177.db2.gz DFGIVKCOCSRNPS-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Cl)c(F)c2)CC1 ZINC000212498205 1047428944 /nfs/dbraw/zinc/42/89/44/1047428944.db2.gz VVHJSPUBIQRIEV-ZDUSSCGKSA-N 2 1 312.860 4.394 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)cc2)cc1 ZINC001142310206 1047430215 /nfs/dbraw/zinc/43/02/15/1047430215.db2.gz TYJDSJILLPALRL-FGZHOGPDSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)cc2)cc1 ZINC001142310206 1047430218 /nfs/dbraw/zinc/43/02/18/1047430218.db2.gz TYJDSJILLPALRL-FGZHOGPDSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C)c(F)c2)cc1 ZINC000086279298 1047439780 /nfs/dbraw/zinc/43/97/80/1047439780.db2.gz UPEFFGIVIQHJGI-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2c(Cl)cccc2Cl)CC1 ZINC001168324610 1047446297 /nfs/dbraw/zinc/44/62/97/1047446297.db2.gz RFLCEZOGUWWLAB-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP COc1cccc([C@H]2CCCC[N@H+]2C2CCC([NH+](C)C)CC2)c1 ZINC001168323990 1047447271 /nfs/dbraw/zinc/44/72/71/1047447271.db2.gz FPYSWTQHUPYEQL-AFMYVXGZSA-N 2 1 316.489 4.095 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001168323745 1047447332 /nfs/dbraw/zinc/44/73/32/1047447332.db2.gz BSFVRYZBQPGSPG-JMLCCBQJSA-N 2 1 306.881 4.350 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@H]2c2ccc(Cl)s2)CC1 ZINC001168323807 1047448053 /nfs/dbraw/zinc/44/80/53/1047448053.db2.gz CTMYCZIYQFSWKC-RUXDESIVSA-N 2 1 312.910 4.411 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617219 1047455055 /nfs/dbraw/zinc/45/50/55/1047455055.db2.gz WKDXYIOTFRXLRT-LPHOPBHVSA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617219 1047455063 /nfs/dbraw/zinc/45/50/63/1047455063.db2.gz WKDXYIOTFRXLRT-LPHOPBHVSA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617219 1047455068 /nfs/dbraw/zinc/45/50/68/1047455068.db2.gz WKDXYIOTFRXLRT-LPHOPBHVSA-N 2 1 312.457 4.109 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617219 1047455077 /nfs/dbraw/zinc/45/50/77/1047455077.db2.gz WKDXYIOTFRXLRT-LPHOPBHVSA-N 2 1 312.457 4.109 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000537618158 1047456999 /nfs/dbraw/zinc/45/69/99/1047456999.db2.gz OXBUZESXVQAPGE-DYESRHJHSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000537618158 1047457003 /nfs/dbraw/zinc/45/70/03/1047457003.db2.gz OXBUZESXVQAPGE-DYESRHJHSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618158 1047457008 /nfs/dbraw/zinc/45/70/08/1047457008.db2.gz OXBUZESXVQAPGE-DYESRHJHSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618158 1047457012 /nfs/dbraw/zinc/45/70/12/1047457012.db2.gz OXBUZESXVQAPGE-DYESRHJHSA-N 2 1 308.469 4.268 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001168327535 1047457086 /nfs/dbraw/zinc/45/70/86/1047457086.db2.gz NXXKKQYWSIBCSQ-ZLPCBKJTSA-N 2 1 306.881 4.002 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001168327534 1047457281 /nfs/dbraw/zinc/45/72/81/1047457281.db2.gz NXXKKQYWSIBCSQ-FAEJEUNOSA-N 2 1 306.881 4.002 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(F)c2)C2CCCC2)CC[N@@H+]1C ZINC000119727752 1047465349 /nfs/dbraw/zinc/46/53/49/1047465349.db2.gz HSPTWSPAYLJTCC-MDASCCDHSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2cccc(F)c2)C2CCCC2)CC[N@H+]1C ZINC000119727752 1047465354 /nfs/dbraw/zinc/46/53/54/1047465354.db2.gz HSPTWSPAYLJTCC-MDASCCDHSA-N 2 1 304.453 4.129 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@H](CCc3ccccc3)C2)CC1 ZINC001168330636 1047468045 /nfs/dbraw/zinc/46/80/45/1047468045.db2.gz USVLRHGMRNKQFP-QNGMFEMESA-N 2 1 314.517 4.204 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)C2CCC([NH+](C)C)CC2)c1C ZINC001168330958 1047470994 /nfs/dbraw/zinc/47/09/94/1047470994.db2.gz WEOLXNAWCDCHJI-UHFFFAOYSA-N 2 1 300.490 4.141 20 0 DIADMP Cc1nccn1CCCC[N@H+](C)CCc1cccc2ccccc21 ZINC000120358414 1047487636 /nfs/dbraw/zinc/48/76/36/1047487636.db2.gz FIFLCNDTCZQLPO-UHFFFAOYSA-N 2 1 321.468 4.299 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)CCc1cccc2ccccc21 ZINC000120358414 1047487640 /nfs/dbraw/zinc/48/76/40/1047487640.db2.gz FIFLCNDTCZQLPO-UHFFFAOYSA-N 2 1 321.468 4.299 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)CCc1cccc2ccccc21 ZINC000120358414 1047487641 /nfs/dbraw/zinc/48/76/41/1047487641.db2.gz FIFLCNDTCZQLPO-UHFFFAOYSA-N 2 1 321.468 4.299 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341924 1047509224 /nfs/dbraw/zinc/50/92/24/1047509224.db2.gz UYXOSIYUCRSIQH-XOQVMUHJSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341924 1047509225 /nfs/dbraw/zinc/50/92/25/1047509225.db2.gz UYXOSIYUCRSIQH-XOQVMUHJSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC000121224310 1047514639 /nfs/dbraw/zinc/51/46/39/1047514639.db2.gz VTCVFZRTGNJERZ-MOPGFXCFSA-N 2 1 322.496 4.138 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1cc(-c2ccccc2)cs1 ZINC000843053950 1047525911 /nfs/dbraw/zinc/52/59/11/1047525911.db2.gz MUDBNALSEXJSPI-AYHJJNSGSA-N 2 1 312.482 4.259 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC=C(c2cccc(C)c2)CC1 ZINC000092821801 1047540032 /nfs/dbraw/zinc/54/00/32/1047540032.db2.gz NNPVSQURZSNAEU-UHFFFAOYSA-N 2 1 309.457 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC=C(c2cccc(C)c2)CC1 ZINC000092821801 1047540036 /nfs/dbraw/zinc/54/00/36/1047540036.db2.gz NNPVSQURZSNAEU-UHFFFAOYSA-N 2 1 309.457 4.069 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc(C(F)F)cc1 ZINC001143252245 1047545006 /nfs/dbraw/zinc/54/50/06/1047545006.db2.gz WRZLQZMDMSZVPK-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc(C(F)F)cc1 ZINC001143252245 1047545011 /nfs/dbraw/zinc/54/50/11/1047545011.db2.gz WRZLQZMDMSZVPK-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC001143252245 1047545013 /nfs/dbraw/zinc/54/50/13/1047545013.db2.gz WRZLQZMDMSZVPK-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000050337931 1047648887 /nfs/dbraw/zinc/64/88/87/1047648887.db2.gz WRPIPLATZXIPMS-OAHLLOKOSA-N 2 1 300.471 4.063 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCCc2ccc(Cl)cc21 ZINC000537967807 1047650847 /nfs/dbraw/zinc/65/08/47/1047650847.db2.gz AYHDLEZPFYCCDB-ACJLOTCBSA-N 2 1 317.864 4.148 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H](Cc2ccccc2)C2CCCCC2)CC1 ZINC000538406891 1047673224 /nfs/dbraw/zinc/67/32/24/1047673224.db2.gz YGGRLKCSQJIGKI-OAQYLSRUSA-N 2 1 312.501 4.030 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000538408108 1047675711 /nfs/dbraw/zinc/67/57/11/1047675711.db2.gz RUQANXCFSSGFKL-QGZVFWFLSA-N 2 1 324.390 4.008 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000538452019 1047678657 /nfs/dbraw/zinc/67/86/57/1047678657.db2.gz ZYVFTYMDTQMRRP-KXBFYZLASA-N 2 1 300.446 4.061 20 0 DIADMP CCCCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000538717469 1047699219 /nfs/dbraw/zinc/69/92/19/1047699219.db2.gz CKOCEHOKUPELDS-MJGOQNOKSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000538717469 1047699223 /nfs/dbraw/zinc/69/92/23/1047699223.db2.gz CKOCEHOKUPELDS-MJGOQNOKSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000538717469 1047699227 /nfs/dbraw/zinc/69/92/27/1047699227.db2.gz CKOCEHOKUPELDS-MJGOQNOKSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000538717469 1047699229 /nfs/dbraw/zinc/69/92/29/1047699229.db2.gz CKOCEHOKUPELDS-MJGOQNOKSA-N 2 1 318.505 4.170 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000539159764 1047739104 /nfs/dbraw/zinc/73/91/04/1047739104.db2.gz XTKFBRMOEYXPOM-YLJYHZDGSA-N 2 1 300.490 4.239 20 0 DIADMP C[N@H+]1CCC[C@H]1CCNC(C)(c1ccccc1)c1ccccc1 ZINC000539307352 1047746854 /nfs/dbraw/zinc/74/68/54/1047746854.db2.gz UQESYHGWYQUUQD-FQEVSTJZSA-N 2 1 308.469 4.024 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH2+]C(C)(c1ccccc1)c1ccccc1 ZINC000539307352 1047746864 /nfs/dbraw/zinc/74/68/64/1047746864.db2.gz UQESYHGWYQUUQD-FQEVSTJZSA-N 2 1 308.469 4.024 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+]C(C)(c1ccccc1)c1ccccc1 ZINC000539307352 1047746871 /nfs/dbraw/zinc/74/68/71/1047746871.db2.gz UQESYHGWYQUUQD-FQEVSTJZSA-N 2 1 308.469 4.024 20 0 DIADMP C[N@H+]1CCC[C@@H]1CCNC(C)(c1ccccc1)c1ccccc1 ZINC000539307355 1047747180 /nfs/dbraw/zinc/74/71/80/1047747180.db2.gz UQESYHGWYQUUQD-HXUWFJFHSA-N 2 1 308.469 4.024 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH2+]C(C)(c1ccccc1)c1ccccc1 ZINC000539307355 1047747182 /nfs/dbraw/zinc/74/71/82/1047747182.db2.gz UQESYHGWYQUUQD-HXUWFJFHSA-N 2 1 308.469 4.024 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+]C(C)(c1ccccc1)c1ccccc1 ZINC000539307355 1047747184 /nfs/dbraw/zinc/74/71/84/1047747184.db2.gz UQESYHGWYQUUQD-HXUWFJFHSA-N 2 1 308.469 4.024 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1F ZINC001168360286 1047751936 /nfs/dbraw/zinc/75/19/36/1047751936.db2.gz MSUUGUSFFDQQFL-IBGZPJMESA-N 2 1 304.453 4.131 20 0 DIADMP Cc1[nH+]c2c(Nc3ccc(C4CC[NH2+]CC4)cc3)cccn2c1C ZINC001159398283 1047840588 /nfs/dbraw/zinc/84/05/88/1047840588.db2.gz VVQJAMAUGBURCG-UHFFFAOYSA-N 2 1 320.440 4.162 20 0 DIADMP C[NH+]1C(C)(C)CC(Nc2ccc3c([nH+]2)CCCC3)CC1(C)C ZINC001159397792 1047841043 /nfs/dbraw/zinc/84/10/43/1047841043.db2.gz QPULNGHCZPSLJJ-UHFFFAOYSA-N 2 1 301.478 4.024 20 0 DIADMP C[C@]1(C[NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C[C@@H]1c1ccccc1 ZINC001182959247 1047866447 /nfs/dbraw/zinc/86/64/47/1047866447.db2.gz IMRDLEHGGLPUSA-HMXCVIKNSA-N 2 1 312.501 4.177 20 0 DIADMP C[C@]1(C[NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C[C@@H]1c1ccccc1 ZINC001182959247 1047866467 /nfs/dbraw/zinc/86/64/67/1047866467.db2.gz IMRDLEHGGLPUSA-HMXCVIKNSA-N 2 1 312.501 4.177 20 0 DIADMP Cc1cc[nH+]c(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)c1 ZINC001159555053 1047868091 /nfs/dbraw/zinc/86/80/91/1047868091.db2.gz WEPKCBKCNQBPAQ-GHBBCFCZSA-N 2 1 321.468 4.022 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCCCCC2)[C@@H]1c1cccs1 ZINC000553514296 1047868202 /nfs/dbraw/zinc/86/82/02/1047868202.db2.gz LMUJTBCJUFXAPH-MAUKXSAKSA-N 2 1 306.519 4.443 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CCCCCC2)[C@@H]1c1cccs1 ZINC000553514296 1047868217 /nfs/dbraw/zinc/86/82/17/1047868217.db2.gz LMUJTBCJUFXAPH-MAUKXSAKSA-N 2 1 306.519 4.443 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001183023921 1047881431 /nfs/dbraw/zinc/88/14/31/1047881431.db2.gz KGOSGMZJTQTFKC-UHFFFAOYSA-N 2 1 304.522 4.237 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001183023921 1047881441 /nfs/dbraw/zinc/88/14/41/1047881441.db2.gz KGOSGMZJTQTFKC-UHFFFAOYSA-N 2 1 304.522 4.237 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2cccc3c2CC[NH2+]C3)c(C)c1 ZINC001159655984 1047894624 /nfs/dbraw/zinc/89/46/24/1047894624.db2.gz KVTDDJPACBOLNG-UHFFFAOYSA-N 2 1 309.457 4.231 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001205257942 1047907574 /nfs/dbraw/zinc/90/75/74/1047907574.db2.gz YWUGCXSPGHAVHK-MRXNPFEDSA-N 2 1 315.288 4.129 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)c1C ZINC001183268166 1047914523 /nfs/dbraw/zinc/91/45/23/1047914523.db2.gz GFBSSHJLSSMZOO-KUHUBIRLSA-N 2 1 320.546 4.498 20 0 DIADMP CCC[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(OC)cc1 ZINC000479520372 1047919057 /nfs/dbraw/zinc/91/90/57/1047919057.db2.gz ZSAYQBFQHGGXEV-AFMYVXGZSA-N 2 1 316.489 4.143 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479539529 1047921541 /nfs/dbraw/zinc/92/15/41/1047921541.db2.gz JSLPUCVFEQQHPQ-ZLPCBKJTSA-N 2 1 318.530 4.466 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2ccc([C@@H]3CC[NH2+]C3)cc2)cc1 ZINC001159779552 1047923038 /nfs/dbraw/zinc/92/30/38/1047923038.db2.gz YSJBQUCWPDMSAS-QGZVFWFLSA-N 2 1 309.457 4.353 20 0 DIADMP C[N@@H+](Cc1ccccc1NC1=CCC[NH2+]CC1)C1CCCCC1 ZINC001159791060 1047924883 /nfs/dbraw/zinc/92/48/83/1047924883.db2.gz IHAORJQICXGFCJ-UHFFFAOYSA-N 2 1 313.489 4.130 20 0 DIADMP C[N@@H+](Cc1ccccc1NC=C1CC[NH2+]CC1)C1CCCCC1 ZINC001159791856 1047925518 /nfs/dbraw/zinc/92/55/18/1047925518.db2.gz WLFFZRQMMBYUGW-UHFFFAOYSA-N 2 1 313.489 4.130 20 0 DIADMP c1ccc(C2([NH+]3CCCC3)CC[NH+]([C@@H]3C=CCCC3)CC2)cc1 ZINC001198202056 1047933473 /nfs/dbraw/zinc/93/34/73/1047933473.db2.gz IMXKHIPTKJYSNM-HXUWFJFHSA-N 2 1 310.485 4.182 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)s2)CC1 ZINC001205273455 1047937554 /nfs/dbraw/zinc/93/75/54/1047937554.db2.gz LFHHLVOCPSNLLG-MRXNPFEDSA-N 2 1 306.500 4.180 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC001183571144 1047944122 /nfs/dbraw/zinc/94/41/22/1047944122.db2.gz FMESUKBOIAPDJA-WJMWBRGCSA-N 2 1 314.517 4.455 20 0 DIADMP CC1CCC([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000553851014 1047952798 /nfs/dbraw/zinc/95/27/98/1047952798.db2.gz NGOAKMVLMINWBW-VLWBHCEFSA-N 2 1 306.519 4.299 20 0 DIADMP CC1CCC([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CC1 ZINC000553851014 1047952812 /nfs/dbraw/zinc/95/28/12/1047952812.db2.gz NGOAKMVLMINWBW-VLWBHCEFSA-N 2 1 306.519 4.299 20 0 DIADMP c1cc2cc[nH+]cc2c(Nc2ccc(O[C@@H]3CCC[NH2+]C3)cc2)c1 ZINC001159949433 1047955546 /nfs/dbraw/zinc/95/55/46/1047955546.db2.gz OBBFLVHGBSWPPU-GOSISDBHSA-N 2 1 319.408 4.109 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000479873646 1047989811 /nfs/dbraw/zinc/98/98/11/1047989811.db2.gz NHEINYFSDQUSGY-PGRDOPGGSA-N 2 1 322.496 4.138 20 0 DIADMP CC1CC[NH+](CCC[NH2+]Cc2cccc(OC(C)(C)C)c2)CC1 ZINC001199021033 1048024929 /nfs/dbraw/zinc/02/49/29/1048024929.db2.gz BDRTWQKSGIKTFW-UHFFFAOYSA-N 2 1 318.505 4.076 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+]C[C@]1(C)CCCCO1)c1ccccc1 ZINC001184340353 1048031383 /nfs/dbraw/zinc/03/13/83/1048031383.db2.gz VWARQNLNWREFIU-PMACEKPBSA-N 2 1 318.505 4.008 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](CCc2ccc(Cl)cc2)C(C)C)CC1 ZINC000480027815 1048032615 /nfs/dbraw/zinc/03/26/15/1048032615.db2.gz CFDRVUYQJPGJCI-IBGZPJMESA-N 2 1 322.924 4.371 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)ccc1C ZINC001175061966 1048089367 /nfs/dbraw/zinc/08/93/67/1048089367.db2.gz KWSRIOHXHQQJCQ-UHFFFAOYSA-N 2 1 314.448 4.218 20 0 DIADMP CC[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1cccs1 ZINC000480235297 1048098506 /nfs/dbraw/zinc/09/85/06/1048098506.db2.gz SWYHXZJBVATECI-SFHVURJKSA-N 2 1 314.498 4.237 20 0 DIADMP CC[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1cccs1 ZINC000480235297 1048098514 /nfs/dbraw/zinc/09/85/14/1048098514.db2.gz SWYHXZJBVATECI-SFHVURJKSA-N 2 1 314.498 4.237 20 0 DIADMP Cc1nc2c(s1)[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)CCC2 ZINC000480268670 1048106763 /nfs/dbraw/zinc/10/67/63/1048106763.db2.gz SWFFDSJCTXTDAK-MRXNPFEDSA-N 2 1 321.534 4.073 20 0 DIADMP Cc1nc2c(s1)[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)CCC2 ZINC000480268670 1048106769 /nfs/dbraw/zinc/10/67/69/1048106769.db2.gz SWFFDSJCTXTDAK-MRXNPFEDSA-N 2 1 321.534 4.073 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCc3ccccc3C2)s1 ZINC000480278490 1048111238 /nfs/dbraw/zinc/11/12/38/1048111238.db2.gz OKTVFGPYAXCALQ-MRXNPFEDSA-N 2 1 314.498 4.156 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCc3ccccc3C2)s1 ZINC000480278490 1048111246 /nfs/dbraw/zinc/11/12/46/1048111246.db2.gz OKTVFGPYAXCALQ-MRXNPFEDSA-N 2 1 314.498 4.156 20 0 DIADMP Cc1cccc2cc[nH+]c(N3CCC([NH3+])(CC4CCC4)CC3)c12 ZINC001161577270 1048140986 /nfs/dbraw/zinc/14/09/86/1048140986.db2.gz KEWABIFLSQCTCS-UHFFFAOYSA-N 2 1 309.457 4.031 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)ccc1F ZINC000480613771 1048191181 /nfs/dbraw/zinc/19/11/81/1048191181.db2.gz QBDRMEIQVZKRLW-HUUCEWRRSA-N 2 1 310.432 4.270 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000480610481 1048192071 /nfs/dbraw/zinc/19/20/71/1048192071.db2.gz JHRMKEKHTXXXLQ-BEFAXECRSA-N 2 1 304.453 4.057 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000480606267 1048195859 /nfs/dbraw/zinc/19/58/59/1048195859.db2.gz CEZJVMGPAZKMMQ-WIYYLYMNSA-N 2 1 314.517 4.252 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1F ZINC000480620891 1048198546 /nfs/dbraw/zinc/19/85/46/1048198546.db2.gz BZSXUKDSPVDNPF-HZPDHXFCSA-N 2 1 322.468 4.140 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1cccc2F ZINC000480635032 1048202008 /nfs/dbraw/zinc/20/20/08/1048202008.db2.gz VJLRKOOKYQEMBK-BEFAXECRSA-N 2 1 304.453 4.057 20 0 DIADMP C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646435 1048207257 /nfs/dbraw/zinc/20/72/57/1048207257.db2.gz VIUNVCDCDIDRIS-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCN2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646435 1048207269 /nfs/dbraw/zinc/20/72/69/1048207269.db2.gz VIUNVCDCDIDRIS-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646435 1048207278 /nfs/dbraw/zinc/20/72/78/1048207278.db2.gz VIUNVCDCDIDRIS-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646435 1048207292 /nfs/dbraw/zinc/20/72/92/1048207292.db2.gz VIUNVCDCDIDRIS-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccsc2Cl)C1 ZINC000480659881 1048209377 /nfs/dbraw/zinc/20/93/77/1048209377.db2.gz GSICUWAPDRTMQJ-ZDUSSCGKSA-N 2 1 300.899 4.003 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000480693317 1048216463 /nfs/dbraw/zinc/21/64/63/1048216463.db2.gz BIWBNICZGSMLHA-KFWWJZLASA-N 2 1 320.443 4.350 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)oc2cc1C ZINC000480738105 1048229359 /nfs/dbraw/zinc/22/93/59/1048229359.db2.gz JOAFZSXLJSETHK-SZMVWBNQSA-N 2 1 312.457 4.327 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)oc2cc1C ZINC000480738105 1048229368 /nfs/dbraw/zinc/22/93/68/1048229368.db2.gz JOAFZSXLJSETHK-SZMVWBNQSA-N 2 1 312.457 4.327 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(-c2ccccc2)c1 ZINC000480741756 1048233365 /nfs/dbraw/zinc/23/33/65/1048233365.db2.gz ACDFYPNSBXPSPS-ROUUACIJSA-N 2 1 320.480 4.489 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)cc(Cl)c1 ZINC000480741942 1048233966 /nfs/dbraw/zinc/23/39/66/1048233966.db2.gz VBRNJYVTCYBRSQ-IUIKQTSFSA-N 2 1 313.272 4.271 20 0 DIADMP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480746342 1048236796 /nfs/dbraw/zinc/23/67/96/1048236796.db2.gz QOVMTKFUZMSZHY-YLJYHZDGSA-N 2 1 300.490 4.156 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000480770393 1048242945 /nfs/dbraw/zinc/24/29/45/1048242945.db2.gz RMPVGXRISFOKLQ-LIRRHRJNSA-N 2 1 318.892 4.181 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008587 1048287472 /nfs/dbraw/zinc/28/74/72/1048287472.db2.gz ANVSXEYZRKUYAC-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@H](C)C[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201501407 1048287464 /nfs/dbraw/zinc/28/74/64/1048287464.db2.gz JNYDCJBQAOOIPE-WMZOPIPTSA-N 2 1 304.478 4.002 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008587 1048287481 /nfs/dbraw/zinc/28/74/81/1048287481.db2.gz ANVSXEYZRKUYAC-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3c(s2)CCCC3)C1 ZINC000481041990 1048298206 /nfs/dbraw/zinc/29/82/06/1048298206.db2.gz BUQSEDJTDXUQQL-GJZGRUSLSA-N 2 1 306.519 4.009 20 0 DIADMP CCC(CC)C[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001201534989 1048299138 /nfs/dbraw/zinc/29/91/38/1048299138.db2.gz VWZBBCKJOGYUFQ-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP CCC(CC)C[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001201534989 1048299152 /nfs/dbraw/zinc/29/91/52/1048299152.db2.gz VWZBBCKJOGYUFQ-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[C@@H]([NH2+]CCCCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000481051754 1048301841 /nfs/dbraw/zinc/30/18/41/1048301841.db2.gz CLZQACVAJDMNFH-UYAOXDASSA-N 2 1 314.517 4.252 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201552223 1048304876 /nfs/dbraw/zinc/30/48/76/1048304876.db2.gz BVCFUDKHFZMHSB-MRXNPFEDSA-N 2 1 306.469 4.158 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201552223 1048304892 /nfs/dbraw/zinc/30/48/92/1048304892.db2.gz BVCFUDKHFZMHSB-MRXNPFEDSA-N 2 1 306.469 4.158 20 0 DIADMP CC(C)(C[N@@H+]1CCCC[C@@H]([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001205923077 1048317449 /nfs/dbraw/zinc/31/74/49/1048317449.db2.gz HZZRYOWFPQBLBO-CQSZACIVSA-N 2 1 312.910 4.024 20 0 DIADMP CC(C)(C[N@H+]1CCCC[C@@H]([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001205923077 1048317468 /nfs/dbraw/zinc/31/74/68/1048317468.db2.gz HZZRYOWFPQBLBO-CQSZACIVSA-N 2 1 312.910 4.024 20 0 DIADMP CC(C)CC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201617035 1048333086 /nfs/dbraw/zinc/33/30/86/1048333086.db2.gz FFHFDCKXUJKDQT-WDSOQIARSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201617035 1048333100 /nfs/dbraw/zinc/33/31/00/1048333100.db2.gz FFHFDCKXUJKDQT-WDSOQIARSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201617035 1048333113 /nfs/dbraw/zinc/33/31/13/1048333113.db2.gz FFHFDCKXUJKDQT-WDSOQIARSA-N 2 1 320.546 4.327 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3cccs3)cc2)C1 ZINC000481305066 1048359221 /nfs/dbraw/zinc/35/92/21/1048359221.db2.gz JZFMJXADGATFQX-CVEARBPZSA-N 2 1 314.498 4.408 20 0 DIADMP Cc1ccc2c(C)cc(NCc3ccc4c(c3)CC[NH2+]C4)[nH+]c2c1 ZINC001162801727 1048360599 /nfs/dbraw/zinc/36/05/99/1048360599.db2.gz FXKZIFRHRBZTPJ-UHFFFAOYSA-N 2 1 317.436 4.109 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](CCC(C)C)c2ccc(OC)cc2)C1 ZINC000481301215 1048363031 /nfs/dbraw/zinc/36/30/31/1048363031.db2.gz XZTDOXZKAZAIQU-PXNSSMCTSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555597462 1048401179 /nfs/dbraw/zinc/40/11/79/1048401179.db2.gz IHEIQFMXHKBPQP-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555597462 1048401186 /nfs/dbraw/zinc/40/11/86/1048401186.db2.gz IHEIQFMXHKBPQP-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000555597462 1048401191 /nfs/dbraw/zinc/40/11/91/1048401191.db2.gz IHEIQFMXHKBPQP-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000555597462 1048401202 /nfs/dbraw/zinc/40/12/02/1048401202.db2.gz IHEIQFMXHKBPQP-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP CSc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001201947256 1048407323 /nfs/dbraw/zinc/40/73/23/1048407323.db2.gz VOWVRSZZKDCDNL-RDJZCZTQSA-N 2 1 318.530 4.151 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccc(Cl)s1 ZINC001175686535 1048417763 /nfs/dbraw/zinc/41/77/63/1048417763.db2.gz GATBAPLTQLYONM-UHFFFAOYSA-N 2 1 300.899 4.099 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCCC1 ZINC000481559600 1048433335 /nfs/dbraw/zinc/43/33/35/1048433335.db2.gz RZIHYBWYYHQHOW-QAPCUYQASA-N 2 1 320.908 4.082 20 0 DIADMP c1cc(C2CC2)cc(NC2CC[NH+](C[C@@H]3CC=CCC3)CC2)[nH+]1 ZINC001163320725 1048451731 /nfs/dbraw/zinc/45/17/31/1048451731.db2.gz YRJMLRVORUDGAL-MRXNPFEDSA-N 2 1 311.473 4.192 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556039306 1048519232 /nfs/dbraw/zinc/51/92/32/1048519232.db2.gz UYCNXKFWFRXTDX-KSEOMHKRSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000556039306 1048519247 /nfs/dbraw/zinc/51/92/47/1048519247.db2.gz UYCNXKFWFRXTDX-KSEOMHKRSA-N 2 1 320.480 4.489 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)c2)c1 ZINC000481920653 1048528594 /nfs/dbraw/zinc/52/85/94/1048528594.db2.gz FSBZXTXRUBLLMD-DYESRHJHSA-N 2 1 308.469 4.234 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC)cc1 ZINC000482340554 1048589374 /nfs/dbraw/zinc/58/93/74/1048589374.db2.gz ATOXMFDLGKKADR-YLJYHZDGSA-N 2 1 318.505 4.246 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)c3ccccc32)C1 ZINC000482330517 1048590196 /nfs/dbraw/zinc/59/01/96/1048590196.db2.gz UTKVOPUYXPFVAE-VQIMIIECSA-N 2 1 300.490 4.119 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3F)c1 ZINC000482353745 1048593945 /nfs/dbraw/zinc/59/39/45/1048593945.db2.gz RZKRBKUVTQCSLQ-HXUWFJFHSA-N 2 1 312.432 4.055 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccnc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000781426481 1048603766 /nfs/dbraw/zinc/60/37/66/1048603766.db2.gz OUEYGDVEKOPVOY-SQWLQELKSA-N 2 1 321.896 4.039 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)nc2)CC1 ZINC000850037387 1048612893 /nfs/dbraw/zinc/61/28/93/1048612893.db2.gz CDKYZKYNYVBTSC-AEFFLSMTSA-N 2 1 312.461 4.024 20 0 DIADMP CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)nc2)CC1 ZINC000850037388 1048613340 /nfs/dbraw/zinc/61/33/40/1048613340.db2.gz CDKYZKYNYVBTSC-FUHWJXTLSA-N 2 1 312.461 4.024 20 0 DIADMP Cc1ccc(C)c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)[nH+]1 ZINC001164486709 1048634226 /nfs/dbraw/zinc/63/42/26/1048634226.db2.gz QGRUDFQZQBYSLF-VAMGGRTRSA-N 2 1 321.468 4.021 20 0 DIADMP c1coc(C[N@H+]2CCCC3(CC[NH+](Cc4ccccc4)CC3)C2)c1 ZINC001203284460 1048641564 /nfs/dbraw/zinc/64/15/64/1048641564.db2.gz DGODJLBKMHLVRR-UHFFFAOYSA-N 2 1 324.468 4.158 20 0 DIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000850467387 1048667790 /nfs/dbraw/zinc/66/77/90/1048667790.db2.gz VGPLYQRYEWGASS-BEFAXECRSA-N 2 1 324.459 4.168 20 0 DIADMP CCC(C)(C)CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716622495 1048677586 /nfs/dbraw/zinc/67/75/86/1048677586.db2.gz VNRRXEVCCALWBF-UFYCRDLUSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640532842 1048680057 /nfs/dbraw/zinc/68/00/57/1048680057.db2.gz KNYAWZWGIWKYCA-MRXNPFEDSA-N 2 1 321.509 4.231 20 0 DIADMP C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC000640532842 1048680066 /nfs/dbraw/zinc/68/00/66/1048680066.db2.gz KNYAWZWGIWKYCA-MRXNPFEDSA-N 2 1 321.509 4.231 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CCC[C@@]1(C)Cc1ccc(Cl)s1 ZINC001176663296 1048768652 /nfs/dbraw/zinc/76/86/52/1048768652.db2.gz FBNICGYYHSOKOO-INIZCTEOSA-N 2 1 323.893 4.004 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CCC[C@@]1(C)Cc1ccc(Cl)s1 ZINC001176663296 1048768667 /nfs/dbraw/zinc/76/86/67/1048768667.db2.gz FBNICGYYHSOKOO-INIZCTEOSA-N 2 1 323.893 4.004 20 0 DIADMP C(=C\C[N@@H+](CC1CC1)C1CCC1)\C[NH+](CC1CC1)C1CCC1 ZINC000483310373 1048777041 /nfs/dbraw/zinc/77/70/41/1048777041.db2.gz CJRHLWAGARABQE-UPHRSURJSA-N 2 1 302.506 4.072 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@H]([NH2+]CC[C@@H]2CC=CCC2)C3)cc1 ZINC000716654383 1048785934 /nfs/dbraw/zinc/78/59/34/1048785934.db2.gz GAEZJDCFMPDMHM-ZDFPQIBNSA-N 2 1 324.512 4.376 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000483495365 1048805942 /nfs/dbraw/zinc/80/59/42/1048805942.db2.gz YTOSEDBBLDIPMZ-HBGVWJBISA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483495365 1048805957 /nfs/dbraw/zinc/80/59/57/1048805957.db2.gz YTOSEDBBLDIPMZ-HBGVWJBISA-N 2 1 308.469 4.317 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)Cc3ccsc3)C2)s1 ZINC000852023893 1048820546 /nfs/dbraw/zinc/82/05/46/1048820546.db2.gz ZEGJIVRUWLRYBZ-HNNXBMFYSA-N 2 1 320.527 4.072 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)Cc3ccsc3)C2)s1 ZINC000852023893 1048820563 /nfs/dbraw/zinc/82/05/63/1048820563.db2.gz ZEGJIVRUWLRYBZ-HNNXBMFYSA-N 2 1 320.527 4.072 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)Cc3ccsc3)C2)s1 ZINC000852023893 1048820584 /nfs/dbraw/zinc/82/05/84/1048820584.db2.gz ZEGJIVRUWLRYBZ-HNNXBMFYSA-N 2 1 320.527 4.072 20 0 DIADMP CCCCC[C@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001177148782 1048837966 /nfs/dbraw/zinc/83/79/66/1048837966.db2.gz MUFMJJAPQFVOMY-KRWDZBQOSA-N 2 1 320.496 4.391 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206295254 1048842416 /nfs/dbraw/zinc/84/24/16/1048842416.db2.gz LTHJLLKQMITLBY-MJGOQNOKSA-N 2 1 312.542 4.059 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721999 1048845082 /nfs/dbraw/zinc/84/50/82/1048845082.db2.gz CRAYOZYNXIGAMA-XGHQBKJUSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721999 1048845095 /nfs/dbraw/zinc/84/50/95/1048845095.db2.gz CRAYOZYNXIGAMA-XGHQBKJUSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cscc1Cl ZINC001177299269 1048859961 /nfs/dbraw/zinc/85/99/61/1048859961.db2.gz MYPOPESGXOVUBY-ZDUSSCGKSA-N 2 1 300.899 4.146 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1ccc(F)cc1F ZINC001177299444 1048860218 /nfs/dbraw/zinc/86/02/18/1048860218.db2.gz QUWOEJJDQNJARL-IQIBNGDESA-N 2 1 322.443 4.222 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCCN1Cc1ccccc1Cl ZINC001203385179 1048884931 /nfs/dbraw/zinc/88/49/31/1048884931.db2.gz MSRJAYLTBRVZGQ-DLBZAZTESA-N 2 1 306.881 4.179 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccccc1Cl ZINC001203385179 1048884952 /nfs/dbraw/zinc/88/49/52/1048884952.db2.gz MSRJAYLTBRVZGQ-DLBZAZTESA-N 2 1 306.881 4.179 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccccc1Cl ZINC001203385179 1048884972 /nfs/dbraw/zinc/88/49/72/1048884972.db2.gz MSRJAYLTBRVZGQ-DLBZAZTESA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccccc1Cl ZINC001203385179 1048884992 /nfs/dbraw/zinc/88/49/92/1048884992.db2.gz MSRJAYLTBRVZGQ-DLBZAZTESA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccccc1Cl ZINC001203385179 1048885012 /nfs/dbraw/zinc/88/50/12/1048885012.db2.gz MSRJAYLTBRVZGQ-DLBZAZTESA-N 2 1 306.881 4.179 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)cc1F ZINC001177453590 1048887529 /nfs/dbraw/zinc/88/75/29/1048887529.db2.gz CBYRQYKLCCNNLO-CKEIUWERSA-N 2 1 315.436 4.234 20 0 DIADMP CCC[C@@H](C)[C@H](CC)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000484147367 1048904164 /nfs/dbraw/zinc/90/41/64/1048904164.db2.gz RXLMHDWNBOAJNQ-AEFFLSMTSA-N 2 1 303.494 4.163 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000484154338 1048908974 /nfs/dbraw/zinc/90/89/74/1048908974.db2.gz BMVKRVJBYOCGQS-ZWKOTPCHSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1ccccc1C1CC([NH+](CC[C@H]2CCC[N@@H+]2C)C2CC2)C1 ZINC001191329849 1048927550 /nfs/dbraw/zinc/92/75/50/1048927550.db2.gz KJGINSLRTKQJPC-QPIRBTGLSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1ccccc1C1CC([N@H+](CC[C@H]2CCC[NH+]2C)C2CC2)C1 ZINC001191329849 1048927558 /nfs/dbraw/zinc/92/75/58/1048927558.db2.gz KJGINSLRTKQJPC-QPIRBTGLSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1ccccc1C1CC([N@@H+](CC[C@H]2CCC[NH+]2C)C2CC2)C1 ZINC001191329849 1048927575 /nfs/dbraw/zinc/92/75/75/1048927575.db2.gz KJGINSLRTKQJPC-QPIRBTGLSA-N 2 1 312.501 4.190 20 0 DIADMP CC/C=C\CC[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359294 1048932077 /nfs/dbraw/zinc/93/20/77/1048932077.db2.gz TYSKQWZUWTWBHH-VKUXZERMSA-N 2 1 312.501 4.331 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC001191368036 1048935479 /nfs/dbraw/zinc/93/54/79/1048935479.db2.gz WMNSFFYKRAFIED-OALUTQOASA-N 2 1 302.506 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC001191368036 1048935487 /nfs/dbraw/zinc/93/54/87/1048935487.db2.gz WMNSFFYKRAFIED-OALUTQOASA-N 2 1 302.506 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC001191368036 1048935495 /nfs/dbraw/zinc/93/54/95/1048935495.db2.gz WMNSFFYKRAFIED-OALUTQOASA-N 2 1 302.506 4.337 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2CC(C)C)C[C@@H]1C ZINC001191417642 1048939015 /nfs/dbraw/zinc/93/90/15/1048939015.db2.gz QDFQKRKAFPUDBX-FXAWDEMLSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2CC(C)C)C[C@@H]1C ZINC001191417642 1048939026 /nfs/dbraw/zinc/93/90/26/1048939026.db2.gz QDFQKRKAFPUDBX-FXAWDEMLSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2CC(C)C)C[C@@H]1C ZINC001191417642 1048939033 /nfs/dbraw/zinc/93/90/33/1048939033.db2.gz QDFQKRKAFPUDBX-FXAWDEMLSA-N 2 1 302.506 4.190 20 0 DIADMP C[C@@H]1CCCC[C@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001177859909 1048955257 /nfs/dbraw/zinc/95/52/57/1048955257.db2.gz NKMGEOGIDFJZRJ-QUCCMNQESA-N 2 1 314.517 4.457 20 0 DIADMP C[C@H]1CCCC[C@@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001177859907 1048955654 /nfs/dbraw/zinc/95/56/54/1048955654.db2.gz NKMGEOGIDFJZRJ-AZUAARDMSA-N 2 1 314.517 4.457 20 0 DIADMP CCC(CC)([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Cl)cc1 ZINC001191569961 1048967596 /nfs/dbraw/zinc/96/75/96/1048967596.db2.gz VAKQUAGHTFATHM-QGZVFWFLSA-N 2 1 308.897 4.429 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000194908261 1048968352 /nfs/dbraw/zinc/96/83/52/1048968352.db2.gz FXAPJRLYQHBFKC-OAHLLOKOSA-N 2 1 318.530 4.466 20 0 DIADMP Cc1ccccc1C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001203709878 1048973224 /nfs/dbraw/zinc/97/32/24/1048973224.db2.gz SLNNDLZAIKPLHO-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccccc1C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001203709878 1048973239 /nfs/dbraw/zinc/97/32/39/1048973239.db2.gz SLNNDLZAIKPLHO-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccccc1C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001203709878 1048973244 /nfs/dbraw/zinc/97/32/44/1048973244.db2.gz SLNNDLZAIKPLHO-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2c(C)cc(C)cc2C)CC1 ZINC001203743276 1048987054 /nfs/dbraw/zinc/98/70/54/1048987054.db2.gz FKJPNENFRDIPDK-UHFFFAOYSA-N 2 1 323.484 4.054 20 0 DIADMP Cc1cc([C@@H]([NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)ccc1F ZINC001178218724 1049005242 /nfs/dbraw/zinc/00/52/42/1049005242.db2.gz XLLZCQBYNMYGNU-WMZOPIPTSA-N 2 1 304.453 4.048 20 0 DIADMP C[N@H+]1CC[C@@]2(CCN(Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC001203815308 1049005982 /nfs/dbraw/zinc/00/59/82/1049005982.db2.gz MOAPTHIVHIMQNR-OAQYLSRUSA-N 2 1 322.452 4.007 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC001203815308 1049006017 /nfs/dbraw/zinc/00/60/17/1049006017.db2.gz MOAPTHIVHIMQNR-OAQYLSRUSA-N 2 1 322.452 4.007 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC001203815308 1049006028 /nfs/dbraw/zinc/00/60/28/1049006028.db2.gz MOAPTHIVHIMQNR-OAQYLSRUSA-N 2 1 322.452 4.007 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)c(F)c(Cl)c2)CC1 ZINC001206324831 1049012494 /nfs/dbraw/zinc/01/24/94/1049012494.db2.gz DPYNEJVVOAMZMF-OAHLLOKOSA-N 2 1 319.251 4.083 20 0 DIADMP c1c[nH]c([C@H]2CCC[N@@H+]2Cc2cccc(C[NH+]3CCCCC3)c2)c1 ZINC001191939417 1049019145 /nfs/dbraw/zinc/01/91/45/1049019145.db2.gz UIZXPINUBFDXNC-OAQYLSRUSA-N 2 1 323.484 4.338 20 0 DIADMP C[C@@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904309365 1049027555 /nfs/dbraw/zinc/02/75/55/1049027555.db2.gz IUEPSSPUSAFVGR-BHYGNILZSA-N 2 1 300.471 4.049 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc(Cl)cc1 ZINC001203923425 1049033413 /nfs/dbraw/zinc/03/34/13/1049033413.db2.gz OAPMLBYZGXGQEA-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc(Cl)cc1 ZINC001203923425 1049033421 /nfs/dbraw/zinc/03/34/21/1049033421.db2.gz OAPMLBYZGXGQEA-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC001203923425 1049033426 /nfs/dbraw/zinc/03/34/26/1049033426.db2.gz OAPMLBYZGXGQEA-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1 ZINC001203923425 1049033434 /nfs/dbraw/zinc/03/34/34/1049033434.db2.gz OAPMLBYZGXGQEA-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+](C)CC1(C[NH2+]Cc2ccc(-c3ccccc3)o2)CCCC1 ZINC001178444280 1049033611 /nfs/dbraw/zinc/03/36/11/1049033611.db2.gz IZUWUTVUCHHZAT-UHFFFAOYSA-N 2 1 312.457 4.158 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)c1C ZINC001178409860 1049034813 /nfs/dbraw/zinc/03/48/13/1049034813.db2.gz YDRJJDIROIUXGN-UHFFFAOYSA-N 2 1 306.519 4.109 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1c(OC)ccc2ccccc21 ZINC001203990375 1049052827 /nfs/dbraw/zinc/05/28/27/1049052827.db2.gz BAEGICHRZNZVTF-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1c(OC)ccc2ccccc21 ZINC001203990375 1049052837 /nfs/dbraw/zinc/05/28/37/1049052837.db2.gz BAEGICHRZNZVTF-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP Cc1cn2cc(Nc3cccc(C[NH+]4CCCCC4)c3)ccc2[nH+]1 ZINC001204094740 1049084472 /nfs/dbraw/zinc/08/44/72/1049084472.db2.gz MQGPMGZPKQJECE-UHFFFAOYSA-N 2 1 320.440 4.372 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001178774219 1049094977 /nfs/dbraw/zinc/09/49/77/1049094977.db2.gz HDQHJFKBJVOHFB-RTWAWAEBSA-N 2 1 314.517 4.034 20 0 DIADMP c1cc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc(C2CCCC2)c1 ZINC001204196258 1049108811 /nfs/dbraw/zinc/10/88/11/1049108811.db2.gz SVJDFZMCHDRAJU-LJQANCHMSA-N 2 1 312.501 4.262 20 0 DIADMP c1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc(C2CCCC2)c1 ZINC001204196258 1049108816 /nfs/dbraw/zinc/10/88/16/1049108816.db2.gz SVJDFZMCHDRAJU-LJQANCHMSA-N 2 1 312.501 4.262 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC[C@H]2CCC[N@@H+](C)C2)C1 ZINC001178917154 1049109590 /nfs/dbraw/zinc/10/95/90/1049109590.db2.gz UXAYZDNLVHUAMV-ZSXPUABSSA-N 2 1 314.517 4.280 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001178916698 1049110081 /nfs/dbraw/zinc/11/00/81/1049110081.db2.gz NAJCMPWJOOXPSW-MLRPBERTSA-N 2 1 306.881 4.065 20 0 DIADMP C[N@@H+]1CCCC12CC[NH+](CCCCc1cccc(Cl)c1)CC2 ZINC001192536973 1049116789 /nfs/dbraw/zinc/11/67/89/1049116789.db2.gz PARIABQDHKJMGU-UHFFFAOYSA-N 2 1 320.908 4.223 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](CCCCc1cccc(Cl)c1)CC2 ZINC001192536973 1049116795 /nfs/dbraw/zinc/11/67/95/1049116795.db2.gz PARIABQDHKJMGU-UHFFFAOYSA-N 2 1 320.908 4.223 20 0 DIADMP CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001192645072 1049126954 /nfs/dbraw/zinc/12/69/54/1049126954.db2.gz GRQWBXOUJAVKDL-YLJYHZDGSA-N 2 1 300.490 4.435 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CC1 ZINC000716710924 1049144218 /nfs/dbraw/zinc/14/42/18/1049144218.db2.gz YXUDZBZPOLGKJQ-NRDMVMEKSA-N 2 1 312.501 4.064 20 0 DIADMP CN(C)c1cc[nH+]cc1C[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC001179232459 1049145942 /nfs/dbraw/zinc/14/59/42/1049145942.db2.gz AADFDANLKIUOJP-UHFFFAOYSA-N 2 1 323.465 4.166 20 0 DIADMP CCC1(CC)CCC([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC001179266580 1049149454 /nfs/dbraw/zinc/14/94/54/1049149454.db2.gz QYMWWPWRZROBTN-GOSISDBHSA-N 2 1 306.538 4.447 20 0 DIADMP CC(C)C1CCC(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC001179266932 1049150771 /nfs/dbraw/zinc/15/07/71/1049150771.db2.gz ZWRQZVANFCCUSO-SYYJFZTOSA-N 2 1 306.538 4.160 20 0 DIADMP CC(C)[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Cl)cc1F ZINC001193260141 1049191598 /nfs/dbraw/zinc/19/15/98/1049191598.db2.gz GADBHMBMXKXUDT-PBHICJAKSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[C@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Cl)cc1F ZINC001193260141 1049191604 /nfs/dbraw/zinc/19/16/04/1049191604.db2.gz GADBHMBMXKXUDT-PBHICJAKSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)(C)[NH2+]Cc1ccc(Nc2cc[nH+]cc2C(F)(F)F)cc1 ZINC001204670793 1049217501 /nfs/dbraw/zinc/21/75/01/1049217501.db2.gz MAJDQAXEPSBFGM-UHFFFAOYSA-N 2 1 323.362 4.154 20 0 DIADMP Cn1c2ccccc2[nH+]c1Nc1ccc(C[NH2+]C(C)(C)C)cc1 ZINC001204670660 1049218158 /nfs/dbraw/zinc/21/81/58/1049218158.db2.gz FKBXEUGLTSOGQE-UHFFFAOYSA-N 2 1 308.429 4.205 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1csc2ccccc12 ZINC000858128161 1049220126 /nfs/dbraw/zinc/22/01/26/1049220126.db2.gz CIRVMHXBTNFFBV-ZIAGYGMSSA-N 2 1 302.487 4.425 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2C(C)=CCC[C@@H]2C)CC1 ZINC001180125294 1049291351 /nfs/dbraw/zinc/29/13/51/1049291351.db2.gz XBNDWXROYYGJCP-ICSRJNTNSA-N 2 1 306.538 4.423 20 0 DIADMP CC(C)[C@H](C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001180147117 1049298612 /nfs/dbraw/zinc/29/86/12/1049298612.db2.gz DOCXVJOZSAANTL-RTWAWAEBSA-N 2 1 314.517 4.377 20 0 DIADMP CC(C)(C[N@@H+]1CCCC[C@@H]1C[NH3+])Sc1ccc(Cl)cc1 ZINC001204919256 1049310230 /nfs/dbraw/zinc/31/02/30/1049310230.db2.gz WQWIIJRGPQYEKJ-CQSZACIVSA-N 2 1 312.910 4.024 20 0 DIADMP CC(C)(C[N@H+]1CCCC[C@@H]1C[NH3+])Sc1ccc(Cl)cc1 ZINC001204919256 1049310239 /nfs/dbraw/zinc/31/02/39/1049310239.db2.gz WQWIIJRGPQYEKJ-CQSZACIVSA-N 2 1 312.910 4.024 20 0 DIADMP CC[C@H](C)[C@@H](C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1)OC ZINC001180225660 1049310549 /nfs/dbraw/zinc/31/05/49/1049310549.db2.gz VNKUMVOOPTWAMG-CMKODMSKSA-N 2 1 324.553 4.024 20 0 DIADMP Cc1scc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1C ZINC001180208350 1049311192 /nfs/dbraw/zinc/31/11/92/1049311192.db2.gz JSRLLURXKNRGIL-GOSISDBHSA-N 2 1 320.546 4.453 20 0 DIADMP Cc1scc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1C ZINC001180208350 1049311201 /nfs/dbraw/zinc/31/12/01/1049311201.db2.gz JSRLLURXKNRGIL-GOSISDBHSA-N 2 1 320.546 4.453 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(F)cc(Cl)c2)C1 ZINC000485692888 1049313970 /nfs/dbraw/zinc/31/39/70/1049313970.db2.gz GYYFZXIYYVGMCL-AWEZNQCLSA-N 2 1 312.860 4.081 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[C@](C)([NH3+])C2)c1 ZINC001204946709 1049319556 /nfs/dbraw/zinc/31/95/56/1049319556.db2.gz ROKPZSLXOLBKFC-NRFANRHFSA-N 2 1 308.469 4.284 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@](C)([NH3+])C2)c1 ZINC001204946709 1049319565 /nfs/dbraw/zinc/31/95/65/1049319565.db2.gz ROKPZSLXOLBKFC-NRFANRHFSA-N 2 1 308.469 4.284 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(C(F)F)c2)cc1 ZINC000859213204 1049319814 /nfs/dbraw/zinc/31/98/14/1049319814.db2.gz TWKAIGFUXVPBGP-UHFFFAOYSA-N 2 1 318.411 4.318 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](C[C@@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001205001328 1049337036 /nfs/dbraw/zinc/33/70/36/1049337036.db2.gz PYARBZXURACKQB-HKUYNNGSSA-N 2 1 316.533 4.094 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001180291894 1049337344 /nfs/dbraw/zinc/33/73/44/1049337344.db2.gz HMYDSPPCWYYIIU-HXUWFJFHSA-N 2 1 302.506 4.438 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001205009328 1049338764 /nfs/dbraw/zinc/33/87/64/1049338764.db2.gz NVCRGYJEYPKXPU-CZQLGGELSA-N 2 1 320.480 4.288 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(Oc3ccccc3)c(C)c2)C1 ZINC001205015786 1049341735 /nfs/dbraw/zinc/34/17/35/1049341735.db2.gz FTNHNWVZTHEWAQ-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(Oc3ccccc3)c(C)c2)C1 ZINC001205015786 1049341745 /nfs/dbraw/zinc/34/17/45/1049341745.db2.gz FTNHNWVZTHEWAQ-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccc(-c3ccccc3)c2C)C1 ZINC001205017252 1049343135 /nfs/dbraw/zinc/34/31/35/1049343135.db2.gz MHTSTNMAEOVUDA-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2C)C1 ZINC001205018716 1049343813 /nfs/dbraw/zinc/34/38/13/1049343813.db2.gz YKDBCRPTYMKJQC-SFHVURJKSA-N 2 1 324.468 4.219 20 0 DIADMP Cc1cccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1C ZINC001205088264 1049370812 /nfs/dbraw/zinc/37/08/12/1049370812.db2.gz DSFBJEAJBLNZNE-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1C ZINC001205088264 1049370825 /nfs/dbraw/zinc/37/08/25/1049370825.db2.gz DSFBJEAJBLNZNE-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1C ZINC001205088264 1049370838 /nfs/dbraw/zinc/37/08/38/1049370838.db2.gz DSFBJEAJBLNZNE-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2cccc3c4ccccc4sc32)CC1 ZINC001205102617 1049377799 /nfs/dbraw/zinc/37/77/99/1049377799.db2.gz UQUHAHLFJWPDSC-HNNXBMFYSA-N 2 1 310.466 4.368 20 0 DIADMP Cc1ccc(N(C)c2ccc(C[N@H+]3CCC[C@@H]([NH3+])CC3)cc2)cc1 ZINC001205102412 1049378232 /nfs/dbraw/zinc/37/82/32/1049378232.db2.gz RQSKRTUNRYETHZ-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccc3sc4ccccc4c3c2)CC1 ZINC001205124126 1049386241 /nfs/dbraw/zinc/38/62/41/1049386241.db2.gz KNHQDPMWWDYVGR-OAHLLOKOSA-N 2 1 310.466 4.368 20 0 DIADMP CC[C@H](Cc1cccs1)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001180795322 1049404775 /nfs/dbraw/zinc/40/47/75/1049404775.db2.gz VAOFBKHSIWGBLT-IXDOHACOSA-N 2 1 320.546 4.312 20 0 DIADMP Cc1cc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)ccc1F ZINC001205205862 1049411561 /nfs/dbraw/zinc/41/15/61/1049411561.db2.gz LDTDXBQMMJABBM-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP Cc1cc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)ccc1F ZINC001205205862 1049411566 /nfs/dbraw/zinc/41/15/66/1049411566.db2.gz LDTDXBQMMJABBM-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC001194692631 1049414130 /nfs/dbraw/zinc/41/41/30/1049414130.db2.gz QWIXEOVKDJJKQO-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC001194692631 1049414135 /nfs/dbraw/zinc/41/41/35/1049414135.db2.gz QWIXEOVKDJJKQO-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC001194692631 1049414141 /nfs/dbraw/zinc/41/41/41/1049414141.db2.gz QWIXEOVKDJJKQO-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP Cc1ccc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC001205252024 1049418059 /nfs/dbraw/zinc/41/80/59/1049418059.db2.gz VPFRJZSDJWEBBM-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC001205252024 1049418068 /nfs/dbraw/zinc/41/80/68/1049418068.db2.gz VPFRJZSDJWEBBM-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC001205265650 1049421637 /nfs/dbraw/zinc/42/16/37/1049421637.db2.gz QIZMKEHKHGUJKZ-SFHVURJKSA-N 2 1 318.848 4.303 20 0 DIADMP COc1ccc(-c2ccc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)cc2)cc1 ZINC001205264792 1049421853 /nfs/dbraw/zinc/42/18/53/1049421853.db2.gz MNEYBICJJQFESK-OAQYLSRUSA-N 2 1 324.468 4.066 20 0 DIADMP COc1ccccc1-c1ccc(C[N@H+]2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205274573 1049422824 /nfs/dbraw/zinc/42/28/24/1049422824.db2.gz XXYAXYZOKCGFMS-OAQYLSRUSA-N 2 1 324.468 4.066 20 0 DIADMP COc1ccc(-c2ccccc2)cc1C[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205274060 1049423693 /nfs/dbraw/zinc/42/36/93/1049423693.db2.gz SQXJUMLRNOZPFA-NRFANRHFSA-N 2 1 324.468 4.066 20 0 DIADMP C[C@@H]([NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC001180978368 1049425977 /nfs/dbraw/zinc/42/59/77/1049425977.db2.gz ZRHOUEDQSMSNED-NUJGCVRESA-N 2 1 314.498 4.309 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc2[nH]ccc21 ZINC001205297581 1049430416 /nfs/dbraw/zinc/43/04/16/1049430416.db2.gz BNVAKYMQXJFLTI-ROUUACIJSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc2[nH]ccc21 ZINC001205297581 1049430421 /nfs/dbraw/zinc/43/04/21/1049430421.db2.gz BNVAKYMQXJFLTI-ROUUACIJSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC001205297581 1049430429 /nfs/dbraw/zinc/43/04/29/1049430429.db2.gz BNVAKYMQXJFLTI-ROUUACIJSA-N 2 1 311.473 4.007 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@](C)([NH3+])CC2)ccc1Oc1ccccc1 ZINC001205296411 1049431550 /nfs/dbraw/zinc/43/15/50/1049431550.db2.gz OQFDSZCPCYRBJY-OAQYLSRUSA-N 2 1 324.468 4.491 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCC1(F)F ZINC001194832983 1049437506 /nfs/dbraw/zinc/43/75/06/1049437506.db2.gz FLMMTAGBLSQMJI-INIZCTEOSA-N 2 1 322.443 4.150 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001181155131 1049448383 /nfs/dbraw/zinc/44/83/83/1049448383.db2.gz ZEJLAXGMZAECPX-SLFFLAALSA-N 2 1 314.517 4.311 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001181155131 1049448388 /nfs/dbraw/zinc/44/83/88/1049448388.db2.gz ZEJLAXGMZAECPX-SLFFLAALSA-N 2 1 314.517 4.311 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385392 1049455425 /nfs/dbraw/zinc/45/54/25/1049455425.db2.gz DTZUMTHPBXQNNX-MKXGPGLRSA-N 2 1 306.538 4.445 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CCC3(CC3)CC2)[C@@H]1c1cccs1 ZINC000486690258 1049455708 /nfs/dbraw/zinc/45/57/08/1049455708.db2.gz FEIUVZUKWSKQPO-CRAIPNDOSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCC3(CC3)CC2)[C@@H]1c1cccs1 ZINC000486690258 1049455717 /nfs/dbraw/zinc/45/57/17/1049455717.db2.gz FEIUVZUKWSKQPO-CRAIPNDOSA-N 2 1 318.530 4.443 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775627032 1049458575 /nfs/dbraw/zinc/45/85/75/1049458575.db2.gz FOSQBOQTEYSGEI-IAGOWNOFSA-N 2 1 313.489 4.187 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)CC1 ZINC001205409539 1049463631 /nfs/dbraw/zinc/46/36/31/1049463631.db2.gz UHXHTSOJUSNSIF-IBGZPJMESA-N 2 1 312.501 4.358 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc3ccccc3[nH]2)c1 ZINC000775630340 1049469659 /nfs/dbraw/zinc/46/96/59/1049469659.db2.gz YUFRLJXKSZQXPA-INIZCTEOSA-N 2 1 321.468 4.470 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCC[C@H]1C ZINC001181349614 1049470735 /nfs/dbraw/zinc/47/07/35/1049470735.db2.gz LNIHDQUAUQOQEB-UKAVVXHISA-N 2 1 314.517 4.313 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCC[C@H](C)C1 ZINC001181483879 1049485502 /nfs/dbraw/zinc/48/55/02/1049485502.db2.gz AWOCEEMFSDMJPF-FXAWDEMLSA-N 2 1 302.506 4.396 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC001181514224 1049486091 /nfs/dbraw/zinc/48/60/91/1049486091.db2.gz BCVBQDPXKSIOTA-XLIONFOSSA-N 2 1 306.538 4.257 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCC[C@@H](C)C1 ZINC001181483881 1049486160 /nfs/dbraw/zinc/48/61/60/1049486160.db2.gz AWOCEEMFSDMJPF-XLIONFOSSA-N 2 1 302.506 4.396 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001205546667 1049494837 /nfs/dbraw/zinc/49/48/37/1049494837.db2.gz YICHSLONKFURLP-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001205554473 1049496978 /nfs/dbraw/zinc/49/69/78/1049496978.db2.gz GPGLBOVKVKPOFJ-OXQOHEQNSA-N 2 1 318.480 4.143 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(-c3cccs3)s2)CC1 ZINC001205558515 1049497307 /nfs/dbraw/zinc/49/73/07/1049497307.db2.gz FULLGYZJUVZRKO-MRXNPFEDSA-N 2 1 324.490 4.130 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC1 ZINC001205571263 1049500927 /nfs/dbraw/zinc/50/09/27/1049500927.db2.gz SECJFWBHABXMCZ-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC[C@@H]1C[NH3+] ZINC001205604448 1049508707 /nfs/dbraw/zinc/50/87/07/1049508707.db2.gz VROGDSQVSUUWDL-PKOBYXMFSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccs3)s2)CC[C@@H]1C[NH3+] ZINC001205618121 1049510710 /nfs/dbraw/zinc/51/07/10/1049510710.db2.gz RQQFCKRFYIRAFZ-ZIAGYGMSSA-N 2 1 320.527 4.283 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC[C@H]1C[NH3+] ZINC001205617193 1049511775 /nfs/dbraw/zinc/51/17/75/1049511775.db2.gz ICDLXRAPYDWRIZ-WBVHZDCISA-N 2 1 314.498 4.222 20 0 DIADMP CC[C@H]1CCC[C@@H](C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)C1 ZINC001205622413 1049513622 /nfs/dbraw/zinc/51/36/22/1049513622.db2.gz SAVONTWBRLWPEG-ZWKOTPCHSA-N 2 1 316.489 4.450 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC[C@@H]1C[NH3+] ZINC001205626978 1049513906 /nfs/dbraw/zinc/51/39/06/1049513906.db2.gz LDLBRRSRKSNVBA-LAUBAEHRSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC[C@H]1C[NH3+] ZINC001205629147 1049516350 /nfs/dbraw/zinc/51/63/50/1049516350.db2.gz XUVXNAVLAWOPFN-QAPCUYQASA-N 2 1 314.498 4.222 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205638637 1049517747 /nfs/dbraw/zinc/51/77/47/1049517747.db2.gz QKAWWISYWWXAIB-IEBWSBKVSA-N 2 1 322.496 4.469 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC[C@@H]1C[NH3+] ZINC001205638679 1049518006 /nfs/dbraw/zinc/51/80/06/1049518006.db2.gz QQXKVQFEGGZPDH-ZIAGYGMSSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c(Cl)c1Cl ZINC001205639086 1049519174 /nfs/dbraw/zinc/51/91/74/1049519174.db2.gz VOOYMEZQFMJVOT-WCQYABFASA-N 2 1 315.288 4.109 20 0 DIADMP Cc1c(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)cccc1-c1ccccc1 ZINC001205651942 1049522131 /nfs/dbraw/zinc/52/21/31/1049522131.db2.gz MGFFHIHRWPXACS-PXNSSMCTSA-N 2 1 322.496 4.469 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205654168 1049523841 /nfs/dbraw/zinc/52/38/41/1049523841.db2.gz WOVJHUUCQTWPTN-YPMHNXCESA-N 2 1 315.288 4.109 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001205672163 1049528373 /nfs/dbraw/zinc/52/83/73/1049528373.db2.gz UFEOYCFGIAEWLS-KRWDZBQOSA-N 2 1 312.501 4.261 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)C[C@@H](C)c1cccc(Cl)c1 ZINC001205693241 1049535252 /nfs/dbraw/zinc/53/52/52/1049535252.db2.gz SCWDPXFCSOTKLG-MRXNPFEDSA-N 2 1 308.897 4.251 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703142 1049538405 /nfs/dbraw/zinc/53/84/05/1049538405.db2.gz WTCWQDQUDHBVHY-KXBFYZLASA-N 2 1 322.452 4.358 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703142 1049538415 /nfs/dbraw/zinc/53/84/15/1049538415.db2.gz WTCWQDQUDHBVHY-KXBFYZLASA-N 2 1 322.452 4.358 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703142 1049538430 /nfs/dbraw/zinc/53/84/30/1049538430.db2.gz WTCWQDQUDHBVHY-KXBFYZLASA-N 2 1 322.452 4.358 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703142 1049538446 /nfs/dbraw/zinc/53/84/46/1049538446.db2.gz WTCWQDQUDHBVHY-KXBFYZLASA-N 2 1 322.452 4.358 20 0 DIADMP [NH3+]C[C@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CCC1(F)F ZINC001205795198 1049565804 /nfs/dbraw/zinc/56/58/04/1049565804.db2.gz DNLWWAGKEHJXPS-SFHVURJKSA-N 2 1 322.443 4.150 20 0 DIADMP [NH3+]C[C@H]1C[N@@H+](Cc2ccc(C3CCCCC3)cc2)CCC1(F)F ZINC001205795198 1049565813 /nfs/dbraw/zinc/56/58/13/1049565813.db2.gz DNLWWAGKEHJXPS-SFHVURJKSA-N 2 1 322.443 4.150 20 0 DIADMP C[C@H]1C[N@H+](CCC[NH+]2CCCCC2)CCc2ccc(Cl)cc21 ZINC001195767319 1049566178 /nfs/dbraw/zinc/56/61/78/1049566178.db2.gz JZAFEXMJQGFCNS-INIZCTEOSA-N 2 1 320.908 4.178 20 0 DIADMP C[C@H]1C[N@@H+](CCC[NH+]2CCCCC2)CCc2ccc(Cl)cc21 ZINC001195767319 1049566188 /nfs/dbraw/zinc/56/61/88/1049566188.db2.gz JZAFEXMJQGFCNS-INIZCTEOSA-N 2 1 320.908 4.178 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827954 1049575795 /nfs/dbraw/zinc/57/57/95/1049575795.db2.gz IIBGTSMHQDKQPJ-BEFAXECRSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827954 1049575803 /nfs/dbraw/zinc/57/58/03/1049575803.db2.gz IIBGTSMHQDKQPJ-BEFAXECRSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827955 1049576215 /nfs/dbraw/zinc/57/62/15/1049576215.db2.gz IIBGTSMHQDKQPJ-DNVCBOLYSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827955 1049576230 /nfs/dbraw/zinc/57/62/30/1049576230.db2.gz IIBGTSMHQDKQPJ-DNVCBOLYSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827956 1049576886 /nfs/dbraw/zinc/57/68/86/1049576886.db2.gz IIBGTSMHQDKQPJ-HNAYVOBHSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827956 1049576892 /nfs/dbraw/zinc/57/68/92/1049576892.db2.gz IIBGTSMHQDKQPJ-HNAYVOBHSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001205901993 1049594822 /nfs/dbraw/zinc/59/48/22/1049594822.db2.gz GQSHTEABZFEZDZ-STQMWFEESA-N 2 1 306.500 4.036 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001205903444 1049595908 /nfs/dbraw/zinc/59/59/08/1049595908.db2.gz OZIYBBNFZWHQLG-HIFRSBDPSA-N 2 1 318.848 4.159 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@H](C[NH3+])[C@H]2C)cc1 ZINC001205904509 1049597400 /nfs/dbraw/zinc/59/74/00/1049597400.db2.gz VQMRIFVGQLSADU-IEBWSBKVSA-N 2 1 318.505 4.205 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205904481 1049597922 /nfs/dbraw/zinc/59/79/22/1049597922.db2.gz VOYXVNLQQJFNKW-HUUCEWRRSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001205912845 1049599864 /nfs/dbraw/zinc/59/98/64/1049599864.db2.gz DBAARMHMWPAIJM-HUUCEWRRSA-N 2 1 316.470 4.100 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001205915143 1049601495 /nfs/dbraw/zinc/60/14/95/1049601495.db2.gz OONCVWORQORHMX-QWHCGFSZSA-N 2 1 306.500 4.036 20 0 DIADMP C[C@@H]1C[N@@H+](CC(c2ccccc2)c2ccccc2)CCC[C@@H]1C[NH3+] ZINC001205981911 1049619241 /nfs/dbraw/zinc/61/92/41/1049619241.db2.gz IYXQNPPANKNSCH-WIYYLYMNSA-N 2 1 322.496 4.125 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001206011082 1049627752 /nfs/dbraw/zinc/62/77/52/1049627752.db2.gz ABZQFEDPXSAAGM-DZGCQCFKSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001206011087 1049627811 /nfs/dbraw/zinc/62/78/11/1049627811.db2.gz ABZQFEDPXSAAGM-UKRRQHHQSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001206011089 1049627877 /nfs/dbraw/zinc/62/78/77/1049627877.db2.gz ABZQFEDPXSAAGM-ZFWWWQNUSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@H](C[NH3+])[C@H](C)C3)cc2)o1 ZINC001206011273 1049627999 /nfs/dbraw/zinc/62/79/99/1049627999.db2.gz BETURMQMRDRHCU-BEFAXECRSA-N 2 1 312.457 4.062 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(-c3ccccc3)c2)CCC[C@@H]1C[NH3+] ZINC001206011857 1049629177 /nfs/dbraw/zinc/62/91/77/1049629177.db2.gz GYEFKLNHPGCYFK-LAUBAEHRSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(-c3ccccc3)c2)CCC[C@H]1C[NH3+] ZINC001206011861 1049629323 /nfs/dbraw/zinc/62/93/23/1049629323.db2.gz GYEFKLNHPGCYFK-UWJYYQICSA-N 2 1 308.469 4.160 20 0 DIADMP CC1(C)CCC[C@@H]1[C@@H]1CC[N@@H+](Cc2cc3c(s2)CC[NH2+]C3)C1 ZINC000864049197 1049638565 /nfs/dbraw/zinc/63/85/65/1049638565.db2.gz CYXXXGSHERKCEL-RHSMWYFYSA-N 2 1 318.530 4.042 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC000774265382 1049639815 /nfs/dbraw/zinc/63/98/15/1049639815.db2.gz DQWCRTBAIDJEGU-SMLSOGCJSA-N 2 1 312.501 4.402 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2cccc(OC)c2)CC1 ZINC000488434025 1049653589 /nfs/dbraw/zinc/65/35/89/1049653589.db2.gz IJJGJJXTUOCUCC-KRWDZBQOSA-N 2 1 318.505 4.200 20 0 DIADMP CC(C)C1CC([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)C1 ZINC000488451000 1049657763 /nfs/dbraw/zinc/65/77/63/1049657763.db2.gz RGZLZJCONUMDJS-MMIPBJDJSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)C1CC([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC000488451000 1049657769 /nfs/dbraw/zinc/65/77/69/1049657769.db2.gz RGZLZJCONUMDJS-MMIPBJDJSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC000488470309 1049661530 /nfs/dbraw/zinc/66/15/30/1049661530.db2.gz VHWPMIQDLDALSN-CJGGRQNCSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000488584470 1049680817 /nfs/dbraw/zinc/68/08/17/1049680817.db2.gz RNGLALDLDGCGFS-NBOOPKSLSA-N 2 1 324.578 4.149 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC001206215055 1049682723 /nfs/dbraw/zinc/68/27/23/1049682723.db2.gz KFJOVBPRMSENFP-IBGZPJMESA-N 2 1 322.496 4.140 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]C2CCC(C)(c3ccccc3)CC2)C1 ZINC001206215539 1049683448 /nfs/dbraw/zinc/68/34/48/1049683448.db2.gz PHHRZLOMWRARHQ-PELRDEGISA-N 2 1 314.517 4.208 20 0 DIADMP CCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001182542787 1049685849 /nfs/dbraw/zinc/68/58/49/1049685849.db2.gz GAMOGGAVSVMPSU-MXEMCNAFSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001206262921 1049693181 /nfs/dbraw/zinc/69/31/81/1049693181.db2.gz JODRRUHALXKBMZ-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001206262921 1049693184 /nfs/dbraw/zinc/69/31/84/1049693184.db2.gz JODRRUHALXKBMZ-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001206276296 1049696669 /nfs/dbraw/zinc/69/66/69/1049696669.db2.gz DUGRXNLMFBQCKI-CQSZACIVSA-N 2 1 310.466 4.096 20 0 DIADMP C[C@H]1C[NH2+]CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001206276295 1049697094 /nfs/dbraw/zinc/69/70/94/1049697094.db2.gz DUGRXNLMFBQCKI-AWEZNQCLSA-N 2 1 310.466 4.096 20 0 DIADMP C[C@H]1C[NH2+]CC[N@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001206284968 1049699928 /nfs/dbraw/zinc/69/99/28/1049699928.db2.gz KBSLQSCNGDDHRR-AWEZNQCLSA-N 2 1 310.466 4.096 20 0 DIADMP C[C@H]1C[NH2+]CC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001206284968 1049699934 /nfs/dbraw/zinc/69/99/34/1049699934.db2.gz KBSLQSCNGDDHRR-AWEZNQCLSA-N 2 1 310.466 4.096 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](CC(c2ccccc2)c2ccccc2)CC1 ZINC001206293235 1049702650 /nfs/dbraw/zinc/70/26/50/1049702650.db2.gz GVICAMQXHBPRRU-JOCHJYFZSA-N 2 1 322.496 4.269 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC1 ZINC001206294152 1049703065 /nfs/dbraw/zinc/70/30/65/1049703065.db2.gz JMBUAGPGBUSEAW-NRFANRHFSA-N 2 1 324.468 4.430 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001206304253 1049705601 /nfs/dbraw/zinc/70/56/01/1049705601.db2.gz INEWFSRXRJVAMR-OAHLLOKOSA-N 2 1 319.251 4.083 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001206304252 1049707006 /nfs/dbraw/zinc/70/70/06/1049707006.db2.gz INEWFSRXRJVAMR-HNNXBMFYSA-N 2 1 319.251 4.083 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)CC1 ZINC001206318472 1049709899 /nfs/dbraw/zinc/70/98/99/1049709899.db2.gz QAAODIGJUHVVTQ-HNNXBMFYSA-N 2 1 319.251 4.083 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC001206318069 1049710500 /nfs/dbraw/zinc/71/05/00/1049710500.db2.gz LYKMVHKAXDGYRO-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001206325167 1049711086 /nfs/dbraw/zinc/71/10/86/1049711086.db2.gz GBBCQTYFPTZICQ-HNNXBMFYSA-N 2 1 319.251 4.083 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)c(Cl)cc1Cl ZINC001206324782 1049711661 /nfs/dbraw/zinc/71/16/61/1049711661.db2.gz DIJYQLMNIAQWLL-MRXNPFEDSA-N 2 1 315.288 4.253 20 0 DIADMP Cc1ccc(-c2cncc(C[N@H+]3CCC[C@](C)(C[NH3+])CC3)c2)cc1 ZINC001206326148 1049713057 /nfs/dbraw/zinc/71/30/57/1049713057.db2.gz KSGBDENWHWNDPE-NRFANRHFSA-N 2 1 323.484 4.008 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001206336342 1049715355 /nfs/dbraw/zinc/71/53/55/1049715355.db2.gz MDQIGJDPXXGLDL-OAHLLOKOSA-N 2 1 319.251 4.083 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC001206352372 1049719533 /nfs/dbraw/zinc/71/95/33/1049719533.db2.gz VKFWRNWXAJSQFV-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC001206352372 1049719541 /nfs/dbraw/zinc/71/95/41/1049719541.db2.gz VKFWRNWXAJSQFV-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP C[C@H](c1cc(F)ccc1F)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001197284386 1049738447 /nfs/dbraw/zinc/73/84/47/1049738447.db2.gz ILYVWLLPEZFWCW-OAHLLOKOSA-N 2 1 310.432 4.224 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001206549375 1049753503 /nfs/dbraw/zinc/75/35/03/1049753503.db2.gz MDCQJFCKIRRPTK-NRFANRHFSA-N 2 1 324.468 4.430 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001206549376 1049753703 /nfs/dbraw/zinc/75/37/03/1049753703.db2.gz MDCQJFCKIRRPTK-OAQYLSRUSA-N 2 1 324.468 4.430 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H](C)Cc1ccc(F)cc1)C1CCCCC1 ZINC001206559191 1049755332 /nfs/dbraw/zinc/75/53/32/1049755332.db2.gz AQJBPHKJMMCHHS-KRWDZBQOSA-N 2 1 320.496 4.391 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206574171 1049759704 /nfs/dbraw/zinc/75/97/04/1049759704.db2.gz PYJJYQLHLMBKPE-INIZCTEOSA-N 2 1 312.910 4.013 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206574171 1049759713 /nfs/dbraw/zinc/75/97/13/1049759713.db2.gz PYJJYQLHLMBKPE-INIZCTEOSA-N 2 1 312.910 4.013 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206572609 1049759729 /nfs/dbraw/zinc/75/97/29/1049759729.db2.gz DJIKETCGPSAGRB-HXUWFJFHSA-N 2 1 318.505 4.042 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(C(C)(C)C)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206580076 1049760796 /nfs/dbraw/zinc/76/07/96/1049760796.db2.gz CANZNGNUVKVHRK-IBGZPJMESA-N 2 1 302.506 4.337 20 0 DIADMP CC(C)[N@@H+](C[C@@H]1C[C@@H]1c1ccc(Cl)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206580119 1049762319 /nfs/dbraw/zinc/76/23/19/1049762319.db2.gz CJKLZRBQRFAZBM-QXAKKESOSA-N 2 1 320.908 4.296 20 0 DIADMP CCCCc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)s1 ZINC001206591844 1049764524 /nfs/dbraw/zinc/76/45/24/1049764524.db2.gz WSZYERXDSMXGJQ-INIZCTEOSA-N 2 1 308.535 4.443 20 0 DIADMP Cc1cc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c(F)cc1Cl ZINC001206598708 1049765101 /nfs/dbraw/zinc/76/51/01/1049765101.db2.gz LIJXTHNZBWXANA-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1cc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c(F)cc1Cl ZINC001206598708 1049765108 /nfs/dbraw/zinc/76/51/08/1049765108.db2.gz LIJXTHNZBWXANA-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCCC[C@@H](C[NH3+])C2)cc1 ZINC001206606115 1049768637 /nfs/dbraw/zinc/76/86/37/1049768637.db2.gz DSEWDWJHVJEPAV-HKUYNNGSSA-N 2 1 302.506 4.049 20 0 DIADMP CSc1cc(C)cc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1 ZINC001206606078 1049768983 /nfs/dbraw/zinc/76/89/83/1049768983.db2.gz CLOBRPWXCZWXFG-QGZVFWFLSA-N 2 1 306.519 4.069 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001206615071 1049770170 /nfs/dbraw/zinc/77/01/70/1049770170.db2.gz BGIZAPLOZLCQEV-SFHVURJKSA-N 2 1 318.505 4.207 20 0 DIADMP CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206617028 1049771228 /nfs/dbraw/zinc/77/12/28/1049771228.db2.gz YEKBHTCFEBAARO-OAHLLOKOSA-N 2 1 313.489 4.026 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]C2CCC(C)(c3ccccc3)CC2)C1 ZINC001206680440 1049778772 /nfs/dbraw/zinc/77/87/72/1049778772.db2.gz JXPMFUDRCRMIQS-KMFTYDHNSA-N 2 1 314.517 4.208 20 0 DIADMP C1CCC2(C1)CCCC[C@H]2[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001206715757 1049783918 /nfs/dbraw/zinc/78/39/18/1049783918.db2.gz WWIKCATXIPGCDV-PKOBYXMFSA-N 2 1 304.522 4.486 20 0 DIADMP C1CCC2(C1)CCCC[C@H]2[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001206715757 1049783928 /nfs/dbraw/zinc/78/39/28/1049783928.db2.gz WWIKCATXIPGCDV-PKOBYXMFSA-N 2 1 304.522 4.486 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001206769260 1049794838 /nfs/dbraw/zinc/79/48/38/1049794838.db2.gz NUDNDGXNENABFP-KGLIPLIRSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001206767801 1049795073 /nfs/dbraw/zinc/79/50/73/1049795073.db2.gz FGZGMEPFJDVVHK-HOCLYGCPSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001206769261 1049795449 /nfs/dbraw/zinc/79/54/49/1049795449.db2.gz NUDNDGXNENABFP-UONOGXRCSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001206767800 1049795514 /nfs/dbraw/zinc/79/55/14/1049795514.db2.gz FGZGMEPFJDVVHK-GOEBONIOSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001206771415 1049796692 /nfs/dbraw/zinc/79/66/92/1049796692.db2.gz WQKMNOFWFKTOGM-HZPDHXFCSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001206770482 1049796845 /nfs/dbraw/zinc/79/68/45/1049796845.db2.gz SIYXXCGNMPJDKO-HUUCEWRRSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001206771398 1049797059 /nfs/dbraw/zinc/79/70/59/1049797059.db2.gz WOFSRTUYHITINI-LSDHHAIUSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001206771411 1049797103 /nfs/dbraw/zinc/79/71/03/1049797103.db2.gz WQKMNOFWFKTOGM-CVEARBPZSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001206771416 1049797123 /nfs/dbraw/zinc/79/71/23/1049797123.db2.gz WQKMNOFWFKTOGM-JKSUJKDBSA-N 2 1 312.432 4.052 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)[N@H+](CC[C@H]3CCCC[NH+]3C)C2)cc1 ZINC000490105577 1049798832 /nfs/dbraw/zinc/79/88/32/1049798832.db2.gz XBPWEQSPNAXYPY-DFQSSKMNSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)[NH+](CC[C@H]3CCCC[N@@H+]3C)C2)cc1 ZINC000490105577 1049798839 /nfs/dbraw/zinc/79/88/39/1049798839.db2.gz XBPWEQSPNAXYPY-DFQSSKMNSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)[NH+](CC[C@H]3CCCC[N@H+]3C)C2)cc1 ZINC000490105577 1049798843 /nfs/dbraw/zinc/79/88/43/1049798843.db2.gz XBPWEQSPNAXYPY-DFQSSKMNSA-N 2 1 300.490 4.047 20 0 DIADMP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1ccc2c(c1)CCCC2 ZINC001206800094 1049802002 /nfs/dbraw/zinc/80/20/02/1049802002.db2.gz HWPOLKGGFPJEML-DYESRHJHSA-N 2 1 314.517 4.118 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@@H](C[NH3+])CC[C@H]2C)ccc1Oc1ccccc1 ZINC001206806213 1049803783 /nfs/dbraw/zinc/80/37/83/1049803783.db2.gz FZLPXXKZQJRKDS-IEBWSBKVSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001206811472 1049805618 /nfs/dbraw/zinc/80/56/18/1049805618.db2.gz UZACRYWEYKBJGZ-WBVHZDCISA-N 2 1 312.432 4.052 20 0 DIADMP Cc1occc1C[N@@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000490423106 1049827760 /nfs/dbraw/zinc/82/77/60/1049827760.db2.gz NDXWEGYDDKBITA-OXJNMPFZSA-N 2 1 312.457 4.073 20 0 DIADMP Cc1occc1C[N@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000490423106 1049827766 /nfs/dbraw/zinc/82/77/66/1049827766.db2.gz NDXWEGYDDKBITA-OXJNMPFZSA-N 2 1 312.457 4.073 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c1C ZINC001207093638 1049836110 /nfs/dbraw/zinc/83/61/10/1049836110.db2.gz MUETXFRPKKLWIS-IFXJQAMLSA-N 2 1 320.546 4.498 20 0 DIADMP C[N@H+](C1CC1)C1CC[NH+](C[C@H]2C[C@H]2c2ccc(Cl)cc2)CC1 ZINC001207198384 1049861695 /nfs/dbraw/zinc/86/16/95/1049861695.db2.gz SQGQXAGGPPAYMP-BEFAXECRSA-N 2 1 318.892 4.002 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+](C[C@H]2C[C@H]2c2ccc(Cl)cc2)CC1 ZINC001207198384 1049861709 /nfs/dbraw/zinc/86/17/09/1049861709.db2.gz SQGQXAGGPPAYMP-BEFAXECRSA-N 2 1 318.892 4.002 20 0 DIADMP CC[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207284776 1049874294 /nfs/dbraw/zinc/87/42/94/1049874294.db2.gz QYMCNCUFWPJKPZ-UHFFFAOYSA-N 2 1 322.496 4.421 20 0 DIADMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)C1CCCCC1 ZINC001207284484 1049874919 /nfs/dbraw/zinc/87/49/19/1049874919.db2.gz ODJPNRVKYUYAJQ-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2c3cc(C)ccc3C[C@H]2C)c1 ZINC000491028148 1049880279 /nfs/dbraw/zinc/88/02/79/1049880279.db2.gz CVEQERKWADBRDO-VGOFRKELSA-N 2 1 322.496 4.470 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1 ZINC000491028146 1049880471 /nfs/dbraw/zinc/88/04/71/1049880471.db2.gz CVEQERKWADBRDO-HTAPYJJXSA-N 2 1 322.496 4.470 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)CC1CC[NH2+]CC1 ZINC001207441644 1049893353 /nfs/dbraw/zinc/89/33/53/1049893353.db2.gz HXCJUSGQBXFCSJ-FQEVSTJZSA-N 2 1 302.506 4.109 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001207485630 1049897470 /nfs/dbraw/zinc/89/74/70/1049897470.db2.gz YSHZPUCPZVRSHX-LJQANCHMSA-N 2 1 304.453 4.085 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001207485637 1049897507 /nfs/dbraw/zinc/89/75/07/1049897507.db2.gz ZAAXFBNMGXAZLT-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP C1=CCC(CC[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001207509643 1049900913 /nfs/dbraw/zinc/90/09/13/1049900913.db2.gz NTYLGBGKGRWKSB-FPOVZHCZSA-N 2 1 310.485 4.300 20 0 DIADMP C1=CCC(CC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001207509643 1049900920 /nfs/dbraw/zinc/90/09/20/1049900920.db2.gz NTYLGBGKGRWKSB-FPOVZHCZSA-N 2 1 310.485 4.300 20 0 DIADMP CC(C)c1ccc(CC[NH+]2CCC(C)([NH+]3CCCC3)CC2)cc1 ZINC001207522268 1049903287 /nfs/dbraw/zinc/90/32/87/1049903287.db2.gz DKVZCJFHIWYSNB-UHFFFAOYSA-N 2 1 314.517 4.303 20 0 DIADMP CC[NH+](CC)C1CC[NH+](CCCc2ccc(Cl)cc2)CC1 ZINC001207595961 1049914089 /nfs/dbraw/zinc/91/40/89/1049914089.db2.gz MTWYDGKCKDCAPV-UHFFFAOYSA-N 2 1 308.897 4.079 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)CCCc2ccc(Cl)cc2)CC1 ZINC001207597175 1049914149 /nfs/dbraw/zinc/91/41/49/1049914149.db2.gz GOSDPFGJYZHNHL-UHFFFAOYSA-N 2 1 322.924 4.469 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](CCCC2CCCCC2)CC1 ZINC001207607284 1049916490 /nfs/dbraw/zinc/91/64/90/1049916490.db2.gz NIDMVCVNGPYBFU-UHFFFAOYSA-N 2 1 315.505 4.289 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1CCCCc1ccccc1 ZINC001207616666 1049918350 /nfs/dbraw/zinc/91/83/50/1049918350.db2.gz HKNVKYKWNQLQJQ-LEWJYISDSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCCCc1ccccc1 ZINC001207616666 1049918355 /nfs/dbraw/zinc/91/83/55/1049918355.db2.gz HKNVKYKWNQLQJQ-LEWJYISDSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCCCc1ccccc1 ZINC001207616666 1049918357 /nfs/dbraw/zinc/91/83/57/1049918357.db2.gz HKNVKYKWNQLQJQ-LEWJYISDSA-N 2 1 314.517 4.348 20 0 DIADMP CC(C)=CCC[C@H](C)CC[N@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@H]2C1 ZINC001207783449 1049938900 /nfs/dbraw/zinc/93/89/00/1049938900.db2.gz GUMACBNCSXFWCO-LWYYNNOASA-N 2 1 306.538 4.421 20 0 DIADMP C[C@H](c1nccc2ccccc21)[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001207837297 1049942726 /nfs/dbraw/zinc/94/27/26/1049942726.db2.gz OPYGOKAROIXEFA-OAHLLOKOSA-N 2 1 311.473 4.148 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cccc(OCC)c2)CC1 ZINC000164473741 1049947343 /nfs/dbraw/zinc/94/73/43/1049947343.db2.gz WRTDGVHYCLYBKE-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@H+](C)C1CC[NH+](C)CC1 ZINC001207913285 1049954869 /nfs/dbraw/zinc/95/48/69/1049954869.db2.gz IZIKEJQAYQLKDT-QGZVFWFLSA-N 2 1 316.533 4.189 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C1CC[NH+](C)CC1 ZINC001207913285 1049954871 /nfs/dbraw/zinc/95/48/71/1049954871.db2.gz IZIKEJQAYQLKDT-QGZVFWFLSA-N 2 1 316.533 4.189 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC001207936198 1049956808 /nfs/dbraw/zinc/95/68/08/1049956808.db2.gz CTZFQXVGKYQQHR-SFHVURJKSA-N 2 1 316.533 4.262 20 0 DIADMP CC[NH+]1CCC([N@H+](C)C[C@@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001207936768 1049959359 /nfs/dbraw/zinc/95/93/59/1049959359.db2.gz JLXBFXIVDOWDLF-SFHVURJKSA-N 2 1 316.533 4.405 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)C[C@@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001207936768 1049959365 /nfs/dbraw/zinc/95/93/65/1049959365.db2.gz JLXBFXIVDOWDLF-SFHVURJKSA-N 2 1 316.533 4.405 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C/C=C/c1ccccc1 ZINC000588177556 1049973552 /nfs/dbraw/zinc/97/35/52/1049973552.db2.gz CFZFNNFPBYZUKV-FMIVXFBMSA-N 2 1 308.469 4.330 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001208107696 1049973679 /nfs/dbraw/zinc/97/36/79/1049973679.db2.gz YXJHQFWVIHQBEB-KRWDZBQOSA-N 2 1 306.881 4.209 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC1 ZINC001208113437 1049974072 /nfs/dbraw/zinc/97/40/72/1049974072.db2.gz INYLJRJUOAUOHW-CYBMUJFWSA-N 2 1 312.910 4.270 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)CC1(C)CC[NH+](C)CC1 ZINC001208110914 1049974195 /nfs/dbraw/zinc/97/41/95/1049974195.db2.gz YADJUQUEXIMVOJ-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC/C=C\CCC[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001208136294 1049976393 /nfs/dbraw/zinc/97/63/93/1049976393.db2.gz UBZLROSQIPNDTD-PLNGDYQASA-N 2 1 300.490 4.329 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)CC1 ZINC001208166228 1049980069 /nfs/dbraw/zinc/98/00/69/1049980069.db2.gz AHPSLGHIXKZGDG-AZUAARDMSA-N 2 1 316.533 4.319 20 0 DIADMP Cc1ccc([C@@H](C)CC[NH+]2CCC(C)([NH+]3CCCC3)CC2)o1 ZINC001208159710 1049980446 /nfs/dbraw/zinc/98/04/46/1049980446.db2.gz CQVZEQYXKHVJAM-INIZCTEOSA-N 2 1 304.478 4.032 20 0 DIADMP CC/C=C\CCCCCN1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001208194843 1049983565 /nfs/dbraw/zinc/98/35/65/1049983565.db2.gz SDCMYVFBAOXPLH-PRPIBZDOSA-N 2 1 322.537 4.088 20 0 DIADMP CC/C=C\CCCCC[NH+]1CCC([N@H+](CC)[C@H]2CCOC2)CC1 ZINC001208194843 1049983569 /nfs/dbraw/zinc/98/35/69/1049983569.db2.gz SDCMYVFBAOXPLH-PRPIBZDOSA-N 2 1 322.537 4.088 20 0 DIADMP CC/C=C\CCCCCN1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001208194842 1049983764 /nfs/dbraw/zinc/98/37/64/1049983764.db2.gz SDCMYVFBAOXPLH-KKHYBRAUSA-N 2 1 322.537 4.088 20 0 DIADMP CC/C=C\CCCCC[NH+]1CCC([N@H+](CC)[C@@H]2CCOC2)CC1 ZINC001208194842 1049983767 /nfs/dbraw/zinc/98/37/67/1049983767.db2.gz SDCMYVFBAOXPLH-KKHYBRAUSA-N 2 1 322.537 4.088 20 0 DIADMP C[N@@H+](C[C@H]1CCC[NH+](C)C1)C(c1ccccc1)c1ccccc1 ZINC001208603846 1049997603 /nfs/dbraw/zinc/99/76/03/1049997603.db2.gz GYNFQEZASSATRH-SFHVURJKSA-N 2 1 308.469 4.050 20 0 DIADMP C[NH+](C[C@H]1CCC[N@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC001208603846 1049997606 /nfs/dbraw/zinc/99/76/06/1049997606.db2.gz GYNFQEZASSATRH-SFHVURJKSA-N 2 1 308.469 4.050 20 0 DIADMP C[NH+](C[C@H]1CCC[N@@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC001208603846 1049997610 /nfs/dbraw/zinc/99/76/10/1049997610.db2.gz GYNFQEZASSATRH-SFHVURJKSA-N 2 1 308.469 4.050 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)CC1 ZINC001208597164 1049997655 /nfs/dbraw/zinc/99/76/55/1049997655.db2.gz DJHQVBUEFJEHEQ-AWEZNQCLSA-N 2 1 312.910 4.270 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](CC[C@H](C)CC(C)(C)C)CC1 ZINC001208654620 1049999182 /nfs/dbraw/zinc/99/91/82/1049999182.db2.gz MHAFDIHWJHDVKT-INIZCTEOSA-N 2 1 317.521 4.391 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CCC3CC3)C[C@H]21 ZINC001208683132 1050001496 /nfs/dbraw/zinc/00/14/96/1050001496.db2.gz YODLMQADXGQRIP-BHIYHBOVSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CCC3CC3)C[C@H]21 ZINC001208683132 1050001502 /nfs/dbraw/zinc/00/15/02/1050001502.db2.gz YODLMQADXGQRIP-BHIYHBOVSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](CCC3CC3)C[C@H]21 ZINC001208683132 1050001506 /nfs/dbraw/zinc/00/15/06/1050001506.db2.gz YODLMQADXGQRIP-BHIYHBOVSA-N 2 1 318.530 4.081 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CCC2CC2)CC1 ZINC001208686650 1050002232 /nfs/dbraw/zinc/00/22/32/1050002232.db2.gz OQIYOEFEAMNCCQ-UHFFFAOYSA-N 2 1 306.881 4.036 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CCC2CC2)CC1 ZINC001208686650 1050002237 /nfs/dbraw/zinc/00/22/37/1050002237.db2.gz OQIYOEFEAMNCCQ-UHFFFAOYSA-N 2 1 306.881 4.036 20 0 DIADMP CCC[N@@H+]1C[C@@H]2C[NH+](C[C@H](C)c3cccc4ccccc43)C[C@@H]2C1 ZINC001208710632 1050006145 /nfs/dbraw/zinc/00/61/45/1050006145.db2.gz RCADQZOHARSDPX-YSIASYRMSA-N 2 1 322.496 4.217 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@@H+](C[C@H](C)c3cccc4ccccc43)C[C@@H]2C1 ZINC001208710632 1050006148 /nfs/dbraw/zinc/00/61/48/1050006148.db2.gz RCADQZOHARSDPX-YSIASYRMSA-N 2 1 322.496 4.217 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@H+](C[C@H](C)c3cccc4ccccc43)C[C@@H]2C1 ZINC001208710632 1050006152 /nfs/dbraw/zinc/00/61/52/1050006152.db2.gz RCADQZOHARSDPX-YSIASYRMSA-N 2 1 322.496 4.217 20 0 DIADMP CC(C)CCC[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001208736816 1050007780 /nfs/dbraw/zinc/00/77/80/1050007780.db2.gz PDSSPRVSLRGEGQ-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[C@H]1CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208931264 1050024083 /nfs/dbraw/zinc/02/40/83/1050024083.db2.gz IRZPBSFBPNENOD-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208931264 1050024086 /nfs/dbraw/zinc/02/40/86/1050024086.db2.gz IRZPBSFBPNENOD-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208931264 1050024090 /nfs/dbraw/zinc/02/40/90/1050024090.db2.gz IRZPBSFBPNENOD-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[N@H+](C[C@H]1CCC[NH+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929418 1050024926 /nfs/dbraw/zinc/02/49/26/1050024926.db2.gz RTMZWYJBCYBXJY-QUCCMNQESA-N 2 1 302.506 4.409 20 0 DIADMP CCC[N@@H+](C[C@H]1CCC[NH+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929418 1050024930 /nfs/dbraw/zinc/02/49/30/1050024930.db2.gz RTMZWYJBCYBXJY-QUCCMNQESA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929418 1050024936 /nfs/dbraw/zinc/02/49/36/1050024936.db2.gz RTMZWYJBCYBXJY-QUCCMNQESA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929418 1050024940 /nfs/dbraw/zinc/02/49/40/1050024940.db2.gz RTMZWYJBCYBXJY-QUCCMNQESA-N 2 1 302.506 4.409 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC[C@@H]4CCCC[C@H]43)C2)cc1 ZINC001208947801 1050027577 /nfs/dbraw/zinc/02/75/77/1050027577.db2.gz DAEIYJURFZIXDV-PCCBWWKXSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCC[C@@H]4CCCC[C@H]43)C2)cc1 ZINC001208947801 1050027581 /nfs/dbraw/zinc/02/75/81/1050027581.db2.gz DAEIYJURFZIXDV-PCCBWWKXSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCC[C@@H]4CCCC[C@H]43)C2)cc1 ZINC001208947801 1050027589 /nfs/dbraw/zinc/02/75/89/1050027589.db2.gz DAEIYJURFZIXDV-PCCBWWKXSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[N@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935420 1050028547 /nfs/dbraw/zinc/02/85/47/1050028547.db2.gz JARYDZVTSOWRRX-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935420 1050028552 /nfs/dbraw/zinc/02/85/52/1050028552.db2.gz JARYDZVTSOWRRX-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935420 1050028556 /nfs/dbraw/zinc/02/85/56/1050028556.db2.gz JARYDZVTSOWRRX-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935420 1050028560 /nfs/dbraw/zinc/02/85/60/1050028560.db2.gz JARYDZVTSOWRRX-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@@H+](Cc1ccsc1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208939913 1050028576 /nfs/dbraw/zinc/02/85/76/1050028576.db2.gz LGFGRSYABORIDL-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[N@H+](Cc1ccsc1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208939913 1050028578 /nfs/dbraw/zinc/02/85/78/1050028578.db2.gz LGFGRSYABORIDL-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1ccsc1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208939913 1050028584 /nfs/dbraw/zinc/02/85/84/1050028584.db2.gz LGFGRSYABORIDL-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1ccsc1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208939913 1050028590 /nfs/dbraw/zinc/02/85/90/1050028590.db2.gz LGFGRSYABORIDL-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[N@@H+](CCc1cccs1)C1CC[NH+](C2CCCCC2)CC1 ZINC001209228752 1050045739 /nfs/dbraw/zinc/04/57/39/1050045739.db2.gz OSEMSFFPSNIWQR-UHFFFAOYSA-N 2 1 306.519 4.020 20 0 DIADMP CC[NH+](CC)CCC[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000589633215 1050051162 /nfs/dbraw/zinc/05/11/62/1050051162.db2.gz CKOZPIVXLDWNPD-UHFFFAOYSA-N 2 1 322.802 4.180 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168393115 1050055156 /nfs/dbraw/zinc/05/51/56/1050055156.db2.gz WASMILDZIGHJFI-LJQANCHMSA-N 2 1 318.892 4.351 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168393115 1050055162 /nfs/dbraw/zinc/05/51/62/1050055162.db2.gz WASMILDZIGHJFI-LJQANCHMSA-N 2 1 318.892 4.351 20 0 DIADMP c1cc2ccc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)cc2[nH]1 ZINC001209512675 1050064473 /nfs/dbraw/zinc/06/44/73/1050064473.db2.gz NRQWBVAISFZQPF-IBGZPJMESA-N 2 1 311.473 4.008 20 0 DIADMP CC[N@@H+](CCCc1ccccc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999640 1050069037 /nfs/dbraw/zinc/06/90/37/1050069037.db2.gz PPBYSCRRYOLQGO-UHFFFAOYSA-N 2 1 310.485 4.203 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999574 1050069334 /nfs/dbraw/zinc/06/93/34/1050069334.db2.gz PFQSFNVRCCNGKN-UHFFFAOYSA-N 2 1 316.876 4.424 20 0 DIADMP CC[NH+](CC)Cc1ccc(Nc2ccc3[nH+]c(C)cn3c2)cc1 ZINC001209821576 1050088735 /nfs/dbraw/zinc/08/87/35/1050088735.db2.gz JCGKEHUROLBPGD-UHFFFAOYSA-N 2 1 308.429 4.228 20 0 DIADMP CCC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)C1CCCC1 ZINC000823677276 1050150234 /nfs/dbraw/zinc/15/02/34/1050150234.db2.gz RDKKZGBTLWPBMF-GOSISDBHSA-N 2 1 312.461 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000348049179 1050170312 /nfs/dbraw/zinc/17/03/12/1050170312.db2.gz PQESPBDNEDGDND-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000348049179 1050170317 /nfs/dbraw/zinc/17/03/17/1050170317.db2.gz PQESPBDNEDGDND-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP CCCC[C@@H](CC)CC[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1 ZINC000770727369 1050186419 /nfs/dbraw/zinc/18/64/19/1050186419.db2.gz YOUPAGDLBHCGBY-QGZVFWFLSA-N 2 1 314.477 4.272 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000591695697 1050197242 /nfs/dbraw/zinc/19/72/42/1050197242.db2.gz UVURHKZLDNFIRW-LEWJYISDSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000591695699 1050197331 /nfs/dbraw/zinc/19/73/31/1050197331.db2.gz UVURHKZLDNFIRW-RTWAWAEBSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccncc1[C@@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000771389436 1050247275 /nfs/dbraw/zinc/24/72/75/1050247275.db2.gz RNSAPTRBTFXKLS-QGZVFWFLSA-N 2 1 315.505 4.085 20 0 DIADMP c1ccc(C[N@H+](CC[C@@H]2CCC[NH2+]C2)C2CCCCC2)cc1 ZINC001210580153 1050304180 /nfs/dbraw/zinc/30/41/80/1050304180.db2.gz GFHHHVLXOXYDJR-SFHVURJKSA-N 2 1 300.490 4.211 20 0 DIADMP [NH3+]Cc1cccc(C[N@@H+](Cc2ccccc2)C2CCCCC2)c1 ZINC001210581580 1050305708 /nfs/dbraw/zinc/30/57/08/1050305708.db2.gz RQVUQMBRFIPYME-UHFFFAOYSA-N 2 1 308.469 4.480 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2cc(Cl)ccc2C1 ZINC001171096617 1050339083 /nfs/dbraw/zinc/33/90/83/1050339083.db2.gz UPUICNGJKDXDMN-BEFAXECRSA-N 2 1 320.908 4.051 20 0 DIADMP Cc1c(F)cc(F)cc1C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001143767561 1050353955 /nfs/dbraw/zinc/35/39/55/1050353955.db2.gz BJRPDZRMZWOEEA-ZWKOTPCHSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(F)cc(F)cc1C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001143767561 1050353960 /nfs/dbraw/zinc/35/39/60/1050353960.db2.gz BJRPDZRMZWOEEA-ZWKOTPCHSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001143767561 1050353965 /nfs/dbraw/zinc/35/39/65/1050353965.db2.gz BJRPDZRMZWOEEA-ZWKOTPCHSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001143767561 1050353968 /nfs/dbraw/zinc/35/39/68/1050353968.db2.gz BJRPDZRMZWOEEA-ZWKOTPCHSA-N 2 1 322.443 4.112 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@@H]2CCc3cc(Cl)ccc3C2)C1 ZINC001171113165 1050384205 /nfs/dbraw/zinc/38/42/05/1050384205.db2.gz OYHDCLAHVCLZHI-HNAYVOBHSA-N 2 1 320.908 4.038 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030180 1050424763 /nfs/dbraw/zinc/42/47/63/1050424763.db2.gz AIVJOTNWLORECS-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030180 1050424773 /nfs/dbraw/zinc/42/47/73/1050424773.db2.gz AIVJOTNWLORECS-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000574452384 1050477382 /nfs/dbraw/zinc/47/73/82/1050477382.db2.gz FVECYSWYZGVAJJ-IVDHNXQLSA-N 2 1 316.464 4.052 20 0 DIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574690818 1050508623 /nfs/dbraw/zinc/50/86/23/1050508623.db2.gz KXNOKRPYHPPGBI-IPMKNSEASA-N 2 1 316.464 4.054 20 0 DIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574690818 1050508634 /nfs/dbraw/zinc/50/86/34/1050508634.db2.gz KXNOKRPYHPPGBI-IPMKNSEASA-N 2 1 316.464 4.054 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000786679005 1050510399 /nfs/dbraw/zinc/51/03/99/1050510399.db2.gz VJWGUDNGVMOJGP-IEBWSBKVSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000786679005 1050510409 /nfs/dbraw/zinc/51/04/09/1050510409.db2.gz VJWGUDNGVMOJGP-IEBWSBKVSA-N 2 1 318.892 4.278 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@@H](C)CCCC(C)C)CC1 ZINC001170068770 1050557017 /nfs/dbraw/zinc/55/70/17/1050557017.db2.gz JQWKQTXIHIOIOE-KRWDZBQOSA-N 2 1 303.494 4.163 20 0 DIADMP CC(C)CCC[C@@H](C)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001170083735 1050662526 /nfs/dbraw/zinc/66/25/26/1050662526.db2.gz YWQZZWUYADNZAU-QZTJIDSGSA-N 2 1 324.553 4.213 20 0 DIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000742375916 1050837870 /nfs/dbraw/zinc/83/78/70/1050837870.db2.gz XZVOPJMUPITOGX-IEBWSBKVSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@H]1CC[C@@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001170109372 1050839714 /nfs/dbraw/zinc/83/97/14/1050839714.db2.gz OJXJARCTJQSDJW-XNUXLAJESA-N 2 1 312.501 4.303 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC000742733875 1050929936 /nfs/dbraw/zinc/92/99/36/1050929936.db2.gz HSDYBLABUNVZOO-SFHVURJKSA-N 2 1 308.469 4.174 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000348199413 1051006493 /nfs/dbraw/zinc/00/64/93/1051006493.db2.gz CGMBWTGSQMLPKY-KXBFYZLASA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000348199413 1051006507 /nfs/dbraw/zinc/00/65/07/1051006507.db2.gz CGMBWTGSQMLPKY-KXBFYZLASA-N 2 1 315.436 4.194 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([N@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156276 1051059680 /nfs/dbraw/zinc/05/96/80/1051059680.db2.gz CDKYFUGIRKTDBW-DNVCBOLYSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156276 1051059686 /nfs/dbraw/zinc/05/96/86/1051059686.db2.gz CDKYFUGIRKTDBW-DNVCBOLYSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H]1CC[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC1(F)F ZINC001171632238 1051175570 /nfs/dbraw/zinc/17/55/70/1051175570.db2.gz XXNLQHVENYRTNC-CYBMUJFWSA-N 2 1 302.453 4.005 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3c2cc(F)cc3F)CC1(C)C ZINC001171623996 1051178858 /nfs/dbraw/zinc/17/88/58/1051178858.db2.gz KOHWRECMEUZFTK-QGZVFWFLSA-N 2 1 322.443 4.193 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)CCO2 ZINC001171624350 1051179916 /nfs/dbraw/zinc/17/99/16/1051179916.db2.gz RKFQEUXZSFNDTR-KRWDZBQOSA-N 2 1 316.489 4.060 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2sccc2Cl)CC1(C)C ZINC001171626079 1051182003 /nfs/dbraw/zinc/18/20/03/1051182003.db2.gz VEHPIACBMMGTTG-UHFFFAOYSA-N 2 1 300.899 4.143 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171667268 1051188763 /nfs/dbraw/zinc/18/87/63/1051188763.db2.gz VIGQEAKWUZYGEK-YYWHXJBOSA-N 2 1 314.517 4.298 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171636907 1051194804 /nfs/dbraw/zinc/19/48/04/1051194804.db2.gz KHKIQCBWIGXQIU-UHFFFAOYSA-N 2 1 308.897 4.423 20 0 DIADMP CC1(C)C[C@H]([NH2+]C2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171966193 1051249636 /nfs/dbraw/zinc/24/96/36/1051249636.db2.gz TULBMFOYHZKWCQ-LJQANCHMSA-N 2 1 300.490 4.352 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171971336 1051259971 /nfs/dbraw/zinc/25/99/71/1051259971.db2.gz GXQKKVFOIMTION-PKOBYXMFSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975748 1051265064 /nfs/dbraw/zinc/26/50/64/1051265064.db2.gz FEEWDXFCJWUJRI-WDSOQIARSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975748 1051265072 /nfs/dbraw/zinc/26/50/72/1051265072.db2.gz FEEWDXFCJWUJRI-WDSOQIARSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@H]1C[C@@H](CF)[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975748 1051265082 /nfs/dbraw/zinc/26/50/82/1051265082.db2.gz FEEWDXFCJWUJRI-WDSOQIARSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@H]1C[C@@H](CF)[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975748 1051265093 /nfs/dbraw/zinc/26/50/93/1051265093.db2.gz FEEWDXFCJWUJRI-WDSOQIARSA-N 2 1 318.480 4.110 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2C3)CC[N@H+]1Cc1ccccc1 ZINC001171977666 1051267686 /nfs/dbraw/zinc/26/76/86/1051267686.db2.gz GEZRDSYOQCVQSW-FUMNGEBKSA-N 2 1 312.501 4.208 20 0 DIADMP CC1(C)C[C@H]([NH2+]CCC2CCC2)CC[N@H+]1Cc1ccccc1 ZINC001171981784 1051268351 /nfs/dbraw/zinc/26/83/51/1051268351.db2.gz DBQMIFIJFFPJMS-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC23CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001171982721 1051269368 /nfs/dbraw/zinc/26/93/68/1051269368.db2.gz SMQWXZGGNFLKGW-LJQANCHMSA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171982721 1051269382 /nfs/dbraw/zinc/26/93/82/1051269382.db2.gz SMQWXZGGNFLKGW-LJQANCHMSA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC23CCCC3)CC[NH+]1Cc1ccccc1 ZINC001171982721 1051269393 /nfs/dbraw/zinc/26/93/93/1051269393.db2.gz SMQWXZGGNFLKGW-LJQANCHMSA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC23CCCC3)CC[NH+]1Cc1ccccc1 ZINC001171982721 1051269402 /nfs/dbraw/zinc/26/94/02/1051269402.db2.gz SMQWXZGGNFLKGW-LJQANCHMSA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)C[C@@H]([NH+]2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171978065 1051269416 /nfs/dbraw/zinc/26/94/16/1051269416.db2.gz WGNWJPAPUKZYNJ-NRFANRHFSA-N 2 1 320.480 4.445 20 0 DIADMP CC1(C)C[C@@H]([NH+]2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001171978065 1051269421 /nfs/dbraw/zinc/26/94/21/1051269421.db2.gz WGNWJPAPUKZYNJ-NRFANRHFSA-N 2 1 320.480 4.445 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC(CF)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171987985 1051271442 /nfs/dbraw/zinc/27/14/42/1051271442.db2.gz NLWUZPSWEJRTFE-IBGZPJMESA-N 2 1 318.480 4.111 20 0 DIADMP C[N@@H+](CC(C)(C)C)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985237 1051272575 /nfs/dbraw/zinc/27/25/75/1051272575.db2.gz ULLNMRMTYHDBBF-GOSISDBHSA-N 2 1 302.506 4.408 20 0 DIADMP C[NH+](CC(C)(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985237 1051272589 /nfs/dbraw/zinc/27/25/89/1051272589.db2.gz ULLNMRMTYHDBBF-GOSISDBHSA-N 2 1 302.506 4.408 20 0 DIADMP C[NH+](CC(C)(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985237 1051272599 /nfs/dbraw/zinc/27/25/99/1051272599.db2.gz ULLNMRMTYHDBBF-GOSISDBHSA-N 2 1 302.506 4.408 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCC1 ZINC001172070886 1051273924 /nfs/dbraw/zinc/27/39/24/1051273924.db2.gz SBNZSDMTCJWEDP-LRGNLBRXSA-N 2 1 312.501 4.350 20 0 DIADMP CC1(C)CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076474 1051276509 /nfs/dbraw/zinc/27/65/09/1051276509.db2.gz ZGRMGRIOBPSAMY-ACDBMABISA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076474 1051276512 /nfs/dbraw/zinc/27/65/12/1051276512.db2.gz ZGRMGRIOBPSAMY-ACDBMABISA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172076474 1051276521 /nfs/dbraw/zinc/27/65/21/1051276521.db2.gz ZGRMGRIOBPSAMY-ACDBMABISA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172076474 1051276536 /nfs/dbraw/zinc/27/65/36/1051276536.db2.gz ZGRMGRIOBPSAMY-ACDBMABISA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082435 1051280319 /nfs/dbraw/zinc/28/03/19/1051280319.db2.gz JYCMSDIWZSUNDN-MJUUVYJYSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1C[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082435 1051280326 /nfs/dbraw/zinc/28/03/26/1051280326.db2.gz JYCMSDIWZSUNDN-MJUUVYJYSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082435 1051280335 /nfs/dbraw/zinc/28/03/35/1051280335.db2.gz JYCMSDIWZSUNDN-MJUUVYJYSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082435 1051280342 /nfs/dbraw/zinc/28/03/42/1051280342.db2.gz JYCMSDIWZSUNDN-MJUUVYJYSA-N 2 1 324.512 4.447 20 0 DIADMP CC(C)[C@@H](C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172065523 1051283683 /nfs/dbraw/zinc/28/36/83/1051283683.db2.gz OAIKSJJDHIUAKS-AFYVEPGGSA-N 2 1 300.490 4.206 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CCC2CCC2)C3)cc1 ZINC001172066679 1051284785 /nfs/dbraw/zinc/28/47/85/1051284785.db2.gz FCRPHAYEBFSCSR-MZADTFQBSA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)(C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172066819 1051285498 /nfs/dbraw/zinc/28/54/98/1051285498.db2.gz KJMWFOXCRMIPNE-LDLYASANSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172063805 1051285705 /nfs/dbraw/zinc/28/57/05/1051285705.db2.gz CURLXBVPKIBIMM-JBINPLMMSA-N 2 1 312.501 4.350 20 0 DIADMP CC1(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC001172062873 1051285851 /nfs/dbraw/zinc/28/58/51/1051285851.db2.gz ADNAYDFMGIRQHO-ACDBMABISA-N 2 1 312.501 4.352 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2CC=CCC2)C3)cc1 ZINC001172065880 1051286050 /nfs/dbraw/zinc/28/60/50/1051286050.db2.gz AQHTWSHYEGAGQR-MXEMCNAFSA-N 2 1 310.485 4.270 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2CC24CCC4)C3)cc1 ZINC001172065842 1051286214 /nfs/dbraw/zinc/28/62/14/1051286214.db2.gz ACPDCHXUSSISLW-YSTOQKLRSA-N 2 1 310.485 4.104 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2CC4(CCC4)C2)C3)cc1 ZINC001172065267 1051286430 /nfs/dbraw/zinc/28/64/30/1051286430.db2.gz JTXNOTIYASZIFI-ZKTXZKFHSA-N 2 1 324.512 4.494 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2CC=CCC2)C3)cc1 ZINC001172065881 1051286594 /nfs/dbraw/zinc/28/65/94/1051286594.db2.gz AQHTWSHYEGAGQR-NCYKPQTJSA-N 2 1 310.485 4.270 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172063611 1051286653 /nfs/dbraw/zinc/28/66/53/1051286653.db2.gz CEZHFQJYKKMABZ-VTJKKSGASA-N 2 1 324.512 4.350 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(C)(c3ccccc3)CC1)C2 ZINC001172127750 1051287559 /nfs/dbraw/zinc/28/75/59/1051287559.db2.gz KCUVTCNUIOMMCS-PMOLBWCYSA-N 2 1 312.501 4.055 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(C)(c3ccccc3)CC1)C2 ZINC001172127750 1051287573 /nfs/dbraw/zinc/28/75/73/1051287573.db2.gz KCUVTCNUIOMMCS-PMOLBWCYSA-N 2 1 312.501 4.055 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125323 1051288151 /nfs/dbraw/zinc/28/81/51/1051288151.db2.gz PMJKBYIQFIETED-MWDXBVQZSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125323 1051288164 /nfs/dbraw/zinc/28/81/64/1051288164.db2.gz PMJKBYIQFIETED-MWDXBVQZSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125323 1051288171 /nfs/dbraw/zinc/28/81/71/1051288171.db2.gz PMJKBYIQFIETED-MWDXBVQZSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125323 1051288180 /nfs/dbraw/zinc/28/81/80/1051288180.db2.gz PMJKBYIQFIETED-MWDXBVQZSA-N 2 1 318.892 4.145 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069378 1051289296 /nfs/dbraw/zinc/28/92/96/1051289296.db2.gz PNAGUUBCLMTEKL-ANWOVWILSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069378 1051289306 /nfs/dbraw/zinc/28/93/06/1051289306.db2.gz PNAGUUBCLMTEKL-ANWOVWILSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069378 1051289320 /nfs/dbraw/zinc/28/93/20/1051289320.db2.gz PNAGUUBCLMTEKL-ANWOVWILSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069378 1051289331 /nfs/dbraw/zinc/28/93/31/1051289331.db2.gz PNAGUUBCLMTEKL-ANWOVWILSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC4(CC4)CC2)C3)cc1 ZINC001172067903 1051289907 /nfs/dbraw/zinc/28/99/07/1051289907.db2.gz GILCBPRZHZUOAR-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001172130998 1051292701 /nfs/dbraw/zinc/29/27/01/1051292701.db2.gz SRULFNCHZNZUGL-RDGPPVDQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001172130998 1051292709 /nfs/dbraw/zinc/29/27/09/1051292709.db2.gz SRULFNCHZNZUGL-RDGPPVDQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001172130998 1051292713 /nfs/dbraw/zinc/29/27/13/1051292713.db2.gz SRULFNCHZNZUGL-RDGPPVDQSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)C2 ZINC001172103184 1051296517 /nfs/dbraw/zinc/29/65/17/1051296517.db2.gz UGECVVWNEGZDLF-QKDCVEJESA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)C2 ZINC001172103184 1051296529 /nfs/dbraw/zinc/29/65/29/1051296529.db2.gz UGECVVWNEGZDLF-QKDCVEJESA-N 2 1 313.272 4.098 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1CCC(c3ccccc3)CC1)C2 ZINC001172102830 1051297607 /nfs/dbraw/zinc/29/76/07/1051297607.db2.gz PIYHTVFSSBLUOU-SMCZBRLRSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1CCC(c3ccccc3)CC1)C2 ZINC001172102830 1051297612 /nfs/dbraw/zinc/29/76/12/1051297612.db2.gz PIYHTVFSSBLUOU-SMCZBRLRSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)C2 ZINC001172103183 1051298058 /nfs/dbraw/zinc/29/80/58/1051298058.db2.gz UGECVVWNEGZDLF-QDMKHBRRSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)C2 ZINC001172103183 1051298078 /nfs/dbraw/zinc/29/80/78/1051298078.db2.gz UGECVVWNEGZDLF-QDMKHBRRSA-N 2 1 313.272 4.098 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001172108812 1051300678 /nfs/dbraw/zinc/30/06/78/1051300678.db2.gz ZRAXRQNGIVUPCO-HAGHYFMRSA-N 2 1 300.490 4.379 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001172108812 1051300690 /nfs/dbraw/zinc/30/06/90/1051300690.db2.gz ZRAXRQNGIVUPCO-HAGHYFMRSA-N 2 1 300.490 4.379 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001172108814 1051300861 /nfs/dbraw/zinc/30/08/61/1051300861.db2.gz ZRAXRQNGIVUPCO-YRPNKDGESA-N 2 1 300.490 4.379 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001172108814 1051300876 /nfs/dbraw/zinc/30/08/76/1051300876.db2.gz ZRAXRQNGIVUPCO-YRPNKDGESA-N 2 1 300.490 4.379 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172111150 1051302085 /nfs/dbraw/zinc/30/20/85/1051302085.db2.gz QKRZEFKLZPIEJJ-AKHDSKFASA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172111150 1051302094 /nfs/dbraw/zinc/30/20/94/1051302094.db2.gz QKRZEFKLZPIEJJ-AKHDSKFASA-N 2 1 304.453 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112457 1051302484 /nfs/dbraw/zinc/30/24/84/1051302484.db2.gz XCUDCSBLPPZMEG-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112457 1051302490 /nfs/dbraw/zinc/30/24/90/1051302490.db2.gz XCUDCSBLPPZMEG-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001172112694 1051302967 /nfs/dbraw/zinc/30/29/67/1051302967.db2.gz YUDQZSSMPFKWRF-YYAJDYIMSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172112694 1051302979 /nfs/dbraw/zinc/30/29/79/1051302979.db2.gz YUDQZSSMPFKWRF-YYAJDYIMSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3ccccc3F)CC1)C2 ZINC001172122904 1051303981 /nfs/dbraw/zinc/30/39/81/1051303981.db2.gz VKALARULQQUKRW-PIIMJCKOSA-N 2 1 316.464 4.020 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3ccccc3F)CC1)C2 ZINC001172122904 1051303991 /nfs/dbraw/zinc/30/39/91/1051303991.db2.gz VKALARULQQUKRW-PIIMJCKOSA-N 2 1 316.464 4.020 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1F ZINC001172116320 1051304096 /nfs/dbraw/zinc/30/40/96/1051304096.db2.gz GVTMAILDJVKQMR-ZXFNITATSA-N 2 1 308.416 4.021 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120179 1051304350 /nfs/dbraw/zinc/30/43/50/1051304350.db2.gz ACOFIOWAGBQKSZ-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120179 1051304362 /nfs/dbraw/zinc/30/43/62/1051304362.db2.gz ACOFIOWAGBQKSZ-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120179 1051304373 /nfs/dbraw/zinc/30/43/73/1051304373.db2.gz ACOFIOWAGBQKSZ-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120179 1051304382 /nfs/dbraw/zinc/30/43/82/1051304382.db2.gz ACOFIOWAGBQKSZ-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(C=Cc4ccccc43)CC1)C2 ZINC001172121661 1051305081 /nfs/dbraw/zinc/30/50/81/1051305081.db2.gz SBRSVRBYUCPLQY-ACDBMABISA-N 2 1 322.496 4.062 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc3sccc31)C2 ZINC001172118275 1051306378 /nfs/dbraw/zinc/30/63/78/1051306378.db2.gz QVSLQWDXLNZPPE-MUJYYYPQSA-N 2 1 300.471 4.006 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc4ccccc43)CC1)C2 ZINC001172116043 1051307008 /nfs/dbraw/zinc/30/70/08/1051307008.db2.gz XJUPLVTVUHABJJ-REPLKXPHSA-N 2 1 320.480 4.434 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc4ccccc43)CC1)C2 ZINC001172116043 1051307016 /nfs/dbraw/zinc/30/70/16/1051307016.db2.gz XJUPLVTVUHABJJ-REPLKXPHSA-N 2 1 320.480 4.434 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001172121567 1051307069 /nfs/dbraw/zinc/30/70/69/1051307069.db2.gz KOSBPJMTMZRVRV-YYAJDYIMSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001172121567 1051307077 /nfs/dbraw/zinc/30/70/77/1051307077.db2.gz KOSBPJMTMZRVRV-YYAJDYIMSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001172121567 1051307086 /nfs/dbraw/zinc/30/70/86/1051307086.db2.gz KOSBPJMTMZRVRV-YYAJDYIMSA-N 2 1 318.892 4.492 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C[C@H]1C ZINC001172372809 1051353580 /nfs/dbraw/zinc/35/35/80/1051353580.db2.gz JFTXRHNQOXMVSX-ZHALLVOQSA-N 2 1 304.522 4.152 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(Nc2ccc3c(c2)C[N@H+](C)CC3)cc1 ZINC001215765532 1051354784 /nfs/dbraw/zinc/35/47/84/1051354784.db2.gz ZBOLBQQMEDUANP-UHFFFAOYSA-N 2 1 323.484 4.164 20 0 DIADMP CCC(CC)[N@H+]([C@@H](C)CCO[C@@H](C)CC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172332223 1051357466 /nfs/dbraw/zinc/35/74/66/1051357466.db2.gz HLFRXJWDYMJIJV-DWRORGKVSA-N 2 1 312.542 4.341 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CCSc3c(F)cccc32)CC(C)(C)[NH2+]1 ZINC000191747819 1051365462 /nfs/dbraw/zinc/36/54/62/1051365462.db2.gz QKDQLODMALXNTM-OAHLLOKOSA-N 2 1 322.493 4.261 20 0 DIADMP CC(C)C([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000381827218 1051374503 /nfs/dbraw/zinc/37/45/03/1051374503.db2.gz HROFUUAYODSIEQ-HKUYNNGSSA-N 2 1 302.506 4.167 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C[C@@H]1C ZINC001172369403 1051378962 /nfs/dbraw/zinc/37/89/62/1051378962.db2.gz LXEXAMRCLIGVNQ-VKJFTORMSA-N 2 1 320.908 4.415 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001172403641 1051381018 /nfs/dbraw/zinc/38/10/18/1051381018.db2.gz NGSXTQUWAIJGHD-VQTJNVASSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@H](CC(C)C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172403641 1051381029 /nfs/dbraw/zinc/38/10/29/1051381029.db2.gz NGSXTQUWAIJGHD-VQTJNVASSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@H](CC(C)C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172403641 1051381043 /nfs/dbraw/zinc/38/10/43/1051381043.db2.gz NGSXTQUWAIJGHD-VQTJNVASSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001172403640 1051381554 /nfs/dbraw/zinc/38/15/54/1051381554.db2.gz NGSXTQUWAIJGHD-UXHICEINSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@@H](CC(C)C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172403640 1051381577 /nfs/dbraw/zinc/38/15/77/1051381577.db2.gz NGSXTQUWAIJGHD-UXHICEINSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@@H](CC(C)C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172403640 1051381587 /nfs/dbraw/zinc/38/15/87/1051381587.db2.gz NGSXTQUWAIJGHD-UXHICEINSA-N 2 1 302.506 4.265 20 0 DIADMP CCCCCC[C@@H](CCC)[NH+]1CCC2(CC(N(C)C)=[NH+]O2)CC1 ZINC001172387845 1051392391 /nfs/dbraw/zinc/39/23/91/1051392391.db2.gz UMIDSVQFNSQCFG-QGZVFWFLSA-N 2 1 323.525 4.256 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001172400557 1051397919 /nfs/dbraw/zinc/39/79/19/1051397919.db2.gz LDZMFXKJECGPPX-MISYRCLQSA-N 2 1 302.506 4.311 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001172400557 1051397929 /nfs/dbraw/zinc/39/79/29/1051397929.db2.gz LDZMFXKJECGPPX-MISYRCLQSA-N 2 1 302.506 4.311 20 0 DIADMP CC[C@H](CC(C)C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172401494 1051400584 /nfs/dbraw/zinc/40/05/84/1051400584.db2.gz ZNJYIEYLYPTCBN-LJQANCHMSA-N 2 1 318.505 4.392 20 0 DIADMP CC(C)COCC[C@@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001172477542 1051402602 /nfs/dbraw/zinc/40/26/02/1051402602.db2.gz AWICQRNBMAIFBL-GOSISDBHSA-N 2 1 324.553 4.167 20 0 DIADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001170452455 1051415578 /nfs/dbraw/zinc/41/55/78/1051415578.db2.gz YPUGOLCJICFMMT-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001170452455 1051415587 /nfs/dbraw/zinc/41/55/87/1051415587.db2.gz YPUGOLCJICFMMT-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccc(C3CCCC3)cc1)C2 ZINC001170452455 1051415592 /nfs/dbraw/zinc/41/55/92/1051415592.db2.gz YPUGOLCJICFMMT-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH+]3CC4(C3)CC[N@@H+](CC3CC3)C4)C2)cc1 ZINC001172539889 1051453932 /nfs/dbraw/zinc/45/39/32/1051453932.db2.gz DYFJSDUGGDXDRO-RTWAWAEBSA-N 2 1 324.512 4.131 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH+]3CC4(C3)CC[N@H+](CC3CC3)C4)C2)cc1 ZINC001172539889 1051453936 /nfs/dbraw/zinc/45/39/36/1051453936.db2.gz DYFJSDUGGDXDRO-RTWAWAEBSA-N 2 1 324.512 4.131 20 0 DIADMP CC(C)c1ccc([C@@H]2CCC[N@H+]2CC[C@@H]2CCC[NH+]2C)cc1 ZINC001168919116 1051468517 /nfs/dbraw/zinc/46/85/17/1051468517.db2.gz VNTVFXUWANWPKP-PMACEKPBSA-N 2 1 300.490 4.431 20 0 DIADMP c1ccc(CC2CCC([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC001172819717 1051511983 /nfs/dbraw/zinc/51/19/83/1051511983.db2.gz KSRHVXYZAJNINV-UHFFFAOYSA-N 2 1 312.501 4.004 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]C2CCC(Cc3ccccc3)CC2)C1 ZINC001172818686 1051512628 /nfs/dbraw/zinc/51/26/28/1051512628.db2.gz PPHYQJLQOROWAV-NYLDSWQDSA-N 2 1 314.517 4.109 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001169124440 1051522756 /nfs/dbraw/zinc/52/27/56/1051522756.db2.gz CNXLBFWSKUOKAZ-BWTSREIZSA-N 2 1 316.876 4.054 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001169124440 1051522765 /nfs/dbraw/zinc/52/27/65/1051522765.db2.gz CNXLBFWSKUOKAZ-BWTSREIZSA-N 2 1 316.876 4.054 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001169124440 1051522773 /nfs/dbraw/zinc/52/27/73/1051522773.db2.gz CNXLBFWSKUOKAZ-BWTSREIZSA-N 2 1 316.876 4.054 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001169155035 1051538143 /nfs/dbraw/zinc/53/81/43/1051538143.db2.gz WJZCLPLKOJIMQN-XMTFNYHQSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001169155035 1051538153 /nfs/dbraw/zinc/53/81/53/1051538153.db2.gz WJZCLPLKOJIMQN-XMTFNYHQSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001169155035 1051538163 /nfs/dbraw/zinc/53/81/63/1051538163.db2.gz WJZCLPLKOJIMQN-XMTFNYHQSA-N 2 1 304.865 4.102 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC[C@@H]1C[NH3+] ZINC001206004567 1051546675 /nfs/dbraw/zinc/54/66/75/1051546675.db2.gz UBGUUFWCLNVRJJ-VQIMIIECSA-N 2 1 320.480 4.065 20 0 DIADMP CC[NH+]1CCC([NH2+]C2(c3cccc(F)c3)CCCCC2)CC1 ZINC001169232770 1051558490 /nfs/dbraw/zinc/55/84/90/1051558490.db2.gz AGDKIOGWYCLFLK-UHFFFAOYSA-N 2 1 304.453 4.059 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC001169237888 1051558758 /nfs/dbraw/zinc/55/87/58/1051558758.db2.gz BLXDGOVXZMHYES-INIZCTEOSA-N 2 1 314.395 4.230 20 0 DIADMP CC[NH+]1CCC([NH2+]C2(c3ccccc3)CCC(F)(F)CC2)CC1 ZINC001169241643 1051561600 /nfs/dbraw/zinc/56/16/00/1051561600.db2.gz XPHOZJLZKCACRS-UHFFFAOYSA-N 2 1 322.443 4.165 20 0 DIADMP CC[NH+]1CCC([NH+]2CCC(Cc3cccc(Cl)c3)CC2)CC1 ZINC001169245529 1051562781 /nfs/dbraw/zinc/56/27/81/1051562781.db2.gz GXALHJAXUZLQDK-UHFFFAOYSA-N 2 1 320.908 4.079 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001169240888 1051563109 /nfs/dbraw/zinc/56/31/09/1051563109.db2.gz MSNQBPPHLLYDJH-IBGZPJMESA-N 2 1 304.453 4.131 20 0 DIADMP CC[NH+]1CCC([N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001169258795 1051564579 /nfs/dbraw/zinc/56/45/79/1051564579.db2.gz SDHMWGOECPYELP-QFIPXVFZSA-N 2 1 320.480 4.118 20 0 DIADMP CC[NH+]1CCC([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001169258795 1051564591 /nfs/dbraw/zinc/56/45/91/1051564591.db2.gz SDHMWGOECPYELP-QFIPXVFZSA-N 2 1 320.480 4.118 20 0 DIADMP C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2n1)C[NH+]1CCCCC1 ZINC000178408901 1051571445 /nfs/dbraw/zinc/57/14/45/1051571445.db2.gz ASXZBIPJAGLXFX-IAGOWNOFSA-N 2 1 311.473 4.007 20 0 DIADMP C[C@@H]1CCCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001169395931 1051608032 /nfs/dbraw/zinc/60/80/32/1051608032.db2.gz NUSZHEVDTBVZEN-GOSISDBHSA-N 2 1 300.490 4.295 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2Cc3ccccc3C(C)(C)C2)CC1 ZINC001173112623 1051609961 /nfs/dbraw/zinc/60/99/61/1051609961.db2.gz CZYCBNXVLDLJMI-UHFFFAOYSA-N 2 1 314.517 4.433 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](Cc3ccccc3)C2)CC1 ZINC001173112122 1051610512 /nfs/dbraw/zinc/61/05/12/1051610512.db2.gz QQFQEJOWUWSPMH-MWXLCCTBSA-N 2 1 314.517 4.204 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3c(C)cccc3C2)CC1 ZINC001173108011 1051610583 /nfs/dbraw/zinc/61/05/83/1051610583.db2.gz BEDNEZDBVVEZRJ-UHFFFAOYSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(Cl)c1 ZINC000256049223 1051618403 /nfs/dbraw/zinc/61/84/03/1051618403.db2.gz YYCBATNHNWCKMI-ZRJCITRHSA-N 2 1 313.272 4.269 20 0 DIADMP CCCOC1CCC([N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)CC1 ZINC001173099694 1051620702 /nfs/dbraw/zinc/62/07/02/1051620702.db2.gz PHRWXILTNNWHIZ-XEVCZEQESA-N 2 1 322.537 4.065 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173248436 1051653922 /nfs/dbraw/zinc/65/39/22/1051653922.db2.gz GUGLUHKLCMXSIM-MAODMQOUSA-N 2 1 314.517 4.162 20 0 DIADMP CCCC[C@H](CC(C)C)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001173255527 1051657368 /nfs/dbraw/zinc/65/73/68/1051657368.db2.gz DUACNAIAEWZAIH-QGZVFWFLSA-N 3 1 313.574 4.067 20 0 DIADMP CCCC[C@H](CC(C)C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001173257673 1051658462 /nfs/dbraw/zinc/65/84/62/1051658462.db2.gz BWVCQOPSNRYQJG-HXUWFJFHSA-N 2 1 324.553 4.167 20 0 DIADMP CC[C@H]1CC[C@@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)C1 ZINC001173273490 1051670688 /nfs/dbraw/zinc/67/06/88/1051670688.db2.gz FGZBHDDODWKUKW-YXYSEUPNSA-N 2 1 314.517 4.313 20 0 DIADMP CCSC[C@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173296612 1051678049 /nfs/dbraw/zinc/67/80/49/1051678049.db2.gz VDMXECNCTDLOGH-WBAXXEDZSA-N 2 1 324.509 4.039 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001173276393 1051684256 /nfs/dbraw/zinc/68/42/56/1051684256.db2.gz QHEJVBIMSCVSEI-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001173288847 1051690571 /nfs/dbraw/zinc/69/05/71/1051690571.db2.gz PKVOPSSMPBCLLZ-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288847 1051690581 /nfs/dbraw/zinc/69/05/81/1051690581.db2.gz PKVOPSSMPBCLLZ-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288847 1051690587 /nfs/dbraw/zinc/69/05/87/1051690587.db2.gz PKVOPSSMPBCLLZ-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183197276 1051709972 /nfs/dbraw/zinc/70/99/72/1051709972.db2.gz WDEBHFPJDZCJIY-DKICVRJWSA-N 2 1 316.464 4.056 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000183199034 1051710608 /nfs/dbraw/zinc/71/06/08/1051710608.db2.gz UDQGIPUKWJDVFG-YQVWRLOYSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183197235 1051711785 /nfs/dbraw/zinc/71/17/85/1051711785.db2.gz WDEBHFPJDZCJIY-YYFZDKIDSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000183197142 1051711933 /nfs/dbraw/zinc/71/19/33/1051711933.db2.gz RXKDBAOHMMGUPE-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000183197142 1051711946 /nfs/dbraw/zinc/71/19/46/1051711946.db2.gz RXKDBAOHMMGUPE-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1CCC3(CCc4ccccc43)CC1)C2 ZINC001173687107 1051778739 /nfs/dbraw/zinc/77/87/39/1051778739.db2.gz JOBAAAHBHGSDKS-ILRYCDRDSA-N 2 1 324.512 4.028 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c(C)o1 ZINC000767378799 1051789063 /nfs/dbraw/zinc/78/90/63/1051789063.db2.gz OAJDZMFWGVZEKG-CRAIPNDOSA-N 2 1 318.486 4.131 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(C)o1 ZINC000767378799 1051789066 /nfs/dbraw/zinc/78/90/66/1051789066.db2.gz OAJDZMFWGVZEKG-CRAIPNDOSA-N 2 1 318.486 4.131 20 0 DIADMP CC[C@H](NC[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330007 1051873253 /nfs/dbraw/zinc/87/32/53/1051873253.db2.gz GJHSRJXEOOENLT-LPHOPBHVSA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccccc1F ZINC000494330007 1051873257 /nfs/dbraw/zinc/87/32/57/1051873257.db2.gz GJHSRJXEOOENLT-LPHOPBHVSA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330007 1051873262 /nfs/dbraw/zinc/87/32/62/1051873262.db2.gz GJHSRJXEOOENLT-LPHOPBHVSA-N 2 1 306.469 4.234 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCC34CCCC4)CC2)cc1 ZINC000189062591 1051874002 /nfs/dbraw/zinc/87/40/02/1051874002.db2.gz IQYRXNMWMZLACO-HXUWFJFHSA-N 2 1 312.501 4.006 20 0 DIADMP C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)o1 ZINC000768215792 1051905348 /nfs/dbraw/zinc/90/53/48/1051905348.db2.gz YIPYLNKBCPJNJS-DNVCBOLYSA-N 2 1 312.457 4.097 20 0 DIADMP Cc1c([C@@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cnn1C(C)(C)C ZINC000191324713 1051971265 /nfs/dbraw/zinc/97/12/65/1051971265.db2.gz NPPQMQQBTQXHBE-MRXNPFEDSA-N 2 1 322.541 4.106 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168467304 1051992783 /nfs/dbraw/zinc/99/27/83/1051992783.db2.gz IRRQFFFJDPWYEM-ATZDWAIDSA-N 2 1 320.496 4.375 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CCN1C ZINC000769484134 1052052855 /nfs/dbraw/zinc/05/28/55/1052052855.db2.gz DLCCGGUJSKHLIA-XLIONFOSSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@@H+]1C ZINC000769484134 1052052867 /nfs/dbraw/zinc/05/28/67/1052052867.db2.gz DLCCGGUJSKHLIA-XLIONFOSSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@H+]1C ZINC000769484134 1052052880 /nfs/dbraw/zinc/05/28/80/1052052880.db2.gz DLCCGGUJSKHLIA-XLIONFOSSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484134 1052052893 /nfs/dbraw/zinc/05/28/93/1052052893.db2.gz DLCCGGUJSKHLIA-XLIONFOSSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484134 1052052905 /nfs/dbraw/zinc/05/29/05/1052052905.db2.gz DLCCGGUJSKHLIA-XLIONFOSSA-N 2 1 308.469 4.268 20 0 DIADMP CCCCC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)C(C)(C)C ZINC000808696461 1052084077 /nfs/dbraw/zinc/08/40/77/1052084077.db2.gz UQYNAKBAGDNSCS-RBUKOAKNSA-N 2 1 324.553 4.214 20 0 DIADMP Cc1ccccc1[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000494882754 1052158422 /nfs/dbraw/zinc/15/84/22/1052158422.db2.gz KSCJXYAKRHZHTN-OAQYLSRUSA-N 2 1 312.501 4.443 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2sccc2Cl)CC1 ZINC000495077283 1052210398 /nfs/dbraw/zinc/21/03/98/1052210398.db2.gz DQZCTGHCPVTPBO-UHFFFAOYSA-N 2 1 314.926 4.345 20 0 DIADMP CCC[C@@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)C(C)(C)C ZINC001218294007 1052219041 /nfs/dbraw/zinc/21/90/41/1052219041.db2.gz QPFSSYRYGOUINU-LJQANCHMSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)C[C@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)C(C)C ZINC001218297699 1052220374 /nfs/dbraw/zinc/22/03/74/1052220374.db2.gz XFNBAWUTDIJVKX-FQEVSTJZSA-N 2 1 318.505 4.059 20 0 DIADMP CC(C)C[C@@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)C(C)C ZINC001218297700 1052220881 /nfs/dbraw/zinc/22/08/81/1052220881.db2.gz XFNBAWUTDIJVKX-HXUWFJFHSA-N 2 1 318.505 4.059 20 0 DIADMP Cc1ccc([C@H](C)Oc2ccc(C[NH+]3CCC([NH3+])CC3)cc2)cc1 ZINC001218344042 1052228378 /nfs/dbraw/zinc/22/83/78/1052228378.db2.gz OOUIRRLHSVKSIL-KRWDZBQOSA-N 2 1 324.468 4.058 20 0 DIADMP CCC[C@@H](C)[C@@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218438288 1052238742 /nfs/dbraw/zinc/23/87/42/1052238742.db2.gz IRPRMWYCDJJVTR-OXQOHEQNSA-N 2 1 318.505 4.203 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)[C@H](C)C1 ZINC000495400496 1052335914 /nfs/dbraw/zinc/33/59/14/1052335914.db2.gz BQTUBEAKDVSCDA-YSGRDPCXSA-N 2 1 316.464 4.082 20 0 DIADMP c1ccc(CC2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCCC2)cc1 ZINC000495401274 1052336392 /nfs/dbraw/zinc/33/63/92/1052336392.db2.gz KQJZVEVWTQLXNW-VQTJNVASSA-N 2 1 312.501 4.006 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001168492431 1052407033 /nfs/dbraw/zinc/40/70/33/1052407033.db2.gz RLPPFISNMUMMIE-YLJYHZDGSA-N 2 1 318.480 4.097 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000236606263 1052427403 /nfs/dbraw/zinc/42/74/03/1052427403.db2.gz GMEKVRPQGAFTFC-KRWDZBQOSA-N 2 1 304.478 4.064 20 0 DIADMP CC(C)CC[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000236604187 1052427513 /nfs/dbraw/zinc/42/75/13/1052427513.db2.gz LMIHAYJFRVLXFA-GOSISDBHSA-N 2 1 302.506 4.108 20 0 DIADMP CCc1ccccc1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237005207 1052434414 /nfs/dbraw/zinc/43/44/14/1052434414.db2.gz TZKFBPHBLSQIID-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CC[C@@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222141137 1052449771 /nfs/dbraw/zinc/44/97/71/1052449771.db2.gz FSIXUUVEWQVVLL-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222141137 1052449775 /nfs/dbraw/zinc/44/97/75/1052449775.db2.gz FSIXUUVEWQVVLL-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222148723 1052450331 /nfs/dbraw/zinc/45/03/31/1052450331.db2.gz RNILIYIIOMHBJY-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222149258 1052450704 /nfs/dbraw/zinc/45/07/04/1052450704.db2.gz WQJJTWJITOHMSX-NRFANRHFSA-N 2 1 320.436 4.162 20 0 DIADMP Fc1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1-c1ccccc1 ZINC001222154663 1052452441 /nfs/dbraw/zinc/45/24/41/1052452441.db2.gz PDSYUFPDJUJHFU-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP Fc1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1-c1ccccc1 ZINC001222154663 1052452448 /nfs/dbraw/zinc/45/24/48/1052452448.db2.gz PDSYUFPDJUJHFU-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP FC1(F)CCC(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)CC1 ZINC001222155279 1052452485 /nfs/dbraw/zinc/45/24/85/1052452485.db2.gz ZCRXFKRIVBGLLB-KRWDZBQOSA-N 2 1 314.464 4.058 20 0 DIADMP c1cc2cc(C[N@H+]3CCCC[C@]4(CCCC[NH2+]C4)C3)ccc2o1 ZINC001222160282 1052453770 /nfs/dbraw/zinc/45/37/70/1052453770.db2.gz DQZZZCUQQPSVIH-FQEVSTJZSA-N 2 1 312.457 4.179 20 0 DIADMP Clc1ccsc1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222161062 1052454098 /nfs/dbraw/zinc/45/40/98/1052454098.db2.gz JZBKQAXXXURDAX-INIZCTEOSA-N 2 1 312.910 4.147 20 0 DIADMP Clc1ccsc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222161062 1052454103 /nfs/dbraw/zinc/45/41/03/1052454103.db2.gz JZBKQAXXXURDAX-INIZCTEOSA-N 2 1 312.910 4.147 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222160831 1052454275 /nfs/dbraw/zinc/45/42/75/1052454275.db2.gz JBFRFUOUGCUBSU-IBGZPJMESA-N 2 1 322.443 4.370 20 0 DIADMP Cc1c(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)ccc(F)c1F ZINC001222172407 1052457338 /nfs/dbraw/zinc/45/73/38/1052457338.db2.gz KOOKHTBZCJVCKB-IBGZPJMESA-N 2 1 322.443 4.019 20 0 DIADMP Cc1c(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)ccc(F)c1F ZINC001222172407 1052457340 /nfs/dbraw/zinc/45/73/40/1052457340.db2.gz KOOKHTBZCJVCKB-IBGZPJMESA-N 2 1 322.443 4.019 20 0 DIADMP c1ccc(C(C[N@H+]2CCC[C@]23CCC[NH2+]C3)c2ccccc2)cc1 ZINC001222230881 1052465105 /nfs/dbraw/zinc/46/51/05/1052465105.db2.gz FXOSOCWACNCOHF-QFIPXVFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1cc(-c2ccccc2)sc1C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222243799 1052468189 /nfs/dbraw/zinc/46/81/89/1052468189.db2.gz OLWYANZUTZKTEM-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP c1cc(-c2ccccc2)sc1C[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222243799 1052468191 /nfs/dbraw/zinc/46/81/91/1052468191.db2.gz OLWYANZUTZKTEM-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@@H+]2CCC[C@@]23CCC[NH2+]C3)cc1 ZINC001222249850 1052469445 /nfs/dbraw/zinc/46/94/45/1052469445.db2.gz XHKDARHBICRSNR-OAQYLSRUSA-N 2 1 324.443 4.211 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CCC[C@@]23CCC[NH2+]C3)cc1 ZINC001222249850 1052469448 /nfs/dbraw/zinc/46/94/48/1052469448.db2.gz XHKDARHBICRSNR-OAQYLSRUSA-N 2 1 324.443 4.211 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000316789450 1052472313 /nfs/dbraw/zinc/47/23/13/1052472313.db2.gz NPCSNVZUARPIFW-QEJZJMRPSA-N 2 1 321.534 4.026 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000316789450 1052472319 /nfs/dbraw/zinc/47/23/19/1052472319.db2.gz NPCSNVZUARPIFW-QEJZJMRPSA-N 2 1 321.534 4.026 20 0 DIADMP CC(C)(C)c1cccc(C[NH+]2CCC3(CCCC[NH2+]3)CC2)c1 ZINC001222292472 1052474694 /nfs/dbraw/zinc/47/46/94/1052474694.db2.gz BECZQAWTMRQWCP-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP CC(C)(C)C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000316903645 1052474997 /nfs/dbraw/zinc/47/49/97/1052474997.db2.gz ZOKBDVPKPMOWCV-QRVBRYPASA-N 2 1 300.490 4.380 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001222309794 1052478472 /nfs/dbraw/zinc/47/84/72/1052478472.db2.gz SJGMJKUOFPKMBI-WDSOQIARSA-N 2 1 318.892 4.052 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)cc2)cc1 ZINC001222310918 1052478588 /nfs/dbraw/zinc/47/85/88/1052478588.db2.gz YNXATGKCYTUTDL-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222308635 1052479101 /nfs/dbraw/zinc/47/91/01/1052479101.db2.gz KUSSFKFOIXCKIM-ICSRJNTNSA-N 2 1 324.553 4.216 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c1 ZINC001222321503 1052481654 /nfs/dbraw/zinc/48/16/54/1052481654.db2.gz XTIMUZYFVNYGER-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320295 1052481969 /nfs/dbraw/zinc/48/19/69/1052481969.db2.gz GEQVNVGDOSYXGY-QGZVFWFLSA-N 2 1 324.921 4.170 20 0 DIADMP c1ccc(C(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000393551930 1052486291 /nfs/dbraw/zinc/48/62/91/1052486291.db2.gz SYEXMGFSHWIBHT-SFTDATJTSA-N 2 1 320.480 4.035 20 0 DIADMP C[C@@H](C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345077 1052487608 /nfs/dbraw/zinc/48/76/08/1052487608.db2.gz IFTGRNZKPGCLDP-UWJYYQICSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345077 1052487612 /nfs/dbraw/zinc/48/76/12/1052487612.db2.gz IFTGRNZKPGCLDP-UWJYYQICSA-N 2 1 308.469 4.161 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385018 1052493877 /nfs/dbraw/zinc/49/38/77/1052493877.db2.gz CUFFCVHOWBOCDO-NZSAHSFTSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385018 1052493881 /nfs/dbraw/zinc/49/38/81/1052493881.db2.gz CUFFCVHOWBOCDO-NZSAHSFTSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385019 1052494297 /nfs/dbraw/zinc/49/42/97/1052494297.db2.gz CUFFCVHOWBOCDO-WDSOQIARSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385019 1052494298 /nfs/dbraw/zinc/49/42/98/1052494298.db2.gz CUFFCVHOWBOCDO-WDSOQIARSA-N 2 1 318.892 4.052 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C[C@@H](c2ccccc2)C1 ZINC000322814584 1052497698 /nfs/dbraw/zinc/49/76/98/1052497698.db2.gz ALNJNFXUNUZBQL-YLJVNHBBSA-N 2 1 312.501 4.174 20 0 DIADMP CC(C)=CCC[C@@H](C)C[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222596031 1052514941 /nfs/dbraw/zinc/51/49/41/1052514941.db2.gz OSFDDFLGXVCUNK-UYAOXDASSA-N 2 1 312.501 4.058 20 0 DIADMP CC(C)=CCC[C@@H](C)C[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222596030 1052515459 /nfs/dbraw/zinc/51/54/59/1052515459.db2.gz OSFDDFLGXVCUNK-QUCCMNQESA-N 2 1 312.501 4.058 20 0 DIADMP CC1=CC[C@H](CC[N@H+]2C[C@@H](c3ccccc3)C3(C[NH2+]C3)C2)C1(C)C ZINC001222596052 1052515815 /nfs/dbraw/zinc/51/58/15/1052515815.db2.gz PCLLSASAVMSCOZ-UXHICEINSA-N 2 1 324.512 4.058 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@H]3C[NH2+]CC[C@H]32)CC1 ZINC001222614370 1052518393 /nfs/dbraw/zinc/51/83/93/1052518393.db2.gz DLNWDQNBXMWYOW-SLFFLAALSA-N 2 1 302.506 4.143 20 0 DIADMP C[C@@H](C[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C(C)(C)C ZINC000670267132 1052542651 /nfs/dbraw/zinc/54/26/51/1052542651.db2.gz RTRCPZQOAPEKJH-DLBZAZTESA-N 2 1 302.506 4.484 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1 ZINC000326430112 1052555622 /nfs/dbraw/zinc/55/56/22/1052555622.db2.gz RMPCEKQSIJHVCD-KRWDZBQOSA-N 2 1 319.452 4.002 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C/C=C/c1ccccc1 ZINC000398007158 1052561656 /nfs/dbraw/zinc/56/16/56/1052561656.db2.gz ZSOFFMWZFURAKI-FUSPUOGNSA-N 2 1 320.480 4.200 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000037140907 1052605837 /nfs/dbraw/zinc/60/58/37/1052605837.db2.gz UVXWQWLIRJROCR-LLVKDONJSA-N 2 1 313.272 4.271 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649131 1052628087 /nfs/dbraw/zinc/62/80/87/1052628087.db2.gz PWNZGQAVMARMGW-RYUDHWBXSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649131 1052628090 /nfs/dbraw/zinc/62/80/90/1052628090.db2.gz PWNZGQAVMARMGW-RYUDHWBXSA-N 2 1 313.272 4.128 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3C)c1 ZINC000123906694 1052635475 /nfs/dbraw/zinc/63/54/75/1052635475.db2.gz NXWFKAVAUDHITE-OAQYLSRUSA-N 2 1 308.469 4.224 20 0 DIADMP c1ccc(C[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000124356721 1052640314 /nfs/dbraw/zinc/64/03/14/1052640314.db2.gz DKAOWVSEUOXQAC-UGKGYDQZSA-N 2 1 320.480 4.044 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CC1 ZINC000125186416 1052646057 /nfs/dbraw/zinc/64/60/57/1052646057.db2.gz UFEQBDFXUKHDTK-JXFKEZNVSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2ccccc2s1 ZINC000125522124 1052649623 /nfs/dbraw/zinc/64/96/23/1052649623.db2.gz NMZWOYLEEKHMDS-NUEKZKHPSA-N 2 1 300.471 4.179 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2ccccc2C)C[C@H]1C ZINC000125524102 1052649714 /nfs/dbraw/zinc/64/97/14/1052649714.db2.gz MJMCVVVXVYOVON-MJGOQNOKSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2ccccc2C)C[C@H]1C ZINC000125524102 1052649716 /nfs/dbraw/zinc/64/97/16/1052649716.db2.gz MJMCVVVXVYOVON-MJGOQNOKSA-N 2 1 311.473 4.158 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)s2)C1 ZINC000125786236 1052654129 /nfs/dbraw/zinc/65/41/29/1052654129.db2.gz KNXDNVZRMQPHIP-QWHCGFSZSA-N 2 1 300.899 4.173 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)c1cccc(O)c1 ZINC000126637902 1052672872 /nfs/dbraw/zinc/67/28/72/1052672872.db2.gz DCVHOVNAYTVMAP-GUXCAODWSA-N 2 1 316.489 4.086 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126888529 1052683847 /nfs/dbraw/zinc/68/38/47/1052683847.db2.gz GVOGDTWVSBVWCE-HZPDHXFCSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126888529 1052683850 /nfs/dbraw/zinc/68/38/50/1052683850.db2.gz GVOGDTWVSBVWCE-HZPDHXFCSA-N 2 1 306.519 4.128 20 0 DIADMP Cc1ccc(C)c([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000128114440 1052710221 /nfs/dbraw/zinc/71/02/21/1052710221.db2.gz RQXYNOFRKYFPDO-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000129303622 1052783298 /nfs/dbraw/zinc/78/32/98/1052783298.db2.gz LQCHHMKQGHZGDK-OWCLPIDISA-N 2 1 320.443 4.352 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000129304105 1052783540 /nfs/dbraw/zinc/78/35/40/1052783540.db2.gz ZNRNDSGQXSVVNZ-OWCLPIDISA-N 2 1 320.443 4.209 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556062250 1052794986 /nfs/dbraw/zinc/79/49/86/1052794986.db2.gz RKWSUBMAWIOFFZ-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556062250 1052794989 /nfs/dbraw/zinc/79/49/89/1052794989.db2.gz RKWSUBMAWIOFFZ-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587843 1052796996 /nfs/dbraw/zinc/79/69/96/1052796996.db2.gz FVLAAJNPEJEFGM-GVXVVHGQSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587843 1052797002 /nfs/dbraw/zinc/79/70/02/1052797002.db2.gz FVLAAJNPEJEFGM-GVXVVHGQSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129624457 1052798632 /nfs/dbraw/zinc/79/86/32/1052798632.db2.gz NMYBCUXBSCIRSZ-NTZNESFSSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129624457 1052798637 /nfs/dbraw/zinc/79/86/37/1052798637.db2.gz NMYBCUXBSCIRSZ-NTZNESFSSA-N 2 1 301.261 4.127 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000556149602 1052810323 /nfs/dbraw/zinc/81/03/23/1052810323.db2.gz JJONRUJOHMZIMJ-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C[C@H]1c1ccccc1 ZINC000556178512 1052816796 /nfs/dbraw/zinc/81/67/96/1052816796.db2.gz IVTMBPWIYSDJQE-NJAFHUGGSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C[C@H]1c1ccccc1 ZINC000556178512 1052816801 /nfs/dbraw/zinc/81/68/01/1052816801.db2.gz IVTMBPWIYSDJQE-NJAFHUGGSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000556225343 1052822825 /nfs/dbraw/zinc/82/28/25/1052822825.db2.gz SKZSHIIDXIKOOX-VLOYRQLPSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000556225343 1052822827 /nfs/dbraw/zinc/82/28/27/1052822827.db2.gz SKZSHIIDXIKOOX-VLOYRQLPSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000556225341 1052822848 /nfs/dbraw/zinc/82/28/48/1052822848.db2.gz SKZSHIIDXIKOOX-JEVOJNTISA-N 2 1 300.490 4.236 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000556225341 1052822850 /nfs/dbraw/zinc/82/28/50/1052822850.db2.gz SKZSHIIDXIKOOX-JEVOJNTISA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)C2CC2)C[C@H]1c1ccccc1 ZINC000556255048 1052827700 /nfs/dbraw/zinc/82/77/00/1052827700.db2.gz VFBUDGFGYZGCIF-OALUTQOASA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCC(C)(C)C2CC2)C[C@H]1c1ccccc1 ZINC000556255048 1052827705 /nfs/dbraw/zinc/82/77/05/1052827705.db2.gz VFBUDGFGYZGCIF-OALUTQOASA-N 2 1 300.490 4.238 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)C2CC2)C[C@@H]1c1ccccc1 ZINC000556255050 1052827821 /nfs/dbraw/zinc/82/78/21/1052827821.db2.gz VFBUDGFGYZGCIF-RBUKOAKNSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCC(C)(C)C2CC2)C[C@@H]1c1ccccc1 ZINC000556255050 1052827825 /nfs/dbraw/zinc/82/78/25/1052827825.db2.gz VFBUDGFGYZGCIF-RBUKOAKNSA-N 2 1 300.490 4.238 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]CCCn2cc[nH+]c2C)cc1 ZINC000556576655 1052866867 /nfs/dbraw/zinc/86/68/67/1052866867.db2.gz VKWPRALQSYXOMC-MRXNPFEDSA-N 2 1 315.461 4.111 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000556867627 1052890167 /nfs/dbraw/zinc/89/01/67/1052890167.db2.gz HFLXBMLZLNQPQO-LMCOJAPRSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000556867627 1052890169 /nfs/dbraw/zinc/89/01/69/1052890169.db2.gz HFLXBMLZLNQPQO-LMCOJAPRSA-N 2 1 300.490 4.064 20 0 DIADMP c1ccc(Oc2ccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)cc2)cc1 ZINC001226784683 1052931056 /nfs/dbraw/zinc/93/10/56/1052931056.db2.gz KYSOTYHXOPTRFX-UHFFFAOYSA-N 2 1 322.452 4.197 20 0 DIADMP c1cc(-c2ccccc2)sc1C[NH+]1CCC2(CCC[NH2+]2)CC1 ZINC001226783947 1052931078 /nfs/dbraw/zinc/93/10/78/1052931078.db2.gz IKGFEPYNSPKTQA-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP CC[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@@H]1CC[NH2+]C1 ZINC001236412793 1053020739 /nfs/dbraw/zinc/02/07/39/1053020739.db2.gz YKERXAJLHNFAGG-SNVBAGLBSA-N 2 1 321.679 4.078 20 0 DIADMP CC[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@@H]1CC[NH2+]C1 ZINC001236412793 1053020745 /nfs/dbraw/zinc/02/07/45/1053020745.db2.gz YKERXAJLHNFAGG-SNVBAGLBSA-N 2 1 321.679 4.078 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[N@H+](C)C2CCCC2)C[C@@H](c2ccccc2)C1 ZINC000323422096 1053063998 /nfs/dbraw/zinc/06/39/98/1053063998.db2.gz SYRGNHMMGRFXHR-IHPCNDPISA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[N@@H+](C)C2CCCC2)C[C@@H](c2ccccc2)C1 ZINC000323422096 1053064009 /nfs/dbraw/zinc/06/40/09/1053064009.db2.gz SYRGNHMMGRFXHR-IHPCNDPISA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC[N@H+](C)C2CCCC2)C1 ZINC000323422097 1053064741 /nfs/dbraw/zinc/06/47/41/1053064741.db2.gz SYRGNHMMGRFXHR-SXLOBPIMSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC[N@@H+](C)C2CCCC2)C1 ZINC000323422097 1053064746 /nfs/dbraw/zinc/06/47/46/1053064746.db2.gz SYRGNHMMGRFXHR-SXLOBPIMSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC000518946902 1053105104 /nfs/dbraw/zinc/10/51/04/1053105104.db2.gz AAVZKRKQAHQMJJ-CVYSASLGSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC000518946902 1053105117 /nfs/dbraw/zinc/10/51/17/1053105117.db2.gz AAVZKRKQAHQMJJ-CVYSASLGSA-N 2 1 300.490 4.236 20 0 DIADMP CCC(C)(C)[NH+](C)Cc1cncc(C[N@H+](C)C(C)(C)CC)c1 ZINC000649381825 1053157544 /nfs/dbraw/zinc/15/75/44/1053157544.db2.gz SFXFOQUOEWKXOH-UHFFFAOYSA-N 2 1 305.510 4.322 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000089512989 1053205498 /nfs/dbraw/zinc/20/54/98/1053205498.db2.gz MKILDLNYHBKXCP-ZDUSSCGKSA-N 2 1 323.550 4.488 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSc2ccccc21 ZINC000252096506 1053256179 /nfs/dbraw/zinc/25/61/79/1053256179.db2.gz FNUPIFJQSVZZOV-RDJZCZTQSA-N 2 1 304.503 4.078 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCSc2ccccc21 ZINC000252096506 1053256188 /nfs/dbraw/zinc/25/61/88/1053256188.db2.gz FNUPIFJQSVZZOV-RDJZCZTQSA-N 2 1 304.503 4.078 20 0 DIADMP Fc1ccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)cc1 ZINC000091268634 1053258533 /nfs/dbraw/zinc/25/85/33/1053258533.db2.gz OPXDCVRTDZTXIQ-HXUWFJFHSA-N 2 1 316.464 4.273 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2ccccc2s1 ZINC000252703261 1053274644 /nfs/dbraw/zinc/27/46/44/1053274644.db2.gz NMZWOYLEEKHMDS-IMJJTQAJSA-N 2 1 300.471 4.179 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2[NH+](C)C)C[C@@H](c2ccccc2)C1 ZINC001200089767 1053369895 /nfs/dbraw/zinc/36/98/95/1053369895.db2.gz XQMITNYCYHLMHB-BWUHRYBWSA-N 2 1 314.517 4.421 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CCN1C ZINC000093644859 1053430760 /nfs/dbraw/zinc/43/07/60/1053430760.db2.gz GDJLPDJWOBEYKR-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644859 1053430761 /nfs/dbraw/zinc/43/07/61/1053430761.db2.gz GDJLPDJWOBEYKR-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644859 1053430766 /nfs/dbraw/zinc/43/07/66/1053430766.db2.gz GDJLPDJWOBEYKR-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644859 1053430769 /nfs/dbraw/zinc/43/07/69/1053430769.db2.gz GDJLPDJWOBEYKR-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644859 1053430773 /nfs/dbraw/zinc/43/07/73/1053430773.db2.gz GDJLPDJWOBEYKR-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644859 1053430779 /nfs/dbraw/zinc/43/07/79/1053430779.db2.gz GDJLPDJWOBEYKR-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644859 1053430781 /nfs/dbraw/zinc/43/07/81/1053430781.db2.gz GDJLPDJWOBEYKR-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(C)(C)C)s2)C1 ZINC001200243472 1053494313 /nfs/dbraw/zinc/49/43/13/1053494313.db2.gz IOWCIBFMLWTPQA-OAHLLOKOSA-N 2 1 308.535 4.256 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634016 1053529865 /nfs/dbraw/zinc/52/98/65/1053529865.db2.gz PHQGCFUXIOLIND-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634016 1053529877 /nfs/dbraw/zinc/52/98/77/1053529877.db2.gz PHQGCFUXIOLIND-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631679 1053530217 /nfs/dbraw/zinc/53/02/17/1053530217.db2.gz BVGZMJTUJSTVKV-DLBZAZTESA-N 2 1 312.457 4.329 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631679 1053530236 /nfs/dbraw/zinc/53/02/36/1053530236.db2.gz BVGZMJTUJSTVKV-DLBZAZTESA-N 2 1 312.457 4.329 20 0 DIADMP CC(C)c1ccc(C[NH+]2CCC([NH+](C)C)CC2)c(C(C)C)c1 ZINC000620278140 1053635111 /nfs/dbraw/zinc/63/51/11/1053635111.db2.gz OYCDQNIPFJXAIX-UHFFFAOYSA-N 2 1 302.506 4.459 20 0 DIADMP Cc1cccc(NC2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)[nH+]1 ZINC001324331890 1053643388 /nfs/dbraw/zinc/64/33/88/1053643388.db2.gz XSYNQLGIVONUTK-IHWFROFDSA-N 2 1 321.468 4.388 20 0 DIADMP Cc1cccc(NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)[nH+]1 ZINC001324331890 1053643394 /nfs/dbraw/zinc/64/33/94/1053643394.db2.gz XSYNQLGIVONUTK-IHWFROFDSA-N 2 1 321.468 4.388 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CCSc3c(Cl)cccc32)C1 ZINC000414170848 1053672594 /nfs/dbraw/zinc/67/25/94/1053672594.db2.gz CLDANKWFWROPPA-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](c2cccs2)C2CCCC2)C1 ZINC001324836081 1053683185 /nfs/dbraw/zinc/68/31/85/1053683185.db2.gz VIWRWXOQUIBGGW-YJBOKZPZSA-N 2 1 306.519 4.301 20 0 DIADMP Cc1cc(C)c(C[N@@H+](C2CCCC2)C2CCN(C)CC2)cc1C ZINC001231485213 1053764729 /nfs/dbraw/zinc/76/47/29/1053764729.db2.gz DKBCXHWIEUPMAV-UHFFFAOYSA-N 2 1 314.517 4.451 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)CC1 ZINC001231493565 1053768249 /nfs/dbraw/zinc/76/82/49/1053768249.db2.gz MHPACXKKOJIWLD-UHFFFAOYSA-N 2 1 302.506 4.145 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)CC1 ZINC001231493565 1053768252 /nfs/dbraw/zinc/76/82/52/1053768252.db2.gz MHPACXKKOJIWLD-UHFFFAOYSA-N 2 1 302.506 4.145 20 0 DIADMP C[NH+]1CCC2(CC[N@@H+](Cc3cccc(-c4ccccc4)c3)C2)CC1 ZINC001231511754 1053775129 /nfs/dbraw/zinc/77/51/29/1053775129.db2.gz WRVRLAUAAOMGQU-UHFFFAOYSA-N 2 1 320.480 4.271 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000156048706 1053794465 /nfs/dbraw/zinc/79/44/65/1053794465.db2.gz XSOQYMNELBTVCQ-HMFYCAOWSA-N 2 1 322.496 4.137 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001231648358 1053818390 /nfs/dbraw/zinc/81/83/90/1053818390.db2.gz CHYYQWZNMMQWGU-UHFFFAOYSA-N 2 1 314.498 4.127 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000157229781 1053845397 /nfs/dbraw/zinc/84/53/97/1053845397.db2.gz WPCNGYSBTSEYCB-OYGLOCFBSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000157229926 1053845524 /nfs/dbraw/zinc/84/55/24/1053845524.db2.gz WPCNGYSBTSEYCB-CLPROHDKSA-N 2 1 300.490 4.033 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccccc2SC)CC1 ZINC001231786148 1053857784 /nfs/dbraw/zinc/85/77/84/1053857784.db2.gz BWFVXBQIYNMSJG-UHFFFAOYSA-N 2 1 306.519 4.105 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccccc2SC)CC1 ZINC001231786148 1053857796 /nfs/dbraw/zinc/85/77/96/1053857796.db2.gz BWFVXBQIYNMSJG-UHFFFAOYSA-N 2 1 306.519 4.105 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@@H]1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001327569893 1053864103 /nfs/dbraw/zinc/86/41/03/1053864103.db2.gz OUGRYRPGDRBSSY-RDJZCZTQSA-N 2 1 303.837 4.173 20 0 DIADMP CCC1(CC)CCC([NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC001200672906 1053873611 /nfs/dbraw/zinc/87/36/11/1053873611.db2.gz ULPFANGUHWZRFS-HDICACEKSA-N 2 1 324.553 4.214 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2sc3scc(C)c3c2C)CC1 ZINC001231834805 1053887645 /nfs/dbraw/zinc/88/76/45/1053887645.db2.gz SXTBKVGHVWZCGW-UHFFFAOYSA-N 2 1 322.543 4.496 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2sc3scc(C)c3c2C)CC1 ZINC001231834805 1053887653 /nfs/dbraw/zinc/88/76/53/1053887653.db2.gz SXTBKVGHVWZCGW-UHFFFAOYSA-N 2 1 322.543 4.496 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000158195328 1053893990 /nfs/dbraw/zinc/89/39/90/1053893990.db2.gz IFDGEIBFGBIVMD-HZPDHXFCSA-N 2 1 306.519 4.180 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001231875073 1053901358 /nfs/dbraw/zinc/90/13/58/1053901358.db2.gz MXBUYZRENFIJRI-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(Cl)ccc1Cl ZINC001200714808 1053919112 /nfs/dbraw/zinc/91/91/12/1053919112.db2.gz MPSBALUDGMIUAD-UHFFFAOYSA-N 2 1 312.244 4.068 20 0 DIADMP CCC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccccn1 ZINC000159010165 1053931079 /nfs/dbraw/zinc/93/10/79/1053931079.db2.gz UQBSJXWTNZVJQW-LJQANCHMSA-N 2 1 311.473 4.164 20 0 DIADMP CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232018857 1053942800 /nfs/dbraw/zinc/94/28/00/1053942800.db2.gz PHOHIWYMVJKXKU-LJQANCHMSA-N 2 1 321.424 4.046 20 0 DIADMP CCC[C@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232018857 1053942816 /nfs/dbraw/zinc/94/28/16/1053942816.db2.gz PHOHIWYMVJKXKU-LJQANCHMSA-N 2 1 321.424 4.046 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cc(F)cc(C[NH+](C)C)c2)Cc2ccccc21 ZINC001232145267 1053970959 /nfs/dbraw/zinc/97/09/59/1053970959.db2.gz ZWQJAPMGHKQHMD-HNNXBMFYSA-N 2 1 312.432 4.007 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232145657 1053971228 /nfs/dbraw/zinc/97/12/28/1053971228.db2.gz CQSAZUWYYAQVME-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232147166 1053971346 /nfs/dbraw/zinc/97/13/46/1053971346.db2.gz KRNKWAYPJLHIDJ-UHFFFAOYSA-N 2 1 314.448 4.300 20 0 DIADMP C[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232144911 1053972047 /nfs/dbraw/zinc/97/20/47/1053972047.db2.gz NXIMNXMYDZIPDO-HNNXBMFYSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@H](NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccco1 ZINC000164991345 1054067229 /nfs/dbraw/zinc/06/72/29/1054067229.db2.gz MFQHDDWFCPFCJE-VBQJREDUSA-N 2 1 304.459 4.075 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCN(C)[C@@H]1c1cccs1)c1ccco1 ZINC000164991345 1054067242 /nfs/dbraw/zinc/06/72/42/1054067242.db2.gz MFQHDDWFCPFCJE-VBQJREDUSA-N 2 1 304.459 4.075 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(F)c1 ZINC001331386420 1054074388 /nfs/dbraw/zinc/07/43/88/1054074388.db2.gz JVTSPKROBYPVHC-FGTMMUONSA-N 2 1 304.453 4.129 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CCCC(F)(F)F)[C@H]1c1cccs1 ZINC001355263086 1054097376 /nfs/dbraw/zinc/09/73/76/1054097376.db2.gz HTPRWTFWEPKKAJ-JSGCOSHPSA-N 2 1 320.424 4.063 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]CCCC(F)(F)F)[C@H]1c1cccs1 ZINC001355263086 1054097389 /nfs/dbraw/zinc/09/73/89/1054097389.db2.gz HTPRWTFWEPKKAJ-JSGCOSHPSA-N 2 1 320.424 4.063 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]CCCC(F)(F)F)[C@H]1c1cccs1 ZINC001355263087 1054097786 /nfs/dbraw/zinc/09/77/86/1054097786.db2.gz HTPRWTFWEPKKAJ-OCCSQVGLSA-N 2 1 320.424 4.063 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]CCCC(F)(F)F)[C@H]1c1cccs1 ZINC001355263087 1054097798 /nfs/dbraw/zinc/09/77/98/1054097798.db2.gz HTPRWTFWEPKKAJ-OCCSQVGLSA-N 2 1 320.424 4.063 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1cccc(SC(F)(F)F)c1 ZINC001232946588 1054156414 /nfs/dbraw/zinc/15/64/14/1054156414.db2.gz NFPWXSYDUHVCOB-UHFFFAOYSA-N 2 1 320.424 4.072 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1cccc(SC(F)(F)F)c1 ZINC001232946588 1054156422 /nfs/dbraw/zinc/15/64/22/1054156422.db2.gz NFPWXSYDUHVCOB-UHFFFAOYSA-N 2 1 320.424 4.072 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC[N@@H+]1C ZINC000168479895 1054171255 /nfs/dbraw/zinc/17/12/55/1054171255.db2.gz BFMDRTGUCCLZMG-SIXWZSSISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC[N@H+]1C ZINC000168479895 1054171259 /nfs/dbraw/zinc/17/12/59/1054171259.db2.gz BFMDRTGUCCLZMG-SIXWZSSISA-N 2 1 304.453 4.129 20 0 DIADMP Cc1sccc1C[NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000339289937 1054495781 /nfs/dbraw/zinc/49/57/81/1054495781.db2.gz KFTVBISMUYOPRI-HNNXBMFYSA-N 2 1 302.487 4.057 20 0 DIADMP Cc1sccc1C[NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000339289937 1054495790 /nfs/dbraw/zinc/49/57/90/1054495790.db2.gz KFTVBISMUYOPRI-HNNXBMFYSA-N 2 1 302.487 4.057 20 0 DIADMP C[NH2+][C@H](C)CC[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F ZINC001345481485 1054496875 /nfs/dbraw/zinc/49/68/75/1054496875.db2.gz CSIXJUZWOQGHAE-OLZOCXBDSA-N 2 1 322.399 4.090 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)CC1(C)C ZINC000623335352 1054561563 /nfs/dbraw/zinc/56/15/63/1054561563.db2.gz JOMWUERDPKWNQS-LJQANCHMSA-N 2 1 308.469 4.238 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)CC1(C)C ZINC000623335352 1054561583 /nfs/dbraw/zinc/56/15/83/1054561583.db2.gz JOMWUERDPKWNQS-LJQANCHMSA-N 2 1 308.469 4.238 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235045647 1054646299 /nfs/dbraw/zinc/64/62/99/1054646299.db2.gz LEWINJJPUQXVOZ-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)cc2)cc1 ZINC001235091894 1054653995 /nfs/dbraw/zinc/65/39/95/1054653995.db2.gz DSUWDRLSTZFUQB-UHFFFAOYSA-N 2 1 322.452 4.054 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)c2)cc1 ZINC001235094033 1054654666 /nfs/dbraw/zinc/65/46/66/1054654666.db2.gz WWMFGXBPQYYZQZ-UHFFFAOYSA-N 2 1 324.443 4.068 20 0 DIADMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)s1 ZINC000178706706 1054657351 /nfs/dbraw/zinc/65/73/51/1054657351.db2.gz JRKNYVDFNPALRG-AAEUAGOBSA-N 2 1 311.882 4.283 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC001235112380 1054658884 /nfs/dbraw/zinc/65/88/84/1054658884.db2.gz XGKXESVORKZGQU-FQEVSTJZSA-N 2 1 322.477 4.382 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CCC[C@@]12CC[NH2+]C2 ZINC001235112380 1054658889 /nfs/dbraw/zinc/65/88/89/1054658889.db2.gz XGKXESVORKZGQU-FQEVSTJZSA-N 2 1 322.477 4.382 20 0 DIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(Cl)s1 ZINC000178787184 1054660234 /nfs/dbraw/zinc/66/02/34/1054660234.db2.gz HBCZYAARDTXJNK-ZDUSSCGKSA-N 2 1 311.882 4.428 20 0 DIADMP Cc1cc(C[NH+]2CCC3(CC[NH2+]3)CC2)ccc1Oc1ccccc1 ZINC001235112135 1054660513 /nfs/dbraw/zinc/66/05/13/1054660513.db2.gz WJIPZDOHHABJCB-UHFFFAOYSA-N 2 1 322.452 4.115 20 0 DIADMP c1cc(-c2ccccc2)sc1C[N@H+]1CCCC12CC[NH2+]CC2 ZINC001235140319 1054665495 /nfs/dbraw/zinc/66/54/95/1054665495.db2.gz JDZREXYQKMTNNA-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235159039 1054666874 /nfs/dbraw/zinc/66/68/74/1054666874.db2.gz UYVUKRWYGIJUKR-SFHVURJKSA-N 2 1 314.498 4.255 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1F ZINC001235156856 1054667513 /nfs/dbraw/zinc/66/75/13/1054667513.db2.gz RUBBNFNWGWXYTO-KRWDZBQOSA-N 2 1 324.871 4.142 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235158521 1054667709 /nfs/dbraw/zinc/66/77/09/1054667709.db2.gz KRAVGYKKQGTGKO-HXUWFJFHSA-N 2 1 324.468 4.301 20 0 DIADMP Cc1csc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1Cl ZINC001235151734 1054667801 /nfs/dbraw/zinc/66/78/01/1054667801.db2.gz AQEVZUGDQYPHHJ-CQSZACIVSA-N 2 1 312.910 4.064 20 0 DIADMP Clc1ccccc1CCC[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235153408 1054667835 /nfs/dbraw/zinc/66/78/35/1054667835.db2.gz SCCQQKKHXCJQKN-LJQANCHMSA-N 2 1 320.908 4.127 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235152684 1054667864 /nfs/dbraw/zinc/66/78/64/1054667864.db2.gz AHKDAKKSXVZOSK-GOSISDBHSA-N 2 1 324.871 4.142 20 0 DIADMP c1cc(C2CCC2)ccc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235155533 1054667905 /nfs/dbraw/zinc/66/79/05/1054667905.db2.gz LIFWQJNPFIRFCI-OAQYLSRUSA-N 2 1 312.501 4.308 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235156194 1054668096 /nfs/dbraw/zinc/66/80/96/1054668096.db2.gz FMMDTTFVNVCIOR-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1C ZINC001235158938 1054670214 /nfs/dbraw/zinc/67/02/14/1054670214.db2.gz WTLPGQFYDDSFOI-IBGZPJMESA-N 2 1 320.908 4.311 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1 ZINC001235158720 1054670666 /nfs/dbraw/zinc/67/06/66/1054670666.db2.gz VJUXKMXEXOMSCU-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP c1ccc(C2(C[N@H+]3CCCC[C@]34CCC[NH2+]C4)CCCC2)cc1 ZINC001235171423 1054673793 /nfs/dbraw/zinc/67/37/93/1054673793.db2.gz JPXJTXGLPBXRFG-OAQYLSRUSA-N 2 1 312.501 4.107 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC001235187186 1054677815 /nfs/dbraw/zinc/67/78/15/1054677815.db2.gz SSMQAUBMDJQFRX-AQNXPRMDSA-N 2 1 302.506 4.001 20 0 DIADMP Clc1ccc([C@H]2C[C@@H]2C[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235191801 1054680360 /nfs/dbraw/zinc/68/03/60/1054680360.db2.gz ZEBKPACNXSWCSZ-SJLPKXTDSA-N 2 1 318.892 4.052 20 0 DIADMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190532 1054680814 /nfs/dbraw/zinc/68/08/14/1054680814.db2.gz ZNAQNVCPVXIQAJ-KRWDZBQOSA-N 2 1 318.511 4.004 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190532 1054680819 /nfs/dbraw/zinc/68/08/19/1054680819.db2.gz ZNAQNVCPVXIQAJ-KRWDZBQOSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190532 1054680822 /nfs/dbraw/zinc/68/08/22/1054680822.db2.gz ZNAQNVCPVXIQAJ-KRWDZBQOSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190532 1054680828 /nfs/dbraw/zinc/68/08/28/1054680828.db2.gz ZNAQNVCPVXIQAJ-KRWDZBQOSA-N 2 1 318.511 4.004 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235191796 1054681859 /nfs/dbraw/zinc/68/18/59/1054681859.db2.gz ZEBKPACNXSWCSZ-AEFFLSMTSA-N 2 1 318.892 4.052 20 0 DIADMP Cc1ccc(C[N@H+]2CCCCC23CC[NH2+]CC3)c2ccccc12 ZINC001235191282 1054682177 /nfs/dbraw/zinc/68/21/77/1054682177.db2.gz RKVAREMOPBHDQD-UHFFFAOYSA-N 2 1 308.469 4.256 20 0 DIADMP CC1(C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)CCCCC1 ZINC001235248402 1054691813 /nfs/dbraw/zinc/69/18/13/1054691813.db2.gz SVBFQWVWTMVZLL-TZIWHRDSSA-N 2 1 312.501 4.178 20 0 DIADMP CCOc1ccccc1[C@@H](CC)[NH2+]CCCCn1cc[nH+]c1C ZINC000179733892 1054698403 /nfs/dbraw/zinc/69/84/03/1054698403.db2.gz IQIZRAXAFWSIKM-GOSISDBHSA-N 2 1 315.461 4.111 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)CCN1C ZINC000179906091 1054713014 /nfs/dbraw/zinc/71/30/14/1054713014.db2.gz MLQWHLCZGIRVPY-RHSMWYFYSA-N 2 1 316.420 4.000 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235427425 1054715274 /nfs/dbraw/zinc/71/52/74/1054715274.db2.gz RWIYCHVUZSCSCA-IAGOWNOFSA-N 2 1 314.498 4.113 20 0 DIADMP c1ccc2cc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)ccc2c1 ZINC001235426709 1054715903 /nfs/dbraw/zinc/71/59/03/1054715903.db2.gz QNIBDDZHBIZNGX-RTWAWAEBSA-N 2 1 308.469 4.051 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cc2s1 ZINC001235426000 1054716465 /nfs/dbraw/zinc/71/64/65/1054716465.db2.gz KNTKOZSTTZAECF-ZWKOTPCHSA-N 2 1 314.498 4.113 20 0 DIADMP c1cc(C2CCC2)ccc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235427760 1054717034 /nfs/dbraw/zinc/71/70/34/1054717034.db2.gz ODOPRYREGUUDJV-SFTDATJTSA-N 2 1 312.501 4.166 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1Cl)CC1CC[NH2+]CC1 ZINC001235433037 1054717665 /nfs/dbraw/zinc/71/76/65/1054717665.db2.gz FHQCQZJKZKHMIN-UHFFFAOYSA-N 2 1 321.679 4.078 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235431739 1054718050 /nfs/dbraw/zinc/71/80/50/1054718050.db2.gz VRHUEKAPRUJWNO-RTBURBONSA-N 2 1 324.468 4.158 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)CC1CC[NH2+]CC1 ZINC001235433772 1054718684 /nfs/dbraw/zinc/71/86/84/1054718684.db2.gz PJFZFGREUTUCRY-UHFFFAOYSA-N 2 1 308.425 4.017 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235429610 1054720068 /nfs/dbraw/zinc/72/00/68/1054720068.db2.gz BGOLUCVBWSYIOA-SJORKVTESA-N 2 1 318.530 4.010 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)cc1)C1CC[NH2+]CC1 ZINC001235467297 1054731293 /nfs/dbraw/zinc/73/12/93/1054731293.db2.gz YBECGZZOOFYJEA-UHFFFAOYSA-N 2 1 314.860 4.191 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(Cl)cc1)C1CC1 ZINC000180132518 1054737076 /nfs/dbraw/zinc/73/70/76/1054737076.db2.gz SWSJMZIQKGAQOT-SFHVURJKSA-N 2 1 317.864 4.366 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCCOC(C)C)cc1 ZINC000180464051 1054758485 /nfs/dbraw/zinc/75/84/85/1054758485.db2.gz BXPDVUGETYCINE-MRXNPFEDSA-N 2 1 315.461 4.037 20 0 DIADMP C[N@H+](Cc1cccc2ccccc21)CC1CC2(C1)CC[NH2+]CC2 ZINC001235662501 1054764439 /nfs/dbraw/zinc/76/44/39/1054764439.db2.gz IOSHVTQMINJDDM-UHFFFAOYSA-N 2 1 308.469 4.051 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2CC2CC3(C2)CC[NH2+]CC3)cc1 ZINC001235674764 1054769237 /nfs/dbraw/zinc/76/92/37/1054769237.db2.gz ODIYLMCFWTVILS-SFHVURJKSA-N 2 1 318.892 4.257 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001235676620 1054770761 /nfs/dbraw/zinc/77/07/61/1054770761.db2.gz BYZZHRMPQWGYAE-HXUWFJFHSA-N 2 1 310.416 4.156 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001235675640 1054771211 /nfs/dbraw/zinc/77/12/11/1054771211.db2.gz KODVKHOWQBBSMK-HNNXBMFYSA-N 2 1 310.466 4.225 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1ccc2c(c1)C[NH2+]CC2 ZINC001235677625 1054771512 /nfs/dbraw/zinc/77/15/12/1054771512.db2.gz HOJATIOKKUSAEL-OAQYLSRUSA-N 2 1 324.443 4.199 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC001235693601 1054781122 /nfs/dbraw/zinc/78/11/22/1054781122.db2.gz DNPRLTOOKQPPID-GOSISDBHSA-N 2 1 300.833 4.136 20 0 DIADMP C[C@H](C[N@@H+](C)CCC1CC[NH2+]CC1)c1cccc2ccccc21 ZINC001235715959 1054785418 /nfs/dbraw/zinc/78/54/18/1054785418.db2.gz ZLOQDHOXKKDOMF-QGZVFWFLSA-N 2 1 310.485 4.265 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)CC(c1ccccc1)c1ccccc1 ZINC001235712336 1054786832 /nfs/dbraw/zinc/78/68/32/1054786832.db2.gz AAUAAPBYRQCYNG-UHFFFAOYSA-N 2 1 322.496 4.140 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)cc2)CC1 ZINC001235725374 1054787760 /nfs/dbraw/zinc/78/77/60/1054787760.db2.gz GLMFKNZBWKLJGK-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001235716910 1054787931 /nfs/dbraw/zinc/78/79/31/1054787931.db2.gz MMRNZZOKLAJBAR-UHFFFAOYSA-N 2 1 302.487 4.031 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1cccc2c3ccccc3oc21 ZINC001235717677 1054788596 /nfs/dbraw/zinc/78/85/96/1054788596.db2.gz YLCAHYLYEXWXSY-UHFFFAOYSA-N 2 1 322.452 4.408 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc2oc3ccccc3c2c1 ZINC001235717678 1054789527 /nfs/dbraw/zinc/78/95/27/1054789527.db2.gz YMZVTEXQHMEDPG-UHFFFAOYSA-N 2 1 322.452 4.408 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccc(-c3cccc(C)c3)cc2)CC1 ZINC001235726988 1054791535 /nfs/dbraw/zinc/79/15/35/1054791535.db2.gz UOUXLIDHLZPUGG-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP CC1(C)CCC(c2ccc(C[N@H+]3CC[C@H](C[NH3+])C3)cc2)CC1 ZINC001235748652 1054798961 /nfs/dbraw/zinc/79/89/61/1054798961.db2.gz DBDKWNSDSLTKAV-QGZVFWFLSA-N 2 1 300.490 4.151 20 0 DIADMP CC[N@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C1CC[NH2+]CC1 ZINC001235759817 1054800171 /nfs/dbraw/zinc/80/01/71/1054800171.db2.gz ANECNVTVQQSZGN-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C1CC[NH2+]CC1 ZINC001235759817 1054800184 /nfs/dbraw/zinc/80/01/84/1054800184.db2.gz ANECNVTVQQSZGN-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP CC[N@@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)C1CC[NH2+]CC1 ZINC001235760612 1054800886 /nfs/dbraw/zinc/80/08/86/1054800886.db2.gz GMWJRYFJAMVSCO-UHFFFAOYSA-N 2 1 313.489 4.039 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2ccc(F)cc2)cc1)C1CC[NH2+]CC1 ZINC001235761578 1054801453 /nfs/dbraw/zinc/80/14/53/1054801453.db2.gz MPQILHMILGHIOB-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP C[N@H+](Cc1cccc(C[NH3+])c1)Cc1cccc(Cl)c1Cl ZINC001235790834 1054805897 /nfs/dbraw/zinc/80/58/97/1054805897.db2.gz MFCWIEJAFSSMMF-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP C[N@@H+](Cc1cccc(C[NH3+])c1)Cc1cccc(Cl)c1Cl ZINC001235790834 1054805913 /nfs/dbraw/zinc/80/59/13/1054805913.db2.gz MFCWIEJAFSSMMF-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+]3[C@@H]4CC[C@H]3C[C@@H]([NH3+])C4)c2)cc1 ZINC001235808857 1054811606 /nfs/dbraw/zinc/81/16/06/1054811606.db2.gz ICJIZLDLGPPPIR-REPLKXPHSA-N 2 1 322.452 4.241 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)CC1 ZINC001235810900 1054813438 /nfs/dbraw/zinc/81/34/38/1054813438.db2.gz PIUMVHKDLFMYTG-HAGHYFMRSA-N 2 1 302.506 4.413 20 0 DIADMP C[N@H+](Cc1ccc2sc3ccccc3c2c1)C[C@H]1CC[NH2+]C1 ZINC001235842225 1054822180 /nfs/dbraw/zinc/82/21/80/1054822180.db2.gz MSTOPEBNONSPGN-HNNXBMFYSA-N 2 1 310.466 4.096 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891666 1054832561 /nfs/dbraw/zinc/83/25/61/1054832561.db2.gz HIZQEHWDVVBRDJ-GXTWGEPZSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891666 1054832568 /nfs/dbraw/zinc/83/25/68/1054832568.db2.gz HIZQEHWDVVBRDJ-GXTWGEPZSA-N 2 1 312.910 4.022 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC001235919112 1054847133 /nfs/dbraw/zinc/84/71/33/1054847133.db2.gz TYANWSSBLQHVEH-OAHLLOKOSA-N 2 1 314.395 4.014 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H]2CC[NH3+])ccc1Oc1ccccc1 ZINC001235925336 1054848070 /nfs/dbraw/zinc/84/80/70/1054848070.db2.gz IHEDHKCCGZLQLA-SFHVURJKSA-N 2 1 310.441 4.101 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCC[C@H]3CC[NH3+])c2)cc1 ZINC001235925139 1054848528 /nfs/dbraw/zinc/84/85/28/1054848528.db2.gz CMNXBFQHOZBLHM-SFHVURJKSA-N 2 1 310.441 4.101 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3sc21)C[C@H]1CCC[NH2+]C1 ZINC001235950355 1054865975 /nfs/dbraw/zinc/86/59/75/1054865975.db2.gz BTGJKPUTZBGDPP-HNNXBMFYSA-N 2 1 324.493 4.486 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3oc21)C[C@H]1CCC[NH2+]C1 ZINC001235950648 1054867060 /nfs/dbraw/zinc/86/70/60/1054867060.db2.gz KGLRQZSOYOSWIU-HNNXBMFYSA-N 2 1 308.425 4.017 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001235957650 1054870559 /nfs/dbraw/zinc/87/05/59/1054870559.db2.gz RBTHFCFUELZUFJ-GOSISDBHSA-N 2 1 324.468 4.219 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](Cc3ccc4c(c3)CC[NH2+]C4)CC2)cc1 ZINC001235960596 1054872610 /nfs/dbraw/zinc/87/26/10/1054872610.db2.gz UQVXPZAVAUFMLK-HXUWFJFHSA-N 2 1 320.480 4.102 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](CC3CC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001235960905 1054873201 /nfs/dbraw/zinc/87/32/01/1054873201.db2.gz YAOAWNMRPKFVGD-FQEVSTJZSA-N 2 1 312.501 4.036 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@H]3CC[C@@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989023 1054882267 /nfs/dbraw/zinc/88/22/67/1054882267.db2.gz BOAPPUYQQFHZBC-WIYYLYMNSA-N 2 1 324.443 4.033 20 0 DIADMP Cc1cc(C[N@H+]2C[C@H]3CC[C@@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989023 1054882274 /nfs/dbraw/zinc/88/22/74/1054882274.db2.gz BOAPPUYQQFHZBC-WIYYLYMNSA-N 2 1 324.443 4.033 20 0 DIADMP Cc1ccc2cc([C@@H](C)NC[C@@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123926 1054884803 /nfs/dbraw/zinc/88/48/03/1054884803.db2.gz TZSRRHSOQXNNAD-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]C[C@@H]3CCCC[N@H+](C)C3)oc2c1 ZINC000624123926 1054884811 /nfs/dbraw/zinc/88/48/11/1054884811.db2.gz TZSRRHSOQXNNAD-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123926 1054884818 /nfs/dbraw/zinc/88/48/18/1054884818.db2.gz TZSRRHSOQXNNAD-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP C[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124071 1054885819 /nfs/dbraw/zinc/88/58/19/1054885819.db2.gz WJQGOMQOBFKLLA-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124071 1054885832 /nfs/dbraw/zinc/88/58/32/1054885832.db2.gz WJQGOMQOBFKLLA-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124071 1054885838 /nfs/dbraw/zinc/88/58/38/1054885838.db2.gz WJQGOMQOBFKLLA-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H]1C[NH2+]CC(F)(F)[C@H]1C[N@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009834 1054893327 /nfs/dbraw/zinc/89/33/27/1054893327.db2.gz XYBDWBSPJMDMNJ-LBDPXKHJSA-N 2 1 316.480 4.014 20 0 DIADMP C[C@H]1C[NH2+]CC(F)(F)[C@H]1C[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009834 1054893334 /nfs/dbraw/zinc/89/33/34/1054893334.db2.gz XYBDWBSPJMDMNJ-LBDPXKHJSA-N 2 1 316.480 4.014 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046367 1054913226 /nfs/dbraw/zinc/91/32/26/1054913226.db2.gz GBBOMCHLAFRART-UKRRQHHQSA-N 2 1 310.466 4.224 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046367 1054913240 /nfs/dbraw/zinc/91/32/40/1054913240.db2.gz GBBOMCHLAFRART-UKRRQHHQSA-N 2 1 310.466 4.224 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236066295 1054923199 /nfs/dbraw/zinc/92/31/99/1054923199.db2.gz GYDDPNMTGDMLBR-CQSZACIVSA-N 2 1 310.466 4.096 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2cccc(-c3c(C)cccc3C)c2)C1 ZINC001236067458 1054924132 /nfs/dbraw/zinc/92/41/32/1054924132.db2.gz ONJBQOHRUMLQRN-IBGZPJMESA-N 2 1 308.469 4.012 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000181733379 1054931324 /nfs/dbraw/zinc/93/13/24/1054931324.db2.gz XVYKTYISUFZBBV-LBPRGKRZSA-N 2 1 309.816 4.115 20 0 DIADMP CC(C)[N@@H+](CCCCC[NH3+])Cc1ccc(Cl)cc1Cl ZINC001236093176 1054939656 /nfs/dbraw/zinc/93/96/56/1054939656.db2.gz SETMAVAURCRPJU-UHFFFAOYSA-N 2 1 303.277 4.333 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C[C@@H](N)c1ccccc1 ZINC001236108159 1054951563 /nfs/dbraw/zinc/95/15/63/1054951563.db2.gz JHYHYOIHXKMGNU-QZTJIDSGSA-N 2 1 312.482 4.245 20 0 DIADMP CSc1ccccc1[C@H]1CCCN1C[C@@H]([NH3+])c1ccccc1 ZINC001236108159 1054951575 /nfs/dbraw/zinc/95/15/75/1054951575.db2.gz JHYHYOIHXKMGNU-QZTJIDSGSA-N 2 1 312.482 4.245 20 0 DIADMP CC(C)[N@@H+](CCCCC[NH3+])Cc1c(Cl)cccc1Cl ZINC001236110839 1054954649 /nfs/dbraw/zinc/95/46/49/1054954649.db2.gz IPOXLQIJPGFLOK-UHFFFAOYSA-N 2 1 303.277 4.333 20 0 DIADMP CCC[N@@H+](Cc1ccccc1-c1ccccc1)C1CC[NH2+]CC1 ZINC001236181788 1054982919 /nfs/dbraw/zinc/98/29/19/1054982919.db2.gz FOBNQCVIRGBOTF-UHFFFAOYSA-N 2 1 308.469 4.318 20 0 DIADMP CCC[N@@H+](Cc1cncc(-c2ccc(C)cc2)c1)C1CC[NH2+]CC1 ZINC001236184785 1054984623 /nfs/dbraw/zinc/98/46/23/1054984623.db2.gz PDSJYAIUKDFVRU-UHFFFAOYSA-N 2 1 323.484 4.021 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@@H+]1CC1CC2(C1)CC[NH2+]CC2 ZINC001236190275 1054987000 /nfs/dbraw/zinc/98/70/00/1054987000.db2.gz RZUBITBLLZBHCV-FQEVSTJZSA-N 2 1 323.484 4.085 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@@H]2c2c[nH]c3ccccc23)CC1 ZINC001236190769 1054987026 /nfs/dbraw/zinc/98/70/26/1054987026.db2.gz XLTUVBFKXORVAT-HXUWFJFHSA-N 2 1 311.473 4.037 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2c[nH]c3ccccc23)CC1 ZINC001236194699 1054994596 /nfs/dbraw/zinc/99/45/96/1054994596.db2.gz WNTUODPESRNSSG-HXUWFJFHSA-N 2 1 311.473 4.037 20 0 DIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])cc1 ZINC001236215249 1055002527 /nfs/dbraw/zinc/00/25/27/1055002527.db2.gz GDDHFWZQTZDBQZ-VQTJNVASSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])cc1 ZINC001236215249 1055002530 /nfs/dbraw/zinc/00/25/30/1055002530.db2.gz GDDHFWZQTZDBQZ-VQTJNVASSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@H+](Cc1ccc(SC(F)(F)F)cc1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236211109 1055002854 /nfs/dbraw/zinc/00/28/54/1055002854.db2.gz GZGHASUISWLGRZ-KGLIPLIRSA-N 2 1 318.408 4.000 20 0 DIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236211109 1055002858 /nfs/dbraw/zinc/00/28/58/1055002858.db2.gz GZGHASUISWLGRZ-KGLIPLIRSA-N 2 1 318.408 4.000 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(Cl)c(Cl)cc2C)CC1 ZINC001236214870 1055002894 /nfs/dbraw/zinc/00/28/94/1055002894.db2.gz IXIFOGMBSVLLIJ-UHFFFAOYSA-N 2 1 315.288 4.264 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236217598 1055003569 /nfs/dbraw/zinc/00/35/69/1055003569.db2.gz PJXVNXXPOWTYOV-UXHICEINSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccsc2)c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236217585 1055003829 /nfs/dbraw/zinc/00/38/29/1055003829.db2.gz PFYXVDUEKROUID-ROUUACIJSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccsc2)c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236217585 1055003843 /nfs/dbraw/zinc/00/38/43/1055003843.db2.gz PFYXVDUEKROUID-ROUUACIJSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccsc2)c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236217582 1055004370 /nfs/dbraw/zinc/00/43/70/1055004370.db2.gz PFYXVDUEKROUID-MSOLQXFVSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccsc2)c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236217582 1055004385 /nfs/dbraw/zinc/00/43/85/1055004385.db2.gz PFYXVDUEKROUID-MSOLQXFVSA-N 2 1 300.471 4.117 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)CC1 ZINC001236215919 1055007076 /nfs/dbraw/zinc/00/70/76/1055007076.db2.gz SMNKUBQEXWTNTL-UHFFFAOYSA-N 2 1 302.506 4.191 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)[C@@H]3CCCC[C@H]3[NH3+])c(C)c12 ZINC001236219465 1055009860 /nfs/dbraw/zinc/00/98/60/1055009860.db2.gz WOMJRZQNLVCXLJ-CHWSQXEVSA-N 2 1 308.516 4.281 20 0 DIADMP Cc1csc2sc(C[N@H+](C)[C@@H]3CCCC[C@H]3[NH3+])c(C)c12 ZINC001236219465 1055009868 /nfs/dbraw/zinc/00/98/68/1055009868.db2.gz WOMJRZQNLVCXLJ-CHWSQXEVSA-N 2 1 308.516 4.281 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2)s1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236219813 1055010014 /nfs/dbraw/zinc/01/00/14/1055010014.db2.gz XUMYKPPITTVMGK-IRXDYDNUSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236219813 1055010029 /nfs/dbraw/zinc/01/00/29/1055010029.db2.gz XUMYKPPITTVMGK-IRXDYDNUSA-N 2 1 300.471 4.117 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+](C)C1(C)CC[NH2+]CC1 ZINC001236221591 1055012427 /nfs/dbraw/zinc/01/24/27/1055012427.db2.gz CVYHCPHUUNOGOH-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](C)C1(C)CC[NH2+]CC1 ZINC001236221591 1055012439 /nfs/dbraw/zinc/01/24/39/1055012439.db2.gz CVYHCPHUUNOGOH-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224687 1055014030 /nfs/dbraw/zinc/01/40/30/1055014030.db2.gz WKBSBOSUPLLNBK-HDJSIYSDSA-N 2 1 318.848 4.302 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@@H+](C)C2(C)CC[NH2+]CC2)cc1 ZINC001236224785 1055015457 /nfs/dbraw/zinc/01/54/57/1055015457.db2.gz WTBCWWKJMUSNMF-QGZVFWFLSA-N 2 1 302.506 4.063 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)c1 ZINC001236227193 1055016338 /nfs/dbraw/zinc/01/63/38/1055016338.db2.gz ADUJXUUYHAQXTK-UHFFFAOYSA-N 2 1 308.469 4.267 20 0 DIADMP CCCCCCc1csc(C[N@@H+](C)C2(C)CC[NH2+]CC2)c1 ZINC001236227596 1055017048 /nfs/dbraw/zinc/01/70/48/1055017048.db2.gz HYULMRHFABOFFI-UHFFFAOYSA-N 2 1 308.535 4.445 20 0 DIADMP C[N@@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)C1(C)CC[NH2+]CC1 ZINC001236226657 1055018046 /nfs/dbraw/zinc/01/80/46/1055018046.db2.gz QQVZMXQXISAUHK-UHFFFAOYSA-N 2 1 313.489 4.039 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)C1(C)CC[NH2+]CC1 ZINC001236228566 1055019045 /nfs/dbraw/zinc/01/90/45/1055019045.db2.gz WJDHUBPBDHDVRE-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cccc(C[NH3+])c2)cc1C ZINC001236243147 1055027458 /nfs/dbraw/zinc/02/74/58/1055027458.db2.gz CPGVYTORSMTJAD-NRFANRHFSA-N 2 1 308.469 4.489 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC001236244488 1055030094 /nfs/dbraw/zinc/03/00/94/1055030094.db2.gz LAYRNPZPPWUAQK-LBPRGKRZSA-N 2 1 320.889 4.240 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC001236244488 1055030099 /nfs/dbraw/zinc/03/00/99/1055030099.db2.gz LAYRNPZPPWUAQK-LBPRGKRZSA-N 2 1 320.889 4.240 20 0 DIADMP C[NH+](C)Cc1cccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000183326644 1055041301 /nfs/dbraw/zinc/04/13/01/1055041301.db2.gz VZGPWEFMLIOYNP-OAQYLSRUSA-N 2 1 320.436 4.220 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CC1 ZINC001236285243 1055046912 /nfs/dbraw/zinc/04/69/12/1055046912.db2.gz DTBYXRWROVNFHA-AZUAARDMSA-N 2 1 312.501 4.233 20 0 DIADMP CCc1ccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1 ZINC001236285821 1055049878 /nfs/dbraw/zinc/04/98/78/1055049878.db2.gz HZASJIIPCMACGH-UHFFFAOYSA-N 2 1 308.469 4.003 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[N@@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236321793 1055054911 /nfs/dbraw/zinc/05/49/11/1055054911.db2.gz QMURHMISPFTLSO-OYRHEFFESA-N 2 1 312.501 4.166 20 0 DIADMP Cc1c(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cccc1-c1ccccc1 ZINC001236321476 1055055559 /nfs/dbraw/zinc/05/55/59/1055055559.db2.gz SVQRJERCTPCSAS-OYRHEFFESA-N 2 1 320.480 4.093 20 0 DIADMP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc2ccccc2n1 ZINC000183953025 1055062045 /nfs/dbraw/zinc/06/20/45/1055062045.db2.gz ZWZAAMAHLZGZPS-INIZCTEOSA-N 2 1 311.473 4.007 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236373668 1055079397 /nfs/dbraw/zinc/07/93/97/1055079397.db2.gz JAQYRBDZYSPNAR-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP FC1(F)CCC(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)CC1 ZINC001236371267 1055079708 /nfs/dbraw/zinc/07/97/08/1055079708.db2.gz JJTWLEBZGGNTSI-INIZCTEOSA-N 2 1 314.464 4.056 20 0 DIADMP Clc1cccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373428 1055079977 /nfs/dbraw/zinc/07/99/77/1055079977.db2.gz HXBMULHTUVQELS-INIZCTEOSA-N 2 1 306.881 4.084 20 0 DIADMP Cc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc(F)c1F ZINC001236374119 1055080336 /nfs/dbraw/zinc/08/03/36/1055080336.db2.gz BKXSGEMSPUELNH-HNNXBMFYSA-N 2 1 322.443 4.017 20 0 DIADMP Fc1c(Cl)cccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374359 1055080500 /nfs/dbraw/zinc/08/05/00/1055080500.db2.gz PVFBOTPCNJQSFR-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Clc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236372821 1055080761 /nfs/dbraw/zinc/08/07/61/1055080761.db2.gz DTJNSLRHHHTYMK-CYBMUJFWSA-N 2 1 312.910 4.146 20 0 DIADMP CSc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236374774 1055081261 /nfs/dbraw/zinc/08/12/61/1055081261.db2.gz TZRFIMBVQJYPCD-KRWDZBQOSA-N 2 1 318.530 4.153 20 0 DIADMP c1ccc(C2CC2)c(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374690 1055081290 /nfs/dbraw/zinc/08/12/90/1055081290.db2.gz SKMCAKQHDCVGCH-KRWDZBQOSA-N 2 1 312.501 4.308 20 0 DIADMP Cc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc(C)c1F ZINC001236376813 1055081493 /nfs/dbraw/zinc/08/14/93/1055081493.db2.gz UNYFSKCEUANBFN-QGZVFWFLSA-N 2 1 318.480 4.187 20 0 DIADMP Fc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1Cl ZINC001236375127 1055082015 /nfs/dbraw/zinc/08/20/15/1055082015.db2.gz XAGAWTPQRPEGBP-HNNXBMFYSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)ccc1Cl ZINC001236375301 1055082306 /nfs/dbraw/zinc/08/23/06/1055082306.db2.gz IXVBRFBNDIMXRI-KRWDZBQOSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(C)c1 ZINC001236374416 1055082400 /nfs/dbraw/zinc/08/24/00/1055082400.db2.gz RBLZUISXWIRBFO-GOSISDBHSA-N 2 1 300.490 4.048 20 0 DIADMP Fc1cc(Cl)ccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374392 1055083205 /nfs/dbraw/zinc/08/32/05/1055083205.db2.gz QJPRAYCWXOHCKJ-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374635 1055083724 /nfs/dbraw/zinc/08/37/24/1055083724.db2.gz FREHAKYCYSXLRJ-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185667174 1055094474 /nfs/dbraw/zinc/09/44/74/1055094474.db2.gz BZZDHYGIZVKXJY-ZHALLVOQSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]([NH2+]CCSc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185681790 1055094743 /nfs/dbraw/zinc/09/47/43/1055094743.db2.gz SNQRUZMWXUMVIR-IAGOWNOFSA-N 2 1 318.530 4.021 20 0 DIADMP C[C@@H]([NH2+]CCc1ccccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185724199 1055096861 /nfs/dbraw/zinc/09/68/61/1055096861.db2.gz XFSVBNHXSGBQIZ-NVXWUHKLSA-N 2 1 320.908 4.125 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccc(C)cc2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236408033 1055099201 /nfs/dbraw/zinc/09/92/01/1055099201.db2.gz KCKATPMZNIDTQO-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415479 1055104244 /nfs/dbraw/zinc/10/42/44/1055104244.db2.gz OKIDJDCEAGTZOA-WFASDCNBSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415479 1055104246 /nfs/dbraw/zinc/10/42/46/1055104246.db2.gz OKIDJDCEAGTZOA-WFASDCNBSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420836 1055105523 /nfs/dbraw/zinc/10/55/23/1055105523.db2.gz ONNSMMPYTFVNNG-DYVFJYSZSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420836 1055105528 /nfs/dbraw/zinc/10/55/28/1055105528.db2.gz ONNSMMPYTFVNNG-DYVFJYSZSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420834 1055105541 /nfs/dbraw/zinc/10/55/41/1055105541.db2.gz OMXFALRXIHPQNU-LIRRHRJNSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420834 1055105543 /nfs/dbraw/zinc/10/55/43/1055105543.db2.gz OMXFALRXIHPQNU-LIRRHRJNSA-N 2 1 314.860 4.319 20 0 DIADMP Clc1ccc(C[N@@H+](C[C@@H]2CC=CCC2)C2CC[NH2+]CC2)cc1 ZINC001236454236 1055122508 /nfs/dbraw/zinc/12/25/08/1055122508.db2.gz XBDKGMNHYLYQQI-MRXNPFEDSA-N 2 1 318.892 4.250 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)o1 ZINC001236458808 1055126302 /nfs/dbraw/zinc/12/63/02/1055126302.db2.gz YRBSVOZSUNGFFH-HNNXBMFYSA-N 2 1 306.494 4.182 20 0 DIADMP CC(C)c1cccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236459427 1055127256 /nfs/dbraw/zinc/12/72/56/1055127256.db2.gz NXYNSKLTVXRXOD-UHFFFAOYSA-N 2 1 302.506 4.410 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1c2ccoc2ccc1F)C1CC[NH2+]CC1 ZINC001236459457 1055127695 /nfs/dbraw/zinc/12/76/95/1055127695.db2.gz PJAOSNYZYSABBO-UHFFFAOYSA-N 2 1 318.436 4.172 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380898081 1055134671 /nfs/dbraw/zinc/13/46/71/1055134671.db2.gz DNPLEMLHKAULLZ-RBUKOAKNSA-N 2 1 300.490 4.067 20 0 DIADMP CCC(CC)C[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236481036 1055138393 /nfs/dbraw/zinc/13/83/93/1055138393.db2.gz MOPHSZJXWGNUMB-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](CCC2CCCC2)C2CC[NH2+]CC2)c1 ZINC001236481320 1055139203 /nfs/dbraw/zinc/13/92/03/1055139203.db2.gz QPONLAOLFSWIPM-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP CCCCCC[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001236503431 1055150578 /nfs/dbraw/zinc/15/05/78/1055150578.db2.gz CBSKQDPBUQDJBY-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP CCCCCC[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001236503431 1055150582 /nfs/dbraw/zinc/15/05/82/1055150582.db2.gz CBSKQDPBUQDJBY-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](CC1CCCCC1)C1CC[NH2+]CC1 ZINC001236509487 1055152875 /nfs/dbraw/zinc/15/28/75/1055152875.db2.gz OUILMJUWMGHOKQ-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236508786 1055152927 /nfs/dbraw/zinc/15/29/27/1055152927.db2.gz AIWPSCVQKYQAOK-PLNGDYQASA-N 2 1 318.480 4.435 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](CCC(C)(C)C)C1CC[NH2+]CC1 ZINC001236518682 1055157683 /nfs/dbraw/zinc/15/76/83/1055157683.db2.gz SZEMBSBZONVCNG-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCC2CCCC2)Cc2ccccc2F)CC1 ZINC001236533640 1055164676 /nfs/dbraw/zinc/16/46/76/1055164676.db2.gz DKTAKUYXYDQIQU-WGSAOQKQSA-N 2 1 318.480 4.478 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccc(Cl)cc2)CC2CCC2)CC1 ZINC001236539848 1055168155 /nfs/dbraw/zinc/16/81/55/1055168155.db2.gz BPDKAHCEPYSPMN-WGSAOQKQSA-N 2 1 320.908 4.255 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3c(c2)CCC3)CC2CCC2)CC1 ZINC001236539897 1055168375 /nfs/dbraw/zinc/16/83/75/1055168375.db2.gz DFDYRIQCFKKAGB-MEMLXQNLSA-N 2 1 312.501 4.047 20 0 DIADMP CCc1cccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236540160 1055168597 /nfs/dbraw/zinc/16/85/97/1055168597.db2.gz IVEFQDVUNWRIEH-MXVIHJGJSA-N 2 1 300.490 4.121 20 0 DIADMP CCc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236539791 1055168625 /nfs/dbraw/zinc/16/86/25/1055168625.db2.gz ARERYMHGZHFXCP-MXVIHJGJSA-N 2 1 300.490 4.121 20 0 DIADMP Cc1cccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236540899 1055170099 /nfs/dbraw/zinc/17/00/99/1055170099.db2.gz FDMYMLXVVHXILV-IYARVYRRSA-N 2 1 304.453 4.006 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2Cl)CC2CCC2)CC1 ZINC001236541934 1055170117 /nfs/dbraw/zinc/17/01/17/1055170117.db2.gz PRXBNBYVODIXFQ-QAQDUYKDSA-N 2 1 324.871 4.351 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)s1 ZINC001236540804 1055170527 /nfs/dbraw/zinc/17/05/27/1055170527.db2.gz CIKHLKBQDYMCHW-IYARVYRRSA-N 2 1 306.519 4.237 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Cl)s2)CC2CCC2)CC1 ZINC001236542644 1055172155 /nfs/dbraw/zinc/17/21/55/1055172155.db2.gz YYBBTAOLAFKHHB-HDJSIYSDSA-N 2 1 312.910 4.274 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3cccnc3c2)CC2CCC2)CC1 ZINC001236542921 1055173045 /nfs/dbraw/zinc/17/30/45/1055173045.db2.gz XJAUASOIRLVEJJ-MXVIHJGJSA-N 2 1 323.484 4.107 20 0 DIADMP Cc1[nH]c2ccccc2c1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236549738 1055177268 /nfs/dbraw/zinc/17/72/68/1055177268.db2.gz AIQGJSMXOZSUBW-QAQDUYKDSA-N 2 1 313.489 4.204 20 0 DIADMP COc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1Cl ZINC001236549756 1055177674 /nfs/dbraw/zinc/17/76/74/1055177674.db2.gz AZEJWFLPLKKPON-WKILWMFISA-N 2 1 324.896 4.077 20 0 DIADMP CC(C)(C)c1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236550809 1055177836 /nfs/dbraw/zinc/17/78/36/1055177836.db2.gz HITUAMDOMTWMDQ-MXVIHJGJSA-N 2 1 314.517 4.466 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1Cl ZINC001236549931 1055178080 /nfs/dbraw/zinc/17/80/80/1055178080.db2.gz DCTZCBBCGAWFAE-IYARVYRRSA-N 2 1 320.908 4.439 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236550826 1055178409 /nfs/dbraw/zinc/17/84/09/1055178409.db2.gz NJCBBVNETSKLMY-KBAYOESNSA-N 2 1 306.494 4.310 20 0 DIADMP CC(C)C[N@@H+](Cc1cccc(OC(C)C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552799 1055179625 /nfs/dbraw/zinc/17/96/25/1055179625.db2.gz ZSTPQZPZUHOMHT-WGSAOQKQSA-N 2 1 318.505 4.202 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552277 1055180217 /nfs/dbraw/zinc/18/02/17/1055180217.db2.gz UCPBXZMONHAOEG-QAQDUYKDSA-N 2 1 306.881 4.130 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1Cl ZINC001236551306 1055180341 /nfs/dbraw/zinc/18/03/41/1055180341.db2.gz BMZGCNVCHOQFLR-QAQDUYKDSA-N 2 1 306.881 4.130 20 0 DIADMP Cc1ccccc1C[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554504 1055181089 /nfs/dbraw/zinc/18/10/89/1055181089.db2.gz ILIHYIFMWJMOCE-MXVIHJGJSA-N 2 1 300.490 4.257 20 0 DIADMP Cc1cc(F)c(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1 ZINC001236554582 1055181203 /nfs/dbraw/zinc/18/12/03/1055181203.db2.gz LWVFNVRDFHAJOP-SHTZXODSSA-N 2 1 310.432 4.001 20 0 DIADMP C[C@H](CC[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1)CC(C)(C)C ZINC001236554440 1055181573 /nfs/dbraw/zinc/18/15/73/1055181573.db2.gz ZZPKNWFDYUFBBG-KZNAEPCWSA-N 2 1 324.553 4.200 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236554581 1055182270 /nfs/dbraw/zinc/18/22/70/1055182270.db2.gz LWGHZOBBGQUONC-IYARVYRRSA-N 2 1 308.897 4.376 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(F)c2cc[nH]c21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554552 1055182276 /nfs/dbraw/zinc/18/22/76/1055182276.db2.gz KQCFKCQGVSEPTJ-WKILWMFISA-N 2 1 317.452 4.035 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(F)c2ccoc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554553 1055182370 /nfs/dbraw/zinc/18/23/70/1055182370.db2.gz KTLRKAQSAPOHGY-WKILWMFISA-N 2 1 318.436 4.300 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236566475 1055185616 /nfs/dbraw/zinc/18/56/16/1055185616.db2.gz IKNRMKIGDDKHMD-KESTWPANSA-N 2 1 300.490 4.318 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236566258 1055185933 /nfs/dbraw/zinc/18/59/33/1055185933.db2.gz UYBLPMSKINICLT-KESTWPANSA-N 2 1 300.490 4.400 20 0 DIADMP CC1(C)C[C@@H](C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001236565966 1055186160 /nfs/dbraw/zinc/18/61/60/1055186160.db2.gz SRLVEUKKUOFKKJ-LNLFQRSKSA-N 2 1 322.537 4.096 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2F)C2CCCCC2)CC1 ZINC001236565498 1055186560 /nfs/dbraw/zinc/18/65/60/1055186560.db2.gz IFYYQQWAHNVVQV-SAABIXHNSA-N 2 1 322.443 4.369 20 0 DIADMP Cc1nc(C)c(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236565874 1055186570 /nfs/dbraw/zinc/18/65/70/1055186570.db2.gz QOUGZZHONOXKBK-JCNLHEQBSA-N 2 1 321.534 4.165 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2c[nH]c3ccccc23)C2CCCC2)CC1 ZINC001236566978 1055188064 /nfs/dbraw/zinc/18/80/64/1055188064.db2.gz PVMFMGGBMCDZIZ-SAABIXHNSA-N 2 1 311.473 4.182 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccnc3ccccc23)C2CCCC2)CC1 ZINC001236567471 1055188109 /nfs/dbraw/zinc/18/81/09/1055188109.db2.gz WRJRXOGYMRIALJ-UAPYVXQJSA-N 2 1 323.484 4.249 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cc(F)cc(F)c2)C2CCCC2)CC1 ZINC001236567394 1055188120 /nfs/dbraw/zinc/18/81/20/1055188120.db2.gz UYHQFIIBPONVJE-UAPYVXQJSA-N 2 1 322.443 4.022 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)c(F)c2)C2CCCC2)CC1 ZINC001236567046 1055188431 /nfs/dbraw/zinc/18/84/31/1055188431.db2.gz RKCYPQQKMTWVAH-KOMQPUFPSA-N 2 1 324.871 4.494 20 0 DIADMP CCOc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236567445 1055188577 /nfs/dbraw/zinc/18/85/77/1055188577.db2.gz WHSRJKWCANIRJA-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892932 1055190191 /nfs/dbraw/zinc/19/01/91/1055190191.db2.gz FFKTZUYQLVCJOU-IEBWSBKVSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892932 1055190194 /nfs/dbraw/zinc/19/01/94/1055190194.db2.gz FFKTZUYQLVCJOU-IEBWSBKVSA-N 2 1 312.457 4.233 20 0 DIADMP CCOc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236571312 1055191278 /nfs/dbraw/zinc/19/12/78/1055191278.db2.gz BPYOYOLJHQCOGF-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3cc[nH]c32)C2CCCC2)CC1 ZINC001236570840 1055191302 /nfs/dbraw/zinc/19/13/02/1055191302.db2.gz CITNJLWDSYTEMM-UAPYVXQJSA-N 2 1 311.473 4.182 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3ccccc32)C2CCC2)CC1 ZINC001236572096 1055192768 /nfs/dbraw/zinc/19/27/68/1055192768.db2.gz MROUIRQNLTWIHS-KESTWPANSA-N 2 1 308.469 4.464 20 0 DIADMP C[C@@H]([NH2+]C1CCCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381945453 1055192923 /nfs/dbraw/zinc/19/29/23/1055192923.db2.gz YXIYNDNPVYXKBT-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236573569 1055195221 /nfs/dbraw/zinc/19/52/21/1055195221.db2.gz ZYGOJYZJUBHVAD-KOMQPUFPSA-N 2 1 324.871 4.412 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381982989 1055195252 /nfs/dbraw/zinc/19/52/52/1055195252.db2.gz NJURHLPIJIILJH-MISYRCLQSA-N 2 1 300.490 4.067 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(F)ccc2Cl)C2CCC2)CC1 ZINC001236573210 1055195527 /nfs/dbraw/zinc/19/55/27/1055195527.db2.gz ZCDVUQMPRVXEQL-KOMQPUFPSA-N 2 1 310.844 4.104 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)ncc1Cl ZINC001236574848 1055196662 /nfs/dbraw/zinc/19/66/62/1055196662.db2.gz VMWWRQYWDPXAJO-CZIWCDLHSA-N 2 1 321.896 4.058 20 0 DIADMP Cc1ccnc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236574731 1055196851 /nfs/dbraw/zinc/19/68/51/1055196851.db2.gz QZNCIXKMAJAREA-KOMQPUFPSA-N 2 1 321.896 4.058 20 0 DIADMP CCOc1ccc(C)c(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236576061 1055197108 /nfs/dbraw/zinc/19/71/08/1055197108.db2.gz ADCGVNNCXOVSEI-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236576353 1055197246 /nfs/dbraw/zinc/19/72/46/1055197246.db2.gz KIYFLCGWHNZFQV-KOMQPUFPSA-N 2 1 324.871 4.412 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C[C@H]3CCC[NH2+]C3)C3CC3)cc2)o1 ZINC001236601156 1055200364 /nfs/dbraw/zinc/20/03/64/1055200364.db2.gz KXYIWAUXKXEUGY-SFHVURJKSA-N 2 1 324.468 4.219 20 0 DIADMP CC(C)c1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CC2)ccc1Cl ZINC001236602531 1055200691 /nfs/dbraw/zinc/20/06/91/1055200691.db2.gz WWCGUMXPSSZISJ-INIZCTEOSA-N 2 1 320.908 4.427 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001236603682 1055204045 /nfs/dbraw/zinc/20/40/45/1055204045.db2.gz CHTOGMQSMJGDBW-LJQANCHMSA-N 2 1 314.860 4.178 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001236636830 1055209460 /nfs/dbraw/zinc/20/94/60/1055209460.db2.gz JULOAZZZNBUAAA-UHFFFAOYSA-N 2 1 314.498 4.316 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)CC1(F)CC[NH2+]CC1 ZINC001236662546 1055217706 /nfs/dbraw/zinc/21/77/06/1055217706.db2.gz KNCNKISXWBMAGZ-LJQANCHMSA-N 2 1 320.496 4.202 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCC2CCCC2)Cc2ccccn2)CC1 ZINC001236671479 1055222265 /nfs/dbraw/zinc/22/22/65/1055222265.db2.gz IHSPIOODMSOSNA-KESTWPANSA-N 2 1 315.505 4.124 20 0 DIADMP Cc1csc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236682472 1055228387 /nfs/dbraw/zinc/22/83/87/1055228387.db2.gz UJXQSUQSONGRQW-IYARVYRRSA-N 2 1 314.498 4.329 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236681049 1055230101 /nfs/dbraw/zinc/23/01/01/1055230101.db2.gz ADUJXUUYHAQXTK-MEMLXQNLSA-N 2 1 308.469 4.267 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236715792 1055240089 /nfs/dbraw/zinc/24/00/89/1055240089.db2.gz ZRNUZDXEDGVINQ-WGSAOQKQSA-N 2 1 312.457 4.169 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236726193 1055241520 /nfs/dbraw/zinc/24/15/20/1055241520.db2.gz GVKSFSPXWHTOFV-SSXICUSMSA-N 2 1 324.512 4.279 20 0 DIADMP CS[C@@H](C)CC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236743307 1055249554 /nfs/dbraw/zinc/24/95/54/1055249554.db2.gz XPUOUJYKCOSTCS-WBAXXEDZSA-N 2 1 324.509 4.039 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(F)ccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767913 1055250294 /nfs/dbraw/zinc/25/02/94/1055250294.db2.gz KGHXYEBPVWPNAU-WKILWMFISA-N 2 1 310.432 4.083 20 0 DIADMP COc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc1C ZINC001236766051 1055251451 /nfs/dbraw/zinc/25/14/51/1055251451.db2.gz CEBNPFOOUAUNLJ-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP COc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236765877 1055251753 /nfs/dbraw/zinc/25/17/53/1055251753.db2.gz BINNOIWQVHMXHP-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236769531 1055253711 /nfs/dbraw/zinc/25/37/11/1055253711.db2.gz XVXKKGPSZUDLRK-WGSAOQKQSA-N 2 1 302.506 4.421 20 0 DIADMP COc1cc(C)ccc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768720 1055253874 /nfs/dbraw/zinc/25/38/74/1055253874.db2.gz VKZXMNFJBACSII-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)Cc2ccco2)cc1 ZINC000764776120 1055254107 /nfs/dbraw/zinc/25/41/07/1055254107.db2.gz YGZMVOODUVAFNH-CABCVRRESA-N 2 1 309.413 4.056 20 0 DIADMP Cc1c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccnc1Cl ZINC001236780408 1055254020 /nfs/dbraw/zinc/25/40/20/1055254020.db2.gz RBUJKSYUTGUJMS-WKILWMFISA-N 2 1 323.912 4.161 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(Cl)ccc1N)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781154 1055254822 /nfs/dbraw/zinc/25/48/22/1055254822.db2.gz AVEBLJSKNBWJFD-JCNLHEQBSA-N 2 1 323.912 4.183 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)n1 ZINC001236780413 1055255626 /nfs/dbraw/zinc/25/56/26/1055255626.db2.gz RCHVLRKSKPOYPS-JCNLHEQBSA-N 2 1 323.912 4.161 20 0 DIADMP Cc1c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc(F)c1F ZINC001236779866 1055255676 /nfs/dbraw/zinc/25/56/76/1055255676.db2.gz LQKNNOVBZXFVFN-WKILWMFISA-N 2 1 324.459 4.391 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(C)cc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783025 1055257398 /nfs/dbraw/zinc/25/73/98/1055257398.db2.gz XVMGMIGVQKIGSQ-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(C)c1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782456 1055257990 /nfs/dbraw/zinc/25/79/90/1055257990.db2.gz RUUZCUYYAWHITF-SAABIXHNSA-N 2 1 306.469 4.395 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(OC)c1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782097 1055258734 /nfs/dbraw/zinc/25/87/34/1055258734.db2.gz MJJFNXOPDPEAND-JCNLHEQBSA-N 2 1 322.468 4.095 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc2[nH]ccc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782055 1055259663 /nfs/dbraw/zinc/25/96/63/1055259663.db2.gz KYFBXBIZLFQTBM-SAABIXHNSA-N 2 1 313.489 4.428 20 0 DIADMP CCC(CC)[N@@H+](Cc1nccc(C)c1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236791355 1055260800 /nfs/dbraw/zinc/26/08/00/1055260800.db2.gz RMJZKJXFVDUCNX-KOMQPUFPSA-N 2 1 323.912 4.304 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(F)c1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236791495 1055264166 /nfs/dbraw/zinc/26/41/66/1055264166.db2.gz VMBBHYZBQCYQSR-JCNLHEQBSA-N 2 1 322.468 4.095 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383436558 1055276750 /nfs/dbraw/zinc/27/67/50/1055276750.db2.gz FKLQRLCYCSHUAD-SIKLNZKXSA-N 2 1 322.496 4.119 20 0 DIADMP CCCCCCc1csc(C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1 ZINC001236826988 1055279225 /nfs/dbraw/zinc/27/92/25/1055279225.db2.gz DNPXZOZCUDGQDQ-CGTJXYLNSA-N 2 1 306.519 4.040 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc4sc5ccccc5c4c3)C[C@@H]12 ZINC001236827868 1055281860 /nfs/dbraw/zinc/28/18/60/1055281860.db2.gz HCXKJVSXXSUTDG-ZTFGCOKTSA-N 2 1 322.477 4.224 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](CCC)C[C@H]2CC[NH2+]C2)cc1 ZINC001236834921 1055284507 /nfs/dbraw/zinc/28/45/07/1055284507.db2.gz KPUKDLVFZDWHNH-IBGZPJMESA-N 2 1 318.505 4.077 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2cccs2)s1)C[C@@H]1CC[NH2+]C1 ZINC001236834840 1055285571 /nfs/dbraw/zinc/28/55/71/1055285571.db2.gz IRSNAWYDWYBXTG-CQSZACIVSA-N 2 1 320.527 4.298 20 0 DIADMP CCC[N@@H+](Cc1ccc(C)c(Cl)c1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236843478 1055287046 /nfs/dbraw/zinc/28/70/46/1055287046.db2.gz PARRHRVKDKOXCU-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP CCC[N@H+](Cc1ccc(C)c(Cl)c1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236843478 1055287052 /nfs/dbraw/zinc/28/70/52/1055287052.db2.gz PARRHRVKDKOXCU-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP CCC[N@H+](Cc1ccccc1-c1ccccc1C)C[C@@H]1CC[NH2+]C1 ZINC001236844649 1055287552 /nfs/dbraw/zinc/28/75/52/1055287552.db2.gz XAWOWVDBOXKFDQ-LJQANCHMSA-N 2 1 322.496 4.484 20 0 DIADMP CCC[N@H+](Cc1ccc(Cl)c(C(C)C)c1)C[C@@H]1CC[NH2+]C1 ZINC001236842375 1055288242 /nfs/dbraw/zinc/28/82/42/1055288242.db2.gz FLISSHLHCNAVMC-MRXNPFEDSA-N 2 1 308.897 4.285 20 0 DIADMP CCC(CC)[N@@H+](CC1(F)CC[NH2+]CC1)[C@H](C)c1ccccc1 ZINC001236858302 1055294768 /nfs/dbraw/zinc/29/47/68/1055294768.db2.gz AYIWZOFAOUJMTA-MRXNPFEDSA-N 2 1 306.469 4.330 20 0 DIADMP C[N@@H+](Cc1ccccc1)Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236902920 1055306130 /nfs/dbraw/zinc/30/61/30/1055306130.db2.gz JZLCCPVXJDJSGM-UHFFFAOYSA-N 2 1 311.816 4.158 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000764963386 1055306527 /nfs/dbraw/zinc/30/65/27/1055306527.db2.gz NXIIFSMXJFGZNY-HZPDHXFCSA-N 2 1 300.556 4.151 20 0 DIADMP C[C@H]([NH2+]C/C=C/c1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383944344 1055309482 /nfs/dbraw/zinc/30/94/82/1055309482.db2.gz VQHYBIOYLBHOTP-NJEHNGEPSA-N 2 1 320.480 4.200 20 0 DIADMP Clc1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)ccc1-n1ccnc1 ZINC001236906151 1055309427 /nfs/dbraw/zinc/30/94/27/1055309427.db2.gz IGIAGLXCRLYFJO-IYBDPMFKSA-N 2 1 315.848 4.148 20 0 DIADMP [NH3+]CCCCC[N@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC001236976300 1055321251 /nfs/dbraw/zinc/32/12/51/1055321251.db2.gz PDKPQBYVZOSMTG-MRXNPFEDSA-N 2 1 314.395 4.361 20 0 DIADMP C[C@H]([NH2+]CCC1=CCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385187800 1055360644 /nfs/dbraw/zinc/36/06/44/1055360644.db2.gz OBTZUECHYRARJR-GHTZIAJQSA-N 2 1 312.501 4.377 20 0 DIADMP C[C@@H]([NH2+]CCC1=CCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385187807 1055360712 /nfs/dbraw/zinc/36/07/12/1055360712.db2.gz OBTZUECHYRARJR-WIYYLYMNSA-N 2 1 312.501 4.377 20 0 DIADMP C[C@@H]([NH2+]CCC1=CCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385187801 1055360983 /nfs/dbraw/zinc/36/09/83/1055360983.db2.gz OBTZUECHYRARJR-NQIIRXRSSA-N 2 1 312.501 4.377 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C2CCCCC2)cc1 ZINC001237078789 1055361850 /nfs/dbraw/zinc/36/18/50/1055361850.db2.gz QCDQBTJTKNMQNW-PRJVBOEPSA-N 2 1 312.501 4.436 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001237082287 1055363803 /nfs/dbraw/zinc/36/38/03/1055363803.db2.gz OSWGOQLYKQLDAN-FQEVSTJZSA-N 2 1 312.432 4.054 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCC[C@](C)(C[NH3+])C3)c2)cc1 ZINC001237081813 1055364238 /nfs/dbraw/zinc/36/42/38/1055364238.db2.gz MRGZWCYTDNJFEP-OAQYLSRUSA-N 2 1 308.469 4.223 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1-c1cccs1 ZINC001237082078 1055364990 /nfs/dbraw/zinc/36/49/90/1055364990.db2.gz OLZCJQWBMUXMAR-ZXFUBFMLSA-N 2 1 312.482 4.117 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)C1 ZINC001237079843 1055365584 /nfs/dbraw/zinc/36/55/84/1055365584.db2.gz CEBRXWQFJKKARS-MRXNPFEDSA-N 2 1 306.500 4.037 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+](C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237153059 1055387247 /nfs/dbraw/zinc/38/72/47/1055387247.db2.gz CBGSYVSVLJYFQM-MRXNPFEDSA-N 2 1 314.498 4.316 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+](C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237153059 1055387256 /nfs/dbraw/zinc/38/72/56/1055387256.db2.gz CBGSYVSVLJYFQM-MRXNPFEDSA-N 2 1 314.498 4.316 20 0 DIADMP CC(C)Cc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000385935619 1055399135 /nfs/dbraw/zinc/39/91/35/1055399135.db2.gz CJDMACROMRHLSA-INIZCTEOSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccc3ccccc3c2)CC[N@H+]1C ZINC000624267316 1055399504 /nfs/dbraw/zinc/39/95/04/1055399504.db2.gz JYTCGNYBOVUVHE-OXJNMPFZSA-N 2 1 310.485 4.190 20 0 DIADMP CC(C)=CCC[C@H](C)C[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001237299292 1055421376 /nfs/dbraw/zinc/42/13/76/1055421376.db2.gz CUVSEQNJULOTIN-SFHVURJKSA-N 2 1 312.501 4.463 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001237300909 1055422212 /nfs/dbraw/zinc/42/22/12/1055422212.db2.gz QTQNAZRPILRWCE-QGZVFWFLSA-N 2 1 300.490 4.297 20 0 DIADMP CCc1cccc(C)c1C[N@@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001237310472 1055423887 /nfs/dbraw/zinc/42/38/87/1055423887.db2.gz JRLGQRGSXNCLCG-UHFFFAOYSA-N 2 1 320.480 4.152 20 0 DIADMP CCc1cccc(C)c1C[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001237310472 1055423892 /nfs/dbraw/zinc/42/38/92/1055423892.db2.gz JRLGQRGSXNCLCG-UHFFFAOYSA-N 2 1 320.480 4.152 20 0 DIADMP c1ccc2c(c1)C[NH2+]C21CC[NH+](CCCC2CCCCC2)CC1 ZINC001237358931 1055438814 /nfs/dbraw/zinc/43/88/14/1055438814.db2.gz KXSRLYCIRMQETC-UHFFFAOYSA-N 2 1 312.501 4.441 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC1 ZINC001237359460 1055439713 /nfs/dbraw/zinc/43/97/13/1055439713.db2.gz OPGZRXYLSQWIMB-PKOBYXMFSA-N 2 1 310.485 4.073 20 0 DIADMP C[C@H](C[N@H+]1CC[C@H]2[NH2+]CCC[C@H]2C1)c1cccc2ccccc21 ZINC001237380727 1055444785 /nfs/dbraw/zinc/44/47/85/1055444785.db2.gz HCVANNYESFRZEB-PLMTUMEDSA-N 2 1 308.469 4.017 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)cc2)cc1 ZINC001237383102 1055444948 /nfs/dbraw/zinc/44/49/48/1055444948.db2.gz OENYWLMHLPKJDS-NQIIRXRSSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)cc2)cc1 ZINC001237383102 1055444950 /nfs/dbraw/zinc/44/49/50/1055444950.db2.gz OENYWLMHLPKJDS-NQIIRXRSSA-N 2 1 322.452 4.053 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)c2)cc1 ZINC001237412712 1055451014 /nfs/dbraw/zinc/45/10/14/1055451014.db2.gz HHICBCNSUMSREK-FGZHOGPDSA-N 2 1 320.480 4.236 20 0 DIADMP Fc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1-c1ccccc1 ZINC001237411012 1055451548 /nfs/dbraw/zinc/45/15/48/1055451548.db2.gz FGSWSOOGTIMRNF-RXVVDRJESA-N 2 1 324.443 4.067 20 0 DIADMP Fc1ccc(C[N@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1-c1ccccc1 ZINC001237411012 1055451553 /nfs/dbraw/zinc/45/15/53/1055451553.db2.gz FGSWSOOGTIMRNF-RXVVDRJESA-N 2 1 324.443 4.067 20 0 DIADMP Cc1cnccc1O[C@H]1CC[N@H+](Cc2cccc(C(C)C)c2)C1 ZINC001237460843 1055455662 /nfs/dbraw/zinc/45/56/62/1055455662.db2.gz ZAAJTMFJMFOPKU-IBGZPJMESA-N 2 1 310.441 4.167 20 0 DIADMP C[N@@H+]1CCC[C@]2(CCC[NH+](CCCc3ccccc3Cl)C2)C1 ZINC001278135421 1055513112 /nfs/dbraw/zinc/51/31/12/1055513112.db2.gz RVVJXJLXPOAXHK-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+]1CCC[C@]2(CCC[NH+](CCCc3ccccc3Cl)C2)C1 ZINC001278135421 1055513120 /nfs/dbraw/zinc/51/31/20/1055513120.db2.gz RVVJXJLXPOAXHK-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CCC[N@H+](CCCc3ccccc3Cl)C2)C1 ZINC001278135421 1055513133 /nfs/dbraw/zinc/51/31/33/1055513133.db2.gz RVVJXJLXPOAXHK-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CCC[N@@H+](CCCc3ccccc3Cl)C2)C1 ZINC001278135421 1055513144 /nfs/dbraw/zinc/51/31/44/1055513144.db2.gz RVVJXJLXPOAXHK-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(C(F)(F)F)cc1)[NH+]1CCCCC1 ZINC001620898072 1055523004 /nfs/dbraw/zinc/52/30/04/1055523004.db2.gz GXUCVLDQJQRFSY-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001620910973 1055535892 /nfs/dbraw/zinc/53/58/92/1055535892.db2.gz PCEMCDQOBVPXKF-WMZOPIPTSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001620910973 1055535903 /nfs/dbraw/zinc/53/59/03/1055535903.db2.gz PCEMCDQOBVPXKF-WMZOPIPTSA-N 2 1 314.517 4.311 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)CC1(C)C ZINC001620926646 1055545788 /nfs/dbraw/zinc/54/57/88/1055545788.db2.gz AAEQPPBYVPKUAQ-QYZOEREBSA-N 2 1 300.490 4.175 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CC[C@H]4CCC[C@@H]4C3)cc21 ZINC001237875563 1055547207 /nfs/dbraw/zinc/54/72/07/1055547207.db2.gz APZDLNBREZTJRG-IEBWSBKVSA-N 2 1 310.485 4.310 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CCC[C@](C)(F)C3)cc21 ZINC001237881188 1055547471 /nfs/dbraw/zinc/54/74/71/1055547471.db2.gz NKKGSMJAOKRJPS-IBGZPJMESA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@](C)(F)C3)cc21 ZINC001237881188 1055547485 /nfs/dbraw/zinc/54/74/85/1055547485.db2.gz NKKGSMJAOKRJPS-IBGZPJMESA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CCCC[C@H](F)C3)cc21 ZINC001237881468 1055547919 /nfs/dbraw/zinc/54/79/19/1055547919.db2.gz STMIHVAPMLTCSN-KRWDZBQOSA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCCC[C@H](F)C3)cc21 ZINC001237881468 1055547933 /nfs/dbraw/zinc/54/79/33/1055547933.db2.gz STMIHVAPMLTCSN-KRWDZBQOSA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCCC[C@](C)(F)C3)cc21 ZINC001237880509 1055548103 /nfs/dbraw/zinc/54/81/03/1055548103.db2.gz GQLVWIFUBYZRHJ-FQEVSTJZSA-N 2 1 316.464 4.402 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc3c[nH+]cn32)cc1 ZINC001238118282 1055608848 /nfs/dbraw/zinc/60/88/48/1055608848.db2.gz IVQUBTPOVQSRNT-FQEVSTJZSA-N 2 1 321.424 4.070 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2Cc2cccc3c[nH+]cn32)cc1 ZINC001238118282 1055608854 /nfs/dbraw/zinc/60/88/54/1055608854.db2.gz IVQUBTPOVQSRNT-FQEVSTJZSA-N 2 1 321.424 4.070 20 0 DIADMP CCN1CCC([N@@H+](C)Cc2cc(Cl)c(Cl)cc2C)CC1 ZINC001238261039 1055631698 /nfs/dbraw/zinc/63/16/98/1055631698.db2.gz XAFWYWNMIPUYQH-UHFFFAOYSA-N 2 1 315.288 4.218 20 0 DIADMP CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001168569631 1055652224 /nfs/dbraw/zinc/65/22/24/1055652224.db2.gz HIGKSLWAJZFRHZ-XLIONFOSSA-N 2 1 300.490 4.435 20 0 DIADMP Cc1cc(C[N@H+](C)C2CCN(C)CC2)ccc1Oc1ccccc1 ZINC001238526304 1055681088 /nfs/dbraw/zinc/68/10/88/1055681088.db2.gz OOIGTPOOCORNTM-UHFFFAOYSA-N 2 1 324.468 4.313 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@H+](C)CCC[NH+]1CCCC1 ZINC001238664907 1055714709 /nfs/dbraw/zinc/71/47/09/1055714709.db2.gz SINBBTPDKNIMIE-UHFFFAOYSA-N 2 1 318.505 4.008 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@@H+](C)CCC[NH+]1CCCC1 ZINC001238664907 1055714713 /nfs/dbraw/zinc/71/47/13/1055714713.db2.gz SINBBTPDKNIMIE-UHFFFAOYSA-N 2 1 318.505 4.008 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC2(C1)CCC[N@@H+](CCCCOC)C2 ZINC001278278224 1055746781 /nfs/dbraw/zinc/74/67/81/1055746781.db2.gz NOJORYKICBWAHP-LJQANCHMSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(C)c(C)cc2OC)CC1 ZINC001238771329 1055748444 /nfs/dbraw/zinc/74/84/44/1055748444.db2.gz XAPCPAGXPIZQBB-UHFFFAOYSA-N 2 1 318.505 4.008 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(C)c(C)cc2OC)CC1 ZINC001238771329 1055748455 /nfs/dbraw/zinc/74/84/55/1055748455.db2.gz XAPCPAGXPIZQBB-UHFFFAOYSA-N 2 1 318.505 4.008 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H](c2ccccc2)C2CCCC2)CC1(C)C ZINC001620751330 1055926001 /nfs/dbraw/zinc/92/60/01/1055926001.db2.gz JNNLDKWTAAAHIY-OALUTQOASA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cc(C)c(C[NH+]2CCC([NH+]3CCCCC3)CC2)c(C)c1 ZINC000065041708 1055937582 /nfs/dbraw/zinc/93/75/82/1055937582.db2.gz XGUMWMFOEPGLMQ-UHFFFAOYSA-N 2 1 300.490 4.062 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1CC[NH2+]C[C@H](c1ccccc1)C(C)C ZINC001620785879 1055959923 /nfs/dbraw/zinc/95/99/23/1055959923.db2.gz QLQUQKCFPFPXFU-PMACEKPBSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@H]1CCCC[N@H+]1CC[NH2+]C[C@H](c1ccccc1)C(C)C ZINC001620785879 1055959934 /nfs/dbraw/zinc/95/99/34/1055959934.db2.gz QLQUQKCFPFPXFU-PMACEKPBSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCC[C@H](SC)C2)C1 ZINC001620791722 1055969103 /nfs/dbraw/zinc/96/91/03/1055969103.db2.gz WFKWGGPHXNQKBK-IKGGRYGDSA-N 2 1 312.567 4.151 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCC[C@H](SC)C2)C1 ZINC001620791722 1055969115 /nfs/dbraw/zinc/96/91/15/1055969115.db2.gz WFKWGGPHXNQKBK-IKGGRYGDSA-N 2 1 312.567 4.151 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCCC3CCC3)CC23CC3)cc1 ZINC001621008791 1055976593 /nfs/dbraw/zinc/97/65/93/1055976593.db2.gz HZFDWYZZEAXJLF-FQEVSTJZSA-N 2 1 312.501 4.354 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CCCC3CCC3)CC23CC3)cc1 ZINC001621008791 1055976602 /nfs/dbraw/zinc/97/66/02/1055976602.db2.gz HZFDWYZZEAXJLF-FQEVSTJZSA-N 2 1 312.501 4.354 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)c1 ZINC001620720674 1055984884 /nfs/dbraw/zinc/98/48/84/1055984884.db2.gz RPGKVMDIUCNAHZ-QGZVFWFLSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)c1 ZINC001620720674 1055984896 /nfs/dbraw/zinc/98/48/96/1055984896.db2.gz RPGKVMDIUCNAHZ-QGZVFWFLSA-N 2 1 312.457 4.252 20 0 DIADMP CCC[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621020539 1055986618 /nfs/dbraw/zinc/98/66/18/1055986618.db2.gz NAOGFLKQYHZBLE-FPOVZHCZSA-N 2 1 314.517 4.282 20 0 DIADMP CCC[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621020538 1055986865 /nfs/dbraw/zinc/98/68/65/1055986865.db2.gz NAOGFLKQYHZBLE-CTNGQTDRSA-N 2 1 314.517 4.282 20 0 DIADMP C[NH+](Cc1ccco1)Cc1ccc(C[N@@H+](C)Cc2ccco2)cc1 ZINC000067131509 1055987235 /nfs/dbraw/zinc/98/72/35/1055987235.db2.gz VUODKQYUKBYVGF-UHFFFAOYSA-N 2 1 324.424 4.137 20 0 DIADMP c1c2ccccc2sc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001621020283 1055987208 /nfs/dbraw/zinc/98/72/08/1055987208.db2.gz GUSGYXKRAUHLRS-MRXNPFEDSA-N 2 1 314.498 4.113 20 0 DIADMP CCC[C@H](C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621020541 1055987270 /nfs/dbraw/zinc/98/72/70/1055987270.db2.gz NAOGFLKQYHZBLE-TZIWHRDSSA-N 2 1 314.517 4.282 20 0 DIADMP CCC[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621020540 1055987705 /nfs/dbraw/zinc/98/77/05/1055987705.db2.gz NAOGFLKQYHZBLE-PZJWPPBQSA-N 2 1 314.517 4.282 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001620798695 1055995169 /nfs/dbraw/zinc/99/51/69/1055995169.db2.gz TVPCHKMDKWZXMF-DCXXXQMHSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccccc2C[NH+](C)C)nc1 ZINC001239684065 1056026520 /nfs/dbraw/zinc/02/65/20/1056026520.db2.gz YCXUVVUBHVUFMI-KRWDZBQOSA-N 2 1 323.484 4.185 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1C ZINC001620823200 1056304677 /nfs/dbraw/zinc/30/46/77/1056304677.db2.gz IUWPJCFLGOJQQH-UHFFFAOYSA-N 2 1 306.519 4.252 20 0 DIADMP CC[C@H](C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)[NH+]1CCCC1 ZINC000474473832 1056317647 /nfs/dbraw/zinc/31/76/47/1056317647.db2.gz GNYFNKPVQAFBQQ-SLTXQBBLSA-N 2 1 320.443 4.208 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474460276 1056317766 /nfs/dbraw/zinc/31/77/66/1056317766.db2.gz LXIJUJLGEUVNHR-LMRVLLHPSA-N 2 1 308.432 4.064 20 0 DIADMP C[C@H]([NH2+]CC1([NH+](C)C)CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000474493463 1056318523 /nfs/dbraw/zinc/31/85/23/1056318523.db2.gz TZRWQQHUTWSBSC-NFOMZHRRSA-N 2 1 320.443 4.208 20 0 DIADMP CC[N@H+](CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)C(C)C ZINC000474600066 1056329715 /nfs/dbraw/zinc/32/97/15/1056329715.db2.gz MFQUBHVDKWDPPE-WLYUNCDWSA-N 2 1 308.432 4.064 20 0 DIADMP CC[N@@H+](CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)C(C)C ZINC000474600066 1056329732 /nfs/dbraw/zinc/32/97/32/1056329732.db2.gz MFQUBHVDKWDPPE-WLYUNCDWSA-N 2 1 308.432 4.064 20 0 DIADMP CCOC(=[NH2+])c1cccc(C2=CCC[N@H+](Cc3ccccc3)C2)c1 ZINC001240386389 1056466968 /nfs/dbraw/zinc/46/69/68/1056466968.db2.gz ATQXXRCGZFARAJ-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP CCOC(=[NH2+])c1cccc(C2=CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC001240386389 1056466975 /nfs/dbraw/zinc/46/69/75/1056466975.db2.gz ATQXXRCGZFARAJ-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310019909 1056532288 /nfs/dbraw/zinc/53/22/88/1056532288.db2.gz QTIVNJQDACGGKF-SFHVURJKSA-N 2 1 314.498 4.058 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC001615540411 1056534269 /nfs/dbraw/zinc/53/42/69/1056534269.db2.gz UVMUVHCEPZQGCO-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615540411 1056534286 /nfs/dbraw/zinc/53/42/86/1056534286.db2.gz UVMUVHCEPZQGCO-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615540411 1056534295 /nfs/dbraw/zinc/53/42/95/1056534295.db2.gz UVMUVHCEPZQGCO-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(C)c1C ZINC001615595967 1056542067 /nfs/dbraw/zinc/54/20/67/1056542067.db2.gz QMGPPICBWHRTCI-FQEVSTJZSA-N 2 1 314.517 4.146 20 0 DIADMP C=C/C=C/CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615846787 1056584184 /nfs/dbraw/zinc/58/41/84/1056584184.db2.gz ONQAOYCLKHFOIZ-ZAOFJCOUSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C/CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615846787 1056584193 /nfs/dbraw/zinc/58/41/93/1056584193.db2.gz ONQAOYCLKHFOIZ-ZAOFJCOUSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C/CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615846787 1056584211 /nfs/dbraw/zinc/58/42/11/1056584211.db2.gz ONQAOYCLKHFOIZ-ZAOFJCOUSA-N 2 1 310.485 4.105 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC001616622539 1056689062 /nfs/dbraw/zinc/68/90/62/1056689062.db2.gz JEPRWJVHASVXAA-VQIMIIECSA-N 2 1 304.453 4.131 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC001616622538 1056689436 /nfs/dbraw/zinc/68/94/36/1056689436.db2.gz JEPRWJVHASVXAA-QFBILLFUSA-N 2 1 304.453 4.131 20 0 DIADMP CC(C)COc1ccc(C(C)(C)[NH2+]CC[C@H]2CCC[N@H+]2C)cc1 ZINC001616787027 1056717047 /nfs/dbraw/zinc/71/70/47/1056717047.db2.gz SCAAFTYJQAMDDB-GOSISDBHSA-N 2 1 318.505 4.030 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)c2ccccc21 ZINC000672806860 1056777860 /nfs/dbraw/zinc/77/78/60/1056777860.db2.gz AYIGFGPXILJGBP-XHSDSOJGSA-N 2 1 312.432 4.256 20 0 DIADMP Cc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c(C)c1 ZINC000065976688 1056817791 /nfs/dbraw/zinc/81/77/91/1056817791.db2.gz VGLUYPKZYGRZDN-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(CC[NH+]([C@@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868195 1056892388 /nfs/dbraw/zinc/89/23/88/1056892388.db2.gz MMWCDZVJTWYFNO-FGZHOGPDSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+]([C@@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868195 1056892391 /nfs/dbraw/zinc/89/23/91/1056892391.db2.gz MMWCDZVJTWYFNO-FGZHOGPDSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@H+]([C@@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868195 1056892399 /nfs/dbraw/zinc/89/23/99/1056892399.db2.gz MMWCDZVJTWYFNO-FGZHOGPDSA-N 2 1 324.512 4.473 20 0 DIADMP c1csc(-c2ccc(CN[C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000657314420 1056932060 /nfs/dbraw/zinc/93/20/60/1056932060.db2.gz VIWKTSWWBVRQPF-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)c1 ZINC000657314420 1056932073 /nfs/dbraw/zinc/93/20/73/1056932073.db2.gz VIWKTSWWBVRQPF-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000657314420 1056932085 /nfs/dbraw/zinc/93/20/85/1056932085.db2.gz VIWKTSWWBVRQPF-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000360028639 1057018304 /nfs/dbraw/zinc/01/83/04/1057018304.db2.gz GSTQAXMKGGWZJO-IOASZLSFSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000360028639 1057018310 /nfs/dbraw/zinc/01/83/10/1057018310.db2.gz GSTQAXMKGGWZJO-IOASZLSFSA-N 2 1 322.905 4.093 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CCSc2c(Cl)cccc21)C[NH+]1CCCC1 ZINC000360440983 1057023434 /nfs/dbraw/zinc/02/34/34/1057023434.db2.gz DOTBTBTWEHDDNR-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000483708609 1057137709 /nfs/dbraw/zinc/13/77/09/1057137709.db2.gz DDYCCZIEQCDPAF-DUXKGJEZSA-N 2 1 314.517 4.250 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000483708609 1057137711 /nfs/dbraw/zinc/13/77/11/1057137711.db2.gz DDYCCZIEQCDPAF-DUXKGJEZSA-N 2 1 314.517 4.250 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000675777249 1057412410 /nfs/dbraw/zinc/41/24/10/1057412410.db2.gz PPVFQQPBTOYTMR-FGSXEWAUSA-N 2 1 322.496 4.357 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000675777249 1057412413 /nfs/dbraw/zinc/41/24/13/1057412413.db2.gz PPVFQQPBTOYTMR-FGSXEWAUSA-N 2 1 322.496 4.357 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccncc2)cc1 ZINC000675926902 1057432855 /nfs/dbraw/zinc/43/28/55/1057432855.db2.gz IUBNEFOPPJGJQM-HZPDHXFCSA-N 2 1 320.440 4.030 20 0 DIADMP C[C@@H](CC[N@H+]1CCCC(F)(F)CC1)[NH+]1CCCC(F)(F)CC1 ZINC000625769173 1057512614 /nfs/dbraw/zinc/51/26/14/1057512614.db2.gz DHYLBIUMAWQKPJ-AWEZNQCLSA-N 2 1 324.406 4.007 20 0 DIADMP C[C@@H](CC[NH+]1CCCC(F)(F)CC1)[N@@H+]1CCCC(F)(F)CC1 ZINC000625769173 1057512619 /nfs/dbraw/zinc/51/26/19/1057512619.db2.gz DHYLBIUMAWQKPJ-AWEZNQCLSA-N 2 1 324.406 4.007 20 0 DIADMP C[C@@H](CC[NH+]1CCCC(F)(F)CC1)[N@H+]1CCCC(F)(F)CC1 ZINC000625769173 1057512627 /nfs/dbraw/zinc/51/26/27/1057512627.db2.gz DHYLBIUMAWQKPJ-AWEZNQCLSA-N 2 1 324.406 4.007 20 0 DIADMP CC[C@H](CC(F)F)C[N@@H+](CC)Cc1ccc(C[NH+](C)C)cc1 ZINC000626063560 1057555016 /nfs/dbraw/zinc/55/50/16/1057555016.db2.gz IHHCLBCPNKXSNS-OAHLLOKOSA-N 2 1 312.448 4.252 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000161626839 1057598209 /nfs/dbraw/zinc/59/82/09/1057598209.db2.gz GUSKSCKZQXYCHI-RYQLBKOJSA-N 2 1 318.530 4.465 20 0 DIADMP CC[NH+](CC)Cc1ccccc1-c1cc(N2CCCC2)cc[nH+]1 ZINC001243340735 1057652063 /nfs/dbraw/zinc/65/20/63/1057652063.db2.gz WVYKMXHTLZZAMK-UHFFFAOYSA-N 2 1 309.457 4.191 20 0 DIADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccoc2)C1 ZINC000727466745 1057654683 /nfs/dbraw/zinc/65/46/83/1057654683.db2.gz FAOGZKBNABYTRS-IAGOWNOFSA-N 2 1 312.457 4.047 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)C(C)(C)C ZINC000166796125 1057676433 /nfs/dbraw/zinc/67/64/33/1057676433.db2.gz OOVLEOOBXURJPB-SCTDSRPQSA-N 2 1 300.490 4.299 20 0 DIADMP C1=CC[C@H](C[N@H+]2CCC[C@@]3(CC[NH+](C4CCCC4)C3)C2)CC1 ZINC001278386334 1058023227 /nfs/dbraw/zinc/02/32/27/1058023227.db2.gz PBXCJVYODMPJPZ-AZUAARDMSA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@H](C[NH+]2CCC[C@@]3(CC[N@@H+](C4CCCC4)C3)C2)CC1 ZINC001278386334 1058023232 /nfs/dbraw/zinc/02/32/32/1058023232.db2.gz PBXCJVYODMPJPZ-AZUAARDMSA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@H](C[NH+]2CCC[C@@]3(CC[N@H+](C4CCCC4)C3)C2)CC1 ZINC001278386334 1058023237 /nfs/dbraw/zinc/02/32/37/1058023237.db2.gz PBXCJVYODMPJPZ-AZUAARDMSA-N 2 1 302.506 4.073 20 0 DIADMP C[NH2+]Cc1cccc(-c2ccc3c(c2)[nH]c2cc[nH+]cc23)c1F ZINC001244863465 1058059897 /nfs/dbraw/zinc/05/98/97/1058059897.db2.gz WSJICBUNJLVCMA-UHFFFAOYSA-N 2 1 305.356 4.242 20 0 DIADMP C[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc([C@H]3CCC[NH2+]3)cc2)nc1 ZINC001245349455 1058149524 /nfs/dbraw/zinc/14/95/24/1058149524.db2.gz MNZULLFNIHIBAP-TZIWHRDSSA-N 2 1 321.468 4.330 20 0 DIADMP C[N@H+]1CC[C@H](c2ccc(-c3ccc([C@@H]4CCC[NH2+]4)cc3)cc2)C1 ZINC001245355658 1058151014 /nfs/dbraw/zinc/15/10/14/1058151014.db2.gz JPOWGFSYHNKZCH-SFTDATJTSA-N 2 1 306.453 4.197 20 0 DIADMP C[N@H+]1CC[C@@H](c2ccc(-c3ccc(C4CC[NH2+]CC4)cc3)cc2)C1 ZINC001245525410 1058200823 /nfs/dbraw/zinc/20/08/23/1058200823.db2.gz DOOJBHDJAGUXOA-JOCHJYFZSA-N 2 1 320.480 4.240 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001548928493 1058276042 /nfs/dbraw/zinc/27/60/42/1058276042.db2.gz NMWGINZDYYBLST-OPWVIFHQSA-N 2 1 324.443 4.155 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001548928494 1058276968 /nfs/dbraw/zinc/27/69/68/1058276968.db2.gz NMWGINZDYYBLST-WDQDQHCCSA-N 2 1 324.443 4.155 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@H](c2[nH+]ccn2C)C1)c1cccc(C2CC2)c1 ZINC001550505032 1058341040 /nfs/dbraw/zinc/34/10/40/1058341040.db2.gz GUYVSUQDWSOPIF-ZOCIIQOWSA-N 2 1 309.457 4.284 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[C@@H]2c2ccccc2)C1 ZINC001550505170 1058342048 /nfs/dbraw/zinc/34/20/48/1058342048.db2.gz VBFSLLWUHCLDNI-FUMNGEBKSA-N 2 1 323.484 4.230 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc(C(C)(C)[NH3+])cc2)nc1 ZINC001245907366 1058611094 /nfs/dbraw/zinc/61/10/94/1058611094.db2.gz SUOCGXHGAMKZMQ-MRXNPFEDSA-N 2 1 323.484 4.317 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246063191 1058659426 /nfs/dbraw/zinc/65/94/26/1058659426.db2.gz AVEQQSJIVRYDMA-QVSURHGTSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC001246065919 1058659926 /nfs/dbraw/zinc/65/99/26/1058659926.db2.gz OZERWMBDQRERMD-MJGOQNOKSA-N 2 1 304.453 4.240 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C2CCC(C)CC2)CC[NH2+]1 ZINC001246066471 1058659984 /nfs/dbraw/zinc/65/99/84/1058659984.db2.gz QYOLWRVKKXHAFU-OLLPYKTGSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC001246065917 1058660049 /nfs/dbraw/zinc/66/00/49/1058660049.db2.gz OZERWMBDQRERMD-HKUYNNGSSA-N 2 1 304.453 4.240 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076571 1058666220 /nfs/dbraw/zinc/66/62/20/1058666220.db2.gz PBXVPVGHLQFXGB-HZPDHXFCSA-N 2 1 306.881 4.085 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246076325 1058667654 /nfs/dbraw/zinc/66/76/54/1058667654.db2.gz NIKANTKHPDHPJV-NORZTCDRSA-N 2 1 315.288 4.421 20 0 DIADMP CCCCCC[N@H+]1Cc2ccccc2C2(CC[NH+](C)CC2)C1 ZINC001278432611 1058693869 /nfs/dbraw/zinc/69/38/69/1058693869.db2.gz AAEZCPMPXSCQPE-UHFFFAOYSA-N 2 1 300.490 4.046 20 0 DIADMP F[C@]1(C[NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CCC[NH2+]C1 ZINC001246172562 1058717471 /nfs/dbraw/zinc/71/74/71/1058717471.db2.gz IABCCPGFKBGOFN-VMWRSERWSA-N 2 1 324.871 4.048 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@H]1CCCC[NH2+]1 ZINC001246174866 1058719179 /nfs/dbraw/zinc/71/91/79/1058719179.db2.gz FOLAFDYFDDTCBJ-GXTWGEPZSA-N 2 1 315.288 4.046 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC001246177626 1058723224 /nfs/dbraw/zinc/72/32/24/1058723224.db2.gz CJGJSAXMAKZCSL-PIYBKPHJSA-N 2 1 324.443 4.230 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@]1(C)CCC[NH2+]C1 ZINC001246191671 1058735522 /nfs/dbraw/zinc/73/55/22/1058735522.db2.gz WXJFMIIJJPRJFE-WBMJQRKESA-N 2 1 315.288 4.046 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)c(Cl)c2)CC[NH2+]1 ZINC001246211508 1058742935 /nfs/dbraw/zinc/74/29/35/1058742935.db2.gz KFPIFVQHCVLYSF-VHDGCEQUSA-N 2 1 312.860 4.441 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+]C[C@]1(C)CC[NH2+]CC1(F)F ZINC001246221901 1058746627 /nfs/dbraw/zinc/74/66/27/1058746627.db2.gz PEOQSUZWUADONS-ROUUACIJSA-N 2 1 324.459 4.012 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C[C@]1(C)CC[NH2+]CC1(F)F ZINC001246223381 1058747526 /nfs/dbraw/zinc/74/75/26/1058747526.db2.gz VPARPBNKOAYOOZ-ROUUACIJSA-N 2 1 324.459 4.012 20 0 DIADMP C[C@@]1(C[NH2+][C@@H]2CCCC3(CCCCC3)C2)CC[NH2+]CC1(F)F ZINC001246224096 1058749492 /nfs/dbraw/zinc/74/94/92/1058749492.db2.gz ZDFOTVAFSPADQP-CVEARBPZSA-N 2 1 314.464 4.104 20 0 DIADMP C=Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)cc1 ZINC001246233814 1058756099 /nfs/dbraw/zinc/75/60/99/1058756099.db2.gz FFSKCOSSVKZZET-CTNGQTDRSA-N 2 1 324.443 4.360 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246240295 1058759889 /nfs/dbraw/zinc/75/98/89/1058759889.db2.gz UHMZWXLYDRMCID-HOTGVXAUSA-N 2 1 306.881 4.085 20 0 DIADMP Cc1ccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246237812 1058760214 /nfs/dbraw/zinc/76/02/14/1058760214.db2.gz IINCDEZCLOUXEB-PMACEKPBSA-N 2 1 308.469 4.313 20 0 DIADMP CCCC[C@H]1CC[C@H](C2CCC([NH2+]C[C@@H]([NH3+])COC)CC2)CC1 ZINC001246242071 1058765805 /nfs/dbraw/zinc/76/58/05/1058765805.db2.gz WILKFASOHPPPNL-ZPTVKNSZSA-N 2 1 324.553 4.105 20 0 DIADMP CCCOc1cccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246243812 1058765840 /nfs/dbraw/zinc/76/58/40/1058765840.db2.gz NABBEBHYTGMYED-TZIWHRDSSA-N 2 1 324.468 4.058 20 0 DIADMP C[C@@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246251845 1058771065 /nfs/dbraw/zinc/77/10/65/1058771065.db2.gz FLIRLJVEVVEYRO-GMTAPVOTSA-N 2 1 301.261 4.173 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246255282 1058774091 /nfs/dbraw/zinc/77/40/91/1058774091.db2.gz VNJHYQWKUYLWIE-HZMBPMFUSA-N 2 1 301.261 4.175 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)c(Cl)c1 ZINC001246265740 1058778911 /nfs/dbraw/zinc/77/89/11/1058778911.db2.gz QOZLXSXTWHNSLS-INIZCTEOSA-N 2 1 306.881 4.193 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246266184 1058781252 /nfs/dbraw/zinc/78/12/52/1058781252.db2.gz FYVIRSCYLRAPJV-CHWSQXEVSA-N 2 1 315.288 4.349 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001246266714 1058782153 /nfs/dbraw/zinc/78/21/53/1058782153.db2.gz QYOLWRVKKXHAFU-VVHMCBODSA-N 2 1 304.453 4.096 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@@H](CC)c2cc(F)ccc2F)CC[NH2+]1 ZINC001246272284 1058788173 /nfs/dbraw/zinc/78/81/73/1058788173.db2.gz YGHNPOQEYMMTLC-MPGHIAIKSA-N 2 1 310.432 4.316 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+]C(C)(C)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246281732 1058798645 /nfs/dbraw/zinc/79/86/45/1058798645.db2.gz UYHCDUPWJONXLA-IAGOWNOFSA-N 2 1 310.432 4.100 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246282270 1058799987 /nfs/dbraw/zinc/79/99/87/1058799987.db2.gz UUVBSJCUIIGJIJ-ZYSHUDEJSA-N 2 1 304.453 4.033 20 0 DIADMP CCOc1cccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246294708 1058807127 /nfs/dbraw/zinc/80/71/27/1058807127.db2.gz HOMRITRQNVHFAO-BSIFCXSSSA-N 2 1 324.468 4.229 20 0 DIADMP Cc1cc(C)cc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246297865 1058810835 /nfs/dbraw/zinc/81/08/35/1058810835.db2.gz QGRMPUHLNALICQ-JRGCBEDISA-N 2 1 308.469 4.447 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246305242 1058815432 /nfs/dbraw/zinc/81/54/32/1058815432.db2.gz HKHNBVQWUYCDKB-FRQCXROJSA-N 2 1 304.453 4.177 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](CC)c2ccccc2OC)CC[NH2+]1 ZINC001246312227 1058820977 /nfs/dbraw/zinc/82/09/77/1058820977.db2.gz CCJFRWXVGOVGHM-NUJGCVRESA-N 2 1 304.478 4.047 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(OC)cc1 ZINC001246316480 1058826120 /nfs/dbraw/zinc/82/61/20/1058826120.db2.gz ZMCDAYBBKHGDNR-HMXCVIKNSA-N 2 1 324.468 4.229 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccc(F)cc1F ZINC001246317067 1058830757 /nfs/dbraw/zinc/83/07/57/1058830757.db2.gz KWTTXMAFZYCFPM-CRAIPNDOSA-N 2 1 322.443 4.460 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](CC(C)C)c2ccccn2)C[C@H](CC)[NH2+]1 ZINC001246325067 1058833491 /nfs/dbraw/zinc/83/34/91/1058833491.db2.gz IAEAOBJYLPQWSZ-FAJBIJEISA-N 2 1 303.494 4.068 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1CCC[NH2+][C@@H]1C ZINC001246324528 1058835328 /nfs/dbraw/zinc/83/53/28/1058835328.db2.gz HMVHYIVWHSVUGD-NJNPRVFISA-N 2 1 322.496 4.327 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+][C@H]1C[NH2+]CCC1(C)C ZINC001246324792 1058835983 /nfs/dbraw/zinc/83/59/83/1058835983.db2.gz GKLKUECVLRALBR-HOCLYGCPSA-N 2 1 324.534 4.048 20 0 DIADMP FC(F)(F)[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246340801 1058848847 /nfs/dbraw/zinc/84/88/47/1058848847.db2.gz LTPOWMVAMJCJNZ-CABCVRRESA-N 2 1 318.427 4.010 20 0 DIADMP CCC(C)(C)C1CCC([NH2+][C@H]2CC[NH2+]C[C@H]2C(F)(F)F)CC1 ZINC001246341890 1058852735 /nfs/dbraw/zinc/85/27/35/1058852735.db2.gz QEOKKKLSUCMVQJ-CVSAEHQPSA-N 2 1 320.443 4.111 20 0 DIADMP CCCCCC[C@H](CCC)[NH2+][C@@H]1CC[NH2+]C[C@H]1C(F)(F)F ZINC001246344432 1058857160 /nfs/dbraw/zinc/85/71/60/1058857160.db2.gz ZCFSDDXEBBUATB-RRFJBIMHSA-N 2 1 308.432 4.256 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246345104 1058858474 /nfs/dbraw/zinc/85/84/74/1058858474.db2.gz UJMQSOCQNGVURP-YADHBBJMSA-N 2 1 322.496 4.435 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)c(F)c1F ZINC001246350939 1058860910 /nfs/dbraw/zinc/86/09/10/1058860910.db2.gz OIPCDEGLXHZIKD-GJZGRUSLSA-N 2 1 322.443 4.379 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1(C[NH3+])CCC1 ZINC001246357931 1058868519 /nfs/dbraw/zinc/86/85/19/1058868519.db2.gz WHLCQBWZEABYQH-QGZVFWFLSA-N 2 1 308.469 4.068 20 0 DIADMP COc1cccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246363686 1058869092 /nfs/dbraw/zinc/86/90/92/1058869092.db2.gz SNOJEIMCFPOXFR-UYAOXDASSA-N 2 1 324.468 4.013 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@H]3CCCNc4ccccc43)CC[NH2+]2)cc1 ZINC001246358396 1058870964 /nfs/dbraw/zinc/87/09/64/1058870964.db2.gz PBASCIGZQHQVLF-QMMLZNLJSA-N 2 1 321.468 4.016 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C1 ZINC001246379619 1058883294 /nfs/dbraw/zinc/88/32/94/1058883294.db2.gz ZRAJXNCKODDBHV-GJZGRUSLSA-N 2 1 306.881 4.087 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C1 ZINC001246379620 1058885510 /nfs/dbraw/zinc/88/55/10/1058885510.db2.gz ZRAJXNCKODDBHV-HUUCEWRRSA-N 2 1 306.881 4.087 20 0 DIADMP Cc1cccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246384135 1058888966 /nfs/dbraw/zinc/88/89/66/1058888966.db2.gz ADQOOGKGRYHYAV-WOJBJXKFSA-N 2 1 308.469 4.313 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)CC1CCC1 ZINC001246387505 1058894184 /nfs/dbraw/zinc/89/41/84/1058894184.db2.gz GDLPLHJXQSDEIG-RBUKOAKNSA-N 2 1 300.490 4.286 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](c2ccncc2Cl)C2CC2)CC[NH2+]1 ZINC001246397862 1058900211 /nfs/dbraw/zinc/90/02/11/1058900211.db2.gz UWZZBBCTEJLKEU-IIDMSEBBSA-N 2 1 321.896 4.087 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)CC[NH2+]1 ZINC001246403481 1058903918 /nfs/dbraw/zinc/90/39/18/1058903918.db2.gz MUHBWKIHDRHXQW-HNBVOPMISA-N 3 1 323.569 4.058 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246404075 1058906658 /nfs/dbraw/zinc/90/66/58/1058906658.db2.gz LYTRUEUXMJWGLN-MAUKXSAKSA-N 2 1 304.453 4.177 20 0 DIADMP C[C@@H]1CC([NH2+][C@@H](CC2CCC2)c2ccccc2F)C[C@@H](C)[NH2+]1 ZINC001246410236 1058909849 /nfs/dbraw/zinc/90/98/49/1058909849.db2.gz ZJQGKXUMWOXSCZ-LPMFXHHGSA-N 2 1 304.453 4.176 20 0 DIADMP Fc1ccccc1[C@@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246408671 1058911841 /nfs/dbraw/zinc/91/18/41/1058911841.db2.gz VSBUOPSCWFAENM-VQIMIIECSA-N 2 1 316.464 4.321 20 0 DIADMP Cc1ccc(C)c([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246416639 1058918943 /nfs/dbraw/zinc/91/89/43/1058918943.db2.gz SKJKPBBLUXAZFA-CUWPLCDZSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246433219 1058928356 /nfs/dbraw/zinc/92/83/56/1058928356.db2.gz QZFLZSSPEXQICG-HKUYNNGSSA-N 2 1 316.464 4.097 20 0 DIADMP CCCCCC[C@H](C)[NH2+]C1(c2ccccc2F)CC[NH2+]CC1 ZINC001246439320 1058933901 /nfs/dbraw/zinc/93/39/01/1058933901.db2.gz XJNLUHWBMKDFPV-INIZCTEOSA-N 2 1 306.469 4.353 20 0 DIADMP Cc1ccccc1C(C)(C)[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246440508 1058934351 /nfs/dbraw/zinc/93/43/51/1058934351.db2.gz VFUGNOWZQKLZRL-QUCCMNQESA-N 2 1 308.469 4.313 20 0 DIADMP C[C@H]1[C@H]2C[C@@H](C[C@H]1[NH2+][C@@H]1CC[NH2+][C@H](c3ccccc3)C1)C2(C)C ZINC001246443632 1058935129 /nfs/dbraw/zinc/93/51/29/1058935129.db2.gz NUGTXWOEZSRGAR-BWAKRKKZSA-N 2 1 312.501 4.140 20 0 DIADMP Cc1ccccc1C1([NH2+][C@H]2CCCC[NH2+]C2)CCC(F)(F)CC1 ZINC001246454146 1058940919 /nfs/dbraw/zinc/94/09/19/1058940919.db2.gz DCXTUWCAPOPJMM-INIZCTEOSA-N 2 1 322.443 4.131 20 0 DIADMP CC[C@]1([NH2+][C@H](C)CCc2ccc(Cl)c(Cl)c2)CC[NH2+]C1 ZINC001246459785 1058946214 /nfs/dbraw/zinc/94/62/14/1058946214.db2.gz GQVWTVFUEJAGMH-WBMJQRKESA-N 2 1 315.288 4.046 20 0 DIADMP Cc1ccccc1C1([NH2+][C@@H]2CC[C@@H](C)[NH2+]C2)CCC(F)(F)CC1 ZINC001246462472 1058949799 /nfs/dbraw/zinc/94/97/99/1058949799.db2.gz ZHVDFDTVOIVPTP-HZPDHXFCSA-N 2 1 322.443 4.130 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](c2ccccc2OC)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246466856 1058951687 /nfs/dbraw/zinc/95/16/87/1058951687.db2.gz BKXLJRAUBUNSLO-QINHECLXSA-N 2 1 316.489 4.045 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@H](c2ccccc2OC)C2CC2)CC[NH2+]1 ZINC001246469828 1058956642 /nfs/dbraw/zinc/95/66/42/1058956642.db2.gz TUAFXRLBALPBJS-ZWOKBUDYSA-N 2 1 316.489 4.047 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1C ZINC001246469367 1058957307 /nfs/dbraw/zinc/95/73/07/1058957307.db2.gz CRZZYNGGJCWJLW-LMNJBCLMSA-N 2 1 308.469 4.447 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(Cl)ccn1 ZINC001246495350 1058969089 /nfs/dbraw/zinc/96/90/89/1058969089.db2.gz OPVVVIFGRDEPRY-HNNXBMFYSA-N 2 1 321.896 4.015 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H](C)CSc1ccc(F)cc1 ZINC001246495390 1058971792 /nfs/dbraw/zinc/97/17/92/1058971792.db2.gz KEEUKNIOWRCPRU-CQSZACIVSA-N 2 1 312.498 4.194 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]C(c2cccs2)c2cccs2)CC[NH2+]1 ZINC001246507459 1058976625 /nfs/dbraw/zinc/97/66/25/1058976625.db2.gz BOWIWXCRALEOIT-KGLIPLIRSA-N 2 1 320.527 4.265 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H]2CCOc3ccc(Cl)cc32)CC[NH2+]1 ZINC001246508253 1058977842 /nfs/dbraw/zinc/97/78/42/1058977842.db2.gz BQOPBQOOJGBVFZ-BFYDXBDKSA-N 2 1 322.880 4.064 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]C(c2cccs2)c2cccs2)CC[NH2+]1 ZINC001246507461 1058979403 /nfs/dbraw/zinc/97/94/03/1058979403.db2.gz BOWIWXCRALEOIT-UONOGXRCSA-N 2 1 320.527 4.265 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2[C@H](C)CCC[C@H]2C)CC[NH2+]1 ZINC001246518563 1058984343 /nfs/dbraw/zinc/98/43/43/1058984343.db2.gz HGFMNOUAHQWNQN-LFEHRJTNSA-N 2 1 304.453 4.190 20 0 DIADMP CCC[N@H+]([C@H](C)CC)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532117 1058987901 /nfs/dbraw/zinc/98/79/01/1058987901.db2.gz XRENZFGLFJYJID-AYBZRNKSSA-N 2 1 306.469 4.438 20 0 DIADMP CCC[N@@H+]([C@H](C)CC)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532117 1058987921 /nfs/dbraw/zinc/98/79/21/1058987921.db2.gz XRENZFGLFJYJID-AYBZRNKSSA-N 2 1 306.469 4.438 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@@H](C(C)(C)C)C2)c1 ZINC001246536449 1058988999 /nfs/dbraw/zinc/98/89/99/1058988999.db2.gz FNWJYVWOHAYTLA-GBESFXJTSA-N 2 1 300.490 4.299 20 0 DIADMP CC[N@@H+](C1CCCCC1)[C@@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246533146 1058989324 /nfs/dbraw/zinc/98/93/24/1058989324.db2.gz TTYWYYFIABNKJG-AZUAARDMSA-N 2 1 300.490 4.004 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534845 1058990152 /nfs/dbraw/zinc/99/01/52/1058990152.db2.gz ZPKXMRJJRHDMDN-HKUYNNGSSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534845 1058990173 /nfs/dbraw/zinc/99/01/73/1058990173.db2.gz ZPKXMRJJRHDMDN-HKUYNNGSSA-N 2 1 304.453 4.192 20 0 DIADMP CCCCCC(CCCCC)[N@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246555884 1058997321 /nfs/dbraw/zinc/99/73/21/1058997321.db2.gz IJXQGZTVQRKOBT-HNNXBMFYSA-N 2 1 304.469 4.432 20 0 DIADMP C[C@@H]1C[N@@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546490 1058997513 /nfs/dbraw/zinc/99/75/13/1058997513.db2.gz KKNPDDGZTFHTFF-OZOXKJRCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546490 1058997535 /nfs/dbraw/zinc/99/75/35/1058997535.db2.gz KKNPDDGZTFHTFF-OZOXKJRCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CCN[C@@H](c2ccccc2)C1 ZINC001246551537 1059001059 /nfs/dbraw/zinc/00/10/59/1059001059.db2.gz ZOLGGBYPYHCFBW-LKUPVBHCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246551537 1059001087 /nfs/dbraw/zinc/00/10/87/1059001087.db2.gz ZOLGGBYPYHCFBW-LKUPVBHCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246551537 1059001110 /nfs/dbraw/zinc/00/11/10/1059001110.db2.gz ZOLGGBYPYHCFBW-LKUPVBHCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@@H](C[NH3+])[C@H]1C ZINC001246565170 1059003116 /nfs/dbraw/zinc/00/31/16/1059003116.db2.gz OUCUGYXWZIXEDT-OAGGEKHMSA-N 2 1 324.534 4.129 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246562262 1059003416 /nfs/dbraw/zinc/00/34/16/1059003416.db2.gz XKLRZRPIHAPGBH-RBUKOAKNSA-N 2 1 302.506 4.311 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@H]1CC[NH2+][C@H](c3ccc(F)cc3C)C1)C2 ZINC001246568876 1059006735 /nfs/dbraw/zinc/00/67/35/1059006735.db2.gz SLZUPTNMQGKYQT-RXVVDRJESA-N 2 1 324.443 4.251 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@H]1CC[NH2+][C@H](c3ccc(F)cc3C)C1)C2 ZINC001246568876 1059006755 /nfs/dbraw/zinc/00/67/55/1059006755.db2.gz SLZUPTNMQGKYQT-RXVVDRJESA-N 2 1 324.443 4.251 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246564511 1059006975 /nfs/dbraw/zinc/00/69/75/1059006975.db2.gz XOIGMZCMAXRNQW-HKBOAZHASA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246564511 1059006998 /nfs/dbraw/zinc/00/69/98/1059006998.db2.gz XOIGMZCMAXRNQW-HKBOAZHASA-N 2 1 324.443 4.456 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246582561 1059010559 /nfs/dbraw/zinc/01/05/59/1059010559.db2.gz NTSIWTNZXNFYOT-CVEARBPZSA-N 2 1 324.534 4.131 20 0 DIADMP CCC1CC[NH+]([C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CC1 ZINC001246587016 1059010855 /nfs/dbraw/zinc/01/08/55/1059010855.db2.gz DGRPJCXRMGSVBQ-HKUYNNGSSA-N 2 1 304.453 4.049 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001246581773 1059013169 /nfs/dbraw/zinc/01/31/69/1059013169.db2.gz AMEAVHPKDGXVOO-XLIONFOSSA-N 2 1 302.506 4.033 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001246585007 1059013349 /nfs/dbraw/zinc/01/33/49/1059013349.db2.gz NQDUFWSLGKYUIP-VQTJNVASSA-N 2 1 302.506 4.239 20 0 DIADMP CC(C)[N@@H+]([C@H]1CCc2c(Cl)cccc2C1)[C@H]1CCC[NH2+]CC1 ZINC001246593430 1059014896 /nfs/dbraw/zinc/01/48/96/1059014896.db2.gz MZJMOLHYMAEEOU-IRXDYDNUSA-N 2 1 320.908 4.050 20 0 DIADMP c1ccc(C[N@@H+](C2CCCCC2)[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246596939 1059015940 /nfs/dbraw/zinc/01/59/40/1059015940.db2.gz KQIANUVEEINWRI-CEQLMSFQSA-N 2 1 312.501 4.494 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1ccc(Cl)cc1)[C@H]1CCC[NH2+]CC1 ZINC001246590683 1059017506 /nfs/dbraw/zinc/01/75/06/1059017506.db2.gz HQXIBRLCHGPFNJ-QAPCUYQASA-N 2 1 308.897 4.124 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC[NH2+]1 ZINC001246593171 1059018082 /nfs/dbraw/zinc/01/80/82/1059018082.db2.gz ANBSTMMBMDYRJV-UYAOXDASSA-N 2 1 300.490 4.352 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1ccccc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001246589757 1059018897 /nfs/dbraw/zinc/01/88/97/1059018897.db2.gz FNRUSXPBHTYBJB-NVXWUHKLSA-N 2 1 308.897 4.124 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001246589250 1059020350 /nfs/dbraw/zinc/02/03/50/1059020350.db2.gz DQPGACQIQSFIGA-QZTJIDSGSA-N 2 1 320.546 4.328 20 0 DIADMP C1C[N@@H+]([C@H]2CCCC3(CCCCC3)C2)[C@]2(C1)CCC[NH2+]CC2 ZINC001246608046 1059021105 /nfs/dbraw/zinc/02/11/05/1059021105.db2.gz SGMKFENOMNTYLM-ICSRJNTNSA-N 2 1 304.522 4.488 20 0 DIADMP C1C[N@@H+]([C@H]2CCCC3(CCCCC3)C2)[C@@]2(C1)CCC[NH2+]CC2 ZINC001246608042 1059021318 /nfs/dbraw/zinc/02/13/18/1059021318.db2.gz SGMKFENOMNTYLM-AZUAARDMSA-N 2 1 304.522 4.488 20 0 DIADMP CC(C)[N@@H+]([C@H]1CCc2cccc(Cl)c2C1)[C@H]1CCC[NH2+]CC1 ZINC001246597944 1059021634 /nfs/dbraw/zinc/02/16/34/1059021634.db2.gz YYHJKUCYZAUMNO-IRXDYDNUSA-N 2 1 320.908 4.050 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001246597048 1059022285 /nfs/dbraw/zinc/02/22/85/1059022285.db2.gz WFCUOSFHZJNJOV-SFTDATJTSA-N 2 1 316.533 4.496 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246604624 1059022851 /nfs/dbraw/zinc/02/28/51/1059022851.db2.gz HPWOWKPGKYWMBV-NHCUHLMSSA-N 2 1 314.517 4.396 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246605469 1059024554 /nfs/dbraw/zinc/02/45/54/1059024554.db2.gz JWBMRATZCLOYRN-RTWAWAEBSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609643 1059024988 /nfs/dbraw/zinc/02/49/88/1059024988.db2.gz MARWMWJICIOYPU-YOEHRIQHSA-N 2 1 324.921 4.039 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609643 1059025009 /nfs/dbraw/zinc/02/50/09/1059025009.db2.gz MARWMWJICIOYPU-YOEHRIQHSA-N 2 1 324.921 4.039 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246608935 1059026564 /nfs/dbraw/zinc/02/65/64/1059026564.db2.gz WBYAQCZQDZKYRM-NHCUHLMSSA-N 2 1 314.517 4.396 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001246609092 1059026654 /nfs/dbraw/zinc/02/66/54/1059026654.db2.gz KPDFJDKXQOWRCM-SFTDATJTSA-N 2 1 314.517 4.254 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609740 1059026904 /nfs/dbraw/zinc/02/69/04/1059026904.db2.gz MZOYVXZIVFOBGE-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@@H+]2CCC[C@]23CCC[NH2+]C3)CC1 ZINC001246611487 1059028680 /nfs/dbraw/zinc/02/86/80/1059028680.db2.gz UCIKALQCPYVABH-VTLFHKLASA-N 2 1 324.512 4.031 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246609163 1059029788 /nfs/dbraw/zinc/02/97/88/1059029788.db2.gz XQRMKXGLQROVGF-KBXCAEBGSA-N 2 1 324.871 4.018 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614384 1059030191 /nfs/dbraw/zinc/03/01/91/1059030191.db2.gz NYYCFXTYBDWNKZ-PKOBYXMFSA-N 2 1 316.464 4.336 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614384 1059030212 /nfs/dbraw/zinc/03/02/12/1059030212.db2.gz NYYCFXTYBDWNKZ-PKOBYXMFSA-N 2 1 316.464 4.336 20 0 DIADMP CCCC[C@@H](CCC)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625082 1059036733 /nfs/dbraw/zinc/03/67/33/1059036733.db2.gz QYCGWQWCHHRCOB-RTBURBONSA-N 2 1 300.490 4.034 20 0 DIADMP C1C[NH2+][C@]2(C1)CCC[N@@H+]([C@@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633784 1059037736 /nfs/dbraw/zinc/03/77/36/1059037736.db2.gz MMCQPAGVDJPMOW-UYAOXDASSA-N 2 1 304.522 4.488 20 0 DIADMP C1C[NH2+][C@]2(C1)CCC[N@H+]([C@@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633784 1059037749 /nfs/dbraw/zinc/03/77/49/1059037749.db2.gz MMCQPAGVDJPMOW-UYAOXDASSA-N 2 1 304.522 4.488 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CC[C@]2(CC[NH2+]2)C1 ZINC001246633012 1059037994 /nfs/dbraw/zinc/03/79/94/1059037994.db2.gz BJTUQFYBFOSONN-XMSQKQJNSA-N 2 1 320.480 4.035 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@]2(CC[NH2+]2)C1 ZINC001246633012 1059038017 /nfs/dbraw/zinc/03/80/17/1059038017.db2.gz BJTUQFYBFOSONN-XMSQKQJNSA-N 2 1 320.480 4.035 20 0 DIADMP c1ccc2c(c1)CCC21CCC([NH+]2CCC3(CCC[NH2+]3)CC2)CC1 ZINC001246623905 1059038259 /nfs/dbraw/zinc/03/82/59/1059038259.db2.gz MBLFZDBYNCFWPB-UHFFFAOYSA-N 2 1 324.512 4.031 20 0 DIADMP C1C[NH2+][C@@]2(C1)CCC[N@@H+]([C@@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633782 1059038971 /nfs/dbraw/zinc/03/89/71/1059038971.db2.gz MMCQPAGVDJPMOW-QUCCMNQESA-N 2 1 304.522 4.488 20 0 DIADMP C1C[NH2+][C@@]2(C1)CCC[N@H+]([C@@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633782 1059038992 /nfs/dbraw/zinc/03/89/92/1059038992.db2.gz MMCQPAGVDJPMOW-QUCCMNQESA-N 2 1 304.522 4.488 20 0 DIADMP c1ccc(C2CCC([N@@H+]3CCC[C@]4(CCC[NH2+]4)CC3)CC2)cc1 ZINC001246628799 1059040113 /nfs/dbraw/zinc/04/01/13/1059040113.db2.gz CGFQUXZRZIOXQC-XVAXZDLZSA-N 2 1 312.501 4.321 20 0 DIADMP c1ccc(C2CCC([N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)CC2)cc1 ZINC001246628799 1059040129 /nfs/dbraw/zinc/04/01/29/1059040129.db2.gz CGFQUXZRZIOXQC-XVAXZDLZSA-N 2 1 312.501 4.321 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[NH+]1CCC2(CCC[NH2+]2)CC1 ZINC001246623912 1059040177 /nfs/dbraw/zinc/04/01/77/1059040177.db2.gz MCWKQUXWTHHEFR-CQSZACIVSA-N 2 1 324.921 4.039 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246634547 1059043462 /nfs/dbraw/zinc/04/34/62/1059043462.db2.gz OEOFUZHIYNYYBI-KDOFPFPSSA-N 2 1 324.871 4.018 20 0 DIADMP CCCCC[C@@H](CCC)[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001246640326 1059045661 /nfs/dbraw/zinc/04/56/61/1059045661.db2.gz SNDDPEPREUCRBG-CVEARBPZSA-N 2 1 302.453 4.056 20 0 DIADMP c1ccc(C[C@@H]2C[C@@H]([NH+]3CCC4(CCCC4)CC3)CC[NH2+]2)cc1 ZINC001246654277 1059052024 /nfs/dbraw/zinc/05/20/24/1059052024.db2.gz JNXABMNHGVMNMH-UXHICEINSA-N 2 1 312.501 4.006 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]2C[C@H]1C[C@@H]2[NH3+] ZINC001246657852 1059052099 /nfs/dbraw/zinc/05/20/99/1059052099.db2.gz JWXWLYATCDLWOJ-SYNNKVJXSA-N 2 1 320.480 4.019 20 0 DIADMP CCc1ccc(C[C@H](C)[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001246657682 1059052865 /nfs/dbraw/zinc/05/28/65/1059052865.db2.gz PIIMPOLOUZVEKP-LAUBAEHRSA-N 2 1 314.517 4.034 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)CC2)cc1 ZINC001246655822 1059053613 /nfs/dbraw/zinc/05/36/13/1059053613.db2.gz ATAWCUXZERWCKD-KXWSQRDISA-N 2 1 318.892 4.050 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)CC2)cc1 ZINC001246655822 1059053628 /nfs/dbraw/zinc/05/36/28/1059053628.db2.gz ATAWCUXZERWCKD-KXWSQRDISA-N 2 1 318.892 4.050 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001246656654 1059053839 /nfs/dbraw/zinc/05/38/39/1059053839.db2.gz NYZIZHQJYYETEM-HKBOAZHASA-N 2 1 312.501 4.177 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@@H+]3CCCC[C@@]34CCC[NH2+]C4)C2)cc1 ZINC001246651514 1059053883 /nfs/dbraw/zinc/05/38/83/1059053883.db2.gz LXRGHEIKRGFHFP-HKBOAZHASA-N 2 1 312.501 4.321 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246675848 1059059126 /nfs/dbraw/zinc/05/91/26/1059059126.db2.gz YJWKRLPFTVUKQG-FPOVZHCZSA-N 2 1 314.517 4.208 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@@H]3CCC[C@H]3C2)CC[NH2+]1 ZINC001246659305 1059059423 /nfs/dbraw/zinc/05/94/23/1059059423.db2.gz WTXAAUAGUWBFEB-YTXYEVPYSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@@H]3CCC[C@H]3C2)CC[NH2+]1 ZINC001246659305 1059059444 /nfs/dbraw/zinc/05/94/44/1059059444.db2.gz WTXAAUAGUWBFEB-YTXYEVPYSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246680750 1059061306 /nfs/dbraw/zinc/06/13/06/1059061306.db2.gz KZIDPIJCQCPCJL-WDSOQIARSA-N 2 1 300.490 4.299 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CC[N@H+](C2CCCCCCC2)C3)cc1 ZINC001246682037 1059064270 /nfs/dbraw/zinc/06/42/70/1059064270.db2.gz BCHKFSNTIUSRRE-RTWAWAEBSA-N 2 1 312.501 4.178 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246682336 1059064896 /nfs/dbraw/zinc/06/48/96/1059064896.db2.gz BQWODRXYFVZAID-PMXSJFBMSA-N 2 1 314.517 4.280 20 0 DIADMP CC(C)CCC[C@H](C)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246683252 1059065435 /nfs/dbraw/zinc/06/54/35/1059065435.db2.gz QGAHRLQHFKGAMU-CEWLAPEOSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@H]1CCC[NH2+]CC1 ZINC001246681045 1059065839 /nfs/dbraw/zinc/06/58/39/1059065839.db2.gz DUNNXTARZBVVSV-RXVVDRJESA-N 2 1 308.469 4.392 20 0 DIADMP CCCCC[C@H](C)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246683400 1059069015 /nfs/dbraw/zinc/06/90/15/1059069015.db2.gz JEFDYKRXDPSAJY-SXLOBPIMSA-N 2 1 300.490 4.034 20 0 DIADMP C[N@H+](Cc1cccc(Cl)c1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246769394 1059071206 /nfs/dbraw/zinc/07/12/06/1059071206.db2.gz JROGNRMJSWIAQC-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246769394 1059071227 /nfs/dbraw/zinc/07/12/27/1059071227.db2.gz JROGNRMJSWIAQC-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246767253 1059071959 /nfs/dbraw/zinc/07/19/59/1059071959.db2.gz AYGOKBFTHOPZSK-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246775604 1059079045 /nfs/dbraw/zinc/07/90/45/1059079045.db2.gz IZQNTDAOIAMFLQ-FHWLQOOXSA-N 2 1 300.490 4.033 20 0 DIADMP Cc1ccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246780379 1059079932 /nfs/dbraw/zinc/07/99/32/1059079932.db2.gz LWYAXVNHRJXUAM-HXUWFJFHSA-N 2 1 312.501 4.444 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC[NH2+]1 ZINC001246783817 1059083119 /nfs/dbraw/zinc/08/31/19/1059083119.db2.gz FBBQKRLCLXAHIL-SQNIBIBYSA-N 2 1 306.881 4.254 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2C2CCC3(C[NH2+]C3)CC2)cc1 ZINC001246784149 1059083417 /nfs/dbraw/zinc/08/34/17/1059083417.db2.gz FEVRHNFGOIFRSD-KRWDZBQOSA-N 2 1 304.865 4.009 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783595 1059084292 /nfs/dbraw/zinc/08/42/92/1059084292.db2.gz PKALHRVIAYPQLS-ZBLKQVMWSA-N 2 1 304.522 4.054 20 0 DIADMP c1csc([C@@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)c1 ZINC001246784189 1059087176 /nfs/dbraw/zinc/08/71/76/1059087176.db2.gz FKVAIHIHTWYVQQ-PQUAAJSLSA-N 2 1 304.503 4.197 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246784678 1059088915 /nfs/dbraw/zinc/08/89/15/1059088915.db2.gz HUUKIUHNCGRWKT-AJPWXKBRSA-N 2 1 316.464 4.275 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246791000 1059092282 /nfs/dbraw/zinc/09/22/82/1059092282.db2.gz XATKWMMWNXMTRV-CRAIPNDOSA-N 2 1 302.437 4.027 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)c1 ZINC001246793078 1059095158 /nfs/dbraw/zinc/09/51/58/1059095158.db2.gz CYYNALUVSWLXAX-IBGZPJMESA-N 2 1 316.464 4.275 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2cccc(F)c2)C[C@@H](CC)[NH2+]1 ZINC001246793091 1059097094 /nfs/dbraw/zinc/09/70/94/1059097094.db2.gz CZXHNJUJWBJAJH-ZHALLVOQSA-N 2 1 304.453 4.272 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2F)CC[NH2+]1 ZINC001246795137 1059097381 /nfs/dbraw/zinc/09/73/81/1059097381.db2.gz IEGWMVVRRQABNF-MDZRGWNJSA-N 2 1 304.453 4.273 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2F)C[C@H](CC)[NH2+]1 ZINC001246794594 1059099031 /nfs/dbraw/zinc/09/90/31/1059099031.db2.gz GDIXYIVSTIBNNL-MKSNKDDYSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246803504 1059101396 /nfs/dbraw/zinc/10/13/96/1059101396.db2.gz YRXSZDQTDMQAHA-KSZLIROESA-N 2 1 304.453 4.129 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246798231 1059102551 /nfs/dbraw/zinc/10/25/51/1059102551.db2.gz MTKRCIWLFINNLG-CEXWTWQISA-N 2 1 304.453 4.273 20 0 DIADMP CC[N@@H+](C1CC[NH2+]CC1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246799642 1059102569 /nfs/dbraw/zinc/10/25/69/1059102569.db2.gz YGZDAJVGMDZQNR-UHFFFAOYSA-N 2 1 320.908 4.440 20 0 DIADMP CC[C@@H]1CC([N@H+]2CC[C@@H](c3ccccc3Cl)C2)C[C@@H](CC)[NH2+]1 ZINC001246809660 1059105759 /nfs/dbraw/zinc/10/57/59/1059105759.db2.gz KXRVRYPDTDLWRG-BZUAXINKSA-N 2 1 320.908 4.439 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+](C)CCc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246815352 1059105817 /nfs/dbraw/zinc/10/58/17/1059105817.db2.gz YECJMANULPPJBM-ZWKOTPCHSA-N 2 1 308.897 4.125 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246807858 1059106833 /nfs/dbraw/zinc/10/68/33/1059106833.db2.gz UEMVSOZRQPQWTA-FPOVZHCZSA-N 2 1 320.480 4.165 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@H](C)C[C@@H]2C)CC[NH2+]1 ZINC001246812401 1059106917 /nfs/dbraw/zinc/10/69/17/1059106917.db2.gz ZTZPXEDEIHDVHX-YRMAPFEESA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@H](C)C[C@@H]2C)CC[NH2+]1 ZINC001246812401 1059106923 /nfs/dbraw/zinc/10/69/23/1059106923.db2.gz ZTZPXEDEIHDVHX-YRMAPFEESA-N 2 1 304.453 4.048 20 0 DIADMP CCCCCC[C@H](CCC)[N@@H+](CCCOC)C1CC[NH2+]CC1 ZINC001246835299 1059113601 /nfs/dbraw/zinc/11/36/01/1059113601.db2.gz INKIJHAGRMAVSS-SFHVURJKSA-N 2 1 312.542 4.216 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)s1 ZINC001246826877 1059114179 /nfs/dbraw/zinc/11/41/79/1059114179.db2.gz YZVQCRUTOGNURC-KGLIPLIRSA-N 2 1 324.921 4.461 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCc3cc(Cl)ccc3C2)C[C@H](CC)[NH2+]1 ZINC001246835652 1059114347 /nfs/dbraw/zinc/11/43/47/1059114347.db2.gz KYTGXORPQMUOLC-PIIMJCKOSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCc3cc(Cl)ccc3C2)C[C@H](CC)[NH2+]1 ZINC001246835652 1059114357 /nfs/dbraw/zinc/11/43/57/1059114357.db2.gz KYTGXORPQMUOLC-PIIMJCKOSA-N 2 1 306.881 4.007 20 0 DIADMP CC(C)c1nc(C[N@@H+](C)C2CCC3(CCC[NH2+]C3)CC2)cs1 ZINC001246836903 1059115582 /nfs/dbraw/zinc/11/55/82/1059115582.db2.gz PSOISBUGMACIPC-UHFFFAOYSA-N 2 1 321.534 4.011 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)s1 ZINC001246826920 1059115874 /nfs/dbraw/zinc/11/58/74/1059115874.db2.gz ZMQZXILHRIQLOW-XOYHFGRZSA-N 2 1 324.921 4.461 20 0 DIADMP COc1ccccc1[C@@H](C)[N@H+](C)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841578 1059117136 /nfs/dbraw/zinc/11/71/36/1059117136.db2.gz UVCSCBMLSLNPRW-IAGOWNOFSA-N 2 1 316.489 4.143 20 0 DIADMP COc1ccccc1[C@@H](C)[N@@H+](C)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841578 1059117143 /nfs/dbraw/zinc/11/71/43/1059117143.db2.gz UVCSCBMLSLNPRW-IAGOWNOFSA-N 2 1 316.489 4.143 20 0 DIADMP CC[C@H]1CC([N@@H+](CC)Cc2ccc(Cl)cc2)C[C@H](CC)[NH2+]1 ZINC001246842896 1059119374 /nfs/dbraw/zinc/11/93/74/1059119374.db2.gz CSYAQOLRDAWTNC-IRXDYDNUSA-N 2 1 308.897 4.471 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246844609 1059121556 /nfs/dbraw/zinc/12/15/56/1059121556.db2.gz JUVGNERSPHMZJQ-IRXDYDNUSA-N 2 1 308.897 4.329 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246845092 1059122081 /nfs/dbraw/zinc/12/20/81/1059122081.db2.gz KKPODVUHEJAWSV-IOJLRTSASA-N 2 1 300.490 4.382 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](C)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246845091 1059122857 /nfs/dbraw/zinc/12/28/57/1059122857.db2.gz KKPODVUHEJAWSV-GPJFCIFZSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001246843745 1059124204 /nfs/dbraw/zinc/12/42/04/1059124204.db2.gz WALIRTNYZXJHEG-JKSUJKDBSA-N 2 1 324.534 4.001 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843320 1059124502 /nfs/dbraw/zinc/12/45/02/1059124502.db2.gz JKCBPCUVFRYXLQ-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843320 1059124515 /nfs/dbraw/zinc/12/45/15/1059124515.db2.gz JKCBPCUVFRYXLQ-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2cccc(OC)c2)C[C@@H](CC)[NH2+]1 ZINC001246849082 1059126911 /nfs/dbraw/zinc/12/69/11/1059126911.db2.gz PWPZPQYHOTWWDS-HLIPFELVSA-N 2 1 316.489 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246847211 1059127233 /nfs/dbraw/zinc/12/72/33/1059127233.db2.gz JWVCKYOUAXMANF-JBACZVJFSA-N 2 1 324.443 4.374 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246847211 1059127240 /nfs/dbraw/zinc/12/72/40/1059127240.db2.gz JWVCKYOUAXMANF-JBACZVJFSA-N 2 1 324.443 4.374 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246848730 1059127397 /nfs/dbraw/zinc/12/73/97/1059127397.db2.gz DHDXLVBIDOTPNT-INIZCTEOSA-N 2 1 316.489 4.000 20 0 DIADMP CC[C@@H]1CC([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)C[C@@H](CC)[NH2+]1 ZINC001246850123 1059127585 /nfs/dbraw/zinc/12/75/85/1059127585.db2.gz HBEVLSNJBWIHPB-CGTJXYLNSA-N 2 1 320.908 4.439 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)C[C@H](CC)[NH2+]1 ZINC001246850124 1059127703 /nfs/dbraw/zinc/12/77/03/1059127703.db2.gz HBEVLSNJBWIHPB-GDAAHCPNSA-N 2 1 320.908 4.439 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)C[C@H](CC)[NH2+]1 ZINC001246848778 1059128062 /nfs/dbraw/zinc/12/80/62/1059128062.db2.gz DZTDJYQBXHXWNL-GDAAHCPNSA-N 2 1 320.908 4.439 20 0 DIADMP CC[C@@H]1CC([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)C[C@@H](CC)[NH2+]1 ZINC001246850126 1059128517 /nfs/dbraw/zinc/12/85/17/1059128517.db2.gz HBEVLSNJBWIHPB-KBAYOESNSA-N 2 1 320.908 4.439 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)C[C@H](CC)[NH2+]1 ZINC001246850128 1059129037 /nfs/dbraw/zinc/12/90/37/1059129037.db2.gz HBEVLSNJBWIHPB-YSHGAJCASA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)C[C@H](C)[NH2+]1 ZINC001246849515 1059129215 /nfs/dbraw/zinc/12/92/15/1059129215.db2.gz FOKLXLPUWUKJGV-IZZQQSIFSA-N 2 1 324.468 4.440 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+]([C@H]3CCC[C@@]4(CC[NH2+]C4)C3)C2)c1 ZINC001246848761 1059129788 /nfs/dbraw/zinc/12/97/88/1059129788.db2.gz DNBYKDDFLUJEBP-NZSAHSFTSA-N 2 1 318.892 4.052 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246848839 1059129982 /nfs/dbraw/zinc/12/99/82/1059129982.db2.gz YFZIQVDQJKBCLX-ZWKOTPCHSA-N 2 1 306.881 4.084 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246852148 1059131293 /nfs/dbraw/zinc/13/12/93/1059131293.db2.gz NDSVEXRZBOTZMJ-OALUTQOASA-N 2 1 324.468 4.441 20 0 DIADMP C1C[N@H+](C2CCC3(CC[NH2+]CC3)CC2)C[C@@H]1C1CCCCC1 ZINC001246850666 1059132762 /nfs/dbraw/zinc/13/27/62/1059132762.db2.gz VOEBUMFNYNIVJI-GOSISDBHSA-N 2 1 304.522 4.201 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)C1 ZINC001246850742 1059132838 /nfs/dbraw/zinc/13/28/38/1059132838.db2.gz WREUHTMLEIKOQH-HHXXYDBFSA-N 2 1 304.453 4.049 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)C1 ZINC001246850742 1059132854 /nfs/dbraw/zinc/13/28/54/1059132854.db2.gz WREUHTMLEIKOQH-HHXXYDBFSA-N 2 1 304.453 4.049 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246851625 1059132886 /nfs/dbraw/zinc/13/28/86/1059132886.db2.gz ZAJYEOCZWAKIKJ-XOKHGSTOSA-N 2 1 308.897 4.500 20 0 DIADMP Clc1ccc([C@H]2CC[N@H+](C3CCC4(CC[NH2+]C4)CC3)C2)cc1 ZINC001246853037 1059133695 /nfs/dbraw/zinc/13/36/95/1059133695.db2.gz QXFXJUWMXPUZCV-IVMQYODDSA-N 2 1 318.892 4.052 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246855354 1059134141 /nfs/dbraw/zinc/13/41/41/1059134141.db2.gz XLJVKAUSEIAWPA-JQHSSLGASA-N 2 1 320.908 4.296 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@H+]2CCC[C@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246863104 1059135999 /nfs/dbraw/zinc/13/59/99/1059135999.db2.gz IZQNTDAOIAMFLQ-GBESFXJTSA-N 2 1 300.490 4.033 20 0 DIADMP Clc1ccc2c(c1)C[N@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866242 1059137310 /nfs/dbraw/zinc/13/73/10/1059137310.db2.gz BIZLLLYJARVJCS-KRWDZBQOSA-N 2 1 304.865 4.111 20 0 DIADMP Clc1ccc2c(c1)C[N@@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866242 1059137329 /nfs/dbraw/zinc/13/73/29/1059137329.db2.gz BIZLLLYJARVJCS-KRWDZBQOSA-N 2 1 304.865 4.111 20 0 DIADMP Clc1ccc2c(c1)C[N@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866243 1059138010 /nfs/dbraw/zinc/13/80/10/1059138010.db2.gz BIZLLLYJARVJCS-QGZVFWFLSA-N 2 1 304.865 4.111 20 0 DIADMP Clc1ccc2c(c1)C[N@@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866243 1059138033 /nfs/dbraw/zinc/13/80/33/1059138033.db2.gz BIZLLLYJARVJCS-QGZVFWFLSA-N 2 1 304.865 4.111 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCc3ccccc3[C@@H]2CC)C[C@H](CC)[NH2+]1 ZINC001246868240 1059141780 /nfs/dbraw/zinc/14/17/80/1059141780.db2.gz RIEDDWLDQZMSCK-XFKSJGNHSA-N 2 1 300.490 4.305 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246870582 1059142493 /nfs/dbraw/zinc/14/24/93/1059142493.db2.gz YMLKQOMQWFKXGE-UHOSZYNNSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2Cc3ccccc3C(C)(C)C2)CC[NH2+]1 ZINC001246869010 1059142669 /nfs/dbraw/zinc/14/26/69/1059142669.db2.gz DVLQSJISVYXJEW-MSOLQXFVSA-N 2 1 300.490 4.091 20 0 DIADMP CC[C@H]1c2ccccc2CC[N@H+]1C1CCC2(CC[NH2+]CC2)CC1 ZINC001246867673 1059142865 /nfs/dbraw/zinc/14/28/65/1059142865.db2.gz PZVOYXPVWPVDAS-FQEVSTJZSA-N 2 1 312.501 4.308 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)CC[NH2+]1 ZINC001246876887 1059145749 /nfs/dbraw/zinc/14/57/49/1059145749.db2.gz DBJDDGGAXTXZSC-VIDZHXABSA-N 2 1 318.464 4.003 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246879305 1059146297 /nfs/dbraw/zinc/14/62/97/1059146297.db2.gz LLQLEFJMYJXVNM-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[NH2+][C@H](C)C1 ZINC001246882781 1059148229 /nfs/dbraw/zinc/14/82/29/1059148229.db2.gz NYNAEHLRBURXCH-DOMZBBRYSA-N 2 1 315.288 4.344 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[NH2+][C@H](C)C1 ZINC001246882781 1059148239 /nfs/dbraw/zinc/14/82/39/1059148239.db2.gz NYNAEHLRBURXCH-DOMZBBRYSA-N 2 1 315.288 4.344 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2SC)CC[NH2+]1 ZINC001246886618 1059150485 /nfs/dbraw/zinc/15/04/85/1059150485.db2.gz HOFMHWXSFHSOSQ-INMHGKMJSA-N 2 1 304.503 4.076 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCC(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246884077 1059150682 /nfs/dbraw/zinc/15/06/82/1059150682.db2.gz SLJHJWPJQCGICY-WIYYLYMNSA-N 2 1 322.496 4.281 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2C(C)C)CCN1 ZINC001246885258 1059150804 /nfs/dbraw/zinc/15/08/04/1059150804.db2.gz DFXUFUCCJMOMJN-NZSAHSFTSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2C(C)C)CC[NH2+]1 ZINC001246885258 1059150809 /nfs/dbraw/zinc/15/08/09/1059150809.db2.gz DFXUFUCCJMOMJN-NZSAHSFTSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2C(C)C)CC[NH2+]1 ZINC001246885258 1059150815 /nfs/dbraw/zinc/15/08/15/1059150815.db2.gz DFXUFUCCJMOMJN-NZSAHSFTSA-N 2 1 304.453 4.048 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC001246887335 1059152307 /nfs/dbraw/zinc/15/23/07/1059152307.db2.gz KSSOMCGIHZGLKQ-IAGOWNOFSA-N 2 1 304.865 4.152 20 0 DIADMP C[N@H+]([C@@H]1CC[NH2+][C@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892840 1059152442 /nfs/dbraw/zinc/15/24/42/1059152442.db2.gz OJVJPKALBYWRCP-RTWAWAEBSA-N 2 1 322.496 4.433 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892840 1059152466 /nfs/dbraw/zinc/15/24/66/1059152466.db2.gz OJVJPKALBYWRCP-RTWAWAEBSA-N 2 1 322.496 4.433 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246886932 1059152783 /nfs/dbraw/zinc/15/27/83/1059152783.db2.gz FZDWEXXHQOYJOE-QYZOEREBSA-N 2 1 318.892 4.399 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC[NH2+]1 ZINC001246886996 1059154405 /nfs/dbraw/zinc/15/44/05/1059154405.db2.gz HOTCNZPWJBPNQC-SQNIBIBYSA-N 2 1 306.881 4.254 20 0 DIADMP CC[C@H]1CC([N@@H+](C)C(C)(C)Cc2ccccc2)C[C@H](CC)[NH2+]1 ZINC001246892941 1059155210 /nfs/dbraw/zinc/15/52/10/1059155210.db2.gz PKWIMSWOHAIJGO-ROUUACIJSA-N 2 1 302.506 4.249 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC001246887334 1059155817 /nfs/dbraw/zinc/15/58/17/1059155817.db2.gz KSSOMCGIHZGLKQ-DLBZAZTESA-N 2 1 304.865 4.152 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+](C)C(C)(C)Cc2ccccc2)CC[NH2+]1 ZINC001246894423 1059158752 /nfs/dbraw/zinc/15/87/52/1059158752.db2.gz TYEUWUFXSCETNB-OALUTQOASA-N 2 1 302.506 4.250 20 0 DIADMP CCCC[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246898504 1059159092 /nfs/dbraw/zinc/15/90/92/1059159092.db2.gz MTKRCIWLFINNLG-IPMKNSEASA-N 2 1 304.453 4.273 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246898499 1059159868 /nfs/dbraw/zinc/15/98/68/1059159868.db2.gz MTKRCIWLFINNLG-GBESFXJTSA-N 2 1 304.453 4.273 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899735 1059160335 /nfs/dbraw/zinc/16/03/35/1059160335.db2.gz FYWITXUYHOGEEH-BORJPKMPSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899735 1059160340 /nfs/dbraw/zinc/16/03/40/1059160340.db2.gz FYWITXUYHOGEEH-BORJPKMPSA-N 2 1 322.443 4.411 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246904393 1059162782 /nfs/dbraw/zinc/16/27/82/1059162782.db2.gz MGEQWWXFKXZNRW-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+](CC)Cc2cccc(Cl)c2)CC[NH2+]1 ZINC001246903887 1059162796 /nfs/dbraw/zinc/16/27/96/1059162796.db2.gz LVBZTCHKEMPHQY-ZWKOTPCHSA-N 2 1 308.897 4.473 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246903012 1059163481 /nfs/dbraw/zinc/16/34/81/1059163481.db2.gz HIIACMCBBLFICQ-QZTJIDSGSA-N 2 1 306.881 4.084 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246904618 1059164522 /nfs/dbraw/zinc/16/45/22/1059164522.db2.gz HXBBFZZNXZICQC-MOPGFXCFSA-N 2 1 324.468 4.441 20 0 DIADMP CC[C@@H]1CC([N@@H+](CC)Cc2cccc(Cl)c2)C[C@@H](CC)[NH2+]1 ZINC001246902211 1059164650 /nfs/dbraw/zinc/16/46/50/1059164650.db2.gz BSSRYWCPZWEARB-IAGOWNOFSA-N 2 1 308.897 4.471 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246903953 1059164889 /nfs/dbraw/zinc/16/48/89/1059164889.db2.gz ZXIPXALROWCXFA-WJAMPBCPSA-N 2 1 323.484 4.227 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)C[C@H](C)[NH2+]1 ZINC001246904901 1059164911 /nfs/dbraw/zinc/16/49/11/1059164911.db2.gz JORGWPACZMHGDO-IZZQQSIFSA-N 2 1 324.468 4.440 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+](CC)Cc2cccc(Cl)c2)CC[NH2+]1 ZINC001246903885 1059164940 /nfs/dbraw/zinc/16/49/40/1059164940.db2.gz LVBZTCHKEMPHQY-ROUUACIJSA-N 2 1 308.897 4.473 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC001246907830 1059168193 /nfs/dbraw/zinc/16/81/93/1059168193.db2.gz JVBDWSMBKMGIBX-RTWAWAEBSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC001246907830 1059168210 /nfs/dbraw/zinc/16/82/10/1059168210.db2.gz JVBDWSMBKMGIBX-RTWAWAEBSA-N 2 1 308.469 4.229 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246911713 1059172286 /nfs/dbraw/zinc/17/22/86/1059172286.db2.gz WILIBTLSNRKLEB-UHFFFAOYSA-N 2 1 300.490 4.048 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246908796 1059172405 /nfs/dbraw/zinc/17/24/05/1059172405.db2.gz NBEHVKFQSSDWOA-WOJBJXKFSA-N 2 1 300.490 4.048 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1(C)CC[NH2+]CC1 ZINC001246914222 1059174876 /nfs/dbraw/zinc/17/48/76/1059174876.db2.gz ZYWFANBCXNUVOH-HNNXBMFYSA-N 2 1 324.534 4.144 20 0 DIADMP FC(F)(F)c1ccc([C@@H]2CCC[N@H+]2[C@@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246920259 1059176160 /nfs/dbraw/zinc/17/61/60/1059176160.db2.gz DJLMVAKVXNITEG-YVSFHVDLSA-N 2 1 324.390 4.125 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](C)C1CCC([NH2+]C)CC1 ZINC001246919712 1059176600 /nfs/dbraw/zinc/17/66/00/1059176600.db2.gz OCKFBJXXANITMI-MHJFOBGBSA-N 2 1 302.506 4.250 20 0 DIADMP C[N@@H+](C1CCC(c2ccc(Cl)cc2)CC1)C1(C)CC[NH2+]CC1 ZINC001246912553 1059176684 /nfs/dbraw/zinc/17/66/84/1059176684.db2.gz UBZXKIIUZLMQNV-UHFFFAOYSA-N 2 1 320.908 4.440 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246916908 1059177629 /nfs/dbraw/zinc/17/76/29/1059177629.db2.gz UMXWCJOFBJVZIO-IEBWSBKVSA-N 2 1 302.506 4.455 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C1C[C@H](C)[NH2+][C@@H](C)C1 ZINC001246917184 1059178054 /nfs/dbraw/zinc/17/80/54/1059178054.db2.gz WKSIKGGSMWHLNL-STQMWFEESA-N 2 1 314.395 4.056 20 0 DIADMP CC1(C)CCC[C@@H]([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C1 ZINC001246932764 1059179184 /nfs/dbraw/zinc/17/91/84/1059179184.db2.gz GXWNSGFXCFMYJL-GOSISDBHSA-N 2 1 318.480 4.349 20 0 DIADMP CC1(C)CCC[C@H]([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C1 ZINC001246932771 1059181383 /nfs/dbraw/zinc/18/13/83/1059181383.db2.gz GXWNSGFXCFMYJL-SFHVURJKSA-N 2 1 318.480 4.349 20 0 DIADMP Fc1ccccc1C[N@@H+](C1CC[NH2+]CC1)C1CCCCCCC1 ZINC001246934044 1059183298 /nfs/dbraw/zinc/18/32/98/1059183298.db2.gz NDBCPCQSPHFTQP-UHFFFAOYSA-N 2 1 318.480 4.493 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246944447 1059189314 /nfs/dbraw/zinc/18/93/14/1059189314.db2.gz CDOHABAVAYOCPA-CRAIPNDOSA-N 2 1 320.908 4.473 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001246945574 1059191436 /nfs/dbraw/zinc/19/14/36/1059191436.db2.gz HBDSEFXMAKCHIC-HNNXBMFYSA-N 2 1 308.897 4.473 20 0 DIADMP CCCCCC[C@H](CC)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246952231 1059193052 /nfs/dbraw/zinc/19/30/52/1059193052.db2.gz JYTQJEIZCKOAMD-IBGZPJMESA-N 2 1 317.521 4.385 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2cc(C)cc(F)c2)C2CC[NH2+]CC2)C1 ZINC001246952443 1059193167 /nfs/dbraw/zinc/19/31/67/1059193167.db2.gz SKYUFOCMNIDOQV-OXQOHEQNSA-N 2 1 318.480 4.267 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246947058 1059193347 /nfs/dbraw/zinc/19/33/47/1059193347.db2.gz SPZPGWNMOGCIRE-DNVCBOLYSA-N 2 1 320.908 4.473 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001246952382 1059193671 /nfs/dbraw/zinc/19/36/71/1059193671.db2.gz ZDEDUOSMTGPWSB-SFHVURJKSA-N 2 1 316.533 4.416 20 0 DIADMP CC(C)(C)C[N@@H+](C1CC[NH2+]CC1)C1CCC(C(F)(F)F)CC1 ZINC001246947663 1059193700 /nfs/dbraw/zinc/19/37/00/1059193700.db2.gz WKEBRHSTPBLDHY-UHFFFAOYSA-N 2 1 320.443 4.208 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2cc(C)cc(F)c2)C2CC[NH2+]CC2)C1 ZINC001246952441 1059193863 /nfs/dbraw/zinc/19/38/63/1059193863.db2.gz SKYUFOCMNIDOQV-JXFKEZNVSA-N 2 1 318.480 4.267 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246946424 1059194709 /nfs/dbraw/zinc/19/47/09/1059194709.db2.gz MJXZVSMHZRKKPK-FQEVSTJZSA-N 2 1 316.533 4.498 20 0 DIADMP C[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246949586 1059196753 /nfs/dbraw/zinc/19/67/53/1059196753.db2.gz AOJWFGLFFUVRHY-WMLDXEAASA-N 2 1 306.881 4.083 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246955499 1059197894 /nfs/dbraw/zinc/19/78/94/1059197894.db2.gz MXVYXQMQWCOIFD-HNNXBMFYSA-N 2 1 324.459 4.488 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955959 1059198376 /nfs/dbraw/zinc/19/83/76/1059198376.db2.gz OQFPDDOGJBBANL-KDOFPFPSSA-N 2 1 322.443 4.098 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001246954423 1059198852 /nfs/dbraw/zinc/19/88/52/1059198852.db2.gz HDJPLZXSKAWANR-MRXNPFEDSA-N 2 1 306.469 4.267 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246955938 1059199272 /nfs/dbraw/zinc/19/92/72/1059199272.db2.gz ODGUSVWDMIDOCO-INIZCTEOSA-N 2 1 324.459 4.488 20 0 DIADMP CCCCC[C@H](C)[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246955425 1059202370 /nfs/dbraw/zinc/20/23/70/1059202370.db2.gz LXOXPUKQEKSSIA-HNNXBMFYSA-N 2 1 324.459 4.488 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246955425 1059202383 /nfs/dbraw/zinc/20/23/83/1059202383.db2.gz LXOXPUKQEKSSIA-HNNXBMFYSA-N 2 1 324.459 4.488 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccc(C)cc2F)C2CC[NH2+]CC2)C1 ZINC001246954221 1059202538 /nfs/dbraw/zinc/20/25/38/1059202538.db2.gz FPNMMNJIQLEVAH-APWZRJJASA-N 2 1 318.480 4.267 20 0 DIADMP CC(C)C[C@@H](C)C[C@@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246956642 1059203359 /nfs/dbraw/zinc/20/33/59/1059203359.db2.gz ZKVMSIWLLCYMTH-QZTJIDSGSA-N 2 1 317.521 4.096 20 0 DIADMP CC(C)CC[C@@H](C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246958374 1059203872 /nfs/dbraw/zinc/20/38/72/1059203872.db2.gz QNSVKFLVJDKHRE-OAHLLOKOSA-N 2 1 324.459 4.344 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246956960 1059206216 /nfs/dbraw/zinc/20/62/16/1059206216.db2.gz BKVGGMHNTLGCDC-QUCCMNQESA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001246962235 1059209035 /nfs/dbraw/zinc/20/90/35/1059209035.db2.gz IXVSEVVHZDLYCI-SFHVURJKSA-N 2 1 306.469 4.267 20 0 DIADMP c1ccc(C[N@@H+](C2CCC2)C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246967112 1059211461 /nfs/dbraw/zinc/21/14/61/1059211461.db2.gz TTZIVNWTKHYRNP-UHFFFAOYSA-N 2 1 312.501 4.354 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+]([C@H]1CCC(C)(C)C1)C1CC[NH2+]CC1 ZINC001246965791 1059212401 /nfs/dbraw/zinc/21/24/01/1059212401.db2.gz SFGUQLSDBYNLJO-IBGZPJMESA-N 2 1 318.480 4.267 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@](C)(C[NH3+])C1 ZINC001246965635 1059212734 /nfs/dbraw/zinc/21/27/34/1059212734.db2.gz HLNUOCVKLPYUGO-XMSQKQJNSA-N 2 1 322.496 4.268 20 0 DIADMP COc1ccc(C[N@@H+]([C@@H](C)CCC(C)C)C2CC[NH2+]CC2)cc1 ZINC001246964679 1059213017 /nfs/dbraw/zinc/21/30/17/1059213017.db2.gz ORFCKWFWXXJKMF-KRWDZBQOSA-N 2 1 318.505 4.074 20 0 DIADMP CC[C@H](CC(C)C)[N@H+](Cc1c(F)cccc1F)C1CC[NH2+]CC1 ZINC001246964543 1059213096 /nfs/dbraw/zinc/21/30/96/1059213096.db2.gz LIMWYHMHXBONIX-OAHLLOKOSA-N 2 1 324.459 4.344 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](Cc1c(F)cccc1F)C1CC[NH2+]CC1 ZINC001246964543 1059213115 /nfs/dbraw/zinc/21/31/15/1059213115.db2.gz LIMWYHMHXBONIX-OAHLLOKOSA-N 2 1 324.459 4.344 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@H+]2CCCC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246968578 1059213483 /nfs/dbraw/zinc/21/34/83/1059213483.db2.gz RUMZSTRGWZKHKO-CEXWTWQISA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2CC[NH2+][C@@H](C(C)C)C2)c1C ZINC001246966617 1059213647 /nfs/dbraw/zinc/21/36/47/1059213647.db2.gz LBUUGFUBVWWHEI-VQTJNVASSA-N 2 1 300.490 4.044 20 0 DIADMP CC1(C)CC([N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)CC(C)(C)O1 ZINC001246966504 1059214183 /nfs/dbraw/zinc/21/41/83/1059214183.db2.gz UTRFDCMLRZJPQF-QAQDUYKDSA-N 2 1 322.537 4.095 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246964710 1059214263 /nfs/dbraw/zinc/21/42/63/1059214263.db2.gz MILVRNKAZHWTAN-YSSFQJQWSA-N 2 1 318.480 4.129 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@@H+](C[C@@H]3CCC[NH2+]C3)C3CC3)C2)cc1 ZINC001246973547 1059214868 /nfs/dbraw/zinc/21/48/68/1059214868.db2.gz ODFMVARDZCVOJF-QFUCXCTJSA-N 2 1 312.501 4.177 20 0 DIADMP CCCCCC[C@H](CCCC)[N@H+]1CC[C@@H](N2CCC([NH3+])CC2)C1 ZINC001246974913 1059216256 /nfs/dbraw/zinc/21/62/56/1059216256.db2.gz KSADHNCMCMOXIA-VQTJNVASSA-N 2 1 323.569 4.013 20 0 DIADMP CCC[N@@H+](C[C@@H]1CC[NH2+]C1)[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001246971975 1059218387 /nfs/dbraw/zinc/21/83/87/1059218387.db2.gz CECCWWYTTAMZET-YZGWKJHDSA-N 2 1 300.490 4.034 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@@H+](C2CCC2)C2CC[NH2+]CC2)cc1 ZINC001246974232 1059218722 /nfs/dbraw/zinc/21/87/22/1059218722.db2.gz JPPOEOPVYLHYJQ-MRXNPFEDSA-N 2 1 318.530 4.082 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246973997 1059219155 /nfs/dbraw/zinc/21/91/55/1059219155.db2.gz NDNPTGSBZKTMHR-KKXNLOMOSA-N 2 1 300.490 4.380 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001246971518 1059219530 /nfs/dbraw/zinc/21/95/30/1059219530.db2.gz HCOWBNBHOINWIP-FPOVZHCZSA-N 2 1 314.517 4.252 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001246971525 1059219658 /nfs/dbraw/zinc/21/96/58/1059219658.db2.gz HCOWBNBHOINWIP-PZJWPPBQSA-N 2 1 314.517 4.252 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246977940 1059221080 /nfs/dbraw/zinc/22/10/80/1059221080.db2.gz RRELRVRFMZYGHV-LJQANCHMSA-N 2 1 314.517 4.394 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@H]12 ZINC001246978243 1059221667 /nfs/dbraw/zinc/22/16/67/1059221667.db2.gz VRGQSJYZUWZMBG-HOBFEBRJSA-N 2 1 318.892 4.035 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246979220 1059222933 /nfs/dbraw/zinc/22/29/33/1059222933.db2.gz XOMMTVFCKUYTDD-OAQYLSRUSA-N 2 1 314.517 4.250 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246979176 1059223952 /nfs/dbraw/zinc/22/39/52/1059223952.db2.gz XBSZUZHKASFYJS-OAQYLSRUSA-N 2 1 314.517 4.394 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246987657 1059226428 /nfs/dbraw/zinc/22/64/28/1059226428.db2.gz NOOZVKHLXARQGD-OAHLLOKOSA-N 2 1 313.272 4.100 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246987657 1059226454 /nfs/dbraw/zinc/22/64/54/1059226454.db2.gz NOOZVKHLXARQGD-OAHLLOKOSA-N 2 1 313.272 4.100 20 0 DIADMP CCCC(CCC)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001246999422 1059227329 /nfs/dbraw/zinc/22/73/29/1059227329.db2.gz BXCIYNBPXYJRHS-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001780 1059231196 /nfs/dbraw/zinc/23/11/96/1059231196.db2.gz LEYAHJZYZJDYEF-CEXWTWQISA-N 2 1 322.443 4.413 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001780 1059231237 /nfs/dbraw/zinc/23/12/37/1059231237.db2.gz LEYAHJZYZJDYEF-CEXWTWQISA-N 2 1 322.443 4.413 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006103 1059231927 /nfs/dbraw/zinc/23/19/27/1059231927.db2.gz WRRQLNHKFVGAIX-PRIDNEQBSA-N 2 1 318.480 4.438 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006103 1059231949 /nfs/dbraw/zinc/23/19/49/1059231949.db2.gz WRRQLNHKFVGAIX-PRIDNEQBSA-N 2 1 318.480 4.438 20 0 DIADMP c1ccc2c(c1)CC[NH2+]C21CC[NH+](C2CCCCCCC2)CC1 ZINC001247001988 1059232729 /nfs/dbraw/zinc/23/27/29/1059232729.db2.gz KFICGLJLYFWTJP-UHFFFAOYSA-N 2 1 312.501 4.236 20 0 DIADMP CCCC[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2C)CC[NH2+]1 ZINC001247002687 1059234503 /nfs/dbraw/zinc/23/45/03/1059234503.db2.gz OBQOWYHEGKSHHT-NLWGTHIKSA-N 2 1 300.490 4.443 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@@H]([NH3+])C[C@H]1C ZINC001247000718 1059235109 /nfs/dbraw/zinc/23/51/09/1059235109.db2.gz WPKAVRSTUNBUAJ-UWVAXJGDSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]([NH3+])C[C@H]1C ZINC001247000718 1059235131 /nfs/dbraw/zinc/23/51/31/1059235131.db2.gz WPKAVRSTUNBUAJ-UWVAXJGDSA-N 2 1 308.469 4.019 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H](OC)C2CCCCC2)CC1 ZINC001559489581 1059267539 /nfs/dbraw/zinc/26/75/39/1059267539.db2.gz XJXXPWKCYBXMQS-HXUWFJFHSA-N 2 1 324.553 4.026 20 0 DIADMP CC(C)Cc1ccccc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC001559523843 1059319477 /nfs/dbraw/zinc/31/94/77/1059319477.db2.gz HYTXFNPPSFYSOX-UHFFFAOYSA-N 2 1 316.533 4.437 20 0 DIADMP CC[C@@H](CC(F)F)C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001559524829 1059323094 /nfs/dbraw/zinc/32/30/94/1059323094.db2.gz RNMIFPCLJNKMKG-DLBZAZTESA-N 2 1 316.480 4.256 20 0 DIADMP CCc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC001559524753 1059323204 /nfs/dbraw/zinc/32/32/04/1059323204.db2.gz PCLLZOIQXBYHDT-NRFANRHFSA-N 2 1 314.517 4.337 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC001559545857 1059347143 /nfs/dbraw/zinc/34/71/43/1059347143.db2.gz ICBHBCBBZJJBMR-ZRNYENFQSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)C1 ZINC001559545857 1059347165 /nfs/dbraw/zinc/34/71/65/1059347165.db2.gz ICBHBCBBZJJBMR-ZRNYENFQSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC001559545857 1059347185 /nfs/dbraw/zinc/34/71/85/1059347185.db2.gz ICBHBCBBZJJBMR-ZRNYENFQSA-N 2 1 306.538 4.399 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[N@H+](CC)CCCn1cc[nH+]c1C ZINC001559560378 1059380512 /nfs/dbraw/zinc/38/05/12/1059380512.db2.gz KFYOOGRHJPNQNL-FQEVSTJZSA-N 2 1 313.489 4.233 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)CCCn1cc[nH+]c1C ZINC001559560378 1059380533 /nfs/dbraw/zinc/38/05/33/1059380533.db2.gz KFYOOGRHJPNQNL-FQEVSTJZSA-N 2 1 313.489 4.233 20 0 DIADMP C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001559560584 1059382505 /nfs/dbraw/zinc/38/25/05/1059382505.db2.gz NQSQVLKXXAPLLP-QZTJIDSGSA-N 2 1 300.490 4.293 20 0 DIADMP C[N@@H+](CCCC(C)(C)C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001559565968 1059392354 /nfs/dbraw/zinc/39/23/54/1059392354.db2.gz VQOJZSQFCSNBLN-IBGZPJMESA-N 2 1 302.506 4.267 20 0 DIADMP C[NH+](CCCC(C)(C)C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001559565968 1059392375 /nfs/dbraw/zinc/39/23/75/1059392375.db2.gz VQOJZSQFCSNBLN-IBGZPJMESA-N 2 1 302.506 4.267 20 0 DIADMP C[NH+](CCCC(C)(C)C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001559565968 1059392396 /nfs/dbraw/zinc/39/23/96/1059392396.db2.gz VQOJZSQFCSNBLN-IBGZPJMESA-N 2 1 302.506 4.267 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC001559584261 1059416312 /nfs/dbraw/zinc/41/63/12/1059416312.db2.gz GTZHKZWJPCZCEG-BPQIPLTHSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC001559584261 1059416326 /nfs/dbraw/zinc/41/63/26/1059416326.db2.gz GTZHKZWJPCZCEG-BPQIPLTHSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1 ZINC001559584261 1059416336 /nfs/dbraw/zinc/41/63/36/1059416336.db2.gz GTZHKZWJPCZCEG-BPQIPLTHSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001559584261 1059416348 /nfs/dbraw/zinc/41/63/48/1059416348.db2.gz GTZHKZWJPCZCEG-BPQIPLTHSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001559584261 1059416362 /nfs/dbraw/zinc/41/63/62/1059416362.db2.gz GTZHKZWJPCZCEG-BPQIPLTHSA-N 2 1 320.546 4.138 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H]2CCC3(CCCCCC3)O2)C[C@H]1C ZINC001559584685 1059418098 /nfs/dbraw/zinc/41/80/98/1059418098.db2.gz UMVOPAMFQWGWRI-QYZOEREBSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)C[C@H]1C ZINC001559584685 1059418115 /nfs/dbraw/zinc/41/81/15/1059418115.db2.gz UMVOPAMFQWGWRI-QYZOEREBSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)C[C@H]1C ZINC001559584685 1059418119 /nfs/dbraw/zinc/41/81/19/1059418119.db2.gz UMVOPAMFQWGWRI-QYZOEREBSA-N 2 1 322.537 4.063 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001559660560 1059490378 /nfs/dbraw/zinc/49/03/78/1059490378.db2.gz XDYBMZRCOJKMFY-WIYYLYMNSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001559660560 1059490386 /nfs/dbraw/zinc/49/03/86/1059490386.db2.gz XDYBMZRCOJKMFY-WIYYLYMNSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001559660560 1059490393 /nfs/dbraw/zinc/49/03/93/1059490393.db2.gz XDYBMZRCOJKMFY-WIYYLYMNSA-N 2 1 312.501 4.259 20 0 DIADMP C[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)CCC1CC1 ZINC001559660911 1059492887 /nfs/dbraw/zinc/49/28/87/1059492887.db2.gz GYWCGTLSLKEIKE-UHFFFAOYSA-N 2 1 314.517 4.063 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCCC1(C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737883 1059569114 /nfs/dbraw/zinc/56/91/14/1059569114.db2.gz PSVHPVQTJNQIBI-OKZBNKHCSA-N 2 1 306.538 4.445 20 0 DIADMP c1cc(C[N@H+](CC2CC2)C2CCC2)cc(C[NH+]2CCCCC2)c1 ZINC001559789004 1059624985 /nfs/dbraw/zinc/62/49/85/1059624985.db2.gz ZFQSFHLMXNWOJD-UHFFFAOYSA-N 2 1 312.501 4.437 20 0 DIADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCCc1cccc3ccccc31)C2 ZINC001559852652 1059677120 /nfs/dbraw/zinc/67/71/20/1059677120.db2.gz WNKZADBLUOSFOL-JOCHJYFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCCc1cccc3ccccc31)C2 ZINC001559852652 1059677132 /nfs/dbraw/zinc/67/71/32/1059677132.db2.gz WNKZADBLUOSFOL-JOCHJYFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCCc1cccc3ccccc31)C2 ZINC001559852652 1059677141 /nfs/dbraw/zinc/67/71/41/1059677141.db2.gz WNKZADBLUOSFOL-JOCHJYFZSA-N 2 1 322.496 4.190 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC001559911513 1059728304 /nfs/dbraw/zinc/72/83/04/1059728304.db2.gz LTZDQYMPGDUGKC-UXHICEINSA-N 2 1 302.506 4.377 20 0 DIADMP CC1(C)C[C@@H](c2ccccc2)[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001559932001 1059743065 /nfs/dbraw/zinc/74/30/65/1059743065.db2.gz UXGHMBDHUGQLMH-IBGZPJMESA-N 2 1 300.490 4.336 20 0 DIADMP Cc1ccc(C[N@H+](CC[C@H]2CCC[NH+]2C)CC(C)C)c(C)c1 ZINC001559935106 1059747482 /nfs/dbraw/zinc/74/74/82/1059747482.db2.gz AHOYTCOOWAZHTR-HXUWFJFHSA-N 2 1 302.506 4.246 20 0 DIADMP Cc1ccc(C[NH+](CC[C@H]2CCC[N@@H+]2C)CC(C)C)c(C)c1 ZINC001559935106 1059747500 /nfs/dbraw/zinc/74/75/00/1059747500.db2.gz AHOYTCOOWAZHTR-HXUWFJFHSA-N 2 1 302.506 4.246 20 0 DIADMP Cc1ccc(C[NH+](CC[C@H]2CCC[N@H+]2C)CC(C)C)c(C)c1 ZINC001559935106 1059747515 /nfs/dbraw/zinc/74/75/15/1059747515.db2.gz AHOYTCOOWAZHTR-HXUWFJFHSA-N 2 1 302.506 4.246 20 0 DIADMP CCCC[N@@H+](CCc1cscn1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001560035623 1059845111 /nfs/dbraw/zinc/84/51/11/1059845111.db2.gz AYNVQMQALMZZRH-UHFFFAOYSA-N 2 1 323.550 4.097 20 0 DIADMP C[NH+]1C[C@]2(C)C[NH+](CCCc3cccc4ccccc43)C[C@@]2(C)C1 ZINC001560043728 1059855190 /nfs/dbraw/zinc/85/51/90/1059855190.db2.gz ITHCTGIESHLESU-FGZHOGPDSA-N 2 1 322.496 4.046 20 0 DIADMP C[N@@H+]1C[C@]2(C)C[NH+](CCCc3cccc4ccccc43)C[C@]2(C)C1 ZINC001560043729 1059856068 /nfs/dbraw/zinc/85/60/68/1059856068.db2.gz ITHCTGIESHLESU-SZPZYZBQSA-N 2 1 322.496 4.046 20 0 DIADMP C[N@H+]1C[C@]2(C)C[NH+](CCCc3cccc4ccccc43)C[C@]2(C)C1 ZINC001560043729 1059856094 /nfs/dbraw/zinc/85/60/94/1059856094.db2.gz ITHCTGIESHLESU-SZPZYZBQSA-N 2 1 322.496 4.046 20 0 DIADMP C[NH+]1C[C@]2(C)C[N@H+](CCCc3cccc4ccccc43)C[C@]2(C)C1 ZINC001560043729 1059856128 /nfs/dbraw/zinc/85/61/28/1059856128.db2.gz ITHCTGIESHLESU-SZPZYZBQSA-N 2 1 322.496 4.046 20 0 DIADMP C[NH+]1C[C@]2(C)C[N@@H+](CCCc3cccc4ccccc43)C[C@]2(C)C1 ZINC001560043729 1059856163 /nfs/dbraw/zinc/85/61/63/1059856163.db2.gz ITHCTGIESHLESU-SZPZYZBQSA-N 2 1 322.496 4.046 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H]2CC[NH+]2CCC(C)CC2)c(C)s1 ZINC001560068910 1059880621 /nfs/dbraw/zinc/88/06/21/1059880621.db2.gz IRBZZJYVNGZHFK-LJQANCHMSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cccc(CCC[N@H+](CC(C)C)CC2CC[NH+](C)CC2)c1 ZINC001560090964 1059900428 /nfs/dbraw/zinc/90/04/28/1059900428.db2.gz VZMSOXJHJKEERB-UHFFFAOYSA-N 2 1 316.533 4.227 20 0 DIADMP COc1ccc(Cl)cc1C[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001560099932 1059905163 /nfs/dbraw/zinc/90/51/63/1059905163.db2.gz ASCLENAQKYPVFT-UHFFFAOYSA-N 2 1 324.896 4.047 20 0 DIADMP CC[NH+](CC)[C@@H](C[NH2+]C1CCc2ccccc2CC1)CC(C)C ZINC001560260618 1060030701 /nfs/dbraw/zinc/03/07/01/1060030701.db2.gz NAQNHMVGFKUTIK-OAQYLSRUSA-N 2 1 316.533 4.280 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001560263551 1060033029 /nfs/dbraw/zinc/03/30/29/1060033029.db2.gz AEHYZHIMAVSPMK-FQEVSTJZSA-N 2 1 314.517 4.383 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001560263551 1060033045 /nfs/dbraw/zinc/03/30/45/1060033045.db2.gz AEHYZHIMAVSPMK-FQEVSTJZSA-N 2 1 314.517 4.383 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@@H](C)[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266643 1060037795 /nfs/dbraw/zinc/03/77/95/1060037795.db2.gz LAQRBNBDFWJMEJ-QWFCFKBJSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@@H](C)[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266643 1060037813 /nfs/dbraw/zinc/03/78/13/1060037813.db2.gz LAQRBNBDFWJMEJ-QWFCFKBJSA-N 2 1 302.506 4.136 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)c1 ZINC001560269547 1060041071 /nfs/dbraw/zinc/04/10/71/1060041071.db2.gz HRKDRCXHLCSEBZ-HDICACEKSA-N 2 1 302.506 4.151 20 0 DIADMP C[NH+](C)[C@@H](C[NH2+]CC(C)(C)c1ccccc1)C1CCCCC1 ZINC001560270081 1060041298 /nfs/dbraw/zinc/04/12/98/1060041298.db2.gz FGSQOWQANHDXQO-IBGZPJMESA-N 2 1 302.506 4.064 20 0 DIADMP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](Cc1ccc(C3CCCCC3)cc1)C2 ZINC001248887170 1060042409 /nfs/dbraw/zinc/04/24/09/1060042409.db2.gz AVEZSUOSUZAKLB-NHCUHLMSSA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+](Cc1ccc(C3CCCCC3)cc1)C2 ZINC001248887170 1060042430 /nfs/dbraw/zinc/04/24/30/1060042430.db2.gz AVEZSUOSUZAKLB-NHCUHLMSSA-N 2 1 312.501 4.118 20 0 DIADMP C[C@@H]1CCC[C@@](C[NH2+][C@H]2CCCc3ccccc3C2)([NH+](C)C)C1 ZINC001560285827 1060064925 /nfs/dbraw/zinc/06/49/25/1060064925.db2.gz JTWJUQGRRWADJO-JRGCBEDISA-N 2 1 314.517 4.034 20 0 DIADMP CN1CCC([N@@H+](Cc2cccc3c2CCC3)C2CCCC2)CC1 ZINC001249459420 1060254654 /nfs/dbraw/zinc/25/46/54/1060254654.db2.gz SYTZDGHSUAFXFR-UHFFFAOYSA-N 2 1 312.501 4.014 20 0 DIADMP c1cnc2cccc(C[NH2+]C[C@@H]3CC[N@@H+]3C3CCCCCC3)c2c1 ZINC001560562101 1060372850 /nfs/dbraw/zinc/37/28/50/1060372850.db2.gz KEHNXQSCNKMEAZ-IBGZPJMESA-N 2 1 323.484 4.122 20 0 DIADMP c1cnc2cccc(C[NH2+]C[C@@H]3CC[N@H+]3C3CCCCCC3)c2c1 ZINC001560562101 1060372861 /nfs/dbraw/zinc/37/28/61/1060372861.db2.gz KEHNXQSCNKMEAZ-IBGZPJMESA-N 2 1 323.484 4.122 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637358 1060451740 /nfs/dbraw/zinc/45/17/40/1060451740.db2.gz ARRBZVGBDMEHCD-YOEHRIQHSA-N 2 1 306.494 4.048 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637358 1060451751 /nfs/dbraw/zinc/45/17/51/1060451751.db2.gz ARRBZVGBDMEHCD-YOEHRIQHSA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637358 1060451767 /nfs/dbraw/zinc/45/17/67/1060451767.db2.gz ARRBZVGBDMEHCD-YOEHRIQHSA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637358 1060451775 /nfs/dbraw/zinc/45/17/75/1060451775.db2.gz ARRBZVGBDMEHCD-YOEHRIQHSA-N 2 1 306.494 4.048 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC001560640480 1060456559 /nfs/dbraw/zinc/45/65/59/1060456559.db2.gz RCPLMDNTDTXPCE-KWOGNLBTSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC001560640480 1060456571 /nfs/dbraw/zinc/45/65/71/1060456571.db2.gz RCPLMDNTDTXPCE-KWOGNLBTSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC001560640480 1060456582 /nfs/dbraw/zinc/45/65/82/1060456582.db2.gz RCPLMDNTDTXPCE-KWOGNLBTSA-N 2 1 318.549 4.398 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCCC[C@H]2/C=C/c2ccccc2)CC1 ZINC001560648424 1060471188 /nfs/dbraw/zinc/47/11/88/1060471188.db2.gz OYSOBRGVFPBWJI-VIOKTNGOSA-N 2 1 312.501 4.286 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCc2ccc(C(C)(C)C)cc2)C1 ZINC001560661411 1060487778 /nfs/dbraw/zinc/48/77/78/1060487778.db2.gz CFSYYEMTHOGECN-IBGZPJMESA-N 2 1 316.533 4.190 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](C[C@H](C)c2cccc(Cl)c2)CC1 ZINC001560680601 1060523149 /nfs/dbraw/zinc/52/31/49/1060523149.db2.gz HZFLDQIZLNFVIO-INIZCTEOSA-N 2 1 322.924 4.496 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC001560680997 1060523326 /nfs/dbraw/zinc/52/33/26/1060523326.db2.gz RVIYDHBXUWTFHX-LEWJYISDSA-N 2 1 314.517 4.303 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC001560680997 1060523338 /nfs/dbraw/zinc/52/33/38/1060523338.db2.gz RVIYDHBXUWTFHX-LEWJYISDSA-N 2 1 314.517 4.303 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2c(C)cc(Cl)cc2C)CC1 ZINC001560680556 1060524899 /nfs/dbraw/zinc/52/48/99/1060524899.db2.gz GBCKDFXZEGPTQR-UHFFFAOYSA-N 2 1 308.897 4.263 20 0 DIADMP CC(C)c1ccc(C[C@@H]2CC[N@@H+](CC3CC[NH+](C)CC3)C2)cc1 ZINC001560731976 1060600711 /nfs/dbraw/zinc/60/07/11/1060600711.db2.gz AFBJLMNWAPWKEI-FQEVSTJZSA-N 2 1 314.517 4.016 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001560749497 1060615779 /nfs/dbraw/zinc/61/57/79/1060615779.db2.gz HRKOZYBALRDYBT-BJLQDIEVSA-N 2 1 314.517 4.169 20 0 DIADMP CC[C@@H](C[N@@H+](CC)CC1CC[NH+](CC)CC1)c1ccccc1 ZINC001560771646 1060636740 /nfs/dbraw/zinc/63/67/40/1060636740.db2.gz BYVXPLRJWLGLEP-IBGZPJMESA-N 2 1 302.506 4.234 20 0 DIADMP C([NH2+][C@H]1CCCC[C@@H]1C1CC1)[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791758 1060651417 /nfs/dbraw/zinc/65/14/17/1060651417.db2.gz QEBHZLVHEFEFKT-AQNXPRMDSA-N 2 1 304.522 4.342 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)CC(C(C)C)C(C)C ZINC001560811043 1060669019 /nfs/dbraw/zinc/66/90/19/1060669019.db2.gz WFYKYLRMKYDNPJ-UHFFFAOYSA-N 2 1 304.522 4.498 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CCCC(C)(C)C1 ZINC001560813174 1060671928 /nfs/dbraw/zinc/67/19/28/1060671928.db2.gz PRGKGXCSYLAIDF-QGZVFWFLSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CCCC(C)(C)C1 ZINC001560813174 1060671936 /nfs/dbraw/zinc/67/19/36/1060671936.db2.gz PRGKGXCSYLAIDF-QGZVFWFLSA-N 2 1 305.510 4.374 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC001560844822 1060699641 /nfs/dbraw/zinc/69/96/41/1060699641.db2.gz BUIWDGXNXDLKCH-HKBOAZHASA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560869401 1060730418 /nfs/dbraw/zinc/73/04/18/1060730418.db2.gz GRVOWEKUOVMRFB-IHPCNDPISA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560869401 1060730428 /nfs/dbraw/zinc/73/04/28/1060730428.db2.gz GRVOWEKUOVMRFB-IHPCNDPISA-N 2 1 302.506 4.207 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001560871864 1060733629 /nfs/dbraw/zinc/73/36/29/1060733629.db2.gz UNXJRDZMMCGHNW-RTWAWAEBSA-N 2 1 312.501 4.377 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC001560877991 1060739529 /nfs/dbraw/zinc/73/95/29/1060739529.db2.gz JFZOWEZGLDTVPM-SCCNAQOGSA-N 2 1 314.517 4.282 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]CC[N@@H+]1CCCC1(C)C ZINC001560882417 1060744247 /nfs/dbraw/zinc/74/42/47/1060744247.db2.gz KOKRJNCMVIRFJD-QGZVFWFLSA-N 2 1 308.897 4.125 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]CC[N@H+]1CCCC1(C)C ZINC001560882417 1060744260 /nfs/dbraw/zinc/74/42/60/1060744260.db2.gz KOKRJNCMVIRFJD-QGZVFWFLSA-N 2 1 308.897 4.125 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CC(C)(C)C[C@H]2c2ccccc2)CC1 ZINC001560898669 1060762421 /nfs/dbraw/zinc/76/24/21/1060762421.db2.gz PLHAYCNFPGMUHF-IBGZPJMESA-N 2 1 300.490 4.192 20 0 DIADMP CC(C)C1CCC(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)CC1 ZINC001561045035 1060896908 /nfs/dbraw/zinc/89/69/08/1060896908.db2.gz CGJWUDBRZRAAPN-GNWGEKMJSA-N 2 1 306.538 4.111 20 0 DIADMP C[C@@H](C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1)c1cccc(Cl)c1 ZINC001561052231 1060900864 /nfs/dbraw/zinc/90/08/64/1060900864.db2.gz VUAQSZSQQHUHGY-AWEZNQCLSA-N 2 1 308.897 4.296 20 0 DIADMP CC(C)C[C@H](C)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203039 1060964668 /nfs/dbraw/zinc/96/46/68/1060964668.db2.gz GMRDUMWJNZZQMU-PZJWPPBQSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203039 1060964695 /nfs/dbraw/zinc/96/46/95/1060964695.db2.gz GMRDUMWJNZZQMU-PZJWPPBQSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203039 1060964713 /nfs/dbraw/zinc/96/47/13/1060964713.db2.gz GMRDUMWJNZZQMU-PZJWPPBQSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203039 1060964734 /nfs/dbraw/zinc/96/47/34/1060964734.db2.gz GMRDUMWJNZZQMU-PZJWPPBQSA-N 2 1 314.517 4.409 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@@H]2CCC[C@@H]21 ZINC001462145363 1060966967 /nfs/dbraw/zinc/96/69/67/1060966967.db2.gz FBFADZGBUUWMMX-MUGJNUQGSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@@H]2CCC[C@@H]21 ZINC001462145363 1060966984 /nfs/dbraw/zinc/96/69/84/1060966984.db2.gz FBFADZGBUUWMMX-MUGJNUQGSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[C@H](C)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203071 1060970276 /nfs/dbraw/zinc/97/02/76/1060970276.db2.gz HMWPDPBYYRPDQZ-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203071 1060970295 /nfs/dbraw/zinc/97/02/95/1060970295.db2.gz HMWPDPBYYRPDQZ-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203071 1060970313 /nfs/dbraw/zinc/97/03/13/1060970313.db2.gz HMWPDPBYYRPDQZ-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203071 1060970332 /nfs/dbraw/zinc/97/03/32/1060970332.db2.gz HMWPDPBYYRPDQZ-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC001473211450 1060982633 /nfs/dbraw/zinc/98/26/33/1060982633.db2.gz YUJYIQKTESWJGG-ZSXPUABSSA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC001473211450 1060982652 /nfs/dbraw/zinc/98/26/52/1060982652.db2.gz YUJYIQKTESWJGG-ZSXPUABSSA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC001473211450 1060982671 /nfs/dbraw/zinc/98/26/71/1060982671.db2.gz YUJYIQKTESWJGG-ZSXPUABSSA-N 2 1 314.517 4.375 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC001473219441 1060994586 /nfs/dbraw/zinc/99/45/86/1060994586.db2.gz HHFFIBDZTBYHTG-DBVUQKKJSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC001473219441 1060994602 /nfs/dbraw/zinc/99/46/02/1060994602.db2.gz HHFFIBDZTBYHTG-DBVUQKKJSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC001473219441 1060994616 /nfs/dbraw/zinc/99/46/16/1060994616.db2.gz HHFFIBDZTBYHTG-DBVUQKKJSA-N 2 1 300.490 4.287 20 0 DIADMP Cc1ccc2cc(C[N@H+](C)Cc3ccc(C[NH+](C)C)cc3)[nH]c2c1 ZINC001462192407 1061013940 /nfs/dbraw/zinc/01/39/40/1061013940.db2.gz OJXLJILFOWJXRK-UHFFFAOYSA-N 2 1 321.468 4.170 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(C)c1F ZINC001462192669 1061013993 /nfs/dbraw/zinc/01/39/93/1061013993.db2.gz PNHGAWRKRSDGLR-UHFFFAOYSA-N 2 1 314.448 4.218 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462215796 1061032355 /nfs/dbraw/zinc/03/23/55/1061032355.db2.gz BPJAJHWCEALMOF-ZCNNSNEGSA-N 2 1 300.490 4.095 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462215796 1061032369 /nfs/dbraw/zinc/03/23/69/1061032369.db2.gz BPJAJHWCEALMOF-ZCNNSNEGSA-N 2 1 300.490 4.095 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC001473262430 1061037113 /nfs/dbraw/zinc/03/71/13/1061037113.db2.gz JZIHMOORBUKALP-HXUWFJFHSA-N 2 1 313.489 4.427 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC001473262430 1061037121 /nfs/dbraw/zinc/03/71/21/1061037121.db2.gz JZIHMOORBUKALP-HXUWFJFHSA-N 2 1 313.489 4.427 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001462271643 1061065692 /nfs/dbraw/zinc/06/56/92/1061065692.db2.gz YCJAFAYUZJAVNG-WCIQWLHISA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001462271639 1061066209 /nfs/dbraw/zinc/06/62/09/1061066209.db2.gz YCJAFAYUZJAVNG-HAGHYFMRSA-N 2 1 306.538 4.445 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001462296885 1061085334 /nfs/dbraw/zinc/08/53/34/1061085334.db2.gz GUHSUOSEYGTBLX-QGZVFWFLSA-N 2 1 304.522 4.237 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001462296885 1061085345 /nfs/dbraw/zinc/08/53/45/1061085345.db2.gz GUHSUOSEYGTBLX-QGZVFWFLSA-N 2 1 304.522 4.237 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+]C1CCC(c2ccc(O)cc2)CC1 ZINC001462303896 1061090724 /nfs/dbraw/zinc/09/07/24/1061090724.db2.gz DWVSOJUHQUADCT-MUYFXNHWSA-N 2 1 318.505 4.128 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+]C1CCC(c2ccc(O)cc2)CC1 ZINC001462303896 1061090729 /nfs/dbraw/zinc/09/07/29/1061090729.db2.gz DWVSOJUHQUADCT-MUYFXNHWSA-N 2 1 318.505 4.128 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001473368831 1061116251 /nfs/dbraw/zinc/11/62/51/1061116251.db2.gz BMFFTTGEAASQGE-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP CCC(CC)(CC)C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001462367257 1061132660 /nfs/dbraw/zinc/13/26/60/1061132660.db2.gz LJJCDAPEGZUULW-MOPGFXCFSA-N 2 1 302.506 4.138 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H]1CC(C)(C)CCc2ccccc21 ZINC001473416776 1061148409 /nfs/dbraw/zinc/14/84/09/1061148409.db2.gz UONHLYFSCLCZMW-LJQANCHMSA-N 2 1 311.473 4.046 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001462407370 1061153993 /nfs/dbraw/zinc/15/39/93/1061153993.db2.gz WNRYULFWNYBILY-WOJBJXKFSA-N 2 1 302.506 4.064 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001462407367 1061154204 /nfs/dbraw/zinc/15/42/04/1061154204.db2.gz WNRYULFWNYBILY-VQTJNVASSA-N 2 1 302.506 4.064 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CCCC3(CC[NH+](C)CC3)C2)C[C@@H](C)C1 ZINC001473426908 1061155634 /nfs/dbraw/zinc/15/56/34/1061155634.db2.gz MHGQRCQTLBLNII-BWTSREIZSA-N 2 1 306.538 4.257 20 0 DIADMP C[C@@H]1CC(CC[N@H+]2CCCC3(CC[NH+](C)CC3)C2)C[C@@H](C)C1 ZINC001473426910 1061156619 /nfs/dbraw/zinc/15/66/19/1061156619.db2.gz MHGQRCQTLBLNII-ROUUACIJSA-N 2 1 306.538 4.257 20 0 DIADMP CCc1ccc([C@H]2CCC[N@@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC001473449074 1061165663 /nfs/dbraw/zinc/16/56/63/1061165663.db2.gz DEUMNDCSRLRRPR-NRFANRHFSA-N 2 1 314.517 4.304 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001462439103 1061174193 /nfs/dbraw/zinc/17/41/93/1061174193.db2.gz KWVUVPCYXNEXGL-OALUTQOASA-N 2 1 300.490 4.004 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001462439103 1061174202 /nfs/dbraw/zinc/17/42/02/1061174202.db2.gz KWVUVPCYXNEXGL-OALUTQOASA-N 2 1 300.490 4.004 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)C1 ZINC001462437887 1061174310 /nfs/dbraw/zinc/17/43/10/1061174310.db2.gz NMFAYMAKYXCDQD-SZVBFZGTSA-N 2 1 320.908 4.298 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444768 1061177427 /nfs/dbraw/zinc/17/74/27/1061177427.db2.gz TXVFICCQUSLYTE-QAPCUYQASA-N 2 1 320.908 4.440 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444768 1061177436 /nfs/dbraw/zinc/17/74/36/1061177436.db2.gz TXVFICCQUSLYTE-QAPCUYQASA-N 2 1 320.908 4.440 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444769 1061177579 /nfs/dbraw/zinc/17/75/79/1061177579.db2.gz TXVFICCQUSLYTE-YJBOKZPZSA-N 2 1 320.908 4.440 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444769 1061177584 /nfs/dbraw/zinc/17/75/84/1061177584.db2.gz TXVFICCQUSLYTE-YJBOKZPZSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC001462443650 1061177768 /nfs/dbraw/zinc/17/77/68/1061177768.db2.gz YOVIMIWGGQVCLL-SCCNAQOGSA-N 2 1 314.517 4.282 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)c1 ZINC001473489934 1061187022 /nfs/dbraw/zinc/18/70/22/1061187022.db2.gz JVVMOLZIEWXZKM-JOCHJYFZSA-N 2 1 322.496 4.374 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c1 ZINC001473489934 1061187034 /nfs/dbraw/zinc/18/70/34/1061187034.db2.gz JVVMOLZIEWXZKM-JOCHJYFZSA-N 2 1 322.496 4.374 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c1 ZINC001473489934 1061187044 /nfs/dbraw/zinc/18/70/44/1061187044.db2.gz JVVMOLZIEWXZKM-JOCHJYFZSA-N 2 1 322.496 4.374 20 0 DIADMP CC(C)(C[NH+]1CCCC1)[NH2+]C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001473558338 1061245641 /nfs/dbraw/zinc/24/56/41/1061245641.db2.gz QWHOJGAFGLUTKC-IEBWSBKVSA-N 2 1 300.490 4.034 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@@H](C)[C@@H]1CCCCO1)c1ccccc1 ZINC001462674218 1061332253 /nfs/dbraw/zinc/33/22/53/1061332253.db2.gz KIOSOGLYYZUHDJ-IHPCNDPISA-N 2 1 318.505 4.007 20 0 DIADMP CCCC[N@H+](Cc1cnc(CC)o1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001473684033 1061343497 /nfs/dbraw/zinc/34/34/97/1061343497.db2.gz XMSAZDJRMKRHAI-UHFFFAOYSA-N 2 1 321.509 4.148 20 0 DIADMP CCCC[N@@H+](Cc1cnc(CC)o1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001473684033 1061343517 /nfs/dbraw/zinc/34/35/17/1061343517.db2.gz XMSAZDJRMKRHAI-UHFFFAOYSA-N 2 1 321.509 4.148 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC001473691559 1061350360 /nfs/dbraw/zinc/35/03/60/1061350360.db2.gz XFCLQFHJMGQBEN-UHFFFAOYSA-N 2 1 322.905 4.485 20 0 DIADMP C[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724610 1061370208 /nfs/dbraw/zinc/37/02/08/1061370208.db2.gz DLFXBCCMHXVWKA-KXBFYZLASA-N 2 1 314.860 4.019 20 0 DIADMP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724610 1061370224 /nfs/dbraw/zinc/37/02/24/1061370224.db2.gz DLFXBCCMHXVWKA-KXBFYZLASA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@H]2C[N@H+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724610 1061370244 /nfs/dbraw/zinc/37/02/44/1061370244.db2.gz DLFXBCCMHXVWKA-KXBFYZLASA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724610 1061370265 /nfs/dbraw/zinc/37/02/65/1061370265.db2.gz DLFXBCCMHXVWKA-KXBFYZLASA-N 2 1 314.860 4.019 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccc(F)c(Cl)c1 ZINC001473749630 1061391317 /nfs/dbraw/zinc/39/13/17/1061391317.db2.gz NMFIAEASTKIKTG-UHFFFAOYSA-N 2 1 312.860 4.177 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CCN(c3cc[nH+]cc3)C[C@@H]2C)c(C)c1 ZINC001473809776 1061418008 /nfs/dbraw/zinc/41/80/08/1061418008.db2.gz QNVNPZMTZWBGPQ-RBUKOAKNSA-N 2 1 323.484 4.279 20 0 DIADMP CC1(C)C[C@@H](c2ccccc2)C[N@H+]1CCC[NH+]1CCCCC1 ZINC001473845880 1061432088 /nfs/dbraw/zinc/43/20/88/1061432088.db2.gz OAIBGFZVHGXJDF-LJQANCHMSA-N 2 1 300.490 4.131 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+]Cc1cc(C(C)(C)C)oc1C ZINC001473908224 1061456835 /nfs/dbraw/zinc/45/68/35/1061456835.db2.gz CQEDHPWVFCUATC-UHFFFAOYSA-N 2 1 308.510 4.487 20 0 DIADMP CCc1cc(OC)ccc1C[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC001473910212 1061457958 /nfs/dbraw/zinc/45/79/58/1061457958.db2.gz GOCNSHNKNZORTP-UHFFFAOYSA-N 2 1 318.505 4.002 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC1(C)C ZINC001473921468 1061471000 /nfs/dbraw/zinc/47/10/00/1061471000.db2.gz MRCDLQQFXVQKDS-SFTDATJTSA-N 2 1 322.496 4.433 20 0 DIADMP CC(C)[N@@H+](C)CCCNCc1cc(C(F)(F)F)ccc1Cl ZINC001473928648 1061475982 /nfs/dbraw/zinc/47/59/82/1061475982.db2.gz YHWVLUXTMUXZQQ-UHFFFAOYSA-N 2 1 322.802 4.179 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC(C)(C)C1 ZINC001473929456 1061477313 /nfs/dbraw/zinc/47/73/13/1061477313.db2.gz IMTXGXDAJCVWSS-PXNSSMCTSA-N 2 1 314.517 4.239 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC(C)(C)C1 ZINC001473929456 1061477319 /nfs/dbraw/zinc/47/73/19/1061477319.db2.gz IMTXGXDAJCVWSS-PXNSSMCTSA-N 2 1 314.517 4.239 20 0 DIADMP CCCc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001473935317 1061480541 /nfs/dbraw/zinc/48/05/41/1061480541.db2.gz ZPQRHHQQKISCDL-KDURUIRLSA-N 2 1 316.533 4.487 20 0 DIADMP CCCc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)s1 ZINC001473936621 1061481609 /nfs/dbraw/zinc/48/16/09/1061481609.db2.gz DJZMQQRNZTUSCE-INIZCTEOSA-N 2 1 308.535 4.445 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001473935949 1061481880 /nfs/dbraw/zinc/48/18/80/1061481880.db2.gz RHKUAYOEUKQUGS-FWYSVENZSA-N 2 1 306.538 4.303 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc3ccccc3c2)C1 ZINC001473936052 1061481967 /nfs/dbraw/zinc/48/19/67/1061481967.db2.gz UPDUIZMHWSYVPB-HDICACEKSA-N 2 1 310.485 4.297 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(Cl)ccc1F ZINC001473937074 1061482772 /nfs/dbraw/zinc/48/27/72/1061482772.db2.gz KNGNVOGNKNOBKG-AWEZNQCLSA-N 2 1 312.860 4.223 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2scnc2c1 ZINC001473937273 1061483207 /nfs/dbraw/zinc/48/32/07/1061483207.db2.gz OWSVFBAYBTUHES-HNNXBMFYSA-N 2 1 317.502 4.041 20 0 DIADMP c1ccc(-c2ccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)cc2)cc1 ZINC001473940536 1061485309 /nfs/dbraw/zinc/48/53/09/1061485309.db2.gz HSGMHWJBOJNXDX-UHFFFAOYSA-N 2 1 320.480 4.318 20 0 DIADMP Cc1cccc(C2(C[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)CCCC2)c1 ZINC001473970943 1061515792 /nfs/dbraw/zinc/51/57/92/1061515792.db2.gz QAYMJCMKWKXZAB-LJQANCHMSA-N 2 1 314.517 4.269 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]CC2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC001474072892 1061618513 /nfs/dbraw/zinc/61/85/13/1061618513.db2.gz AHDBFZXXLPKNMT-GHTZIAJQSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@@H]1CCCc2ccccc2[C@H]1[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001474104657 1061653745 /nfs/dbraw/zinc/65/37/45/1061653745.db2.gz YIGWSSPBWNFAHA-AYBZRNKSSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)COc1ccccc1C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001474108763 1061658584 /nfs/dbraw/zinc/65/85/84/1061658584.db2.gz GBLJQKXMOMLPFB-GOSISDBHSA-N 2 1 318.505 4.076 20 0 DIADMP CCCCOc1ccccc1C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001474108946 1061659127 /nfs/dbraw/zinc/65/91/27/1061659127.db2.gz LWSIBNREZFHLIB-SFHVURJKSA-N 2 1 318.505 4.220 20 0 DIADMP C[C@H](C[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1)C[NH+](C)C ZINC001474161750 1061703770 /nfs/dbraw/zinc/70/37/70/1061703770.db2.gz DRYWPXJUMZPHMT-OAHLLOKOSA-N 2 1 316.876 4.294 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCCC2(CC2)C1 ZINC001474280925 1061849552 /nfs/dbraw/zinc/84/95/52/1061849552.db2.gz QIUNANUESNIGIG-IBGZPJMESA-N 2 1 314.517 4.457 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@@H]32)cc1 ZINC001474320313 1061897908 /nfs/dbraw/zinc/89/79/08/1061897908.db2.gz CFMDCTZEHWNPPJ-NNWRFLSQSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]32)cc1 ZINC001474320313 1061897926 /nfs/dbraw/zinc/89/79/26/1061897926.db2.gz CFMDCTZEHWNPPJ-NNWRFLSQSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]32)cc1 ZINC001474320313 1061897946 /nfs/dbraw/zinc/89/79/46/1061897946.db2.gz CFMDCTZEHWNPPJ-NNWRFLSQSA-N 2 1 324.512 4.329 20 0 DIADMP CCCOc1ccc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1C ZINC001474349966 1061958822 /nfs/dbraw/zinc/95/88/22/1061958822.db2.gz BNXLBLIFKKRRPA-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1C ZINC001474349966 1061958842 /nfs/dbraw/zinc/95/88/42/1061958842.db2.gz BNXLBLIFKKRRPA-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)cc1C ZINC001474349966 1061958864 /nfs/dbraw/zinc/95/88/64/1061958864.db2.gz BNXLBLIFKKRRPA-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@@H]2CCCC[N@H+]2C)cc1C ZINC001474349966 1061958887 /nfs/dbraw/zinc/95/88/87/1061958887.db2.gz BNXLBLIFKKRRPA-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC001474357718 1061976483 /nfs/dbraw/zinc/97/64/83/1061976483.db2.gz KRCIAJPXXHHNMX-HXUWFJFHSA-N 2 1 314.517 4.463 20 0 DIADMP C[NH+]1CCC(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)CC1 ZINC001474366449 1061996558 /nfs/dbraw/zinc/99/65/58/1061996558.db2.gz QXAQEDRVFXQBGO-UHFFFAOYSA-N 2 1 320.480 4.271 20 0 DIADMP Cc1nccn1CCCC[N@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001253940743 1062001743 /nfs/dbraw/zinc/00/17/43/1062001743.db2.gz CBOMKDGIIZXANQ-RTWAWAEBSA-N 2 1 323.484 4.373 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001253940743 1062001768 /nfs/dbraw/zinc/00/17/68/1062001768.db2.gz CBOMKDGIIZXANQ-RTWAWAEBSA-N 2 1 323.484 4.373 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001253940743 1062001795 /nfs/dbraw/zinc/00/17/95/1062001795.db2.gz CBOMKDGIIZXANQ-RTWAWAEBSA-N 2 1 323.484 4.373 20 0 DIADMP CC[N@@H+](CC[C@H]1CCC[NH+]1C)[C@@H](C)c1cc2ccccc2o1 ZINC001459348561 1062105452 /nfs/dbraw/zinc/10/54/52/1062105452.db2.gz YVSZSJGQVZPNKQ-DOTOQJQBSA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@@H+]1C)[C@@H](C)c1cc2ccccc2o1 ZINC001459348561 1062105460 /nfs/dbraw/zinc/10/54/60/1062105460.db2.gz YVSZSJGQVZPNKQ-DOTOQJQBSA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@H+]1C)[C@@H](C)c1cc2ccccc2o1 ZINC001459348561 1062105469 /nfs/dbraw/zinc/10/54/69/1062105469.db2.gz YVSZSJGQVZPNKQ-DOTOQJQBSA-N 2 1 300.446 4.300 20 0 DIADMP c1ccc2c(c1)CC[N@@H+](C1CC[NH+](C3CCC4(CC4)CC3)CC1)C2 ZINC001254445315 1062105709 /nfs/dbraw/zinc/10/57/09/1062105709.db2.gz KUYNVNWLHNJSBB-UHFFFAOYSA-N 2 1 324.512 4.232 20 0 DIADMP c1ccc2c(c1)CC[N@H+](C1CC[NH+](C3CCC4(CC4)CC3)CC1)C2 ZINC001254445315 1062105717 /nfs/dbraw/zinc/10/57/17/1062105717.db2.gz KUYNVNWLHNJSBB-UHFFFAOYSA-N 2 1 324.512 4.232 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001254492533 1062135222 /nfs/dbraw/zinc/13/52/22/1062135222.db2.gz VLPCQBJRBBIGGG-NRSPTQNISA-N 2 1 316.533 4.496 20 0 DIADMP COc1cccc(C[N@@H+](CCC[NH+]2CCCCC2)CC(C)C)c1 ZINC001459424482 1062142241 /nfs/dbraw/zinc/14/22/41/1062142241.db2.gz YDAKXQHIHNHJDH-UHFFFAOYSA-N 2 1 318.505 4.029 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]CCc2ccc(Oc3ccccc3)cc2)CC1 ZINC001254499342 1062143666 /nfs/dbraw/zinc/14/36/66/1062143666.db2.gz DGBVGDAQEVEBPS-LJQANCHMSA-N 2 1 324.468 4.095 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C2(c3ccccc3)CCCCCC2)CC1 ZINC001254501359 1062145680 /nfs/dbraw/zinc/14/56/80/1062145680.db2.gz SZYUEQBIFCAEFA-LJQANCHMSA-N 2 1 300.490 4.310 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001254510137 1062150023 /nfs/dbraw/zinc/15/00/23/1062150023.db2.gz LUQHDIMDDJECNA-FQEVSTJZSA-N 2 1 312.432 4.067 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+]2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001254520156 1062156519 /nfs/dbraw/zinc/15/65/19/1062156519.db2.gz MCGGEHWDIJSRFO-SFHVURJKSA-N 2 1 306.881 4.004 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2C[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001474481100 1062160124 /nfs/dbraw/zinc/16/01/24/1062160124.db2.gz VYEIGDRDFXKSKX-UYAOXDASSA-N 2 1 312.501 4.103 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CCC[NH+](C)CC1 ZINC001254532628 1062163471 /nfs/dbraw/zinc/16/34/71/1062163471.db2.gz VMIUMVWUTKBJSH-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@H]1CCC[N@H+](C)CC1 ZINC001254532628 1062163482 /nfs/dbraw/zinc/16/34/82/1062163482.db2.gz VMIUMVWUTKBJSH-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@H]1CCC[N@@H+](C)CC1 ZINC001254532628 1062163496 /nfs/dbraw/zinc/16/34/96/1062163496.db2.gz VMIUMVWUTKBJSH-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC(C(C)C)C(C)C)CC1 ZINC001474488552 1062166073 /nfs/dbraw/zinc/16/60/73/1062166073.db2.gz IIQKSRJIHIQWDB-UHFFFAOYSA-N 2 1 304.478 4.161 20 0 DIADMP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506044 1062187484 /nfs/dbraw/zinc/18/74/84/1062187484.db2.gz ZPBRPNKUARFRNG-NHCUHLMSSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506044 1062187492 /nfs/dbraw/zinc/18/74/92/1062187492.db2.gz ZPBRPNKUARFRNG-NHCUHLMSSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506044 1062187500 /nfs/dbraw/zinc/18/75/00/1062187500.db2.gz ZPBRPNKUARFRNG-NHCUHLMSSA-N 2 1 312.501 4.260 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)[C@H]1CCc2c1cccc2Cl ZINC001459571131 1062215436 /nfs/dbraw/zinc/21/54/36/1062215436.db2.gz FAELUBCFPQIXBO-KSSFIOAISA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)[C@H]1CCc2c1cccc2Cl ZINC001459571131 1062215455 /nfs/dbraw/zinc/21/54/55/1062215455.db2.gz FAELUBCFPQIXBO-KSSFIOAISA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)[C@H]1CCc2c1cccc2Cl ZINC001459571131 1062215472 /nfs/dbraw/zinc/21/54/72/1062215472.db2.gz FAELUBCFPQIXBO-KSSFIOAISA-N 2 1 306.881 4.134 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2c(C)ccc3ccccc32)C1 ZINC001459576693 1062219697 /nfs/dbraw/zinc/21/96/97/1062219697.db2.gz QNBAAIQYUAPBTI-SFHVURJKSA-N 2 1 310.485 4.312 20 0 DIADMP C[C@@H](C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583522 1062224348 /nfs/dbraw/zinc/22/43/48/1062224348.db2.gz VLNQBBNELMFCLK-PKOBYXMFSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@@H](C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583522 1062224369 /nfs/dbraw/zinc/22/43/69/1062224369.db2.gz VLNQBBNELMFCLK-PKOBYXMFSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@@H](C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583522 1062224394 /nfs/dbraw/zinc/22/43/94/1062224394.db2.gz VLNQBBNELMFCLK-PKOBYXMFSA-N 2 1 302.506 4.123 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCC2(C1)CCCCCC2 ZINC001459602146 1062240713 /nfs/dbraw/zinc/24/07/13/1062240713.db2.gz ZUMWCIKXBJJAHA-UHFFFAOYSA-N 2 1 303.494 4.408 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC2(C1)CCCCCC2 ZINC001459602146 1062240734 /nfs/dbraw/zinc/24/07/34/1062240734.db2.gz ZUMWCIKXBJJAHA-UHFFFAOYSA-N 2 1 303.494 4.408 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001474558292 1062261296 /nfs/dbraw/zinc/26/12/96/1062261296.db2.gz NRBKAWGRDVGTCJ-YSIASYRMSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001474558292 1062261315 /nfs/dbraw/zinc/26/13/15/1062261315.db2.gz NRBKAWGRDVGTCJ-YSIASYRMSA-N 2 1 302.506 4.207 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)C[C@@H](C)C1 ZINC001459625543 1062262134 /nfs/dbraw/zinc/26/21/34/1062262134.db2.gz TVWVEUZDBHMPHB-LCLWPZTBSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)C[C@@H](C)C1 ZINC001459625543 1062262150 /nfs/dbraw/zinc/26/21/50/1062262150.db2.gz TVWVEUZDBHMPHB-LCLWPZTBSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)C[C@@H](C)C1 ZINC001459625543 1062262177 /nfs/dbraw/zinc/26/21/77/1062262177.db2.gz TVWVEUZDBHMPHB-LCLWPZTBSA-N 2 1 306.538 4.113 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)CC1 ZINC001474566912 1062272623 /nfs/dbraw/zinc/27/26/23/1062272623.db2.gz UIXOTYIWJKTPRM-HXUWFJFHSA-N 2 1 312.501 4.336 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001255099711 1062314573 /nfs/dbraw/zinc/31/45/73/1062314573.db2.gz RQZHWLDTCKDNRQ-OXQOHEQNSA-N 2 1 319.452 4.108 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2CCCC24CCC4)C3)cc1 ZINC001255134829 1062328204 /nfs/dbraw/zinc/32/82/04/1062328204.db2.gz CZFOBHGPUCRIBJ-WOZUAGRISA-N 2 1 324.512 4.494 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC001474612792 1062328342 /nfs/dbraw/zinc/32/83/42/1062328342.db2.gz QTWALKDECAZDNJ-KRWDZBQOSA-N 2 1 315.505 4.057 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC001474612793 1062329416 /nfs/dbraw/zinc/32/94/16/1062329416.db2.gz QTWALKDECAZDNJ-QGZVFWFLSA-N 2 1 315.505 4.057 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135360 1062330111 /nfs/dbraw/zinc/33/01/11/1062330111.db2.gz JHVVJXZCNYOSPH-KZFHACJRSA-N 2 1 312.501 4.206 20 0 DIADMP CC(C)[NH+](C(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255135846 1062331316 /nfs/dbraw/zinc/33/13/16/1062331316.db2.gz FWIOPKMASOCGAG-ACDBMABISA-N 2 1 300.490 4.301 20 0 DIADMP CC(C)[NH+](C(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135846 1062331323 /nfs/dbraw/zinc/33/13/23/1062331323.db2.gz FWIOPKMASOCGAG-ACDBMABISA-N 2 1 300.490 4.301 20 0 DIADMP CC[N@@H+](CCC[NH2+]CC1Cc2ccccc2C1)C1CCCCC1 ZINC001474614735 1062333262 /nfs/dbraw/zinc/33/32/62/1062333262.db2.gz ANNPHCWAWFLORO-UHFFFAOYSA-N 2 1 314.517 4.036 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474617337 1062340844 /nfs/dbraw/zinc/34/08/44/1062340844.db2.gz ASZVBOGXECCEQN-PIPMEXSNSA-N 2 1 320.480 4.174 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)C2)cc1 ZINC001474634293 1062355820 /nfs/dbraw/zinc/35/58/20/1062355820.db2.gz QYRSIQIOEBFIGB-CUYAVPTFSA-N 2 1 316.464 4.068 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)C2)cc1 ZINC001474634293 1062355841 /nfs/dbraw/zinc/35/58/41/1062355841.db2.gz QYRSIQIOEBFIGB-CUYAVPTFSA-N 2 1 316.464 4.068 20 0 DIADMP CC1(c2ccccc2)CC([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001474634104 1062356802 /nfs/dbraw/zinc/35/68/02/1062356802.db2.gz OVQUFPVMPKQXDF-LWEYNCJUSA-N 2 1 312.501 4.103 20 0 DIADMP CC1(c2ccccc2)CC([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001474634104 1062356826 /nfs/dbraw/zinc/35/68/26/1062356826.db2.gz OVQUFPVMPKQXDF-LWEYNCJUSA-N 2 1 312.501 4.103 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC001459751356 1062362855 /nfs/dbraw/zinc/36/28/55/1062362855.db2.gz ZXAONUGSAUCGRY-RTWAWAEBSA-N 2 1 308.469 4.044 20 0 DIADMP Cc1oc2ccccc2c1C[N@@H+]1CCCC[C@H]1[C@H](C)C[NH+](C)C ZINC001474646985 1062374238 /nfs/dbraw/zinc/37/42/38/1062374238.db2.gz JQHPSCNYWFHOGG-BEFAXECRSA-N 2 1 314.473 4.293 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@H+]1CCCC[C@H]1[C@@H](C)C[NH+](C)C ZINC001474647168 1062375116 /nfs/dbraw/zinc/37/51/16/1062375116.db2.gz IEQBISBEOCZNGB-YJBOKZPZSA-N 2 1 320.521 4.438 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCCC[C@H]1[C@@H](C)C[NH+](C)C ZINC001474647168 1062375138 /nfs/dbraw/zinc/37/51/38/1062375138.db2.gz IEQBISBEOCZNGB-YJBOKZPZSA-N 2 1 320.521 4.438 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@H+]1CCCC[C@@H]1[C@H](C)C[NH+](C)C ZINC001474647165 1062375783 /nfs/dbraw/zinc/37/57/83/1062375783.db2.gz IEQBISBEOCZNGB-CRAIPNDOSA-N 2 1 320.521 4.438 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCCC[C@@H]1[C@H](C)C[NH+](C)C ZINC001474647165 1062375801 /nfs/dbraw/zinc/37/58/01/1062375801.db2.gz IEQBISBEOCZNGB-CRAIPNDOSA-N 2 1 320.521 4.438 20 0 DIADMP Cc1oc2ccccc2c1C[N@@H+]1CCCC[C@H]1[C@@H](C)C[NH+](C)C ZINC001474646988 1062376752 /nfs/dbraw/zinc/37/67/52/1062376752.db2.gz JQHPSCNYWFHOGG-KXBFYZLASA-N 2 1 314.473 4.293 20 0 DIADMP FC1(F)CCC([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255376320 1062417675 /nfs/dbraw/zinc/41/76/75/1062417675.db2.gz BBJWPQHFFQPCBM-QGZVFWFLSA-N 2 1 322.443 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@@H]3CCc4ccccc43)CC2)cc1 ZINC001255383287 1062421230 /nfs/dbraw/zinc/42/12/30/1062421230.db2.gz HAMWHZPAMDRACT-IFMALSPDSA-N 2 1 320.480 4.318 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC001459816621 1062423401 /nfs/dbraw/zinc/42/34/01/1062423401.db2.gz IFCKFOVHGLVNOU-LJQANCHMSA-N 2 1 306.469 4.379 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccncc1 ZINC001255392493 1062428087 /nfs/dbraw/zinc/42/80/87/1062428087.db2.gz FMRABEGNBSRIAD-NHCUHLMSSA-N 2 1 323.484 4.177 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC001255385515 1062428190 /nfs/dbraw/zinc/42/81/90/1062428190.db2.gz IFOOQAYJNADVCQ-FKBYEOEOSA-N 2 1 320.480 4.187 20 0 DIADMP CC[C@H](C)C[C@@H](C)[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255392559 1062428384 /nfs/dbraw/zinc/42/83/84/1062428384.db2.gz GPSGMLAPJDYFMO-NSHGMRRFSA-N 2 1 302.506 4.455 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCC34CCCCC4)CC2)cc1 ZINC001255400718 1062431898 /nfs/dbraw/zinc/43/18/98/1062431898.db2.gz MZJDHQCXCGEEJS-HXUWFJFHSA-N 2 1 312.501 4.450 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@@H+]3CCC34CCCCC4)CC2)cc1 ZINC001255400718 1062431906 /nfs/dbraw/zinc/43/19/06/1062431906.db2.gz MZJDHQCXCGEEJS-HXUWFJFHSA-N 2 1 312.501 4.450 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@H+]3CCC34CCCCC4)CC2)cc1 ZINC001255400718 1062431920 /nfs/dbraw/zinc/43/19/20/1062431920.db2.gz MZJDHQCXCGEEJS-HXUWFJFHSA-N 2 1 312.501 4.450 20 0 DIADMP C[C@@H]1CCCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398226 1062432122 /nfs/dbraw/zinc/43/21/22/1062432122.db2.gz ISVCFFODAZWABX-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398226 1062432130 /nfs/dbraw/zinc/43/21/30/1062432130.db2.gz ISVCFFODAZWABX-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398226 1062432135 /nfs/dbraw/zinc/43/21/35/1062432135.db2.gz ISVCFFODAZWABX-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255396219 1062433077 /nfs/dbraw/zinc/43/30/77/1062433077.db2.gz HLBNJUMKBNYTHM-IBGZPJMESA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3Cc4ccccc4C3)CC2)cc1 ZINC001255399576 1062433694 /nfs/dbraw/zinc/43/36/94/1062433694.db2.gz VJUFPLARKXXUMN-OAQYLSRUSA-N 2 1 306.453 4.057 20 0 DIADMP C[C@@]1(F)CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255399800 1062434140 /nfs/dbraw/zinc/43/41/40/1062434140.db2.gz ZWCBRJUBSIFQTC-WOJBJXKFSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255399800 1062434143 /nfs/dbraw/zinc/43/41/43/1062434143.db2.gz ZWCBRJUBSIFQTC-WOJBJXKFSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255399800 1062434152 /nfs/dbraw/zinc/43/41/52/1062434152.db2.gz ZWCBRJUBSIFQTC-WOJBJXKFSA-N 2 1 318.480 4.255 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@H]3CCCC34CCC4)CC2)cc1 ZINC001255395754 1062434377 /nfs/dbraw/zinc/43/43/77/1062434377.db2.gz CQEDNFDYXZGYFJ-PMACEKPBSA-N 2 1 312.501 4.354 20 0 DIADMP C[N@H+](Cc1ccsc1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407133 1062438327 /nfs/dbraw/zinc/43/83/27/1062438327.db2.gz WSPCGXDAQMHJOL-IBGZPJMESA-N 2 1 314.498 4.235 20 0 DIADMP C[N@@H+](Cc1ccsc1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407133 1062438336 /nfs/dbraw/zinc/43/83/36/1062438336.db2.gz WSPCGXDAQMHJOL-IBGZPJMESA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1ccsc1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255407133 1062438349 /nfs/dbraw/zinc/43/83/49/1062438349.db2.gz WSPCGXDAQMHJOL-IBGZPJMESA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1ccsc1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255407133 1062438356 /nfs/dbraw/zinc/43/83/56/1062438356.db2.gz WSPCGXDAQMHJOL-IBGZPJMESA-N 2 1 314.498 4.235 20 0 DIADMP CC[C@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255408460 1062438847 /nfs/dbraw/zinc/43/88/47/1062438847.db2.gz MSLRNTYDEWWXPC-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255408460 1062438860 /nfs/dbraw/zinc/43/88/60/1062438860.db2.gz MSLRNTYDEWWXPC-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255408460 1062438867 /nfs/dbraw/zinc/43/88/67/1062438867.db2.gz MSLRNTYDEWWXPC-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP Fc1ccc2c(c1)C[N@H+]([C@@H]1CCC[NH+](Cc3ccccc3)CC1)C2 ZINC001255404446 1062439159 /nfs/dbraw/zinc/43/91/59/1062439159.db2.gz JFDXCKGVJGRTDF-OAQYLSRUSA-N 2 1 324.443 4.196 20 0 DIADMP Fc1ccc2c(c1)C[N@@H+]([C@@H]1CCC[NH+](Cc3ccccc3)CC1)C2 ZINC001255404446 1062439170 /nfs/dbraw/zinc/43/91/70/1062439170.db2.gz JFDXCKGVJGRTDF-OAQYLSRUSA-N 2 1 324.443 4.196 20 0 DIADMP Fc1ccc2c(c1)C[NH+]([C@@H]1CCC[N@H+](Cc3ccccc3)CC1)C2 ZINC001255404446 1062439183 /nfs/dbraw/zinc/43/91/83/1062439183.db2.gz JFDXCKGVJGRTDF-OAQYLSRUSA-N 2 1 324.443 4.196 20 0 DIADMP Fc1ccc2c(c1)C[NH+]([C@@H]1CCC[N@@H+](Cc3ccccc3)CC1)C2 ZINC001255404446 1062439193 /nfs/dbraw/zinc/43/91/93/1062439193.db2.gz JFDXCKGVJGRTDF-OAQYLSRUSA-N 2 1 324.443 4.196 20 0 DIADMP C[N@@H+](C[C@H]1CC1(C)C)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408386 1062440314 /nfs/dbraw/zinc/44/03/14/1062440314.db2.gz KWQBYIXTLPBUMP-RTBURBONSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408386 1062440319 /nfs/dbraw/zinc/44/03/19/1062440319.db2.gz KWQBYIXTLPBUMP-RTBURBONSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408386 1062440324 /nfs/dbraw/zinc/44/03/24/1062440324.db2.gz KWQBYIXTLPBUMP-RTBURBONSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001255403229 1062441372 /nfs/dbraw/zinc/44/13/72/1062441372.db2.gz BQXIEOZUARKHFE-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001255403229 1062441379 /nfs/dbraw/zinc/44/13/79/1062441379.db2.gz BQXIEOZUARKHFE-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001255403229 1062441385 /nfs/dbraw/zinc/44/13/85/1062441385.db2.gz BQXIEOZUARKHFE-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCCCCC3)CC2)cc1 ZINC001255402788 1062442366 /nfs/dbraw/zinc/44/23/66/1062442366.db2.gz ASLWORYESHUJAY-FQEVSTJZSA-N 2 1 300.490 4.307 20 0 DIADMP C[C@@H]1CC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC001255403226 1062443167 /nfs/dbraw/zinc/44/31/67/1062443167.db2.gz BQXIEOZUARKHFE-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC001255403226 1062443179 /nfs/dbraw/zinc/44/31/79/1062443179.db2.gz BQXIEOZUARKHFE-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC001255403226 1062443190 /nfs/dbraw/zinc/44/31/90/1062443190.db2.gz BQXIEOZUARKHFE-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP Fc1ccc(C[NH+]2CCC([NH2+]C3CCC3)CC2)c2ccccc12 ZINC001474740697 1062456794 /nfs/dbraw/zinc/45/67/94/1062456794.db2.gz PLFRYBDCVAIAKV-UHFFFAOYSA-N 2 1 312.432 4.085 20 0 DIADMP CC(C)[N@H+](C1CCC(C(F)(F)F)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255510020 1062467505 /nfs/dbraw/zinc/46/75/05/1062467505.db2.gz DYGLBDHWYPSCCW-MDPANVJJSA-N 2 1 306.416 4.088 20 0 DIADMP CC1(C)C[C@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001255533978 1062476704 /nfs/dbraw/zinc/47/67/04/1062476704.db2.gz NUOHYLKSFYRBIN-GUDVDZBRSA-N 2 1 322.537 4.096 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1sc2ccccc2c1C ZINC001459910763 1062491300 /nfs/dbraw/zinc/49/13/00/1062491300.db2.gz YHEWPTJNDFYYCO-CQSZACIVSA-N 2 1 313.470 4.456 20 0 DIADMP C[C@H](CC(F)(F)F)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255644909 1062495209 /nfs/dbraw/zinc/49/52/09/1062495209.db2.gz WMIGZOMSCZIGBH-BPLDGKMQSA-N 2 1 306.416 4.089 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001255668065 1062506034 /nfs/dbraw/zinc/50/60/34/1062506034.db2.gz CWZVOFCEXPGZIO-XVLXNVKGSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001255668065 1062506057 /nfs/dbraw/zinc/50/60/57/1062506057.db2.gz CWZVOFCEXPGZIO-XVLXNVKGSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001255668062 1062506538 /nfs/dbraw/zinc/50/65/38/1062506538.db2.gz CWZVOFCEXPGZIO-IPQPSQTFSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001255668062 1062506558 /nfs/dbraw/zinc/50/65/58/1062506558.db2.gz CWZVOFCEXPGZIO-IPQPSQTFSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001255670718 1062511675 /nfs/dbraw/zinc/51/16/75/1062511675.db2.gz YUDQZSSMPFKWRF-IYHXRUFHSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001255670718 1062511692 /nfs/dbraw/zinc/51/16/92/1062511692.db2.gz YUDQZSSMPFKWRF-IYHXRUFHSA-N 2 1 304.453 4.128 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)c(C)c1 ZINC001255670366 1062512294 /nfs/dbraw/zinc/51/22/94/1062512294.db2.gz QRQVVMBJJOTBBO-RAFMOHDBSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)c(C)c1 ZINC001255670366 1062512313 /nfs/dbraw/zinc/51/23/13/1062512313.db2.gz QRQVVMBJJOTBBO-RAFMOHDBSA-N 2 1 300.490 4.359 20 0 DIADMP CC[N@H+](Cc1ccc(C)c(C)c1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255684416 1062513224 /nfs/dbraw/zinc/51/32/24/1062513224.db2.gz ZVDBSIJRBQFVFF-YOFSQIOKSA-N 2 1 300.490 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255684416 1062513242 /nfs/dbraw/zinc/51/32/42/1062513242.db2.gz ZVDBSIJRBQFVFF-YOFSQIOKSA-N 2 1 300.490 4.141 20 0 DIADMP CC[NH+](Cc1ccc(C)c(C)c1)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255684416 1062513254 /nfs/dbraw/zinc/51/32/54/1062513254.db2.gz ZVDBSIJRBQFVFF-YOFSQIOKSA-N 2 1 300.490 4.141 20 0 DIADMP CC[NH+](Cc1ccc(C)c(C)c1)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255684416 1062513274 /nfs/dbraw/zinc/51/32/74/1062513274.db2.gz ZVDBSIJRBQFVFF-YOFSQIOKSA-N 2 1 300.490 4.141 20 0 DIADMP CC(C)[N@H+]([C@@H](C)c1ccccc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255685675 1062515950 /nfs/dbraw/zinc/51/59/50/1062515950.db2.gz UBHCHFKJUBLQQO-DAABDDCCSA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255685675 1062515967 /nfs/dbraw/zinc/51/59/67/1062515967.db2.gz UBHCHFKJUBLQQO-DAABDDCCSA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[NH+]([C@@H](C)c1ccccc1)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255685675 1062515982 /nfs/dbraw/zinc/51/59/82/1062515982.db2.gz UBHCHFKJUBLQQO-DAABDDCCSA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[NH+]([C@@H](C)c1ccccc1)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255685675 1062515998 /nfs/dbraw/zinc/51/59/98/1062515998.db2.gz UBHCHFKJUBLQQO-DAABDDCCSA-N 2 1 300.490 4.473 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255725992 1062545954 /nfs/dbraw/zinc/54/59/54/1062545954.db2.gz ZRGYCVYSOODSNY-GOEBONIOSA-N 2 1 320.443 4.304 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@@H]2CC[N@H+](C(C)C)C[C@@H]2C)cc1 ZINC001255762657 1062585927 /nfs/dbraw/zinc/58/59/27/1062585927.db2.gz VUOACGWRIRNWBE-JENIJYKNSA-N 2 1 320.546 4.184 20 0 DIADMP Cc1ccc(SC[C@H](C)n2c[nH+]cc2C2CC[NH2+]CC2)cc1 ZINC001255766513 1062587769 /nfs/dbraw/zinc/58/77/69/1062587769.db2.gz BMNBNWMEEFSICH-HNNXBMFYSA-N 2 1 315.486 4.012 20 0 DIADMP Cc1ccc(SC[C@@H](C)N2CCC([N@@H+](C)C3CC3)CC2)cc1 ZINC001255771515 1062592648 /nfs/dbraw/zinc/59/26/48/1062592648.db2.gz SMUIAYFUBXBMKL-MRXNPFEDSA-N 2 1 318.530 4.034 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH+]2CCC([N@H+](C)C3CC3)CC2)cc1 ZINC001255771515 1062592670 /nfs/dbraw/zinc/59/26/70/1062592670.db2.gz SMUIAYFUBXBMKL-MRXNPFEDSA-N 2 1 318.530 4.034 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH+]2CCC([N@@H+](C)C3CC3)CC2)cc1 ZINC001255771515 1062592693 /nfs/dbraw/zinc/59/26/93/1062592693.db2.gz SMUIAYFUBXBMKL-MRXNPFEDSA-N 2 1 318.530 4.034 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001255773188 1062596532 /nfs/dbraw/zinc/59/65/32/1062596532.db2.gz UUSIKOJFFMWQBS-LJQANCHMSA-N 2 1 322.496 4.180 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H](C)Cc2ccc(C)cc2)CC1 ZINC001255795555 1062613330 /nfs/dbraw/zinc/61/33/30/1062613330.db2.gz GZBMSLKPVXKRLS-SFHVURJKSA-N 2 1 302.506 4.122 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255862195 1062641280 /nfs/dbraw/zinc/64/12/80/1062641280.db2.gz MKPRIUNGUNYIJU-ATZDWAIDSA-N 2 1 320.496 4.375 20 0 DIADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CC1CCC(C(C)(C)C)CC1)C2 ZINC001460136339 1062654608 /nfs/dbraw/zinc/65/46/08/1062654608.db2.gz QVAOQUYVMQYJMR-AFMYVXGZSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CC1CCC(C(C)(C)C)CC1)C2 ZINC001460136339 1062654616 /nfs/dbraw/zinc/65/46/16/1062654616.db2.gz QVAOQUYVMQYJMR-AFMYVXGZSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CC1CCC(C(C)(C)C)CC1)C2 ZINC001460136339 1062654619 /nfs/dbraw/zinc/65/46/19/1062654619.db2.gz QVAOQUYVMQYJMR-AFMYVXGZSA-N 2 1 306.538 4.257 20 0 DIADMP c1cc(C[N@H+]2CCC3(C2)CC[NH+](C2CCCCCC2)CC3)co1 ZINC001255889974 1062657830 /nfs/dbraw/zinc/65/78/30/1062657830.db2.gz SZRZEUZBZAZODW-UHFFFAOYSA-N 2 1 316.489 4.290 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(F)c(C(F)(F)F)c1 ZINC001255943933 1062666413 /nfs/dbraw/zinc/66/64/13/1062666413.db2.gz RDOILEASJFTBIJ-GFCCVEGCSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cccc(OC2CCCC2)c1 ZINC001255949699 1062670583 /nfs/dbraw/zinc/67/05/83/1062670583.db2.gz AMFCKDWYEZFABZ-KRWDZBQOSA-N 2 1 318.505 4.218 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255954757 1062671079 /nfs/dbraw/zinc/67/10/79/1062671079.db2.gz ZLSHFZWIIPXJCO-BJLQDIEVSA-N 2 1 323.569 4.011 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@H](Sc2ccc(F)cc2)C1 ZINC001255971744 1062673888 /nfs/dbraw/zinc/67/38/88/1062673888.db2.gz KMFHCMNTRWVFJV-QAPCUYQASA-N 2 1 324.509 4.113 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CC[C@H](Sc2ccc(F)cc2)C1 ZINC001255971744 1062673901 /nfs/dbraw/zinc/67/39/01/1062673901.db2.gz KMFHCMNTRWVFJV-QAPCUYQASA-N 2 1 324.509 4.113 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001255967841 1062674500 /nfs/dbraw/zinc/67/45/00/1062674500.db2.gz TZMHKIUKGWELTB-WBVHZDCISA-N 2 1 308.897 4.250 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1F ZINC001256069640 1062695534 /nfs/dbraw/zinc/69/55/34/1062695534.db2.gz KHMXKNLANZJXMP-LJQANCHMSA-N 2 1 304.453 4.129 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+]([C@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256121328 1062718974 /nfs/dbraw/zinc/71/89/74/1062718974.db2.gz PPZPQOZJMDWHFA-RXVVDRJESA-N 2 1 312.501 4.271 20 0 DIADMP C[C@@]1(Cc2cccc(F)c2)CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001460274460 1062751666 /nfs/dbraw/zinc/75/16/66/1062751666.db2.gz DZPSLLPOKIRJFF-FQEVSTJZSA-N 2 1 318.480 4.099 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256528212 1062844825 /nfs/dbraw/zinc/84/48/25/1062844825.db2.gz CMHKPILGQYXBEX-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256528212 1062844842 /nfs/dbraw/zinc/84/48/42/1062844842.db2.gz CMHKPILGQYXBEX-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(F)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256524412 1062849347 /nfs/dbraw/zinc/84/93/47/1062849347.db2.gz UILHUWPADYFNGI-MJGOQNOKSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(F)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256524412 1062849368 /nfs/dbraw/zinc/84/93/68/1062849368.db2.gz UILHUWPADYFNGI-MJGOQNOKSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256535845 1062851158 /nfs/dbraw/zinc/85/11/58/1062851158.db2.gz DWKYBXHZHOQGAT-GCJKJVERSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535845 1062851182 /nfs/dbraw/zinc/85/11/82/1062851182.db2.gz DWKYBXHZHOQGAT-GCJKJVERSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535845 1062851206 /nfs/dbraw/zinc/85/12/06/1062851206.db2.gz DWKYBXHZHOQGAT-GCJKJVERSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535845 1062851227 /nfs/dbraw/zinc/85/12/27/1062851227.db2.gz DWKYBXHZHOQGAT-GCJKJVERSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256536822 1062852782 /nfs/dbraw/zinc/85/27/82/1062852782.db2.gz GDQSXTKQSFTQQY-ICSRJNTNSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256536822 1062852810 /nfs/dbraw/zinc/85/28/10/1062852810.db2.gz GDQSXTKQSFTQQY-ICSRJNTNSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536822 1062852842 /nfs/dbraw/zinc/85/28/42/1062852842.db2.gz GDQSXTKQSFTQQY-ICSRJNTNSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536822 1062852861 /nfs/dbraw/zinc/85/28/61/1062852861.db2.gz GDQSXTKQSFTQQY-ICSRJNTNSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2[C@@H](C)CCC[C@@H]2C)CC[N@@H+]1Cc1ccccc1 ZINC001256535762 1062853953 /nfs/dbraw/zinc/85/39/53/1062853953.db2.gz CWHAGEIYKLKWSM-PNYFIKQUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2[C@@H](C)CCC[C@@H]2C)CC[N@H+]1Cc1ccccc1 ZINC001256535762 1062853970 /nfs/dbraw/zinc/85/39/70/1062853970.db2.gz CWHAGEIYKLKWSM-PNYFIKQUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536236 1062855113 /nfs/dbraw/zinc/85/51/13/1062855113.db2.gz JTJSVHLEPHIOOL-FXAWDEMLSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536236 1062855135 /nfs/dbraw/zinc/85/51/35/1062855135.db2.gz JTJSVHLEPHIOOL-FXAWDEMLSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256528412 1062855186 /nfs/dbraw/zinc/85/51/86/1062855186.db2.gz FBDVJWMAZBOWSF-XEYPJELSSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256528412 1062855209 /nfs/dbraw/zinc/85/52/09/1062855209.db2.gz FBDVJWMAZBOWSF-XEYPJELSSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536239 1062856002 /nfs/dbraw/zinc/85/60/02/1062856002.db2.gz JTJSVHLEPHIOOL-YLJYHZDGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536239 1062856022 /nfs/dbraw/zinc/85/60/22/1062856022.db2.gz JTJSVHLEPHIOOL-YLJYHZDGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256529374 1062856651 /nfs/dbraw/zinc/85/66/51/1062856651.db2.gz TVSLXEURTJDKPT-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256529374 1062856671 /nfs/dbraw/zinc/85/66/71/1062856671.db2.gz TVSLXEURTJDKPT-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP CCC[N@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537811 1062861055 /nfs/dbraw/zinc/86/10/55/1062861055.db2.gz OTVCENOWPGIFTL-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537811 1062861082 /nfs/dbraw/zinc/86/10/82/1062861082.db2.gz OTVCENOWPGIFTL-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537811 1062861104 /nfs/dbraw/zinc/86/11/04/1062861104.db2.gz OTVCENOWPGIFTL-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256537811 1062861131 /nfs/dbraw/zinc/86/11/31/1062861131.db2.gz OTVCENOWPGIFTL-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256537873 1062863149 /nfs/dbraw/zinc/86/31/49/1062863149.db2.gz QPFYNKISZXUECQ-PXNSSMCTSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256537873 1062863165 /nfs/dbraw/zinc/86/31/65/1062863165.db2.gz QPFYNKISZXUECQ-PXNSSMCTSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256538284 1062863931 /nfs/dbraw/zinc/86/39/31/1062863931.db2.gz SSYGNVZSZSNRMH-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256538284 1062863951 /nfs/dbraw/zinc/86/39/51/1062863951.db2.gz SSYGNVZSZSNRMH-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCC[C@H]2C)CC[N@@H+]1Cc1ccccc1 ZINC001256548160 1062868473 /nfs/dbraw/zinc/86/84/73/1062868473.db2.gz AMRLEMRIKFDNLZ-GGPKGHCWSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCC[C@H]2C)CC[N@H+]1Cc1ccccc1 ZINC001256548160 1062868488 /nfs/dbraw/zinc/86/84/88/1062868488.db2.gz AMRLEMRIKFDNLZ-GGPKGHCWSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCCC[C@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548160 1062868500 /nfs/dbraw/zinc/86/85/00/1062868500.db2.gz AMRLEMRIKFDNLZ-GGPKGHCWSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCCC[C@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548160 1062868512 /nfs/dbraw/zinc/86/85/12/1062868512.db2.gz AMRLEMRIKFDNLZ-GGPKGHCWSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256551504 1062870763 /nfs/dbraw/zinc/87/07/63/1062870763.db2.gz SMANHHYRUXJBDA-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256551504 1062870788 /nfs/dbraw/zinc/87/07/88/1062870788.db2.gz SMANHHYRUXJBDA-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552395 1062873336 /nfs/dbraw/zinc/87/33/36/1062873336.db2.gz BWRGMXXNPFBFTL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552395 1062873356 /nfs/dbraw/zinc/87/33/56/1062873356.db2.gz BWRGMXXNPFBFTL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552395 1062873372 /nfs/dbraw/zinc/87/33/72/1062873372.db2.gz BWRGMXXNPFBFTL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552395 1062873394 /nfs/dbraw/zinc/87/33/94/1062873394.db2.gz BWRGMXXNPFBFTL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2CC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001256553922 1062875054 /nfs/dbraw/zinc/87/50/54/1062875054.db2.gz MIIJAQDSOCUGLH-NEWSRXKRSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2CC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001256553922 1062875074 /nfs/dbraw/zinc/87/50/74/1062875074.db2.gz MIIJAQDSOCUGLH-NEWSRXKRSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C[C@@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553922 1062875099 /nfs/dbraw/zinc/87/50/99/1062875099.db2.gz MIIJAQDSOCUGLH-NEWSRXKRSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C[C@@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553922 1062875123 /nfs/dbraw/zinc/87/51/23/1062875123.db2.gz MIIJAQDSOCUGLH-NEWSRXKRSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256552578 1062875175 /nfs/dbraw/zinc/87/51/75/1062875175.db2.gz COVOKMUQVSQGFB-QAPCUYQASA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256552578 1062875192 /nfs/dbraw/zinc/87/51/92/1062875192.db2.gz COVOKMUQVSQGFB-QAPCUYQASA-N 2 1 322.443 4.017 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554135 1062875778 /nfs/dbraw/zinc/87/57/78/1062875778.db2.gz NTXSPXCRYBWPAC-DFQSSKMNSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554135 1062875798 /nfs/dbraw/zinc/87/57/98/1062875798.db2.gz NTXSPXCRYBWPAC-DFQSSKMNSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554135 1062875818 /nfs/dbraw/zinc/87/58/18/1062875818.db2.gz NTXSPXCRYBWPAC-DFQSSKMNSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554135 1062875840 /nfs/dbraw/zinc/87/58/40/1062875840.db2.gz NTXSPXCRYBWPAC-DFQSSKMNSA-N 2 1 300.490 4.304 20 0 DIADMP CCC[N@H+](CC(C)C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556764 1062881174 /nfs/dbraw/zinc/88/11/74/1062881174.db2.gz GOGRIMFGWIJFDF-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556764 1062881188 /nfs/dbraw/zinc/88/11/88/1062881188.db2.gz GOGRIMFGWIJFDF-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[NH+](CC(C)C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556764 1062881210 /nfs/dbraw/zinc/88/12/10/1062881210.db2.gz GOGRIMFGWIJFDF-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[NH+](CC(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556764 1062881231 /nfs/dbraw/zinc/88/12/31/1062881231.db2.gz GOGRIMFGWIJFDF-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC3CCC(CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256560894 1062882152 /nfs/dbraw/zinc/88/21/52/1062882152.db2.gz UJVMXQPXZWZNHH-GHOZHQTGSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256559263 1062886011 /nfs/dbraw/zinc/88/60/11/1062886011.db2.gz KCYRFVIECUPHQN-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256559263 1062886029 /nfs/dbraw/zinc/88/60/29/1062886029.db2.gz KCYRFVIECUPHQN-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559263 1062886050 /nfs/dbraw/zinc/88/60/50/1062886050.db2.gz KCYRFVIECUPHQN-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559263 1062886059 /nfs/dbraw/zinc/88/60/59/1062886059.db2.gz KCYRFVIECUPHQN-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@@H](C)C1 ZINC001256556309 1062886873 /nfs/dbraw/zinc/88/68/73/1062886873.db2.gz YRIZPTUVYUFXKR-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@@H](C)C1 ZINC001256556309 1062886899 /nfs/dbraw/zinc/88/68/99/1062886899.db2.gz YRIZPTUVYUFXKR-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[C@@H](C)C1 ZINC001256556309 1062886921 /nfs/dbraw/zinc/88/69/21/1062886921.db2.gz YRIZPTUVYUFXKR-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)[C@@H](C)C1 ZINC001256556309 1062886950 /nfs/dbraw/zinc/88/69/50/1062886950.db2.gz YRIZPTUVYUFXKR-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[N@@H+](CCCn1ccnc1)Cc1ccc(F)c(Cl)c1 ZINC001460520273 1062895952 /nfs/dbraw/zinc/89/59/52/1062895952.db2.gz YHYGWTYPZLOLHE-UHFFFAOYSA-N 2 1 323.843 4.224 20 0 DIADMP COc1ccccc1[C@H]1CCC[N@@H+]1C1CC[NH+](C(C)(C)C)CC1 ZINC001256574206 1062898570 /nfs/dbraw/zinc/89/85/70/1062898570.db2.gz WKBKLOPYGCJBNV-GOSISDBHSA-N 2 1 316.489 4.095 20 0 DIADMP COc1ccccc1[C@H]1CCC[N@H+]1C1CC[NH+](C(C)(C)C)CC1 ZINC001256574206 1062898586 /nfs/dbraw/zinc/89/85/86/1062898586.db2.gz WKBKLOPYGCJBNV-GOSISDBHSA-N 2 1 316.489 4.095 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001256575947 1062899970 /nfs/dbraw/zinc/89/99/70/1062899970.db2.gz YSYVLVACEHZHBS-MRXNPFEDSA-N 2 1 320.908 4.392 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001256575947 1062899993 /nfs/dbraw/zinc/89/99/93/1062899993.db2.gz YSYVLVACEHZHBS-MRXNPFEDSA-N 2 1 320.908 4.392 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](C(C)(C)C)CC1 ZINC001256574906 1062901480 /nfs/dbraw/zinc/90/14/80/1062901480.db2.gz GRPJZHURBNFPTF-UHFFFAOYSA-N 2 1 308.897 4.425 20 0 DIADMP CCCC[N@H+](Cc1ccns1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001460539504 1062903772 /nfs/dbraw/zinc/90/37/72/1062903772.db2.gz DLNWMACZOMWZOZ-UHFFFAOYSA-N 2 1 309.523 4.054 20 0 DIADMP CCCC[N@@H+](Cc1ccns1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001460539504 1062903793 /nfs/dbraw/zinc/90/37/93/1062903793.db2.gz DLNWMACZOMWZOZ-UHFFFAOYSA-N 2 1 309.523 4.054 20 0 DIADMP CC(C)([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC001256595408 1062905303 /nfs/dbraw/zinc/90/53/03/1062905303.db2.gz AZMXRMNKXSDRCH-UHFFFAOYSA-N 2 1 308.469 4.176 20 0 DIADMP C[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC001256604825 1062913578 /nfs/dbraw/zinc/91/35/78/1062913578.db2.gz WZSCQUBPWSXCOD-QZTJIDSGSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC001256604825 1062913602 /nfs/dbraw/zinc/91/36/02/1062913602.db2.gz WZSCQUBPWSXCOD-QZTJIDSGSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1ccccc1C(C)(C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001256601992 1062914096 /nfs/dbraw/zinc/91/40/96/1062914096.db2.gz MORHUFGDXSESIB-UHFFFAOYSA-N 2 1 322.496 4.484 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc2cc[nH]c2c1 ZINC001460565433 1062914640 /nfs/dbraw/zinc/91/46/40/1062914640.db2.gz FEVRJFBUYHPMPN-UHFFFAOYSA-N 2 1 321.468 4.252 20 0 DIADMP CC1([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CCC(F)(F)CC1 ZINC001256602326 1062915914 /nfs/dbraw/zinc/91/59/14/1062915914.db2.gz UPUDAGYBSAFFJZ-UHFFFAOYSA-N 2 1 322.443 4.209 20 0 DIADMP CCc1ccccc1C[NH+]1CCC(CC)([NH+]2CCCC2)CC1 ZINC001460576759 1062922349 /nfs/dbraw/zinc/92/23/49/1062922349.db2.gz HBSRSCPJPXYKAV-UHFFFAOYSA-N 2 1 300.490 4.089 20 0 DIADMP CC(C)C[N@H+](Cc1ccc(Cl)s1)CC1CC[NH+](C)CC1 ZINC001460670322 1062976750 /nfs/dbraw/zinc/97/67/50/1062976750.db2.gz GSTZESAGTQPKRE-UHFFFAOYSA-N 2 1 314.926 4.201 20 0 DIADMP c1ccc([C@H]2CSCCC[N@@H+]2CCC[NH+]2CCCCC2)cc1 ZINC001460710385 1063002665 /nfs/dbraw/zinc/00/26/65/1063002665.db2.gz OWDLBMWTTUFFOC-LJQANCHMSA-N 2 1 318.530 4.043 20 0 DIADMP c1ccc([C@@H]2CCCC[N@H+]2C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC001256855361 1063021294 /nfs/dbraw/zinc/02/12/94/1063021294.db2.gz JYBDBAGQEZSOCH-NRFANRHFSA-N 2 1 321.468 4.278 20 0 DIADMP CCC1CCC([N@@H+](Cc2cccnc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001256869708 1063024351 /nfs/dbraw/zinc/02/43/51/1063024351.db2.gz RVUVMBZNFSQIRU-YAEFEIELSA-N 2 1 315.505 4.122 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2[C@@H]2CCC[N@H+](C3CCCC3)C2)c1 ZINC001256894851 1063029601 /nfs/dbraw/zinc/02/96/01/1063029601.db2.gz NFQBCPQBLUVWCA-DNVCBOLYSA-N 2 1 311.473 4.241 20 0 DIADMP Clc1cccc(CCC[NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)c1 ZINC001256901933 1063038058 /nfs/dbraw/zinc/03/80/58/1063038058.db2.gz MHYMYGVAESPJQE-SFHVURJKSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1cccc(CCC[NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)c1 ZINC001256901933 1063038077 /nfs/dbraw/zinc/03/80/77/1063038077.db2.gz MHYMYGVAESPJQE-SFHVURJKSA-N 2 1 320.908 4.269 20 0 DIADMP Fc1ccc(CC[NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)c(Cl)c1 ZINC001256906522 1063042236 /nfs/dbraw/zinc/04/22/36/1063042236.db2.gz BXGZWJVEISBSSQ-MRXNPFEDSA-N 2 1 324.871 4.018 20 0 DIADMP Fc1ccc(CC[NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)c(Cl)c1 ZINC001256906522 1063042258 /nfs/dbraw/zinc/04/22/58/1063042258.db2.gz BXGZWJVEISBSSQ-MRXNPFEDSA-N 2 1 324.871 4.018 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC001256909257 1063048925 /nfs/dbraw/zinc/04/89/25/1063048925.db2.gz SDNCYKLGBRTEQL-SESVDKBCSA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC001256909257 1063048947 /nfs/dbraw/zinc/04/89/47/1063048947.db2.gz SDNCYKLGBRTEQL-SESVDKBCSA-N 2 1 312.501 4.319 20 0 DIADMP C[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)CC1CCC1 ZINC001460887336 1063118408 /nfs/dbraw/zinc/11/84/08/1063118408.db2.gz RTHWHKTZZFHSNX-UHFFFAOYSA-N 2 1 314.517 4.063 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C(C)C)CC1)c1ccccc1F ZINC001257207931 1063138215 /nfs/dbraw/zinc/13/82/15/1063138215.db2.gz ASKRAIYGRLKCRZ-LJQANCHMSA-N 2 1 306.469 4.375 20 0 DIADMP CCC[C@H](CC)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001257263350 1063167459 /nfs/dbraw/zinc/16/74/59/1063167459.db2.gz QUWQCEHIBDICDZ-SFHVURJKSA-N 2 1 304.478 4.146 20 0 DIADMP CCC[C@H](CC)[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001257271824 1063174092 /nfs/dbraw/zinc/17/40/92/1063174092.db2.gz TZZDPCIANWCYFV-SFHVURJKSA-N 2 1 306.469 4.301 20 0 DIADMP CCC[C@H](CC)[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001257271824 1063174098 /nfs/dbraw/zinc/17/40/98/1063174098.db2.gz TZZDPCIANWCYFV-SFHVURJKSA-N 2 1 306.469 4.301 20 0 DIADMP CCC[C@H](CC)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001257271805 1063175014 /nfs/dbraw/zinc/17/50/14/1063175014.db2.gz TVFTWNWFHRSRJZ-AQNXPRMDSA-N 2 1 300.490 4.019 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC001257292891 1063184392 /nfs/dbraw/zinc/18/43/92/1063184392.db2.gz XRBSBRDGQGUJCM-MSOLQXFVSA-N 2 1 318.505 4.248 20 0 DIADMP CCC(CC)[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001257296852 1063186558 /nfs/dbraw/zinc/18/65/58/1063186558.db2.gz OASHUOYECNTREL-UHFFFAOYSA-N 2 1 306.519 4.225 20 0 DIADMP CCC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(C(F)(F)F)c2)CC1 ZINC001257313120 1063199370 /nfs/dbraw/zinc/19/93/70/1063199370.db2.gz LFLZXMXGGQCBLQ-ZDUSSCGKSA-N 2 1 314.395 4.144 20 0 DIADMP CC(C)c1ccccc1C[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC001461042272 1063209256 /nfs/dbraw/zinc/20/92/56/1063209256.db2.gz WTHNVIQATLZZQR-UHFFFAOYSA-N 2 1 322.496 4.348 20 0 DIADMP CC(C)c1ccccc1C[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC001461042272 1063209276 /nfs/dbraw/zinc/20/92/76/1063209276.db2.gz WTHNVIQATLZZQR-UHFFFAOYSA-N 2 1 322.496 4.348 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]C/C=C\c2ccc(F)cc2)C1 ZINC001461046863 1063211946 /nfs/dbraw/zinc/21/19/46/1063211946.db2.gz LQCRVWVBWSNFOX-SPCWZHTESA-N 2 1 318.480 4.187 20 0 DIADMP CCCCCC[C@H](C)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001257366265 1063232963 /nfs/dbraw/zinc/23/29/63/1063232963.db2.gz SWHWXAJQKZPEBZ-INIZCTEOSA-N 2 1 303.494 4.288 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C2CCCCC2)C3)cc1 ZINC001257461194 1063285857 /nfs/dbraw/zinc/28/58/57/1063285857.db2.gz LZHQJUPPEKBZFA-NRFANRHFSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C2CCCCC2)C3)cc1 ZINC001257461194 1063285879 /nfs/dbraw/zinc/28/58/79/1063285879.db2.gz LZHQJUPPEKBZFA-NRFANRHFSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C2CCCCC2)C3)cc1 ZINC001257461194 1063285901 /nfs/dbraw/zinc/28/59/01/1063285901.db2.gz LZHQJUPPEKBZFA-NRFANRHFSA-N 2 1 312.501 4.307 20 0 DIADMP CCC[C@@H](C)CC[C@@H](C)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001257471399 1063294508 /nfs/dbraw/zinc/29/45/08/1063294508.db2.gz NOZSHMXTKOBQKF-IAGOWNOFSA-N 3 1 313.574 4.067 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC001461168387 1063303599 /nfs/dbraw/zinc/30/35/99/1063303599.db2.gz BJHIWVKMJABIIW-HXUWFJFHSA-N 2 1 302.506 4.095 20 0 DIADMP CCCCC[C@@H](C)[N@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257512929 1063321164 /nfs/dbraw/zinc/32/11/64/1063321164.db2.gz QMJSQWOWBKQWKC-ZACQAIPSSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[C@@H](C)[N@@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257512929 1063321189 /nfs/dbraw/zinc/32/11/89/1063321189.db2.gz QMJSQWOWBKQWKC-ZACQAIPSSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[C@@H](C)[NH+]1C[C@H]2C[N@@H+](Cc3cccs3)C[C@H]2C1 ZINC001257512929 1063321222 /nfs/dbraw/zinc/32/12/22/1063321222.db2.gz QMJSQWOWBKQWKC-ZACQAIPSSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[C@@H](C)[NH+]1C[C@H]2C[N@H+](Cc3cccs3)C[C@H]2C1 ZINC001257512929 1063321251 /nfs/dbraw/zinc/32/12/51/1063321251.db2.gz QMJSQWOWBKQWKC-ZACQAIPSSA-N 2 1 306.519 4.081 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccc(F)c2)CC1 ZINC001461202989 1063330315 /nfs/dbraw/zinc/33/03/15/1063330315.db2.gz AYJQESVUOZMVJG-INIZCTEOSA-N 2 1 312.432 4.141 20 0 DIADMP CCC(CC)[N@H+](C1CCC(OC(C)C)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257875048 1063414826 /nfs/dbraw/zinc/41/48/26/1063414826.db2.gz GHPJEUFGBFIZGF-CAAWEGIDSA-N 2 1 324.553 4.483 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]CC2CCC(C(C)C)CC2)C1 ZINC001461372292 1063455024 /nfs/dbraw/zinc/45/50/24/1063455024.db2.gz BCGUCWNUBMZAMG-GPJFCIFZSA-N 2 1 308.554 4.406 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]CC2CCC(C(C)C)CC2)C1 ZINC001461372294 1063455402 /nfs/dbraw/zinc/45/54/02/1063455402.db2.gz BCGUCWNUBMZAMG-IOJLRTSASA-N 2 1 308.554 4.406 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+](C2CCC(c3ccccc3)CC2)CC1 ZINC001257998389 1063456072 /nfs/dbraw/zinc/45/60/72/1063456072.db2.gz FAJSIOVNWXCVRU-UHFFFAOYSA-N 2 1 312.501 4.271 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](c2ccccc2F)C(C)C)CC1 ZINC001258006492 1063461701 /nfs/dbraw/zinc/46/17/01/1063461701.db2.gz ICWBAFYJLXJLQX-IBGZPJMESA-N 2 1 306.469 4.233 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccccc1F ZINC001258006699 1063462079 /nfs/dbraw/zinc/46/20/79/1063462079.db2.gz LVGLSNQPJFKOEU-LJQANCHMSA-N 2 1 306.469 4.377 20 0 DIADMP c1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)ccc1C[NH+]1CCCCC1 ZINC001473171627 1063474938 /nfs/dbraw/zinc/47/49/38/1063474938.db2.gz DENUMBHWFYNKJC-RTWAWAEBSA-N 2 1 312.501 4.437 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@H](C)C[C@H](C)CC(C)C)CC1 ZINC001258055791 1063488295 /nfs/dbraw/zinc/48/82/95/1063488295.db2.gz MUICWHSLSUGEID-SJLPKXTDSA-N 2 1 317.521 4.409 20 0 DIADMP CC(C)=CCC[C@@H](C)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258098161 1063517424 /nfs/dbraw/zinc/51/74/24/1063517424.db2.gz SUFNQDAKLBTBAY-QGZVFWFLSA-N 2 1 301.478 4.083 20 0 DIADMP CC(C)c1ccccc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001461463732 1063522976 /nfs/dbraw/zinc/52/29/76/1063522976.db2.gz YGVMCKUGNSSXPT-FQEVSTJZSA-N 2 1 322.496 4.422 20 0 DIADMP CC1([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CCCCC1 ZINC001258133956 1063527473 /nfs/dbraw/zinc/52/74/73/1063527473.db2.gz SIRDCAZTTOBVGB-UHFFFAOYSA-N 2 1 300.490 4.006 20 0 DIADMP C[N@H+](CC1CCCCC1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258148009 1063531441 /nfs/dbraw/zinc/53/14/41/1063531441.db2.gz YKDURVJSLJCKTM-UHFFFAOYSA-N 2 1 314.517 4.206 20 0 DIADMP C[N@@H+](CC1CCCCC1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258148009 1063531454 /nfs/dbraw/zinc/53/14/54/1063531454.db2.gz YKDURVJSLJCKTM-UHFFFAOYSA-N 2 1 314.517 4.206 20 0 DIADMP CC1(C)CC[C@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC001258137091 1063531834 /nfs/dbraw/zinc/53/18/34/1063531834.db2.gz AKCNVJSYVCBXJO-IBGZPJMESA-N 2 1 314.517 4.109 20 0 DIADMP Cc1cccc2c1C[N@@H+](C1CC[NH+](CCc3ccccc3)CC1)C2 ZINC001258140985 1063532528 /nfs/dbraw/zinc/53/25/28/1063532528.db2.gz QKNNYCBJWGMCSF-UHFFFAOYSA-N 2 1 320.480 4.018 20 0 DIADMP Cc1cccc2c1C[N@H+](C1CC[NH+](CCc3ccccc3)CC1)C2 ZINC001258140985 1063532531 /nfs/dbraw/zinc/53/25/31/1063532531.db2.gz QKNNYCBJWGMCSF-UHFFFAOYSA-N 2 1 320.480 4.018 20 0 DIADMP C[C@H]1CC([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C[C@H](C)C1 ZINC001258167248 1063537606 /nfs/dbraw/zinc/53/76/06/1063537606.db2.gz HYCPLRVTBQGVGS-GGPKGHCWSA-N 2 1 314.517 4.265 20 0 DIADMP C[C@H](Cc1ccco1)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258182191 1063548083 /nfs/dbraw/zinc/54/80/83/1063548083.db2.gz LHUUNOSKFSUBNI-BHIYHBOVSA-N 2 1 318.505 4.363 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccn2)C2CCCCCCC2)CC1 ZINC001258237915 1063575936 /nfs/dbraw/zinc/57/59/36/1063575936.db2.gz XHLCGXBVANDAPL-IRJFHVNHSA-N 2 1 315.505 4.266 20 0 DIADMP CC(C)(C)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C1CCCCCCC1 ZINC001258240963 1063580572 /nfs/dbraw/zinc/58/05/72/1063580572.db2.gz VUCAIWXRCIGKKD-SFHVURJKSA-N 2 1 322.537 4.111 20 0 DIADMP CC(C)[N@@H+](CCC[NH3+])[C@H](C)CC(C)(C)SCc1ccco1 ZINC001258295647 1063593215 /nfs/dbraw/zinc/59/32/15/1063593215.db2.gz PMOQCSFTVFZEAR-OAHLLOKOSA-N 2 1 312.523 4.129 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001258302841 1063597960 /nfs/dbraw/zinc/59/79/60/1063597960.db2.gz PKWJHHCUEFKWGK-QQFBHYJXSA-N 2 1 324.534 4.272 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258315147 1063605840 /nfs/dbraw/zinc/60/58/40/1063605840.db2.gz KANYZYPSOKIUBF-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP C[N@H+]1CC[C@@H](NCc2ccc(-c3cccs3)cc2)CC1(C)C ZINC001461622781 1063618796 /nfs/dbraw/zinc/61/87/96/1063618796.db2.gz SAWHQIFOCSBAKW-QGZVFWFLSA-N 2 1 314.498 4.378 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3cccs3)cc2)CC1(C)C ZINC001461622781 1063618810 /nfs/dbraw/zinc/61/88/10/1063618810.db2.gz SAWHQIFOCSBAKW-QGZVFWFLSA-N 2 1 314.498 4.378 20 0 DIADMP Cc1ccc(C[N@H+]([C@H](C)CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001258456879 1063663438 /nfs/dbraw/zinc/66/34/38/1063663438.db2.gz RHGSWXBDMUPTTG-NSISKUIASA-N 2 1 300.490 4.256 20 0 DIADMP C[C@H](CC1CC1)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001258471756 1063669915 /nfs/dbraw/zinc/66/99/15/1063669915.db2.gz FBGWALMFGZWBTD-QMMLZNLJSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001258471756 1063669919 /nfs/dbraw/zinc/66/99/19/1063669919.db2.gz FBGWALMFGZWBTD-QMMLZNLJSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001258471756 1063669929 /nfs/dbraw/zinc/66/99/29/1063669929.db2.gz FBGWALMFGZWBTD-QMMLZNLJSA-N 2 1 312.501 4.019 20 0 DIADMP CCCC1CCC([NH2+]C2CCN(c3[nH+]cccc3C)CC2)CC1 ZINC001258529693 1063685454 /nfs/dbraw/zinc/68/54/54/1063685454.db2.gz UMKQUFBBLDIZJN-UHFFFAOYSA-N 2 1 315.505 4.307 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001258600193 1063701704 /nfs/dbraw/zinc/70/17/04/1063701704.db2.gz NURRJZKSXVNWMM-SFHVURJKSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)CC[C@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258604939 1063705648 /nfs/dbraw/zinc/70/56/48/1063705648.db2.gz MHQLTEQCKAJWAU-PZJWPPBQSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604939 1063705664 /nfs/dbraw/zinc/70/56/64/1063705664.db2.gz MHQLTEQCKAJWAU-PZJWPPBQSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604939 1063705675 /nfs/dbraw/zinc/70/56/75/1063705675.db2.gz MHQLTEQCKAJWAU-PZJWPPBQSA-N 2 1 312.501 4.163 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC(C)(C)C1 ZINC001258607907 1063709544 /nfs/dbraw/zinc/70/95/44/1063709544.db2.gz UJIRQFPROGTXPC-RBUKOAKNSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](C(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258653260 1063726341 /nfs/dbraw/zinc/72/63/41/1063726341.db2.gz NCQJCCMCCYWEDG-VAMGGRTRSA-N 2 1 302.506 4.378 20 0 DIADMP CCCCC[C@@H](CCC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258668461 1063734719 /nfs/dbraw/zinc/73/47/19/1063734719.db2.gz VTYGUYBQLGSQBE-GUDVDZBRSA-N 2 1 324.553 4.486 20 0 DIADMP CCCCC[C@H](CCC)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001258671258 1063736869 /nfs/dbraw/zinc/73/68/69/1063736869.db2.gz MLUGBYIDJAVOGV-ICSRJNTNSA-N 2 1 324.553 4.311 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1Cl)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001258674813 1063742633 /nfs/dbraw/zinc/74/26/33/1063742633.db2.gz GUYVQIMJZCYDIB-VCANKDNSSA-N 2 1 315.288 4.126 20 0 DIADMP C[NH+]1CCC(C[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)CC1 ZINC001461861530 1063755663 /nfs/dbraw/zinc/75/56/63/1063755663.db2.gz KNEUPHIZBSFOOB-QFIPXVFZSA-N 2 1 320.480 4.128 20 0 DIADMP CC[C@@H]1CCC[C@H](C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC001461861786 1063757222 /nfs/dbraw/zinc/75/72/22/1063757222.db2.gz LQKUMYBUKQEPRC-LXZJYRNTSA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001461861786 1063757230 /nfs/dbraw/zinc/75/72/30/1063757230.db2.gz LQKUMYBUKQEPRC-LXZJYRNTSA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001461861786 1063757237 /nfs/dbraw/zinc/75/72/37/1063757237.db2.gz LQKUMYBUKQEPRC-LXZJYRNTSA-N 2 1 304.522 4.152 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001258713155 1063768209 /nfs/dbraw/zinc/76/82/09/1063768209.db2.gz DBBLFMYSZQESHW-HBMCJLEFSA-N 2 1 314.517 4.062 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH+]1C[C@H]2C[N@@H+](CCC)C[C@H]2C1 ZINC001258713155 1063768217 /nfs/dbraw/zinc/76/82/17/1063768217.db2.gz DBBLFMYSZQESHW-HBMCJLEFSA-N 2 1 314.517 4.062 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH+]1C[C@H]2C[N@H+](CCC)C[C@H]2C1 ZINC001258713155 1063768224 /nfs/dbraw/zinc/76/82/24/1063768224.db2.gz DBBLFMYSZQESHW-HBMCJLEFSA-N 2 1 314.517 4.062 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258741603 1063790314 /nfs/dbraw/zinc/79/03/14/1063790314.db2.gz MSNGGYFFFDMIAM-FNHZYXHNSA-N 2 1 320.908 4.395 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001258741618 1063791512 /nfs/dbraw/zinc/79/15/12/1063791512.db2.gz NBARULUTZGJBOB-MAUKXSAKSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001258741618 1063791524 /nfs/dbraw/zinc/79/15/24/1063791524.db2.gz NBARULUTZGJBOB-MAUKXSAKSA-N 2 1 320.908 4.268 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H](C)Cc2cccc(Cl)c2)CC1 ZINC001258748231 1063795375 /nfs/dbraw/zinc/79/53/75/1063795375.db2.gz APFXOFLJDHOCNO-INIZCTEOSA-N 2 1 322.924 4.323 20 0 DIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919271 1063799855 /nfs/dbraw/zinc/79/98/55/1063799855.db2.gz NDGKCZHXACSGOM-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919271 1063799865 /nfs/dbraw/zinc/79/98/65/1063799865.db2.gz NDGKCZHXACSGOM-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919271 1063799877 /nfs/dbraw/zinc/79/98/77/1063799877.db2.gz NDGKCZHXACSGOM-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919271 1063799890 /nfs/dbraw/zinc/79/98/90/1063799890.db2.gz NDGKCZHXACSGOM-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC001461922105 1063803200 /nfs/dbraw/zinc/80/32/00/1063803200.db2.gz SISOILSELOGWOL-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC001461922105 1063803216 /nfs/dbraw/zinc/80/32/16/1063803216.db2.gz SISOILSELOGWOL-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922105 1063803229 /nfs/dbraw/zinc/80/32/29/1063803229.db2.gz SISOILSELOGWOL-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922105 1063803243 /nfs/dbraw/zinc/80/32/43/1063803243.db2.gz SISOILSELOGWOL-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC001461921734 1063805989 /nfs/dbraw/zinc/80/59/89/1063805989.db2.gz WILMHERMGQXIHG-QGZVFWFLSA-N 2 1 318.505 4.049 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC001461921734 1063806005 /nfs/dbraw/zinc/80/60/05/1063806005.db2.gz WILMHERMGQXIHG-QGZVFWFLSA-N 2 1 318.505 4.049 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001461921734 1063806024 /nfs/dbraw/zinc/80/60/24/1063806024.db2.gz WILMHERMGQXIHG-QGZVFWFLSA-N 2 1 318.505 4.049 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001461921734 1063806044 /nfs/dbraw/zinc/80/60/44/1063806044.db2.gz WILMHERMGQXIHG-QGZVFWFLSA-N 2 1 318.505 4.049 20 0 DIADMP CCCC[C@@H](CCC)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258762533 1063807746 /nfs/dbraw/zinc/80/77/46/1063807746.db2.gz YHBDCVYBULPPLQ-MSOLQXFVSA-N 2 1 324.553 4.357 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](CC2CC2)c2ccccc2F)CC1 ZINC001258770426 1063813726 /nfs/dbraw/zinc/81/37/26/1063813726.db2.gz LPYLIYGPXNVLHA-IBGZPJMESA-N 2 1 304.453 4.131 20 0 DIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(-c3ccsc3)cc2)CC1 ZINC001258768369 1063814092 /nfs/dbraw/zinc/81/40/92/1063814092.db2.gz LGXWWRCJMHAKAY-UHFFFAOYSA-N 2 1 314.498 4.379 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258786155 1063823706 /nfs/dbraw/zinc/82/37/06/1063823706.db2.gz KTTWKYSVBFZGOM-HZPDHXFCSA-N 2 1 306.469 4.290 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786915 1063825955 /nfs/dbraw/zinc/82/59/55/1063825955.db2.gz PSGMXCFKGDAOQV-VBSBHUPXSA-N 2 1 317.521 4.368 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258827000 1063849585 /nfs/dbraw/zinc/84/95/85/1063849585.db2.gz NYOOVQVMFBEHNT-UTKZUKDTSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258827000 1063849592 /nfs/dbraw/zinc/84/95/92/1063849592.db2.gz NYOOVQVMFBEHNT-UTKZUKDTSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@@H]1CCC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258828769 1063853344 /nfs/dbraw/zinc/85/33/44/1063853344.db2.gz QUNFEFFENBAASN-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258828769 1063853354 /nfs/dbraw/zinc/85/33/54/1063853354.db2.gz QUNFEFFENBAASN-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258828769 1063853365 /nfs/dbraw/zinc/85/33/65/1063853365.db2.gz QUNFEFFENBAASN-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258828770 1063854100 /nfs/dbraw/zinc/85/41/00/1063854100.db2.gz QUNFEFFENBAASN-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258828770 1063854109 /nfs/dbraw/zinc/85/41/09/1063854109.db2.gz QUNFEFFENBAASN-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258828770 1063854121 /nfs/dbraw/zinc/85/41/21/1063854121.db2.gz QUNFEFFENBAASN-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258841964 1063862880 /nfs/dbraw/zinc/86/28/80/1063862880.db2.gz CILPLKDZWQHWIC-BJLQDIEVSA-N 2 1 300.490 4.132 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H](CC)Cc2ccccc2)CC1 ZINC001258852352 1063866778 /nfs/dbraw/zinc/86/67/78/1063866778.db2.gz LESJXKVKGRIDTP-LJQANCHMSA-N 2 1 302.506 4.204 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCC[C@H]1CCF ZINC000556857293 1063899560 /nfs/dbraw/zinc/89/95/60/1063899560.db2.gz RMPRZGTWDQBWAE-LPHOPBHVSA-N 2 1 306.469 4.145 20 0 DIADMP CCCCCC[C@@H]1CCC[C@H]1[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC001462099560 1063930003 /nfs/dbraw/zinc/93/00/03/1063930003.db2.gz QAOLNSMOCNXWTM-VAMGGRTRSA-N 2 1 324.553 4.216 20 0 DIADMP CCCCCC[C@@H]1CCC[C@H]1[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC001462099560 1063930005 /nfs/dbraw/zinc/93/00/05/1063930005.db2.gz QAOLNSMOCNXWTM-VAMGGRTRSA-N 2 1 324.553 4.216 20 0 DIADMP CCC1(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CCCC1 ZINC000378895572 1063979994 /nfs/dbraw/zinc/97/99/94/1063979994.db2.gz ABBKAQJZZMJSOE-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@@H](C[NH2+][C@H]3CCC[C@@H]4C[C@@H]43)C2)cc1 ZINC000378965538 1063983093 /nfs/dbraw/zinc/98/30/93/1063983093.db2.gz UERFFAUBMPZUJW-WOZUAGRISA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H]1C ZINC000379621917 1063984880 /nfs/dbraw/zinc/98/48/80/1063984880.db2.gz GBZYUWOCJHAGJQ-WQBVUOOHSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H]1C ZINC000379621917 1063984884 /nfs/dbraw/zinc/98/48/84/1063984884.db2.gz GBZYUWOCJHAGJQ-WQBVUOOHSA-N 2 1 314.517 4.454 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379633481 1063985058 /nfs/dbraw/zinc/98/50/58/1063985058.db2.gz OUBQSUQFVMAFIQ-NLWGTHIKSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379633481 1063985061 /nfs/dbraw/zinc/98/50/61/1063985061.db2.gz OUBQSUQFVMAFIQ-NLWGTHIKSA-N 2 1 302.506 4.454 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379628059 1063985151 /nfs/dbraw/zinc/98/51/51/1063985151.db2.gz IOFGYHZQIVKXKW-PZJWPPBQSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379628043 1063985232 /nfs/dbraw/zinc/98/52/32/1063985232.db2.gz IOFGYHZQIVKXKW-CTNGQTDRSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C)c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379635007 1063985276 /nfs/dbraw/zinc/98/52/76/1063985276.db2.gz PZTGDESPVQJSQC-KNQAVFIVSA-N 2 1 322.496 4.446 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H](C)C1 ZINC000379632394 1063986060 /nfs/dbraw/zinc/98/60/60/1063986060.db2.gz NQKVKYIFRKAUTL-SQAAOVBZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H](C)C1 ZINC000379632394 1063986067 /nfs/dbraw/zinc/98/60/67/1063986067.db2.gz NQKVKYIFRKAUTL-SQAAOVBZSA-N 2 1 314.517 4.454 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380945861 1063989241 /nfs/dbraw/zinc/98/92/41/1063989241.db2.gz OTJMELRVBAKCPP-RBUKOAKNSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000384523722 1064004936 /nfs/dbraw/zinc/00/49/36/1064004936.db2.gz XRZCOJWHKOEXFE-QGZVFWFLSA-N 2 1 302.506 4.108 20 0 DIADMP CC(C)CCC[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000390239515 1064151579 /nfs/dbraw/zinc/15/15/79/1064151579.db2.gz BMEVIVSDZRACCN-LJQANCHMSA-N 2 1 316.533 4.498 20 0 DIADMP CCC[C@H](CC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390669537 1064166455 /nfs/dbraw/zinc/16/64/55/1064166455.db2.gz NMTVMYNBURENDX-OALUTQOASA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](CC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390669537 1064166463 /nfs/dbraw/zinc/16/64/63/1064166463.db2.gz NMTVMYNBURENDX-OALUTQOASA-N 2 1 302.506 4.455 20 0 DIADMP CCC(CC)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390658050 1064166568 /nfs/dbraw/zinc/16/65/68/1064166568.db2.gz LCXCGQYLTDCQMI-LJQANCHMSA-N 2 1 302.506 4.313 20 0 DIADMP CCC(CC)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390658050 1064166569 /nfs/dbraw/zinc/16/65/69/1064166569.db2.gz LCXCGQYLTDCQMI-LJQANCHMSA-N 2 1 302.506 4.313 20 0 DIADMP CCCC[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390717784 1064167621 /nfs/dbraw/zinc/16/76/21/1064167621.db2.gz YOMRJMYMLWCROF-MJGOQNOKSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390717784 1064167634 /nfs/dbraw/zinc/16/76/34/1064167634.db2.gz YOMRJMYMLWCROF-MJGOQNOKSA-N 2 1 302.506 4.455 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000390800144 1064170309 /nfs/dbraw/zinc/17/03/09/1064170309.db2.gz XOEBGYKCLAEXKQ-PKOBYXMFSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc2c(c1)CCCC2 ZINC000390848065 1064171158 /nfs/dbraw/zinc/17/11/58/1064171158.db2.gz CBRPBKQNKPAJLX-KOVLHOQQSA-N 2 1 312.501 4.231 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc2c(c1)CCCC2 ZINC000390848065 1064171162 /nfs/dbraw/zinc/17/11/62/1064171162.db2.gz CBRPBKQNKPAJLX-KOVLHOQQSA-N 2 1 312.501 4.231 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000393946117 1064312995 /nfs/dbraw/zinc/31/29/95/1064312995.db2.gz FYLLLRXBIDTOMQ-CMKODMSKSA-N 2 1 302.506 4.313 20 0 DIADMP Cc1cccc(C[N@@H+]2C[C@@H]3CC[NH+](C4CCCC4)CC[C@@H]3C2)c1 ZINC001279144057 1064334738 /nfs/dbraw/zinc/33/47/38/1064334738.db2.gz LYKZHELHMXKXJQ-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP Cc1cccc(C[NH+]2C[C@@H]3CC[N@H+](C4CCCC4)CC[C@@H]3C2)c1 ZINC001279144057 1064334742 /nfs/dbraw/zinc/33/47/42/1064334742.db2.gz LYKZHELHMXKXJQ-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP Cc1cccc(C[NH+]2C[C@@H]3CC[N@@H+](C4CCCC4)CC[C@@H]3C2)c1 ZINC001279144057 1064334745 /nfs/dbraw/zinc/33/47/45/1064334745.db2.gz LYKZHELHMXKXJQ-BGYRXZFFSA-N 2 1 312.501 4.081 20 0 DIADMP CCCC[C@@H](CC)C[N@@H+]1CCC2(C[NH+](CCC(C)(C)OC)C2)C1 ZINC001279266445 1064339221 /nfs/dbraw/zinc/33/92/21/1064339221.db2.gz BMHOSGNKIFRYKW-GOSISDBHSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCC2(C[NH+](CCC(C)(C)OC)C2)C1 ZINC001279266445 1064339238 /nfs/dbraw/zinc/33/92/38/1064339238.db2.gz BMHOSGNKIFRYKW-GOSISDBHSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001279496027 1064352763 /nfs/dbraw/zinc/35/27/63/1064352763.db2.gz ZJLGFRQPIAHELM-AZUAARDMSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001279496027 1064352771 /nfs/dbraw/zinc/35/27/71/1064352771.db2.gz ZJLGFRQPIAHELM-AZUAARDMSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001279496027 1064352781 /nfs/dbraw/zinc/35/27/81/1064352781.db2.gz ZJLGFRQPIAHELM-AZUAARDMSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001279496039 1064353044 /nfs/dbraw/zinc/35/30/44/1064353044.db2.gz ZJLGFRQPIAHELM-UYAOXDASSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001279496039 1064353055 /nfs/dbraw/zinc/35/30/55/1064353055.db2.gz ZJLGFRQPIAHELM-UYAOXDASSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001279496039 1064353062 /nfs/dbraw/zinc/35/30/62/1064353062.db2.gz ZJLGFRQPIAHELM-UYAOXDASSA-N 2 1 324.553 4.026 20 0 DIADMP Cc1c(F)ccc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)c1Cl ZINC001279656674 1064360745 /nfs/dbraw/zinc/36/07/45/1064360745.db2.gz OWALNGMUBFLHAK-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP Cc1cc(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)c(F)cc1Cl ZINC001280114706 1064379516 /nfs/dbraw/zinc/37/95/16/1064379516.db2.gz DFRFDJUOABXJML-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP Cc1cc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)c(F)cc1Cl ZINC001280114706 1064379519 /nfs/dbraw/zinc/37/95/19/1064379519.db2.gz DFRFDJUOABXJML-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP Cc1cc[nH+]c(N2CCC3(CCC[N@@H+](C4CCCC4)C3)CC2)c1 ZINC001280090714 1064380442 /nfs/dbraw/zinc/38/04/42/1064380442.db2.gz YHCWPFDBENQWKI-UHFFFAOYSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cc[nH+]c(N2CCC3(CCC[N@H+](C4CCCC4)C3)CC2)c1 ZINC001280090714 1064380448 /nfs/dbraw/zinc/38/04/48/1064380448.db2.gz YHCWPFDBENQWKI-UHFFFAOYSA-N 2 1 313.489 4.015 20 0 DIADMP CSc1cc(C)cc(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)c1 ZINC001280164420 1064384213 /nfs/dbraw/zinc/38/42/13/1064384213.db2.gz RMYGXOWYFFZNGM-UHFFFAOYSA-N 2 1 318.530 4.025 20 0 DIADMP CSc1cc(C)cc(C[N@@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)c1 ZINC001280162531 1064384439 /nfs/dbraw/zinc/38/44/39/1064384439.db2.gz CLOIPXZMKDULQT-IBGZPJMESA-N 2 1 318.530 4.025 20 0 DIADMP CSc1cc(C)cc(C[N@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)c1 ZINC001280162531 1064384453 /nfs/dbraw/zinc/38/44/53/1064384453.db2.gz CLOIPXZMKDULQT-IBGZPJMESA-N 2 1 318.530 4.025 20 0 DIADMP CSc1cc(C)cc(C[NH+]2CCC[C@]3(CCC[N@H+](C)C3)C2)c1 ZINC001280162531 1064384460 /nfs/dbraw/zinc/38/44/60/1064384460.db2.gz CLOIPXZMKDULQT-IBGZPJMESA-N 2 1 318.530 4.025 20 0 DIADMP CSc1cc(C)cc(C[NH+]2CCC[C@]3(CCC[N@@H+](C)C3)C2)c1 ZINC001280162531 1064384472 /nfs/dbraw/zinc/38/44/72/1064384472.db2.gz CLOIPXZMKDULQT-IBGZPJMESA-N 2 1 318.530 4.025 20 0 DIADMP CC(C)Oc1cccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000817888768 1064413352 /nfs/dbraw/zinc/41/33/52/1064413352.db2.gz OGIGEHOOVYWFSO-FPOVZHCZSA-N 2 1 324.468 4.057 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC001307434697 1065393901 /nfs/dbraw/zinc/39/39/01/1065393901.db2.gz XTCKEDGJUNZOCR-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC001307434697 1065393910 /nfs/dbraw/zinc/39/39/10/1065393910.db2.gz XTCKEDGJUNZOCR-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC001307434697 1065393914 /nfs/dbraw/zinc/39/39/14/1065393914.db2.gz XTCKEDGJUNZOCR-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP Cc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(Cl)c1 ZINC001307455913 1065410568 /nfs/dbraw/zinc/41/05/68/1065410568.db2.gz UJCXSSRFACWXOT-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001307492530 1065437444 /nfs/dbraw/zinc/43/74/44/1065437444.db2.gz MABDBRIEZHKATH-QZTJIDSGSA-N 2 1 300.490 4.293 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(C(C)(C)C)c2)CC1 ZINC001307515912 1065455562 /nfs/dbraw/zinc/45/55/62/1065455562.db2.gz XONUWDWBJNCXNN-UHFFFAOYSA-N 2 1 302.506 4.290 20 0 DIADMP c1ccc([C@]23CCCC[C@@H]2C[N@@H+]3CCC[NH+]2CCCCC2)cc1 ZINC001307534991 1065469434 /nfs/dbraw/zinc/46/94/34/1065469434.db2.gz QLOSKHVSKCMKEW-NHCUHLMSSA-N 2 1 312.501 4.264 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC2CC3(CCC3)C2)CC1)CC1CC1 ZINC001307606809 1065511034 /nfs/dbraw/zinc/51/10/34/1065511034.db2.gz QNMSRVBMXXPULW-UHFFFAOYSA-N 2 1 318.549 4.401 20 0 DIADMP CC(C)Cc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[N@H+]2C)C2CC2)cc1 ZINC001307614334 1065518961 /nfs/dbraw/zinc/51/89/61/1065518961.db2.gz GEYZCXBTFBNKQH-LEWJYISDSA-N 2 1 314.517 4.410 20 0 DIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+](CC1CC1)C1CCC1 ZINC001307720789 1065583254 /nfs/dbraw/zinc/58/32/54/1065583254.db2.gz JFWNYIXFRWEKEB-UHFFFAOYSA-N 2 1 312.501 4.437 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001307981383 1065711554 /nfs/dbraw/zinc/71/15/54/1065711554.db2.gz HUGKBQWTPQFRRV-GOSISDBHSA-N 2 1 304.453 4.227 20 0 DIADMP CC[C@H](C)[C@H](C)[N@@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009097 1065723818 /nfs/dbraw/zinc/72/38/18/1065723818.db2.gz PLLGXGSLDSYBRK-JYAXBFRTSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@H](C)[C@H](C)[N@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009097 1065723830 /nfs/dbraw/zinc/72/38/30/1065723830.db2.gz PLLGXGSLDSYBRK-JYAXBFRTSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1C[C@@]2(C)C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009097 1065723848 /nfs/dbraw/zinc/72/38/48/1065723848.db2.gz PLLGXGSLDSYBRK-JYAXBFRTSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1C[C@@]2(C)C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009097 1065723865 /nfs/dbraw/zinc/72/38/65/1065723865.db2.gz PLLGXGSLDSYBRK-JYAXBFRTSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001308041291 1065737746 /nfs/dbraw/zinc/73/77/46/1065737746.db2.gz YVICOZTXSVLKGD-LJQANCHMSA-N 2 1 306.469 4.475 20 0 DIADMP C[C@H](C[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1)C(C)(C)C ZINC001308057935 1065745541 /nfs/dbraw/zinc/74/55/41/1065745541.db2.gz AIKQVAZPWYAWJG-SLYNCCJLSA-N 2 1 314.517 4.123 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2ccccc2)CC1(C)C ZINC001308121269 1065769867 /nfs/dbraw/zinc/76/98/67/1065769867.db2.gz MCMLNLDTHZTXFX-IBGZPJMESA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2ccccc2)CC1(C)C ZINC001308121269 1065769882 /nfs/dbraw/zinc/76/98/82/1065769882.db2.gz MCMLNLDTHZTXFX-IBGZPJMESA-N 2 1 311.473 4.240 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)CC1 ZINC001308180455 1065791564 /nfs/dbraw/zinc/79/15/64/1065791564.db2.gz IHBYERDQERCGDZ-AZUAARDMSA-N 2 1 300.490 4.177 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@H](C(C)(C)C)CC1 ZINC001308196606 1065803241 /nfs/dbraw/zinc/80/32/41/1065803241.db2.gz DKMYCKQTJBXFKY-BPQIPLTHSA-N 2 1 305.510 4.412 20 0 DIADMP CC[C@@H](C[NH2+]C/C(C)=C/c1ccc(Cl)cc1)[NH+]1CCCC1 ZINC001308195073 1065804212 /nfs/dbraw/zinc/80/42/12/1065804212.db2.gz XPHWQEGWLODAAD-XOVFHRFOSA-N 2 1 306.881 4.207 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC001308200020 1065808424 /nfs/dbraw/zinc/80/84/24/1065808424.db2.gz RSACAFIUDPNPDR-FUHIMQAGSA-N 2 1 300.490 4.197 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]CC(C)(C)c2ccccc2)C1 ZINC001308204457 1065812201 /nfs/dbraw/zinc/81/22/01/1065812201.db2.gz TZYLWCXFHPVPPL-KDURUIRLSA-N 2 1 316.533 4.312 20 0 DIADMP CC[C@@H](C)[N@H+](C)CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240764 1065847539 /nfs/dbraw/zinc/84/75/39/1065847539.db2.gz ZATYSSUWRCXPFS-ZWKOTPCHSA-N 2 1 318.549 4.483 20 0 DIADMP CC[C@@H](C)[N@@H+](C)CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240764 1065847552 /nfs/dbraw/zinc/84/75/52/1065847552.db2.gz ZATYSSUWRCXPFS-ZWKOTPCHSA-N 2 1 318.549 4.483 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC001308255013 1065858710 /nfs/dbraw/zinc/85/87/10/1065858710.db2.gz WPFAJOMBFPITOL-MOPGFXCFSA-N 2 1 322.537 4.113 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC001308255013 1065858723 /nfs/dbraw/zinc/85/87/23/1065858723.db2.gz WPFAJOMBFPITOL-MOPGFXCFSA-N 2 1 322.537 4.113 20 0 DIADMP C[C@H]([NH2+]C1(C[NH2+][C@H]2CCC[C@H]2C)CCCC1)c1ccccc1 ZINC001308278581 1065878070 /nfs/dbraw/zinc/87/80/70/1065878070.db2.gz DOCNEVGLKIIFDQ-AOIWGVFYSA-N 2 1 300.490 4.428 20 0 DIADMP CCCC1(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC001308327713 1065916836 /nfs/dbraw/zinc/91/68/36/1065916836.db2.gz UGYXXOILIZHVQI-UHFFFAOYSA-N 2 1 302.506 4.315 20 0 DIADMP CCC(C)(C)c1ccc(C[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001308343822 1065927771 /nfs/dbraw/zinc/92/77/71/1065927771.db2.gz WKRWYJPERMVEPN-SFHVURJKSA-N 2 1 302.506 4.337 20 0 DIADMP Cc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC001308368379 1065944550 /nfs/dbraw/zinc/94/45/50/1065944550.db2.gz SJMRHAMTWKILFK-WBVHZDCISA-N 2 1 320.908 4.391 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001308393367 1065959126 /nfs/dbraw/zinc/95/91/26/1065959126.db2.gz UACDDLLLGRODCC-IEBWSBKVSA-N 2 1 302.506 4.170 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccccc1-c1ccccc1 ZINC001308400155 1065963666 /nfs/dbraw/zinc/96/36/66/1065963666.db2.gz WNBOTRLBWXZVKA-FQEVSTJZSA-N 2 1 308.469 4.318 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+]Cc1ccccc1-c1ccccc1 ZINC001308400155 1065963679 /nfs/dbraw/zinc/96/36/79/1065963679.db2.gz WNBOTRLBWXZVKA-FQEVSTJZSA-N 2 1 308.469 4.318 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cccc(C)c1C)C1CCCCC1 ZINC001308455086 1065998794 /nfs/dbraw/zinc/99/87/94/1065998794.db2.gz BTKRFVMQLMFRKO-UHFFFAOYSA-N 2 1 302.506 4.438 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001308469700 1066009879 /nfs/dbraw/zinc/00/98/79/1066009879.db2.gz RVDZWQYYKWFNHH-QUCCMNQESA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001308469700 1066009895 /nfs/dbraw/zinc/00/98/95/1066009895.db2.gz RVDZWQYYKWFNHH-QUCCMNQESA-N 2 1 314.517 4.252 20 0 DIADMP C1CCC2(C1)CCC([NH2+][C@@H]1CC[N@@H+](C3CCCCC3)C1)CC2 ZINC001308469803 1066009945 /nfs/dbraw/zinc/00/99/45/1066009945.db2.gz WCJNHVPVCUQQNQ-GOSISDBHSA-N 2 1 304.522 4.486 20 0 DIADMP C1CCC2(C1)CCC([NH2+][C@@H]1CC[N@H+](C3CCCCC3)C1)CC2 ZINC001308469803 1066009956 /nfs/dbraw/zinc/00/99/56/1066009956.db2.gz WCJNHVPVCUQQNQ-GOSISDBHSA-N 2 1 304.522 4.486 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@]23C[C@@H]2CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001308521903 1066043952 /nfs/dbraw/zinc/04/39/52/1066043952.db2.gz JTVGGGFUNKIJNH-GFOJFJKKSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@]23C[C@@H]2CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001308521903 1066043961 /nfs/dbraw/zinc/04/39/61/1066043961.db2.gz JTVGGGFUNKIJNH-GFOJFJKKSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573277 1066086442 /nfs/dbraw/zinc/08/64/42/1066086442.db2.gz FHOKAPCNFCMDQJ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573277 1066086451 /nfs/dbraw/zinc/08/64/51/1066086451.db2.gz FHOKAPCNFCMDQJ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1Cl ZINC001308573277 1066086463 /nfs/dbraw/zinc/08/64/63/1066086463.db2.gz FHOKAPCNFCMDQJ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1Cl ZINC001308573277 1066086477 /nfs/dbraw/zinc/08/64/77/1066086477.db2.gz FHOKAPCNFCMDQJ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573275 1066086626 /nfs/dbraw/zinc/08/66/26/1066086626.db2.gz FHOKAPCNFCMDQJ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573275 1066086636 /nfs/dbraw/zinc/08/66/36/1066086636.db2.gz FHOKAPCNFCMDQJ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1Cl ZINC001308573275 1066086645 /nfs/dbraw/zinc/08/66/45/1066086645.db2.gz FHOKAPCNFCMDQJ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1Cl ZINC001308573275 1066086658 /nfs/dbraw/zinc/08/66/58/1066086658.db2.gz FHOKAPCNFCMDQJ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)s1 ZINC001308576059 1066090435 /nfs/dbraw/zinc/09/04/35/1066090435.db2.gz YJKMXAOOFVWKDU-DNVCBOLYSA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC001308576059 1066090442 /nfs/dbraw/zinc/09/04/42/1066090442.db2.gz YJKMXAOOFVWKDU-DNVCBOLYSA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)s1 ZINC001308576059 1066090449 /nfs/dbraw/zinc/09/04/49/1066090449.db2.gz YJKMXAOOFVWKDU-DNVCBOLYSA-N 2 1 318.530 4.149 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)CC1 ZINC001308600281 1066109954 /nfs/dbraw/zinc/10/99/54/1066109954.db2.gz YVRLHUFJMXHFAP-IOJLRTSASA-N 2 1 306.538 4.113 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)CC1 ZINC001308600281 1066109956 /nfs/dbraw/zinc/10/99/56/1066109956.db2.gz YVRLHUFJMXHFAP-IOJLRTSASA-N 2 1 306.538 4.113 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)CC1 ZINC001308600281 1066109958 /nfs/dbraw/zinc/10/99/58/1066109958.db2.gz YVRLHUFJMXHFAP-IOJLRTSASA-N 2 1 306.538 4.113 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC001308612705 1066117264 /nfs/dbraw/zinc/11/72/64/1066117264.db2.gz SAZQYQAACBNAEF-UHFFFAOYSA-N 2 1 300.490 4.116 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)CC1 ZINC001308621400 1066123103 /nfs/dbraw/zinc/12/31/03/1066123103.db2.gz KJLRQNCVLVIJEQ-HNNXBMFYSA-N 2 1 323.550 4.300 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001308735787 1066212082 /nfs/dbraw/zinc/21/20/82/1066212082.db2.gz KLPRAPAUEVDJDT-PGYGNJIDSA-N 2 1 302.506 4.280 20 0 DIADMP C[C@H]1C[C@@H](N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccsc2S1 ZINC001308759402 1066230302 /nfs/dbraw/zinc/23/03/02/1066230302.db2.gz CLSWGVOUBVGFLZ-LLWQXYEOSA-N 2 1 322.543 4.231 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccsc2S1 ZINC001308759402 1066230358 /nfs/dbraw/zinc/23/03/58/1066230358.db2.gz CLSWGVOUBVGFLZ-LLWQXYEOSA-N 2 1 322.543 4.231 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccsc2S1 ZINC001308759402 1066230375 /nfs/dbraw/zinc/23/03/75/1066230375.db2.gz CLSWGVOUBVGFLZ-LLWQXYEOSA-N 2 1 322.543 4.231 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC001308794562 1066270960 /nfs/dbraw/zinc/27/09/60/1066270960.db2.gz XTBFGZIOLQBJEG-IAGOWNOFSA-N 2 1 315.505 4.199 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC001308794562 1066270973 /nfs/dbraw/zinc/27/09/73/1066270973.db2.gz XTBFGZIOLQBJEG-IAGOWNOFSA-N 2 1 315.505 4.199 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001308797446 1066273342 /nfs/dbraw/zinc/27/33/42/1066273342.db2.gz FLYWRGPDZSNAIU-UONOGXRCSA-N 2 1 316.942 4.433 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001308797446 1066273352 /nfs/dbraw/zinc/27/33/52/1066273352.db2.gz FLYWRGPDZSNAIU-UONOGXRCSA-N 2 1 316.942 4.433 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC001308863994 1066344735 /nfs/dbraw/zinc/34/47/35/1066344735.db2.gz OPQUYGDXAZVQLL-AYOQOUSVSA-N 2 1 320.908 4.298 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(-c3cccnc3)c2)CC1 ZINC000092165513 193169507 /nfs/dbraw/zinc/16/95/07/193169507.db2.gz SHNUCAKJPOTXBH-UHFFFAOYSA-N 2 1 323.484 4.055 20 0 DIADMP C[C@@H](N[C@@H](C)c1cccnc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272635158 130048731 /nfs/dbraw/zinc/04/87/31/130048731.db2.gz BOBPLZXAOYYMED-QLFBSQMISA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000274801377 130263810 /nfs/dbraw/zinc/26/38/10/130263810.db2.gz VINKCKYUBLUOJB-QLFBSQMISA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000274801377 130263811 /nfs/dbraw/zinc/26/38/11/130263811.db2.gz VINKCKYUBLUOJB-QLFBSQMISA-N 2 1 321.896 4.039 20 0 DIADMP CSCCCCC[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274817206 130265060 /nfs/dbraw/zinc/26/50/60/130265060.db2.gz XEKDAWCAUYQSFM-HKUYNNGSSA-N 2 1 320.546 4.020 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCSc2cc(C)c(C)cc21 ZINC000275399091 130314683 /nfs/dbraw/zinc/31/46/83/130314683.db2.gz ZLUKEBJBFKEXTG-KRWDZBQOSA-N 2 1 315.486 4.025 20 0 DIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccccn1 ZINC000285809013 131203611 /nfs/dbraw/zinc/20/36/11/131203611.db2.gz VRFXSLHLDNHDPY-KKXNLOMOSA-N 2 1 323.484 4.175 20 0 DIADMP c1[nH+]c(C2CC[NH+]([C@H]3C=CCCCCC3)CC2)n2c1CCCC2 ZINC000559187287 331986623 /nfs/dbraw/zinc/98/66/23/331986623.db2.gz SAQROEDTLVJRLS-SFHVURJKSA-N 2 1 313.489 4.288 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCCc3sc(Cl)cc32)CC1 ZINC000127467961 332002592 /nfs/dbraw/zinc/00/25/92/332002592.db2.gz CZKYWZZUBMJJMX-AWEZNQCLSA-N 2 1 312.910 4.241 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000559273244 332011897 /nfs/dbraw/zinc/01/18/97/332011897.db2.gz KVTLCIRRUPWJOF-RDJZCZTQSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000559273244 332011898 /nfs/dbraw/zinc/01/18/98/332011898.db2.gz KVTLCIRRUPWJOF-RDJZCZTQSA-N 2 1 320.527 4.291 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1CNc1cc[nH+]c2ccccc12 ZINC000518374887 332020908 /nfs/dbraw/zinc/02/09/08/332020908.db2.gz WVICMOHFCJXJQP-UHFFFAOYSA-N 2 1 319.452 4.109 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C/C=C/c2ccccc2)C[C@H]1c1ccccc1 ZINC000518407648 332027524 /nfs/dbraw/zinc/02/75/24/332027524.db2.gz HONSJOIAGSPZEK-GEDDFEBSSA-N 2 1 306.453 4.125 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C/C=C/c2ccccc2)C[C@H]1c1ccccc1 ZINC000518407648 332027527 /nfs/dbraw/zinc/02/75/27/332027527.db2.gz HONSJOIAGSPZEK-GEDDFEBSSA-N 2 1 306.453 4.125 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)CCCSCc2ccccc2)CC1 ZINC000536377699 332234627 /nfs/dbraw/zinc/23/46/27/332234627.db2.gz ILMWMODQYXJLPZ-UHFFFAOYSA-N 2 1 320.546 4.116 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)CCC2 ZINC000536423681 332242256 /nfs/dbraw/zinc/24/22/56/332242256.db2.gz GAKJEVVANMSAKE-MOXGXCLJSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)CCC2 ZINC000536423681 332242258 /nfs/dbraw/zinc/24/22/58/332242258.db2.gz GAKJEVVANMSAKE-MOXGXCLJSA-N 2 1 300.490 4.260 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCc2ccc(Cl)cc21 ZINC000536491164 332252710 /nfs/dbraw/zinc/25/27/10/332252710.db2.gz IQCISJQNBLUKPX-SFHVURJKSA-N 2 1 317.864 4.292 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2C[C@H](C)[N@@H+](C)C[C@H]2C)c2ccccc21 ZINC000448032717 332270762 /nfs/dbraw/zinc/27/07/62/332270762.db2.gz XKAHFOBOBJBVFU-OZMCLOMFSA-N 2 1 314.517 4.232 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000559744069 332278743 /nfs/dbraw/zinc/27/87/43/332278743.db2.gz VCIMETOGZABZPT-BAGYTPMASA-N 2 1 320.480 4.407 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000559744069 332278745 /nfs/dbraw/zinc/27/87/45/332278745.db2.gz VCIMETOGZABZPT-BAGYTPMASA-N 2 1 320.480 4.407 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]C3CC[NH+](C(C)C)CC3)oc2c1 ZINC000426070662 335098434 /nfs/dbraw/zinc/09/84/34/335098434.db2.gz PBMMKHMMJKJBPL-HNNXBMFYSA-N 2 1 300.446 4.265 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)C[C@H]1c1ccccc1 ZINC000559766061 332279707 /nfs/dbraw/zinc/27/97/07/332279707.db2.gz FHQDWXKZFZPAJT-MYGYKHERSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)C[C@H]1c1ccccc1 ZINC000559766061 332279708 /nfs/dbraw/zinc/27/97/08/332279708.db2.gz FHQDWXKZFZPAJT-MYGYKHERSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767178 332280230 /nfs/dbraw/zinc/28/02/30/332280230.db2.gz OXHYSULDDAYULZ-KKUMJFAQSA-N 2 1 300.421 4.112 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767178 332280231 /nfs/dbraw/zinc/28/02/31/332280231.db2.gz OXHYSULDDAYULZ-KKUMJFAQSA-N 2 1 300.421 4.112 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767177 332280267 /nfs/dbraw/zinc/28/02/67/332280267.db2.gz OXHYSULDDAYULZ-ILXRZTDVSA-N 2 1 300.421 4.112 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767177 332280269 /nfs/dbraw/zinc/28/02/69/332280269.db2.gz OXHYSULDDAYULZ-ILXRZTDVSA-N 2 1 300.421 4.112 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2(C)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000559794461 332282333 /nfs/dbraw/zinc/28/23/33/332282333.db2.gz XLSCFJUSXULQAR-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2(C)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000559794461 332282334 /nfs/dbraw/zinc/28/23/34/332282334.db2.gz XLSCFJUSXULQAR-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794461 332282335 /nfs/dbraw/zinc/28/23/35/332282335.db2.gz XLSCFJUSXULQAR-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794461 332282336 /nfs/dbraw/zinc/28/23/36/332282336.db2.gz XLSCFJUSXULQAR-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559845826 332284756 /nfs/dbraw/zinc/28/47/56/332284756.db2.gz VMJKZLVBLWFWJN-GSEOLPGOSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559845826 332284757 /nfs/dbraw/zinc/28/47/57/332284757.db2.gz VMJKZLVBLWFWJN-GSEOLPGOSA-N 2 1 300.490 4.380 20 0 DIADMP c1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000564959120 332296478 /nfs/dbraw/zinc/29/64/78/332296478.db2.gz NPALIUCIPDYWEX-SFHVURJKSA-N 2 1 312.482 4.035 20 0 DIADMP c1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000564959120 332296480 /nfs/dbraw/zinc/29/64/80/332296480.db2.gz NPALIUCIPDYWEX-SFHVURJKSA-N 2 1 312.482 4.035 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CC[C@H](C)c2ccccc2)CC1 ZINC000560007523 332300886 /nfs/dbraw/zinc/30/08/86/332300886.db2.gz HMOOUTICGDCHCA-SFHVURJKSA-N 2 1 302.506 4.232 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)C1 ZINC000560247870 332323420 /nfs/dbraw/zinc/32/34/20/332323420.db2.gz GIOANAMGFGYWLA-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000560484137 332345025 /nfs/dbraw/zinc/34/50/25/332345025.db2.gz BBRJWUMULJQQTC-BQFCYCMXSA-N 2 1 304.503 4.219 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000560484137 332345026 /nfs/dbraw/zinc/34/50/26/332345026.db2.gz BBRJWUMULJQQTC-BQFCYCMXSA-N 2 1 304.503 4.219 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(C(F)(F)F)s1)[NH+]1CCCCC1 ZINC000428861183 332440778 /nfs/dbraw/zinc/44/07/78/332440778.db2.gz JCKSSIOXOYCYKG-LBPRGKRZSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(OC(F)F)c1 ZINC000261883971 332643033 /nfs/dbraw/zinc/64/30/33/332643033.db2.gz MWSOBKLSHWOMFQ-YMRXKLBXSA-N 2 1 318.367 4.083 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000378902529 333061910 /nfs/dbraw/zinc/06/19/10/333061910.db2.gz XPWMONWWBJSRPU-AABGKKOBSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCc2occc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310166066 333221452 /nfs/dbraw/zinc/22/14/52/333221452.db2.gz SFHCPDBUJUPSHQ-HQRMLTQVSA-N 2 1 324.468 4.157 20 0 DIADMP CC(C)[C@@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000319030691 333245845 /nfs/dbraw/zinc/24/58/45/333245845.db2.gz IOONCQCIVUQGHQ-RAFMOHDBSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840351 333283917 /nfs/dbraw/zinc/28/39/17/333283917.db2.gz YKKYGMNWFQJMEK-QZTJIDSGSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840351 333283919 /nfs/dbraw/zinc/28/39/19/333283919.db2.gz YKKYGMNWFQJMEK-QZTJIDSGSA-N 2 1 318.480 4.331 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000497829238 333297502 /nfs/dbraw/zinc/29/75/02/333297502.db2.gz RBONCHHGSWMTFL-KXBFYZLASA-N 2 1 314.473 4.451 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497834950 333298654 /nfs/dbraw/zinc/29/86/54/333298654.db2.gz AZLQIFFBDUNNMR-UZLBHIALSA-N 2 1 316.464 4.083 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000497831358 333299115 /nfs/dbraw/zinc/29/91/15/333299115.db2.gz ISMKRVKQVZHAKV-LJQANCHMSA-N 2 1 304.453 4.082 20 0 DIADMP CC(C)[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(F)cn1 ZINC000497853654 333301967 /nfs/dbraw/zinc/30/19/67/333301967.db2.gz QRKNICYFSJQMHD-LJQANCHMSA-N 2 1 321.484 4.162 20 0 DIADMP CC(C)[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(F)cn1 ZINC000497853654 333301968 /nfs/dbraw/zinc/30/19/68/333301968.db2.gz QRKNICYFSJQMHD-LJQANCHMSA-N 2 1 321.484 4.162 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594283 333305038 /nfs/dbraw/zinc/30/50/38/333305038.db2.gz GYHBWWKNHHTOSM-NZSAHSFTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594283 333305039 /nfs/dbraw/zinc/30/50/39/333305039.db2.gz GYHBWWKNHHTOSM-NZSAHSFTSA-N 2 1 300.490 4.065 20 0 DIADMP c1ccc2c(c1)cccc2C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000525786577 333312160 /nfs/dbraw/zinc/31/21/60/333312160.db2.gz FJFJDMFWTULWDY-GOSISDBHSA-N 2 1 308.469 4.148 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCCC1 ZINC000390666922 333312854 /nfs/dbraw/zinc/31/28/54/333312854.db2.gz RDBGIQWEJLMLTG-LJQANCHMSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCCC1 ZINC000390666922 333312856 /nfs/dbraw/zinc/31/28/56/333312856.db2.gz RDBGIQWEJLMLTG-LJQANCHMSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390685942 333315015 /nfs/dbraw/zinc/31/50/15/333315015.db2.gz XXIVDAPZEZFRSY-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390685942 333315016 /nfs/dbraw/zinc/31/50/16/333315016.db2.gz XXIVDAPZEZFRSY-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccsc1 ZINC000390698657 333316082 /nfs/dbraw/zinc/31/60/82/333316082.db2.gz SIYSQVLPRRDOCZ-SFHVURJKSA-N 2 1 314.498 4.138 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccsc1 ZINC000390698657 333316084 /nfs/dbraw/zinc/31/60/84/333316084.db2.gz SIYSQVLPRRDOCZ-SFHVURJKSA-N 2 1 314.498 4.138 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)CC1 ZINC000186946908 333382003 /nfs/dbraw/zinc/38/20/03/333382003.db2.gz UOSDNJHINDZQFK-OAQYLSRUSA-N 2 1 306.453 4.025 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2c(F)cccc2F)CC1 ZINC000521428558 333382113 /nfs/dbraw/zinc/38/21/13/333382113.db2.gz DFUPRNMCJSIMQK-HNNXBMFYSA-N 2 1 324.459 4.470 20 0 DIADMP Cc1cccc(N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)[nH+]1 ZINC000390853727 333399873 /nfs/dbraw/zinc/39/98/73/333399873.db2.gz HSOHKFKEVLWRFL-SFHVURJKSA-N 2 1 309.457 4.103 20 0 DIADMP Cc1cccc(N[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)[nH+]1 ZINC000390853727 333399875 /nfs/dbraw/zinc/39/98/75/333399875.db2.gz HSOHKFKEVLWRFL-SFHVURJKSA-N 2 1 309.457 4.103 20 0 DIADMP C[C@H](C[NH2+]C(c1ccccc1)c1ccccc1)C[NH+]1CCCC1 ZINC000391017214 333415151 /nfs/dbraw/zinc/41/51/51/333415151.db2.gz YZUSVRDNPYLEEB-GOSISDBHSA-N 2 1 308.469 4.098 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1 ZINC000338010221 333468042 /nfs/dbraw/zinc/46/80/42/333468042.db2.gz JPEVGVHOLGJALV-LLVKDONJSA-N 2 1 312.244 4.239 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC000563352978 333595006 /nfs/dbraw/zinc/59/50/06/333595006.db2.gz LRYVVCSVQWWTJR-LJQANCHMSA-N 2 1 315.436 4.013 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000343450398 335165543 /nfs/dbraw/zinc/16/55/43/335165543.db2.gz PWHSWESLCILLLL-GOSISDBHSA-N 2 1 317.864 4.137 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000343447449 335165586 /nfs/dbraw/zinc/16/55/86/335165586.db2.gz IORISBXJNNSZBX-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000343447449 335165588 /nfs/dbraw/zinc/16/55/88/335165588.db2.gz IORISBXJNNSZBX-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)cc1 ZINC000414289098 333934235 /nfs/dbraw/zinc/93/42/35/333934235.db2.gz QZKCIKSRYLVZSM-MORSLUCNSA-N 2 1 301.409 4.112 20 0 DIADMP C[N@@H+](Cc1ccc(Sc2ccccc2)cc1)C1CC[NH2+]CC1 ZINC000414656179 334058594 /nfs/dbraw/zinc/05/85/94/334058594.db2.gz MTPYJCLPAGKRQA-UHFFFAOYSA-N 2 1 312.482 4.022 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414668477 334063055 /nfs/dbraw/zinc/06/30/55/334063055.db2.gz AAWFGEVARXPRED-HZSPNIEDSA-N 2 1 314.395 4.086 20 0 DIADMP CC[N@H+](Cc1c(Cl)oc2ccccc21)[C@@H]1CCC[NH2+]CC1 ZINC000414717556 334073356 /nfs/dbraw/zinc/07/33/56/334073356.db2.gz PUJHAJXQKSWSSO-CYBMUJFWSA-N 2 1 306.837 4.050 20 0 DIADMP CC[N@@H+](Cc1c(Cl)oc2ccccc21)[C@@H]1CCC[NH2+]CC1 ZINC000414717556 334073357 /nfs/dbraw/zinc/07/33/57/334073357.db2.gz PUJHAJXQKSWSSO-CYBMUJFWSA-N 2 1 306.837 4.050 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000280344874 334116786 /nfs/dbraw/zinc/11/67/86/334116786.db2.gz RVIMYVIOJUWDTJ-XLIONFOSSA-N 2 1 315.505 4.025 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]C2CC(c3ccc(F)c(Cl)c3)C2)[C@@H](C)C1 ZINC000467434321 334146504 /nfs/dbraw/zinc/14/65/04/334146504.db2.gz UTPIDUNBYXEZLU-UQPDNBCRSA-N 2 1 324.871 4.045 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccccc1)c1cccc(Cl)c1)[C@@H]1CC[NH2+]C1 ZINC000415082668 334272002 /nfs/dbraw/zinc/27/20/02/334272002.db2.gz DOVDTWFLFAGDQY-POZUXBRTSA-N 2 1 314.860 4.017 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccs1 ZINC000415079913 334269692 /nfs/dbraw/zinc/26/96/92/334269692.db2.gz ITCIJXUWMNIZJG-IXDOHACOSA-N 2 1 300.471 4.282 20 0 DIADMP Clc1cccc([C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000415094087 334280747 /nfs/dbraw/zinc/28/07/47/334280747.db2.gz WNKRBHOCIJVBBC-DNVCBOLYSA-N 2 1 314.860 4.019 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)[C@@H]1CCC[NH2+]C1 ZINC000415097306 334280881 /nfs/dbraw/zinc/28/08/81/334280881.db2.gz CRBVSKDEXZRETL-OUAUKWLOSA-N 2 1 319.251 4.171 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303781799 334330484 /nfs/dbraw/zinc/33/04/84/334330484.db2.gz SPFXNUWBQVKHIO-DENIHFKCSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303781799 334330486 /nfs/dbraw/zinc/33/04/86/334330486.db2.gz SPFXNUWBQVKHIO-DENIHFKCSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781799 334330488 /nfs/dbraw/zinc/33/04/88/334330488.db2.gz SPFXNUWBQVKHIO-DENIHFKCSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781799 334330490 /nfs/dbraw/zinc/33/04/90/334330490.db2.gz SPFXNUWBQVKHIO-DENIHFKCSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303781801 334330517 /nfs/dbraw/zinc/33/05/17/334330517.db2.gz SPFXNUWBQVKHIO-KNQAVFIVSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303781801 334330519 /nfs/dbraw/zinc/33/05/19/334330519.db2.gz SPFXNUWBQVKHIO-KNQAVFIVSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781801 334330521 /nfs/dbraw/zinc/33/05/21/334330521.db2.gz SPFXNUWBQVKHIO-KNQAVFIVSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781801 334330523 /nfs/dbraw/zinc/33/05/23/334330523.db2.gz SPFXNUWBQVKHIO-KNQAVFIVSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303781803 334330594 /nfs/dbraw/zinc/33/05/94/334330594.db2.gz SPFXNUWBQVKHIO-SIKLNZKXSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303781803 334330595 /nfs/dbraw/zinc/33/05/95/334330595.db2.gz SPFXNUWBQVKHIO-SIKLNZKXSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781803 334330596 /nfs/dbraw/zinc/33/05/96/334330596.db2.gz SPFXNUWBQVKHIO-SIKLNZKXSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303781803 334330597 /nfs/dbraw/zinc/33/05/97/334330597.db2.gz SPFXNUWBQVKHIO-SIKLNZKXSA-N 2 1 322.496 4.214 20 0 DIADMP CC(C)CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972604 334336750 /nfs/dbraw/zinc/33/67/50/334336750.db2.gz ZSWWJTYCZTZFHX-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000534908388 334345492 /nfs/dbraw/zinc/34/54/92/334345492.db2.gz JIMXKEDKEJMDNU-IIBYNOLFSA-N 2 1 312.501 4.261 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000112223604 334372739 /nfs/dbraw/zinc/37/27/39/334372739.db2.gz JBPMXFDZOMOIGF-INIZCTEOSA-N 2 1 314.498 4.372 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000535228784 334381021 /nfs/dbraw/zinc/38/10/21/334381021.db2.gz DUEBKOSPBIHNNS-JCGIZDLHSA-N 2 1 304.503 4.076 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000535228784 334381022 /nfs/dbraw/zinc/38/10/22/334381022.db2.gz DUEBKOSPBIHNNS-JCGIZDLHSA-N 2 1 304.503 4.076 20 0 DIADMP Clc1ccc([C@H](CC2CC2)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000345719153 335345697 /nfs/dbraw/zinc/34/56/97/335345697.db2.gz LFIUBWOIOOUJSM-FHWLQOOXSA-N 2 1 318.892 4.398 20 0 DIADMP c1ccc2ncc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cc2c1 ZINC000518861571 335654774 /nfs/dbraw/zinc/65/47/74/335654774.db2.gz XDIABEXBXJNXGB-UHFFFAOYSA-N 2 1 323.484 4.122 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1cccc(O)c1 ZINC000192035266 336016798 /nfs/dbraw/zinc/01/67/98/336016798.db2.gz YTSOPTORALKPIU-GPMSIDNRSA-N 2 1 316.489 4.086 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+]([C@@H]2CCCc3ccccc32)CC1 ZINC000352364927 336214429 /nfs/dbraw/zinc/21/44/29/336214429.db2.gz KQLQOGWNLPVDHG-HXUWFJFHSA-N 2 1 322.452 4.311 20 0 DIADMP C[C@@H](C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1 ZINC000526123805 336219128 /nfs/dbraw/zinc/21/91/28/336219128.db2.gz MMSBWEFYTBRQNX-SJORKVTESA-N 2 1 306.469 4.031 20 0 DIADMP C[C@@H](C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1 ZINC000526123804 336219135 /nfs/dbraw/zinc/21/91/35/336219135.db2.gz MMSBWEFYTBRQNX-IRXDYDNUSA-N 2 1 306.469 4.031 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000532494012 336250820 /nfs/dbraw/zinc/25/08/20/336250820.db2.gz BJPZZFYPQPGSEK-NUJGCVRESA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000532494012 336250821 /nfs/dbraw/zinc/25/08/21/336250821.db2.gz BJPZZFYPQPGSEK-NUJGCVRESA-N 2 1 306.519 4.128 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC000532476312 336251234 /nfs/dbraw/zinc/25/12/34/336251234.db2.gz TYMXSARZJZKPQT-JOCHJYFZSA-N 2 1 320.480 4.237 20 0 DIADMP Cc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000532485497 336251701 /nfs/dbraw/zinc/25/17/01/336251701.db2.gz RCGMXFZSPVFEMM-FPOVZHCZSA-N 2 1 322.496 4.210 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2cccs2)cc1 ZINC000532507085 336252735 /nfs/dbraw/zinc/25/27/35/336252735.db2.gz VOCFLXXDELDTBX-HZPDHXFCSA-N 2 1 314.498 4.408 20 0 DIADMP COC1CC[NH+](C2(C[NH2+][C@H](C)CCC=C(C)C)CCCC2)CC1 ZINC000532514430 336253213 /nfs/dbraw/zinc/25/32/13/336253213.db2.gz GNROGIILTUWGHK-GOSISDBHSA-N 2 1 322.537 4.135 20 0 DIADMP C[NH+](C)[C@H](CNc1cc[nH+]c2ccc(Cl)cc12)c1ccco1 ZINC000301252122 336296898 /nfs/dbraw/zinc/29/68/98/336296898.db2.gz DLWWHAFBZUQNHP-MRXNPFEDSA-N 2 1 315.804 4.196 20 0 DIADMP c1cc2[nH+]ccc(NC3CC[NH+](Cc4ccccc4)CC3)c2s1 ZINC000301330907 336300878 /nfs/dbraw/zinc/30/08/78/336300878.db2.gz AYFHHFFZOVAUCW-UHFFFAOYSA-N 2 1 323.465 4.373 20 0 DIADMP Cc1cc[nH+]c(NCc2ccccc2C[N@H+](C)Cc2ccco2)c1 ZINC000301650431 336320798 /nfs/dbraw/zinc/32/07/98/336320798.db2.gz PRFIPYWSPFHJRN-UHFFFAOYSA-N 2 1 321.424 4.227 20 0 DIADMP Cc1cc[nH+]c(NCc2ccccc2C[N@@H+](C)Cc2ccco2)c1 ZINC000301650431 336320799 /nfs/dbraw/zinc/32/07/99/336320799.db2.gz PRFIPYWSPFHJRN-UHFFFAOYSA-N 2 1 321.424 4.227 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCC[C@H]2CCF)CC1 ZINC000514104864 336352675 /nfs/dbraw/zinc/35/26/75/336352675.db2.gz NCAHQNIEHZJKRS-FXAWDEMLSA-N 2 1 318.480 4.077 20 0 DIADMP Cc1cc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811241 336370132 /nfs/dbraw/zinc/37/01/32/336370132.db2.gz GZGCBPJPKLHMEN-SJORKVTESA-N 2 1 319.811 4.040 20 0 DIADMP Cc1cc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811241 336370133 /nfs/dbraw/zinc/37/01/33/336370133.db2.gz GZGCBPJPKLHMEN-SJORKVTESA-N 2 1 319.811 4.040 20 0 DIADMP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610535 336386226 /nfs/dbraw/zinc/38/62/26/336386226.db2.gz ZRXPORAFUSPHFY-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610535 336386227 /nfs/dbraw/zinc/38/62/27/336386227.db2.gz ZRXPORAFUSPHFY-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610535 336386228 /nfs/dbraw/zinc/38/62/28/336386228.db2.gz ZRXPORAFUSPHFY-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610535 336386229 /nfs/dbraw/zinc/38/62/29/336386229.db2.gz ZRXPORAFUSPHFY-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C[NH+]2CCCC2)c2ccsc2S1 ZINC000357845909 336601230 /nfs/dbraw/zinc/60/12/30/336601230.db2.gz HMMIZQKSIHIXPC-DZGCQCFKSA-N 2 1 324.559 4.385 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)C[NH+]2CCCC2)c2ccsc2S1 ZINC000357845918 336601296 /nfs/dbraw/zinc/60/12/96/336601296.db2.gz HMMIZQKSIHIXPC-ZFWWWQNUSA-N 2 1 324.559 4.385 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C2CCC(F)(F)CC2)cc1 ZINC000358348773 336625489 /nfs/dbraw/zinc/62/54/89/336625489.db2.gz DGVQWEXHZYJWKS-ZDUSSCGKSA-N 2 1 319.399 4.409 20 0 DIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCn1cc[nH+]c1C ZINC000360948398 336728990 /nfs/dbraw/zinc/72/89/90/336728990.db2.gz RYXAPYUWALGFGE-HNNXBMFYSA-N 2 1 323.893 4.005 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000361378146 336754416 /nfs/dbraw/zinc/75/44/16/336754416.db2.gz QOCGATYISZWIIX-ICSRJNTNSA-N 2 1 322.452 4.037 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c2ccsc2S1 ZINC000361973871 336780736 /nfs/dbraw/zinc/78/07/36/336780736.db2.gz YXDFZXFXMDVLAA-BHPKHCPMSA-N 2 1 310.532 4.136 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035884 337084150 /nfs/dbraw/zinc/08/41/50/337084150.db2.gz LIYWXSSPEPKRPN-CGTJXYLNSA-N 2 1 310.441 4.224 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035884 337084151 /nfs/dbraw/zinc/08/41/51/337084151.db2.gz LIYWXSSPEPKRPN-CGTJXYLNSA-N 2 1 310.441 4.224 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035887 337084164 /nfs/dbraw/zinc/08/41/64/337084164.db2.gz LIYWXSSPEPKRPN-SZMVWBNQSA-N 2 1 310.441 4.224 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035887 337084165 /nfs/dbraw/zinc/08/41/65/337084165.db2.gz LIYWXSSPEPKRPN-SZMVWBNQSA-N 2 1 310.441 4.224 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000178699508 337166070 /nfs/dbraw/zinc/16/60/70/337166070.db2.gz VKQKFKXKGMZQJF-CABCVRRESA-N 2 1 317.502 4.290 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000178707211 337166283 /nfs/dbraw/zinc/16/62/83/337166283.db2.gz LFLSZRPTIIPMGE-CXAGYDPISA-N 2 1 305.853 4.222 20 0 DIADMP CC[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000183190130 337190361 /nfs/dbraw/zinc/19/03/61/337190361.db2.gz RWEBBSUFGBSQKJ-ILZDJORESA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)c1 ZINC000184359391 337198005 /nfs/dbraw/zinc/19/80/05/337198005.db2.gz BOJKLUJXMUCKAI-QZTJIDSGSA-N 2 1 323.484 4.266 20 0 DIADMP Cc1cncc([C@H](C)[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)c1 ZINC000184359410 337198018 /nfs/dbraw/zinc/19/80/18/337198018.db2.gz BOJKLUJXMUCKAI-ZWKOTPCHSA-N 2 1 323.484 4.266 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cncc(C)c2)cc1 ZINC000184384553 337198184 /nfs/dbraw/zinc/19/81/84/337198184.db2.gz BGXDEQHZKYDVPZ-HOTGVXAUSA-N 2 1 320.440 4.296 20 0 DIADMP Cc1ccc(C)c([C@@H]([NH2+]CC2=CC[N@@H+](C)CC2)c2ccccc2)c1 ZINC000392283758 337200049 /nfs/dbraw/zinc/20/00/49/337200049.db2.gz TYUVTIMKIKGSKC-QFIPXVFZSA-N 2 1 320.480 4.244 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024177 337226502 /nfs/dbraw/zinc/22/65/02/337226502.db2.gz MBZMHSZMGZOVOL-RTBURBONSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024177 337226503 /nfs/dbraw/zinc/22/65/03/337226503.db2.gz MBZMHSZMGZOVOL-RTBURBONSA-N 2 1 310.485 4.106 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C)c(Cl)c1 ZINC000583052102 337230118 /nfs/dbraw/zinc/23/01/18/337230118.db2.gz TWNNEOVIAPTWHQ-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C)c(Cl)c1 ZINC000583052102 337230119 /nfs/dbraw/zinc/23/01/19/337230119.db2.gz TWNNEOVIAPTWHQ-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP COc1ccsc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000186185375 337254364 /nfs/dbraw/zinc/25/43/64/337254364.db2.gz NTYSGPOREKQSQH-CQSZACIVSA-N 2 1 322.518 4.204 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000398017792 337303919 /nfs/dbraw/zinc/30/39/19/337303919.db2.gz IGCOJWUXCONTTL-WTNAPCKOSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000398017792 337303920 /nfs/dbraw/zinc/30/39/20/337303920.db2.gz IGCOJWUXCONTTL-WTNAPCKOSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(C)CCCC1 ZINC000398115765 337306111 /nfs/dbraw/zinc/30/61/11/337306111.db2.gz FNPWSSJFSJZMNW-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2F)cc1 ZINC000086279129 337310398 /nfs/dbraw/zinc/31/03/98/337310398.db2.gz JVNBJFJTUMVBTN-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP FC1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000583812100 337336573 /nfs/dbraw/zinc/33/65/73/337336573.db2.gz QXUVUKMFMJZABB-GOSISDBHSA-N 2 1 316.464 4.056 20 0 DIADMP FC1(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000583812100 337336574 /nfs/dbraw/zinc/33/65/74/337336574.db2.gz QXUVUKMFMJZABB-GOSISDBHSA-N 2 1 316.464 4.056 20 0 DIADMP CCCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](CC)CC)C2)cc1 ZINC000580415243 337399579 /nfs/dbraw/zinc/39/95/79/337399579.db2.gz NKFKRKXEWDRMRU-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[N@H+]2CC[C@@H](C[NH+](CC)CC)C2)cc1 ZINC000580415243 337399580 /nfs/dbraw/zinc/39/95/80/337399580.db2.gz NKFKRKXEWDRMRU-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP C[C@H]([NH2+]CC1(c2cccs2)CCCCC1)c1c[nH+]ccc1N ZINC000422775068 337685957 /nfs/dbraw/zinc/68/59/57/337685957.db2.gz ZTFBZQWWAMIPEO-AWEZNQCLSA-N 2 1 315.486 4.108 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC000422792526 337686918 /nfs/dbraw/zinc/68/69/18/337686918.db2.gz ZKJMTLRSMFNPSW-DZFGPLHGSA-N 2 1 308.469 4.447 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C[C@@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC000422807739 337687572 /nfs/dbraw/zinc/68/75/72/337687572.db2.gz PIEFSBONJMFWCY-ONTIZHBOSA-N 2 1 320.480 4.189 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1Oc1ccccc1 ZINC000422878581 337689694 /nfs/dbraw/zinc/68/96/94/337689694.db2.gz KMJBITMLBMRACJ-XNHLSEOASA-N 2 1 322.452 4.413 20 0 DIADMP c1ccc([C@@H]([NH2+]C2CC[NH2+]CC2)c2ccc3ccccc3c2)cc1 ZINC000422913695 337691087 /nfs/dbraw/zinc/69/10/87/337691087.db2.gz ZFAJMNXYQLPNLB-JOCHJYFZSA-N 2 1 316.448 4.271 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1F ZINC000423034962 337696498 /nfs/dbraw/zinc/69/64/98/337696498.db2.gz QXOYXMBPFCTVOM-DVJFUJMWSA-N 2 1 310.844 4.049 20 0 DIADMP COCCCC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000423085319 337698786 /nfs/dbraw/zinc/69/87/86/337698786.db2.gz KCXQWZWQMAHOHM-HKBOAZHASA-N 2 1 324.468 4.279 20 0 DIADMP FC1(F)CCCC[C@H](C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC000423136221 337701299 /nfs/dbraw/zinc/70/12/99/337701299.db2.gz UXFDKKFUKRAKPR-SZMVWBNQSA-N 2 1 322.443 4.285 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423202678 337703689 /nfs/dbraw/zinc/70/36/89/337703689.db2.gz BMILVQLECJMCOG-MWLCHTKSSA-N 2 1 319.301 4.022 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000423329549 337712164 /nfs/dbraw/zinc/71/21/64/337712164.db2.gz MVQRAPAMOVSRBW-ABAIWWIYSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000423329553 337712277 /nfs/dbraw/zinc/71/22/77/337712277.db2.gz MVQRAPAMOVSRBW-IAQYHMDHSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423336361 337712732 /nfs/dbraw/zinc/71/27/32/337712732.db2.gz SKDBTOVMKQJAAA-XHDPSFHLSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cc2c(ccc3ccccc23)o1 ZINC000423376793 337717287 /nfs/dbraw/zinc/71/72/87/337717287.db2.gz LFDOZMDDRSCWBE-IIAWOOMASA-N 2 1 308.425 4.377 20 0 DIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423453057 337720158 /nfs/dbraw/zinc/72/01/58/337720158.db2.gz XCWPEQVDQFCWOJ-IHRRRGAJSA-N 2 1 302.393 4.004 20 0 DIADMP C[C@@H]([NH2+][C@H](Cc1ccccc1Cl)c1ccsc1)[C@H](C)[NH3+] ZINC000423479464 337721859 /nfs/dbraw/zinc/72/18/59/337721859.db2.gz VIDOPGWYFDHJOK-HWWQOWPSSA-N 2 1 308.878 4.011 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C[C@@H](c2ccccc2)C1 ZINC000119735486 337863149 /nfs/dbraw/zinc/86/31/49/337863149.db2.gz SVFHVVWXOWUMJU-XKGZKEIXSA-N 2 1 312.501 4.175 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1oc2ccccc2c1C ZINC000121438846 337893017 /nfs/dbraw/zinc/89/30/17/337893017.db2.gz CCVMLQYBEAHQEL-ZFWWWQNUSA-N 2 1 311.429 4.233 20 0 DIADMP Cc1ccoc1C[NH+](C)CCCCC[N@H+](C)Cc1occc1C ZINC000429393790 338079497 /nfs/dbraw/zinc/07/94/97/338079497.db2.gz LPKSFKUQNFLDRF-UHFFFAOYSA-N 2 1 318.461 4.224 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000432793396 338168043 /nfs/dbraw/zinc/16/80/43/338168043.db2.gz ONWKBTLSMOAYML-SFHVURJKSA-N 2 1 314.498 4.331 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000432797685 338168220 /nfs/dbraw/zinc/16/82/20/338168220.db2.gz FULOREIKEHMHJW-QGZVFWFLSA-N 2 1 316.420 4.002 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000432797685 338168221 /nfs/dbraw/zinc/16/82/21/338168221.db2.gz FULOREIKEHMHJW-QGZVFWFLSA-N 2 1 316.420 4.002 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000432814785 338168810 /nfs/dbraw/zinc/16/88/10/338168810.db2.gz BDEKDMXBNJGGQG-KRWDZBQOSA-N 2 1 314.498 4.331 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]C2CC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000433300953 338190277 /nfs/dbraw/zinc/19/02/77/338190277.db2.gz UPEYWXXCCYHGAI-FUHWJXTLSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386809 338204158 /nfs/dbraw/zinc/20/41/58/338204158.db2.gz KCVKZCFITQNEDK-NEPJUHHUSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386809 338204159 /nfs/dbraw/zinc/20/41/59/338204159.db2.gz KCVKZCFITQNEDK-NEPJUHHUSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386988 338204175 /nfs/dbraw/zinc/20/41/75/338204175.db2.gz KCVKZCFITQNEDK-VXGBXAGGSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1Cl ZINC000152386988 338204176 /nfs/dbraw/zinc/20/41/76/338204176.db2.gz KCVKZCFITQNEDK-VXGBXAGGSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]1CCC[C@@H](C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)C1 ZINC000434672137 338223056 /nfs/dbraw/zinc/22/30/56/338223056.db2.gz XUMZAEHVHSZTGR-IAGOWNOFSA-N 2 1 315.505 4.225 20 0 DIADMP c1[nH+]c(C2CC[NH+](CCC3CCCCC3)CC2)n2c1CCCC2 ZINC000434744379 338224565 /nfs/dbraw/zinc/22/45/65/338224565.db2.gz UCJMVFCKGIMHSP-UHFFFAOYSA-N 2 1 315.505 4.369 20 0 DIADMP C[NH2+]CCC[N@H+](C)[C@H](C)c1sc(-c2ccc(C)cc2)nc1C ZINC000435874612 338251407 /nfs/dbraw/zinc/25/14/07/338251407.db2.gz LYHQOBYUURFUOS-OAHLLOKOSA-N 2 1 317.502 4.029 20 0 DIADMP C[NH2+]CCC[N@@H+](C)[C@H](C)c1sc(-c2ccc(C)cc2)nc1C ZINC000435874612 338251408 /nfs/dbraw/zinc/25/14/08/338251408.db2.gz LYHQOBYUURFUOS-OAHLLOKOSA-N 2 1 317.502 4.029 20 0 DIADMP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436283617 338265783 /nfs/dbraw/zinc/26/57/83/338265783.db2.gz LWDDXPYXFMPIKV-DZGCQCFKSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436283618 338265831 /nfs/dbraw/zinc/26/58/31/338265831.db2.gz LWDDXPYXFMPIKV-HIFRSBDPSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC(C)(C)CCc3ccccc32)CC[N@@H+]1C ZINC000436295833 338267036 /nfs/dbraw/zinc/26/70/36/338267036.db2.gz SGWWGTVKYKSTDU-SZVBFZGTSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC(C)(C)CCc3ccccc32)CC[N@H+]1C ZINC000436295833 338267037 /nfs/dbraw/zinc/26/70/37/338267037.db2.gz SGWWGTVKYKSTDU-SZVBFZGTSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155592775 338294862 /nfs/dbraw/zinc/29/48/62/338294862.db2.gz YNRJBSYZDHVHSR-LVCYWYKZSA-N 2 1 322.496 4.279 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155592775 338294863 /nfs/dbraw/zinc/29/48/63/338294863.db2.gz YNRJBSYZDHVHSR-LVCYWYKZSA-N 2 1 322.496 4.279 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000437778911 338321039 /nfs/dbraw/zinc/32/10/39/338321039.db2.gz BGCHNJXCMDCXOK-NUJGCVRESA-N 2 1 318.480 4.172 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(Cl)cc1F ZINC000438086484 338330686 /nfs/dbraw/zinc/33/06/86/338330686.db2.gz HTJIUTKQBQAQJS-AWEZNQCLSA-N 2 1 312.860 4.223 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCCCOc2ccccc2)C[C@H]1C ZINC000438092857 338330927 /nfs/dbraw/zinc/33/09/27/338330927.db2.gz BIFQPSVXJWYLDY-MOPGFXCFSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCCCOc2ccccc2)C[C@H]1C ZINC000438092857 338330928 /nfs/dbraw/zinc/33/09/28/338330928.db2.gz BIFQPSVXJWYLDY-MOPGFXCFSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCCCOc2ccccc2)C[C@H]1C ZINC000438092857 338330929 /nfs/dbraw/zinc/33/09/29/338330929.db2.gz BIFQPSVXJWYLDY-MOPGFXCFSA-N 2 1 318.505 4.040 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438109476 338332197 /nfs/dbraw/zinc/33/21/97/338332197.db2.gz OILQFDJLBUDPRC-TYPHKJRUSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438109476 338332198 /nfs/dbraw/zinc/33/21/98/338332198.db2.gz OILQFDJLBUDPRC-TYPHKJRUSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438109476 338332199 /nfs/dbraw/zinc/33/21/99/338332199.db2.gz OILQFDJLBUDPRC-TYPHKJRUSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438109473 338332219 /nfs/dbraw/zinc/33/22/19/338332219.db2.gz OILQFDJLBUDPRC-JBACZVJFSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438109473 338332220 /nfs/dbraw/zinc/33/22/20/338332220.db2.gz OILQFDJLBUDPRC-JBACZVJFSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438109473 338332221 /nfs/dbraw/zinc/33/22/21/338332221.db2.gz OILQFDJLBUDPRC-JBACZVJFSA-N 2 1 314.517 4.161 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438112808 338332624 /nfs/dbraw/zinc/33/26/24/338332624.db2.gz IGMZTACHNBWPAG-TYPHKJRUSA-N 2 1 314.517 4.161 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438112806 338332639 /nfs/dbraw/zinc/33/26/39/338332639.db2.gz IGMZTACHNBWPAG-JBACZVJFSA-N 2 1 314.517 4.161 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438198212 338336284 /nfs/dbraw/zinc/33/62/84/338336284.db2.gz GQOOFBYDMIBZDL-GIVPXCGWSA-N 2 1 314.517 4.207 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000459380270 339025910 /nfs/dbraw/zinc/02/59/10/339025910.db2.gz AZUQAUNSPXDNQG-SFHVURJKSA-N 2 1 317.864 4.137 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccccc1Oc1ccccc1 ZINC000459392548 339026753 /nfs/dbraw/zinc/02/67/53/339026753.db2.gz LMSTZNNBQWPBOB-MRXNPFEDSA-N 2 1 321.424 4.106 20 0 DIADMP C[C@@H]1C[C@H]1[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000459403971 339027143 /nfs/dbraw/zinc/02/71/43/339027143.db2.gz BYTAMYRJENRSOK-UPRAQXHNSA-N 2 1 318.892 4.254 20 0 DIADMP c1ccc([C@@H]2CCCC[C@H]2C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459568147 339036466 /nfs/dbraw/zinc/03/64/66/339036466.db2.gz JFYCAKIJWQXLSM-RXVVDRJESA-N 2 1 312.501 4.177 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911834 339097631 /nfs/dbraw/zinc/09/76/31/339097631.db2.gz PACFSWWGAAYBKV-OXJNMPFZSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911834 339097632 /nfs/dbraw/zinc/09/76/32/339097632.db2.gz PACFSWWGAAYBKV-OXJNMPFZSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911834 339097633 /nfs/dbraw/zinc/09/76/33/339097633.db2.gz PACFSWWGAAYBKV-OXJNMPFZSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911834 339097634 /nfs/dbraw/zinc/09/76/34/339097634.db2.gz PACFSWWGAAYBKV-OXJNMPFZSA-N 2 1 300.490 4.116 20 0 DIADMP Fc1ccc2c(N[C@@H]3CC[N@H+](CC4CCCC4)C3)cc[nH+]c2c1 ZINC000462955963 339098930 /nfs/dbraw/zinc/09/89/30/339098930.db2.gz KSSBONJISMLDRY-MRXNPFEDSA-N 2 1 313.420 4.050 20 0 DIADMP Fc1ccc2c(N[C@@H]3CC[N@@H+](CC4CCCC4)C3)cc[nH+]c2c1 ZINC000462955963 339098931 /nfs/dbraw/zinc/09/89/31/339098931.db2.gz KSSBONJISMLDRY-MRXNPFEDSA-N 2 1 313.420 4.050 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC000463023173 339100929 /nfs/dbraw/zinc/10/09/29/339100929.db2.gz GYPZXIVDTQGACQ-DLBZAZTESA-N 2 1 318.505 4.246 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC000463023175 339101011 /nfs/dbraw/zinc/10/10/11/339101011.db2.gz GYPZXIVDTQGACQ-IRXDYDNUSA-N 2 1 318.505 4.246 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000463075788 339104601 /nfs/dbraw/zinc/10/46/01/339104601.db2.gz RFUGNUBPBBIAQR-UZLBHIALSA-N 2 1 318.480 4.001 20 0 DIADMP CCC[C@@H](CC)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463113048 339106207 /nfs/dbraw/zinc/10/62/07/339106207.db2.gz BFWHMFBHMHSRLY-GOSISDBHSA-N 2 1 306.469 4.001 20 0 DIADMP CC(C)CC[C@@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463140010 339107077 /nfs/dbraw/zinc/10/70/77/339107077.db2.gz FSXWQLKYQOMPJL-QGZVFWFLSA-N 2 1 320.496 4.247 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463146134 339107212 /nfs/dbraw/zinc/10/72/12/339107212.db2.gz FBDVJWMAZBOWSF-LFGUQSLTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463146134 339107213 /nfs/dbraw/zinc/10/72/13/339107213.db2.gz FBDVJWMAZBOWSF-LFGUQSLTSA-N 2 1 300.490 4.208 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463204375 339109147 /nfs/dbraw/zinc/10/91/47/339109147.db2.gz ITASNLBAEXPXPU-LNLFQRSKSA-N 2 1 320.546 4.161 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463204375 339109148 /nfs/dbraw/zinc/10/91/48/339109148.db2.gz ITASNLBAEXPXPU-LNLFQRSKSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463206513 339109429 /nfs/dbraw/zinc/10/94/29/339109429.db2.gz PPUOKMNCBAQQKF-XLIONFOSSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000463206513 339109430 /nfs/dbraw/zinc/10/94/30/339109430.db2.gz PPUOKMNCBAQQKF-XLIONFOSSA-N 2 1 312.501 4.209 20 0 DIADMP CCCC1(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000463207761 339109561 /nfs/dbraw/zinc/10/95/61/339109561.db2.gz UJAKKCPZPKPGHB-UHFFFAOYSA-N 2 1 318.480 4.003 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCc2ccc3ccccc3c2)C1 ZINC000464778406 339153182 /nfs/dbraw/zinc/15/31/82/339153182.db2.gz OBAJVKBRPPBHQM-IBGZPJMESA-N 2 1 310.485 4.046 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](CCCc2cccc3ccccc32)C1 ZINC000464792534 339154037 /nfs/dbraw/zinc/15/40/37/339154037.db2.gz PVJIJAPGVXLPIA-GOSISDBHSA-N 2 1 310.485 4.046 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](CCCc2cccc3ccccc32)C1 ZINC000464792534 339154038 /nfs/dbraw/zinc/15/40/38/339154038.db2.gz PVJIJAPGVXLPIA-GOSISDBHSA-N 2 1 310.485 4.046 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](CCCc2cccc3ccccc32)C1 ZINC000464792534 339154039 /nfs/dbraw/zinc/15/40/39/339154039.db2.gz PVJIJAPGVXLPIA-GOSISDBHSA-N 2 1 310.485 4.046 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](CCCc2cccc3ccccc32)C1 ZINC000464792537 339154141 /nfs/dbraw/zinc/15/41/41/339154141.db2.gz PVJIJAPGVXLPIA-SFHVURJKSA-N 2 1 310.485 4.046 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](CCCc2cccc3ccccc32)C1 ZINC000464792537 339154142 /nfs/dbraw/zinc/15/41/42/339154142.db2.gz PVJIJAPGVXLPIA-SFHVURJKSA-N 2 1 310.485 4.046 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](CCCc2cccc3ccccc32)C1 ZINC000464792537 339154143 /nfs/dbraw/zinc/15/41/43/339154143.db2.gz PVJIJAPGVXLPIA-SFHVURJKSA-N 2 1 310.485 4.046 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464830162 339155601 /nfs/dbraw/zinc/15/56/01/339155601.db2.gz KRAVPJXOCGVCCR-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP CCC(C)(C)CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464858613 339158389 /nfs/dbraw/zinc/15/83/89/339158389.db2.gz XDBPINSAXFGUMU-IBGZPJMESA-N 2 1 302.506 4.267 20 0 DIADMP CCC(C)(C)CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464858613 339158390 /nfs/dbraw/zinc/15/83/90/339158390.db2.gz XDBPINSAXFGUMU-IBGZPJMESA-N 2 1 302.506 4.267 20 0 DIADMP CCC(C)(C)CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464858613 339158391 /nfs/dbraw/zinc/15/83/91/339158391.db2.gz XDBPINSAXFGUMU-IBGZPJMESA-N 2 1 302.506 4.267 20 0 DIADMP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]CC[NH+](C(C)C)C(C)C)C1 ZINC000467306451 339230849 /nfs/dbraw/zinc/23/08/49/339230849.db2.gz BDFLVGJGTXCVCC-MOPGFXCFSA-N 2 1 317.521 4.125 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]C2CC(c3ccc(F)c(Cl)c3)C2)[C@@H](C)C1 ZINC000467434319 339238284 /nfs/dbraw/zinc/23/82/84/339238284.db2.gz UTPIDUNBYXEZLU-GJVKMHQDSA-N 2 1 324.871 4.045 20 0 DIADMP CCCCOc1ccccc1CN(C)[C@@H]1CC[N@@H+](CC)[C@@H](C)C1 ZINC000468393119 339261631 /nfs/dbraw/zinc/26/16/31/339261631.db2.gz RUPHDEMKOOSRAB-PKOBYXMFSA-N 2 1 318.505 4.170 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CCC2)[C@@H](C)C1 ZINC000468987670 339276857 /nfs/dbraw/zinc/27/68/57/339276857.db2.gz NOORDSFKQZLZJL-MAUKXSAKSA-N 2 1 320.908 4.082 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)CCC2CC2)CC1 ZINC000469787107 339299819 /nfs/dbraw/zinc/29/98/19/339299819.db2.gz ROSCZVMLHWNVLS-QGZVFWFLSA-N 2 1 300.490 4.128 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000469789524 339300239 /nfs/dbraw/zinc/30/02/39/339300239.db2.gz YRSLHODBPSEVGN-QKLQHJQFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000469789524 339300240 /nfs/dbraw/zinc/30/02/40/339300240.db2.gz YRSLHODBPSEVGN-QKLQHJQFSA-N 2 1 300.490 4.065 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000470015166 339308597 /nfs/dbraw/zinc/30/85/97/339308597.db2.gz LCBGUIYDNLUJMG-UHFFFAOYSA-N 2 1 320.889 4.252 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000470016505 339308744 /nfs/dbraw/zinc/30/87/44/339308744.db2.gz UVJZEAGSWWASLC-ZDUSSCGKSA-N 2 1 320.889 4.110 20 0 DIADMP FC(F)c1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764491 339327075 /nfs/dbraw/zinc/32/70/75/339327075.db2.gz JKQHUYYYAMZHMM-SJLPKXTDSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764491 339327076 /nfs/dbraw/zinc/32/70/76/339327076.db2.gz JKQHUYYYAMZHMM-SJLPKXTDSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000470764491 339327077 /nfs/dbraw/zinc/32/70/77/339327077.db2.gz JKQHUYYYAMZHMM-SJLPKXTDSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000470764491 339327078 /nfs/dbraw/zinc/32/70/78/339327078.db2.gz JKQHUYYYAMZHMM-SJLPKXTDSA-N 2 1 320.427 4.073 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000470975076 339333504 /nfs/dbraw/zinc/33/35/04/339333504.db2.gz MHJQPVKHPUAHBV-APWZRJJASA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000470975076 339333505 /nfs/dbraw/zinc/33/35/05/339333505.db2.gz MHJQPVKHPUAHBV-APWZRJJASA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000470975076 339333506 /nfs/dbraw/zinc/33/35/06/339333506.db2.gz MHJQPVKHPUAHBV-APWZRJJASA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000470975076 339333507 /nfs/dbraw/zinc/33/35/07/339333507.db2.gz MHJQPVKHPUAHBV-APWZRJJASA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470975077 339333541 /nfs/dbraw/zinc/33/35/41/339333541.db2.gz MHJQPVKHPUAHBV-LPHOPBHVSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470975077 339333542 /nfs/dbraw/zinc/33/35/42/339333542.db2.gz MHJQPVKHPUAHBV-LPHOPBHVSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470975077 339333543 /nfs/dbraw/zinc/33/35/43/339333543.db2.gz MHJQPVKHPUAHBV-LPHOPBHVSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470975077 339333544 /nfs/dbraw/zinc/33/35/44/339333544.db2.gz MHJQPVKHPUAHBV-LPHOPBHVSA-N 2 1 320.908 4.455 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000471245664 339341066 /nfs/dbraw/zinc/34/10/66/339341066.db2.gz VVKSNQGXFIRFGF-UWJYYQICSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000471245664 339341067 /nfs/dbraw/zinc/34/10/67/339341067.db2.gz VVKSNQGXFIRFGF-UWJYYQICSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000471245664 339341068 /nfs/dbraw/zinc/34/10/68/339341068.db2.gz VVKSNQGXFIRFGF-UWJYYQICSA-N 2 1 310.485 4.044 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000472157896 339364602 /nfs/dbraw/zinc/36/46/02/339364602.db2.gz PXGWOEXNOIAITL-AWEZNQCLSA-N 2 1 310.507 4.062 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000472157896 339364603 /nfs/dbraw/zinc/36/46/03/339364603.db2.gz PXGWOEXNOIAITL-AWEZNQCLSA-N 2 1 310.507 4.062 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000472157894 339364694 /nfs/dbraw/zinc/36/46/94/339364694.db2.gz NHVVGNDJBTUYFD-CABCVRRESA-N 2 1 310.507 4.062 20 0 DIADMP Cc1cc2cc(C[N@@H+]3CCCC34CC[NH+](C)CC4)oc2cc1C ZINC000472595455 339374821 /nfs/dbraw/zinc/37/48/21/339374821.db2.gz FCIOVPDKMIOGGV-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP CCSc1cccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000473148184 339382834 /nfs/dbraw/zinc/38/28/34/339382834.db2.gz QSJFIPRBGBOPKV-NVXWUHKLSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)c1 ZINC000473148184 339382835 /nfs/dbraw/zinc/38/28/35/339382835.db2.gz QSJFIPRBGBOPKV-NVXWUHKLSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)c1 ZINC000473148184 339382836 /nfs/dbraw/zinc/38/28/36/339382836.db2.gz QSJFIPRBGBOPKV-NVXWUHKLSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)c1 ZINC000473148184 339382837 /nfs/dbraw/zinc/38/28/37/339382837.db2.gz QSJFIPRBGBOPKV-NVXWUHKLSA-N 2 1 306.519 4.103 20 0 DIADMP CCC[N@H+](CCn1cc[nH+]c1C)[C@H](C)c1cc2ccccc2o1 ZINC000499048471 339383933 /nfs/dbraw/zinc/38/39/33/339383933.db2.gz QIJMLMXGDJPDMP-OAHLLOKOSA-N 2 1 311.429 4.411 20 0 DIADMP CCC[N@@H+](CCn1cc[nH+]c1C)[C@H](C)c1cc2ccccc2o1 ZINC000499048471 339383934 /nfs/dbraw/zinc/38/39/34/339383934.db2.gz QIJMLMXGDJPDMP-OAHLLOKOSA-N 2 1 311.429 4.411 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)C1CCC(F)(F)CC1 ZINC000474047182 339398892 /nfs/dbraw/zinc/39/88/92/339398892.db2.gz PEXYVHALPXFUIG-HZPDHXFCSA-N 2 1 316.480 4.302 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)C1CCC(F)(F)CC1 ZINC000474047298 339399107 /nfs/dbraw/zinc/39/91/07/339399107.db2.gz PPHWZEHEEYPLOG-CVEARBPZSA-N 2 1 316.480 4.445 20 0 DIADMP C[C@@H](C[NH+]1CCCCCC1)[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000474056567 339399759 /nfs/dbraw/zinc/39/97/59/339399759.db2.gz LNJFVMTVPZZJPS-GJZGRUSLSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000480157404 339560943 /nfs/dbraw/zinc/56/09/43/339560943.db2.gz FHFUJIVSLZWSSO-MRXNPFEDSA-N 2 1 300.490 4.479 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccccc1C)C1CCCC1 ZINC000494889971 339963653 /nfs/dbraw/zinc/96/36/53/339963653.db2.gz DKJXWASFGRIACU-FQEVSTJZSA-N 2 1 311.473 4.411 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000498928807 340026401 /nfs/dbraw/zinc/02/64/01/340026401.db2.gz JOCHOIQWCUZRGU-HOTGVXAUSA-N 2 1 306.453 4.219 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000499148321 340031085 /nfs/dbraw/zinc/03/10/85/340031085.db2.gz RWPRTOJFRPWYRY-OAHLLOKOSA-N 2 1 321.896 4.216 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000499148321 340031086 /nfs/dbraw/zinc/03/10/86/340031086.db2.gz RWPRTOJFRPWYRY-OAHLLOKOSA-N 2 1 321.896 4.216 20 0 DIADMP CCCC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000499175048 340031784 /nfs/dbraw/zinc/03/17/84/340031784.db2.gz IWXBUQLRDVKMOU-ACDBMABISA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)C1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000499238161 340033057 /nfs/dbraw/zinc/03/30/57/340033057.db2.gz RPFQLWBNQBPCQK-ACDBMABISA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)[C@H](C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499251312 340033249 /nfs/dbraw/zinc/03/32/49/340033249.db2.gz OAUNNPAOTAGWOU-AFYVEPGGSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)CC1 ZINC000502287342 340098900 /nfs/dbraw/zinc/09/89/00/340098900.db2.gz NKKMSTUORQYMRH-DWIQEWEKSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1cnn(C2CCCC2)c1 ZINC000502728157 340112610 /nfs/dbraw/zinc/11/26/10/340112610.db2.gz QZJYNJNMCJCUOQ-MAUKXSAKSA-N 2 1 320.525 4.015 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[N@H+](C)CCCCn1cc[nH+]c1C ZINC000502912576 340116536 /nfs/dbraw/zinc/11/65/36/340116536.db2.gz DUJAFHBDPICGHA-FQEVSTJZSA-N 2 1 313.489 4.233 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CCCCn1cc[nH+]c1C ZINC000502912576 340116537 /nfs/dbraw/zinc/11/65/37/340116537.db2.gz DUJAFHBDPICGHA-FQEVSTJZSA-N 2 1 313.489 4.233 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000503370046 340126539 /nfs/dbraw/zinc/12/65/39/340126539.db2.gz DNZANBUJKBUXJT-KBXCAEBGSA-N 2 1 317.864 4.150 20 0 DIADMP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000504929012 340156607 /nfs/dbraw/zinc/15/66/07/340156607.db2.gz FUUVDRSQMJXNTI-AOIWGVFYSA-N 2 1 300.490 4.253 20 0 DIADMP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000504929017 340156664 /nfs/dbraw/zinc/15/66/64/340156664.db2.gz FUUVDRSQMJXNTI-ZIFCJYIRSA-N 2 1 300.490 4.253 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476028 340195149 /nfs/dbraw/zinc/19/51/49/340195149.db2.gz ZXNWTSMERIFAPW-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476028 340195150 /nfs/dbraw/zinc/19/51/50/340195150.db2.gz ZXNWTSMERIFAPW-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1cccc(F)c1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506476028 340195151 /nfs/dbraw/zinc/19/51/51/340195151.db2.gz ZXNWTSMERIFAPW-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1cccc(F)c1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506476028 340195152 /nfs/dbraw/zinc/19/51/52/340195152.db2.gz ZXNWTSMERIFAPW-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(OCCC(C)C)cc2)CC1 ZINC000506663042 340198977 /nfs/dbraw/zinc/19/89/77/340198977.db2.gz VDNDQASVLXTKBU-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(OCCC(C)C)cc2)CC1 ZINC000506663042 340198978 /nfs/dbraw/zinc/19/89/78/340198978.db2.gz VDNDQASVLXTKBU-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP CC(C)C[C@@H](C)C[C@H](C)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000507533092 340224681 /nfs/dbraw/zinc/22/46/81/340224681.db2.gz SVFXFAUKGYTLOE-MOPGFXCFSA-N 2 1 324.553 4.072 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1csc(Cl)c1 ZINC000300422200 340225801 /nfs/dbraw/zinc/22/58/01/340225801.db2.gz WUMSNLMFPAEURA-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1csc(Cl)c1 ZINC000300422200 340225802 /nfs/dbraw/zinc/22/58/02/340225802.db2.gz WUMSNLMFPAEURA-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000507834629 340233672 /nfs/dbraw/zinc/23/36/72/340233672.db2.gz VBUGLMGXTGMPLV-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000507834629 340233673 /nfs/dbraw/zinc/23/36/73/340233673.db2.gz VBUGLMGXTGMPLV-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000507834629 340233674 /nfs/dbraw/zinc/23/36/74/340233674.db2.gz VBUGLMGXTGMPLV-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000507834629 340233675 /nfs/dbraw/zinc/23/36/75/340233675.db2.gz VBUGLMGXTGMPLV-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP C[C@@H]([NH2+]C1(c2ccccc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508713117 340251254 /nfs/dbraw/zinc/25/12/54/340251254.db2.gz SCWUOILNHMHETL-UYAOXDASSA-N 2 1 320.480 4.176 20 0 DIADMP C[C@H]([NH2+]C1(c2ccccc2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508713111 340251272 /nfs/dbraw/zinc/25/12/72/340251272.db2.gz SCWUOILNHMHETL-AZUAARDMSA-N 2 1 320.480 4.176 20 0 DIADMP CCc1ccc(-c2ccc(C[NH2+]CCCn3cc[nH+]c3C)o2)cc1 ZINC000510023308 340285529 /nfs/dbraw/zinc/28/55/29/340285529.db2.gz JZQHQBPKNKGEGQ-UHFFFAOYSA-N 2 1 323.440 4.194 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@H]1CCCF)Cc1ccccc1 ZINC000510672988 340306076 /nfs/dbraw/zinc/30/60/76/340306076.db2.gz XRGBVNHINXEMNG-RBUKOAKNSA-N 2 1 306.469 4.017 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@@H]1CCCF)Cc1ccccc1 ZINC000510672982 340306118 /nfs/dbraw/zinc/30/61/18/340306118.db2.gz XRGBVNHINXEMNG-MOPGFXCFSA-N 2 1 306.469 4.017 20 0 DIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000510715990 340307819 /nfs/dbraw/zinc/30/78/19/340307819.db2.gz DRTPUUHGTHESMS-ICSRJNTNSA-N 2 1 318.480 4.159 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CC[C@H]3C3CCC3)C2)c1 ZINC000510723818 340308293 /nfs/dbraw/zinc/30/82/93/340308293.db2.gz UBTUCYQATYTYCX-AYOQOUSVSA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CC[C@H]3C3CCC3)C2)c1 ZINC000510723818 340308294 /nfs/dbraw/zinc/30/82/94/340308294.db2.gz UBTUCYQATYTYCX-AYOQOUSVSA-N 2 1 318.530 4.128 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC12CCC2 ZINC000510962026 340316417 /nfs/dbraw/zinc/31/64/17/340316417.db2.gz YJZYVFPBBYJBGQ-OALUTQOASA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC12CCC2 ZINC000510962026 340316418 /nfs/dbraw/zinc/31/64/18/340316418.db2.gz YJZYVFPBBYJBGQ-OALUTQOASA-N 2 1 312.501 4.209 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC000511001241 340317853 /nfs/dbraw/zinc/31/78/53/340317853.db2.gz QPSFWEIKBNSNGR-FQEVSTJZSA-N 2 1 311.473 4.493 20 0 DIADMP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511017652 340318328 /nfs/dbraw/zinc/31/83/28/340318328.db2.gz RLWDPFBLRAVUHU-UFYCRDLUSA-N 2 1 318.480 4.017 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000511039031 340319031 /nfs/dbraw/zinc/31/90/31/340319031.db2.gz YLAAIEGEIMMUAT-IBGZPJMESA-N 2 1 315.436 4.242 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000511149261 340322359 /nfs/dbraw/zinc/32/23/59/340322359.db2.gz FQNSVWKAHGALOL-NVXWUHKLSA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000511149261 340322360 /nfs/dbraw/zinc/32/23/60/340322360.db2.gz FQNSVWKAHGALOL-NVXWUHKLSA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000511149261 340322361 /nfs/dbraw/zinc/32/23/61/340322361.db2.gz FQNSVWKAHGALOL-NVXWUHKLSA-N 2 1 306.519 4.102 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000511896138 340342242 /nfs/dbraw/zinc/34/22/42/340342242.db2.gz ZXAJMWKZRJYIJJ-HBMCJLEFSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000511896138 340342243 /nfs/dbraw/zinc/34/22/43/340342243.db2.gz ZXAJMWKZRJYIJJ-HBMCJLEFSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000511896139 340342256 /nfs/dbraw/zinc/34/22/56/340342256.db2.gz ZXAJMWKZRJYIJJ-NJDAHSKKSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000511896139 340342257 /nfs/dbraw/zinc/34/22/57/340342257.db2.gz ZXAJMWKZRJYIJJ-NJDAHSKKSA-N 2 1 323.484 4.240 20 0 DIADMP CCC[C@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C1CCCCC1 ZINC000512100025 340348557 /nfs/dbraw/zinc/34/85/57/340348557.db2.gz QZFYSLNHOLBGOC-INIZCTEOSA-N 2 1 309.523 4.043 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)s1 ZINC000512170634 340350712 /nfs/dbraw/zinc/35/07/12/340350712.db2.gz STDIXDYKYDSVSW-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)s1 ZINC000512170634 340350713 /nfs/dbraw/zinc/35/07/13/340350713.db2.gz STDIXDYKYDSVSW-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)s1 ZINC000512170634 340350714 /nfs/dbraw/zinc/35/07/14/340350714.db2.gz STDIXDYKYDSVSW-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)s1 ZINC000512170634 340350715 /nfs/dbraw/zinc/35/07/15/340350715.db2.gz STDIXDYKYDSVSW-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)s1 ZINC000512170631 340350848 /nfs/dbraw/zinc/35/08/48/340350848.db2.gz STDIXDYKYDSVSW-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)s1 ZINC000512170631 340350849 /nfs/dbraw/zinc/35/08/49/340350849.db2.gz STDIXDYKYDSVSW-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)s1 ZINC000512170631 340350850 /nfs/dbraw/zinc/35/08/50/340350850.db2.gz STDIXDYKYDSVSW-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)s1 ZINC000512170631 340350851 /nfs/dbraw/zinc/35/08/51/340350851.db2.gz STDIXDYKYDSVSW-DOTOQJQBSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000512212669 340352643 /nfs/dbraw/zinc/35/26/43/340352643.db2.gz OBMYVIUSZGJFMR-IAGOWNOFSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000512212669 340352644 /nfs/dbraw/zinc/35/26/44/340352644.db2.gz OBMYVIUSZGJFMR-IAGOWNOFSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000512212669 340352645 /nfs/dbraw/zinc/35/26/45/340352645.db2.gz OBMYVIUSZGJFMR-IAGOWNOFSA-N 2 1 306.519 4.143 20 0 DIADMP C[N@@H+](Cc1ccc(C(C)(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512560817 340367021 /nfs/dbraw/zinc/36/70/21/340367021.db2.gz GYUSRPQGBVTKPB-DFNIBXOVSA-N 2 1 300.490 4.041 20 0 DIADMP C[NH+](Cc1ccc(C(C)(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000512560817 340367022 /nfs/dbraw/zinc/36/70/22/340367022.db2.gz GYUSRPQGBVTKPB-DFNIBXOVSA-N 2 1 300.490 4.041 20 0 DIADMP C[NH+](Cc1ccc(C(C)(C)C)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512560817 340367023 /nfs/dbraw/zinc/36/70/23/340367023.db2.gz GYUSRPQGBVTKPB-DFNIBXOVSA-N 2 1 300.490 4.041 20 0 DIADMP c1sc2ccccc2c1C[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000513788637 340425008 /nfs/dbraw/zinc/42/50/08/340425008.db2.gz VBVTXDJNZFDGSH-UHFFFAOYSA-N 2 1 314.498 4.352 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000186341940 340511491 /nfs/dbraw/zinc/51/14/91/340511491.db2.gz DNMGDQFTAHNEED-IRXDYDNUSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C(C)(C)c1cccc(Cl)c1F ZINC000186882109 340516709 /nfs/dbraw/zinc/51/67/09/340516709.db2.gz HCNHCGJKBDPGSA-UHFFFAOYSA-N 2 1 323.843 4.289 20 0 DIADMP Cc1ccc(N2CCC([NH2+]CC[C@H](C)c3ccccc3)CC2)[nH+]c1 ZINC000191101453 340550027 /nfs/dbraw/zinc/55/00/27/340550027.db2.gz OVQASMLRXUWEPW-SFHVURJKSA-N 2 1 323.484 4.142 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC000537968060 340725719 /nfs/dbraw/zinc/72/57/19/340725719.db2.gz OTYPFSWABHJHQH-AHRSYUTCSA-N 2 1 311.473 4.144 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCc3sc(Cl)cc32)CC1 ZINC000123390036 340758346 /nfs/dbraw/zinc/75/83/46/340758346.db2.gz RYHHTRMZPZLJDF-CYBMUJFWSA-N 2 1 312.910 4.241 20 0 DIADMP CCCC[C@H](COC)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000125143162 340802434 /nfs/dbraw/zinc/80/24/34/340802434.db2.gz VZVISMOMEDTHTH-FXAWDEMLSA-N 2 1 318.505 4.007 20 0 DIADMP CCCC[C@@H](COC)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000125142956 340802473 /nfs/dbraw/zinc/80/24/73/340802473.db2.gz VZVISMOMEDTHTH-PXNSSMCTSA-N 2 1 318.505 4.007 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1cnc2ccsc2c1 ZINC000126462436 340827248 /nfs/dbraw/zinc/82/72/48/340827248.db2.gz OQTAYXZIHUSNNN-HNNXBMFYSA-N 2 1 317.502 4.069 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](CC(C)C)c1cccs1 ZINC000540167826 340919869 /nfs/dbraw/zinc/91/98/69/340919869.db2.gz XJXZXEFFBHSEFF-HOCLYGCPSA-N 2 1 305.491 4.266 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000130174429 341004594 /nfs/dbraw/zinc/00/45/94/341004594.db2.gz UNIVSXZCMZXEIR-KSZLIROESA-N 2 1 306.881 4.398 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000130174007 341004655 /nfs/dbraw/zinc/00/46/55/341004655.db2.gz UNIVSXZCMZXEIR-KURKYZTESA-N 2 1 306.881 4.398 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000130248751 341009266 /nfs/dbraw/zinc/00/92/66/341009266.db2.gz ATAQOJXJRYOAAD-SWLSCSKDSA-N 2 1 310.532 4.138 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000130248956 341009347 /nfs/dbraw/zinc/00/93/47/341009347.db2.gz ATAQOJXJRYOAAD-WFASDCNBSA-N 2 1 310.532 4.138 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000542534200 341012620 /nfs/dbraw/zinc/01/26/20/341012620.db2.gz YOMUSFQZDJDBTA-ROUUACIJSA-N 2 1 300.490 4.046 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C2CCC2)o1 ZINC000542663919 341015998 /nfs/dbraw/zinc/01/59/98/341015998.db2.gz PZDCXJUSUDMKGU-FQEVSTJZSA-N 2 1 316.489 4.426 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000542774079 341019945 /nfs/dbraw/zinc/01/99/45/341019945.db2.gz WXWDNTJHZNCJFV-WIYYLYMNSA-N 2 1 308.469 4.016 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000542774079 341019946 /nfs/dbraw/zinc/01/99/46/341019946.db2.gz WXWDNTJHZNCJFV-WIYYLYMNSA-N 2 1 308.469 4.016 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1C[C@H](C)Sc2sccc21)C[NH+]1CCCCC1 ZINC000130371507 341020071 /nfs/dbraw/zinc/02/00/71/341020071.db2.gz LKYQFWROZYGJBH-OFQRWUPVSA-N 2 1 324.559 4.385 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1F ZINC000542843894 341023117 /nfs/dbraw/zinc/02/31/17/341023117.db2.gz KCWVCHXDBCELLS-ACJLOTCBSA-N 2 1 324.871 4.250 20 0 DIADMP CSc1ccccc1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000543460602 341045865 /nfs/dbraw/zinc/04/58/65/341045865.db2.gz OGQIZNIBJLKZED-RDJZCZTQSA-N 2 1 318.530 4.151 20 0 DIADMP CSc1ccccc1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000543460603 341045939 /nfs/dbraw/zinc/04/59/39/341045939.db2.gz OGQIZNIBJLKZED-WBVHZDCISA-N 2 1 318.530 4.151 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+]2CCC3(CCC[N@H+]3C)CC2)c(C)c1 ZINC000544126478 341071224 /nfs/dbraw/zinc/07/12/24/341071224.db2.gz GHLANHYYHBZMBR-GOSISDBHSA-N 2 1 300.490 4.233 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccccc2Cl)C[C@H]1C ZINC000544146027 341072218 /nfs/dbraw/zinc/07/22/18/341072218.db2.gz PMADLIBYLDJKPW-WBVHZDCISA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccccc2Cl)C[C@H]1C ZINC000544146027 341072219 /nfs/dbraw/zinc/07/22/19/341072219.db2.gz PMADLIBYLDJKPW-WBVHZDCISA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccccc2Cl)C[C@H]1C ZINC000544146027 341072220 /nfs/dbraw/zinc/07/22/20/341072220.db2.gz PMADLIBYLDJKPW-WBVHZDCISA-N 2 1 308.897 4.077 20 0 DIADMP CCCCC[C@@H]1CCC[N@H+]1Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000544347078 341077149 /nfs/dbraw/zinc/07/71/49/341077149.db2.gz DNERIOVYASZKFC-GOSISDBHSA-N 2 1 312.461 4.120 20 0 DIADMP C[C@@H](C[N@@H+](C)Cc1cc(-n2ccnc2)cs1)c1ccccc1 ZINC000544351637 341077617 /nfs/dbraw/zinc/07/76/17/341077617.db2.gz RNEVVWUESLGYPW-HNNXBMFYSA-N 2 1 311.454 4.169 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568748 341086152 /nfs/dbraw/zinc/08/61/52/341086152.db2.gz ANUFWQNBGDMCNA-APWZRJJASA-N 2 1 304.478 4.141 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568748 341086153 /nfs/dbraw/zinc/08/61/53/341086153.db2.gz ANUFWQNBGDMCNA-APWZRJJASA-N 2 1 304.478 4.141 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000545952772 341148269 /nfs/dbraw/zinc/14/82/69/341148269.db2.gz BWCYMUNBHISNJM-FFZOFVMBSA-N 2 1 311.473 4.062 20 0 DIADMP C[NH+]1CCC([NH2+]CC2(c3ccc(C(C)(C)C)cc3)CCC2)CC1 ZINC000237166671 341208329 /nfs/dbraw/zinc/20/83/29/341208329.db2.gz HUMPXRHWMMLZIT-UHFFFAOYSA-N 2 1 314.517 4.090 20 0 DIADMP c1csc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)c1 ZINC000135276376 341235263 /nfs/dbraw/zinc/23/52/63/341235263.db2.gz WTYITBALPAWYGJ-JFIYKMOQSA-N 2 1 304.503 4.196 20 0 DIADMP CC(C)Oc1ccccc1[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000548729016 341270906 /nfs/dbraw/zinc/27/09/06/341270906.db2.gz HCFXGXYRPLJIQI-KRWDZBQOSA-N 2 1 304.478 4.000 20 0 DIADMP c1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000245764304 341314089 /nfs/dbraw/zinc/31/40/89/341314089.db2.gz WCKANMWKHUKZNI-DKUWSORSSA-N 2 1 320.480 4.014 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(F)c2ccccc21 ZINC000550623166 341319738 /nfs/dbraw/zinc/31/97/38/341319738.db2.gz SYLOWDLCJAOCPX-GKCIPKSASA-N 2 1 312.432 4.256 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(F)c2ccccc21 ZINC000550623166 341319739 /nfs/dbraw/zinc/31/97/39/341319739.db2.gz SYLOWDLCJAOCPX-GKCIPKSASA-N 2 1 312.432 4.256 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550644356 341320236 /nfs/dbraw/zinc/32/02/36/341320236.db2.gz SBIHGZMPWMMKCU-FSSWDIPSSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550644356 341320237 /nfs/dbraw/zinc/32/02/37/341320237.db2.gz SBIHGZMPWMMKCU-FSSWDIPSSA-N 2 1 322.496 4.433 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550662008 341320883 /nfs/dbraw/zinc/32/08/83/341320883.db2.gz NBRWTKYWAZEIIN-FGZHOGPDSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000550662008 341320884 /nfs/dbraw/zinc/32/08/84/341320884.db2.gz NBRWTKYWAZEIIN-FGZHOGPDSA-N 2 1 322.496 4.271 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2CCC(F)(F)CC2)C[C@@H]1c1ccccc1 ZINC000550797656 341323309 /nfs/dbraw/zinc/32/33/09/341323309.db2.gz UHOKGAJAZWSBNK-QZTJIDSGSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2CCC(F)(F)CC2)C[C@@H]1c1ccccc1 ZINC000550797656 341323310 /nfs/dbraw/zinc/32/33/10/341323310.db2.gz UHOKGAJAZWSBNK-QZTJIDSGSA-N 2 1 322.443 4.237 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551015339 341329251 /nfs/dbraw/zinc/32/92/51/341329251.db2.gz WIGJQRVVOAVOLD-YUXAGFNASA-N 2 1 322.496 4.351 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551015339 341329252 /nfs/dbraw/zinc/32/92/52/341329252.db2.gz WIGJQRVVOAVOLD-YUXAGFNASA-N 2 1 322.496 4.351 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2coc3ccccc23)C[C@@H]1c1ccccc1 ZINC000551084284 341331100 /nfs/dbraw/zinc/33/11/00/341331100.db2.gz VNZZGWUKLYBMAK-AZUAARDMSA-N 2 1 320.436 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2coc3ccccc23)C[C@@H]1c1ccccc1 ZINC000551084284 341331101 /nfs/dbraw/zinc/33/11/01/341331101.db2.gz VNZZGWUKLYBMAK-AZUAARDMSA-N 2 1 320.436 4.358 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2coc3ccccc23)C[C@@H]1c1ccccc1 ZINC000551084287 341331130 /nfs/dbraw/zinc/33/11/30/341331130.db2.gz VNZZGWUKLYBMAK-UYAOXDASSA-N 2 1 320.436 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2coc3ccccc23)C[C@@H]1c1ccccc1 ZINC000551084287 341331131 /nfs/dbraw/zinc/33/11/31/341331131.db2.gz VNZZGWUKLYBMAK-UYAOXDASSA-N 2 1 320.436 4.358 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(F)cc32)C[C@@H]1c1ccccc1 ZINC000551085627 341331227 /nfs/dbraw/zinc/33/12/27/341331227.db2.gz DCAMDAOOZUOVTE-SESVDKBCSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(F)cc32)C[C@@H]1c1ccccc1 ZINC000551085627 341331228 /nfs/dbraw/zinc/33/12/28/341331228.db2.gz DCAMDAOOZUOVTE-SESVDKBCSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@@H]1c1ccccc1 ZINC000551176746 341333241 /nfs/dbraw/zinc/33/32/41/341333241.db2.gz CTWBOECGXNFULL-LSDHHAIUSA-N 2 1 314.395 4.000 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@@H]1c1ccccc1 ZINC000551176746 341333242 /nfs/dbraw/zinc/33/32/42/341333242.db2.gz CTWBOECGXNFULL-LSDHHAIUSA-N 2 1 314.395 4.000 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551268261 341336455 /nfs/dbraw/zinc/33/64/55/341336455.db2.gz TYDFSBATLSSSQN-BEEJXANESA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(C(C)(C)C)cc1 ZINC000551517305 341343446 /nfs/dbraw/zinc/34/34/46/341343446.db2.gz IXGYHIZUOFQEAG-LJQANCHMSA-N 2 1 313.489 4.247 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000551541663 341344775 /nfs/dbraw/zinc/34/47/75/341344775.db2.gz ULOVGIIVBGAXAY-INIZCTEOSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000246500147 341350886 /nfs/dbraw/zinc/35/08/86/341350886.db2.gz SNCNOLURGMAZDJ-PXZKYJSBSA-N 2 1 306.881 4.109 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000246500147 341350887 /nfs/dbraw/zinc/35/08/87/341350887.db2.gz SNCNOLURGMAZDJ-PXZKYJSBSA-N 2 1 306.881 4.109 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC000551833022 341353285 /nfs/dbraw/zinc/35/32/85/341353285.db2.gz FXRVMJWAEKMSBZ-HLAWJBBLSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2F)C2CCCC2)CC[N@@H+]1C ZINC000246834098 341357567 /nfs/dbraw/zinc/35/75/67/341357567.db2.gz BFMDRTGUCCLZMG-OGWOLHLISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2F)C2CCCC2)CC[N@H+]1C ZINC000246834098 341357568 /nfs/dbraw/zinc/35/75/68/341357568.db2.gz BFMDRTGUCCLZMG-OGWOLHLISA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccccc3o2)C1 ZINC000246924174 341358659 /nfs/dbraw/zinc/35/86/59/341358659.db2.gz GOIOSDBCAKYPQG-CVEARBPZSA-N 2 1 300.446 4.204 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccccc3o2)C1 ZINC000246924174 341358660 /nfs/dbraw/zinc/35/86/60/341358660.db2.gz GOIOSDBCAKYPQG-CVEARBPZSA-N 2 1 300.446 4.204 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1F ZINC000246975147 341359365 /nfs/dbraw/zinc/35/93/65/341359365.db2.gz JRZIHEWPSXLLLB-HUUCEWRRSA-N 2 1 324.509 4.319 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2c3ccccc3C[C@H]2C)c1 ZINC000247000957 341359760 /nfs/dbraw/zinc/35/97/60/341359760.db2.gz LPLUBLXATRLMDA-IERDGZPVSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H](Cc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000247133137 341361244 /nfs/dbraw/zinc/36/12/44/341361244.db2.gz QJXAZRMZIFLUNI-COPCDDAFSA-N 2 1 322.496 4.085 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(Cl)s2)C1 ZINC000247202531 341362246 /nfs/dbraw/zinc/36/22/46/341362246.db2.gz WMDGNJDRYXUOJU-QWHCGFSZSA-N 2 1 300.899 4.174 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)C1 ZINC000247201678 341362274 /nfs/dbraw/zinc/36/22/74/341362274.db2.gz WHQIUPXPXOGERQ-HZPDHXFCSA-N 2 1 306.519 4.180 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000247222226 341362327 /nfs/dbraw/zinc/36/23/27/341362327.db2.gz WJVSLZVWGIKLLS-NWEBGPFOSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000247222226 341362328 /nfs/dbraw/zinc/36/23/28/341362328.db2.gz WJVSLZVWGIKLLS-NWEBGPFOSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c2ccsc2S1 ZINC000247257736 341362785 /nfs/dbraw/zinc/36/27/85/341362785.db2.gz YXDFZXFXMDVLAA-XPCVCDNBSA-N 2 1 310.532 4.136 20 0 DIADMP C[C@H](c1ccccn1)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000248221833 341374866 /nfs/dbraw/zinc/37/48/66/341374866.db2.gz OKHHZLUHBDUKAZ-ZWKOTPCHSA-N 2 1 315.505 4.119 20 0 DIADMP C[C@H](c1ccccn1)[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000248221832 341374932 /nfs/dbraw/zinc/37/49/32/341374932.db2.gz OKHHZLUHBDUKAZ-QZTJIDSGSA-N 2 1 315.505 4.119 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)ccc1F ZINC000248404346 341376614 /nfs/dbraw/zinc/37/66/14/341376614.db2.gz QBMKSMAFRZWAQU-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1F ZINC000248404346 341376615 /nfs/dbraw/zinc/37/66/15/341376615.db2.gz QBMKSMAFRZWAQU-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000248405965 341376691 /nfs/dbraw/zinc/37/66/91/341376691.db2.gz RXKDBAOHMMGUPE-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000248405965 341376692 /nfs/dbraw/zinc/37/66/92/341376692.db2.gz RXKDBAOHMMGUPE-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000248405965 341376693 /nfs/dbraw/zinc/37/66/93/341376693.db2.gz RXKDBAOHMMGUPE-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248412021 341377090 /nfs/dbraw/zinc/37/70/90/341377090.db2.gz ZXBRGVGSQSKPOU-JEWRLFTDSA-N 2 1 316.489 4.146 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248412021 341377091 /nfs/dbraw/zinc/37/70/91/341377091.db2.gz ZXBRGVGSQSKPOU-JEWRLFTDSA-N 2 1 316.489 4.146 20 0 DIADMP CC(C)Cc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000552224339 341379439 /nfs/dbraw/zinc/37/94/39/341379439.db2.gz UGLJKCMMPNZHFQ-AEFFLSMTSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000552251061 341381435 /nfs/dbraw/zinc/38/14/35/341381435.db2.gz JMIIKAXCOYODHA-OVWQWFNUSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000552251061 341381436 /nfs/dbraw/zinc/38/14/36/341381436.db2.gz JMIIKAXCOYODHA-OVWQWFNUSA-N 2 1 306.519 4.155 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248643862 341382604 /nfs/dbraw/zinc/38/26/04/341382604.db2.gz PJIMSYDLCKBJJH-KKUMJFAQSA-N 2 1 322.518 4.060 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248643862 341382605 /nfs/dbraw/zinc/38/26/05/341382605.db2.gz PJIMSYDLCKBJJH-KKUMJFAQSA-N 2 1 322.518 4.060 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000248749442 341385890 /nfs/dbraw/zinc/38/58/90/341385890.db2.gz BQOSSJTWHHPZRY-GGPKGHCWSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000249275132 341395685 /nfs/dbraw/zinc/39/56/85/341395685.db2.gz LQCHHMKQGHZGDK-PMPSAXMXSA-N 2 1 320.443 4.352 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](c1cccc(F)c1)C1CCCC1 ZINC000566981335 341573436 /nfs/dbraw/zinc/57/34/36/341573436.db2.gz AFVPQRICGVHLSB-IBGZPJMESA-N 2 1 315.436 4.013 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@@H](c2cccc(Cl)c2)C1)c1c[nH+]ccc1N ZINC000567639635 341623743 /nfs/dbraw/zinc/62/37/43/341623743.db2.gz ARCCSLXYNVNMQS-JGGQBBKZSA-N 2 1 315.848 4.134 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1c[nH+]ccc1N)CCC2 ZINC000580639866 341890550 /nfs/dbraw/zinc/89/05/50/341890550.db2.gz SXENGBGFEAGPLE-VLIAUNLRSA-N 2 1 309.457 4.346 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1 ZINC000163468434 522812952 /nfs/dbraw/zinc/81/29/52/522812952.db2.gz ZMYPPHMIGPLTIG-LJQANCHMSA-N 2 1 309.457 4.100 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1csc(Cl)c1 ZINC000191328244 525295836 /nfs/dbraw/zinc/29/58/36/525295836.db2.gz SGKWQQFSWAVJEE-LBPRGKRZSA-N 2 1 312.910 4.459 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccccn1 ZINC000159016572 525534470 /nfs/dbraw/zinc/53/44/70/525534470.db2.gz VYHZJZHYLMLNTR-GOSISDBHSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl ZINC000338008067 527424244 /nfs/dbraw/zinc/42/42/44/527424244.db2.gz OXUWBRHXMCUARG-HNNXBMFYSA-N 2 1 324.255 4.166 20 0 DIADMP Cc1c[nH+]cn1C1CC[NH+]([C@H]2CCc3c2cccc3Cl)CC1 ZINC000225409601 563753889 /nfs/dbraw/zinc/75/38/89/563753889.db2.gz YMVXVIZBNDXWAK-SFHVURJKSA-N 2 1 315.848 4.169 20 0 DIADMP Cc1cccc2cc[nH+]c(N3CCCC[C@H]3CC[NH+]3CCCC3)c12 ZINC001165047411 721977316 /nfs/dbraw/zinc/97/73/16/721977316.db2.gz GOWDOQKYSAYUBO-IBGZPJMESA-N 2 1 323.484 4.388 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1Cl ZINC000643545700 1035590085 /nfs/dbraw/zinc/59/00/85/1035590085.db2.gz AXORGBXRELBFEW-WCQYABFASA-N 2 1 313.272 4.319 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC ZINC000643546512 1035590922 /nfs/dbraw/zinc/59/09/22/1035590922.db2.gz PRJVGYHYVMNCAX-ZBFHGGJFSA-N 2 1 322.880 4.064 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546343 1035592387 /nfs/dbraw/zinc/59/23/87/1035592387.db2.gz NDRYSYQDFRYBQG-JSGCOSHPSA-N 2 1 321.534 4.074 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCS2 ZINC000643546471 1035592554 /nfs/dbraw/zinc/59/25/54/1035592554.db2.gz PHEHIUGBVPFCLP-UKRRQHHQSA-N 2 1 322.905 4.141 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(-c2ccccc2)o1 ZINC000643546378 1035592798 /nfs/dbraw/zinc/59/27/98/1035592798.db2.gz NWARALHZFRESMD-DOTOQJQBSA-N 2 1 310.441 4.272 20 0 DIADMP CC[NH+]1CCC([N@H+](C)CC[C@H](C)CCCC(C)(C)OC)CC1 ZINC001208206823 1035728793 /nfs/dbraw/zinc/72/87/93/1035728793.db2.gz SXWBRFGVBHNELC-QGZVFWFLSA-N 2 1 312.542 4.024 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)CC[C@H](C)CCCC(C)(C)OC)CC1 ZINC001208206823 1035728806 /nfs/dbraw/zinc/72/88/06/1035728806.db2.gz SXWBRFGVBHNELC-QGZVFWFLSA-N 2 1 312.542 4.024 20 0 DIADMP Cc1ccccc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183618 1035894008 /nfs/dbraw/zinc/89/40/08/1035894008.db2.gz GRFNZKPMNHBKLH-FGTMMUONSA-N 2 1 300.490 4.299 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000339682888 1035914934 /nfs/dbraw/zinc/91/49/34/1035914934.db2.gz MSEQVWOXHCIPBU-HUUCEWRRSA-N 2 1 317.502 4.290 20 0 DIADMP c1csc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)c1 ZINC000037318667 1036019587 /nfs/dbraw/zinc/01/95/87/1036019587.db2.gz ITDJXFFQBOZKAH-SFHVURJKSA-N 2 1 304.503 4.196 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@@H+]1C ZINC000443887437 1036158352 /nfs/dbraw/zinc/15/83/52/1036158352.db2.gz HCUIKQMKAQJAHY-AAEUAGOBSA-N 2 1 323.362 4.148 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@H+]1C ZINC000443887437 1036158364 /nfs/dbraw/zinc/15/83/64/1036158364.db2.gz HCUIKQMKAQJAHY-AAEUAGOBSA-N 2 1 323.362 4.148 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C2CCC(C)CC2)CC1 ZINC000236825337 1036313860 /nfs/dbraw/zinc/31/38/60/1036313860.db2.gz NNYZRVZLPHEKIP-UHFFFAOYSA-N 2 1 300.490 4.128 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+]([C@@H]3CCc4ccccc43)C2)CC1 ZINC001167256534 1036328727 /nfs/dbraw/zinc/32/87/27/1036328727.db2.gz ZDAZTIBYSQHTJG-GHTZIAJQSA-N 2 1 312.501 4.118 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@H+]([C@H]3CCc4ccccc43)C2)CC1 ZINC001167256535 1036329330 /nfs/dbraw/zinc/32/93/30/1036329330.db2.gz ZDAZTIBYSQHTJG-NQIIRXRSSA-N 2 1 312.501 4.118 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(F)c1F ZINC000538453659 1036376575 /nfs/dbraw/zinc/37/65/75/1036376575.db2.gz BBWCRXIFBNLOLJ-LSDHHAIUSA-N 2 1 310.432 4.128 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C)SC2)cc1 ZINC000655720925 1036503716 /nfs/dbraw/zinc/50/37/16/1036503716.db2.gz JEUTUTFGJJCSJD-ZQIUZPCESA-N 2 1 315.486 4.115 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000315580829 1036582389 /nfs/dbraw/zinc/58/23/89/1036582389.db2.gz QQCAXXOUVOZIRK-YOEHRIQHSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000315580829 1036582394 /nfs/dbraw/zinc/58/23/94/1036582394.db2.gz QQCAXXOUVOZIRK-YOEHRIQHSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(Cl)c(F)c1 ZINC000213739823 1036619327 /nfs/dbraw/zinc/61/93/27/1036619327.db2.gz ZOSYVKHLBIUAFY-LBPRGKRZSA-N 2 1 312.860 4.393 20 0 DIADMP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174582 1036630519 /nfs/dbraw/zinc/63/05/19/1036630519.db2.gz ATKKUKQASXQGRR-NEPJUHHUSA-N 2 1 308.878 4.114 20 0 DIADMP C[C@@H]([NH3+])[C@H]1CCC[N@@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174582 1036630525 /nfs/dbraw/zinc/63/05/25/1036630525.db2.gz ATKKUKQASXQGRR-NEPJUHHUSA-N 2 1 308.878 4.114 20 0 DIADMP CC[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1(C)C ZINC000397652719 1036709108 /nfs/dbraw/zinc/70/91/08/1036709108.db2.gz MEHSOTOVVIXLSQ-DYXWJJEUSA-N 2 1 314.517 4.313 20 0 DIADMP FCc1ccccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001167326325 1036737617 /nfs/dbraw/zinc/73/76/17/1036737617.db2.gz KQDLQYIWXNFIFS-GOSISDBHSA-N 2 1 318.480 4.244 20 0 DIADMP FCc1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001167326325 1036737635 /nfs/dbraw/zinc/73/76/35/1036737635.db2.gz KQDLQYIWXNFIFS-GOSISDBHSA-N 2 1 318.480 4.244 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC(C)(C)c2ccccc2)CC1 ZINC000683726294 1036773341 /nfs/dbraw/zinc/77/33/41/1036773341.db2.gz BKNWQCORMTVDFL-UHFFFAOYSA-N 2 1 324.468 4.211 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000317325428 1036822035 /nfs/dbraw/zinc/82/20/35/1036822035.db2.gz WPLIEEFGPSPITG-AHRSYUTCSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000317325428 1036822054 /nfs/dbraw/zinc/82/20/54/1036822054.db2.gz WPLIEEFGPSPITG-AHRSYUTCSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3[nH]ccc3c2)c1 ZINC000580095295 1036945489 /nfs/dbraw/zinc/94/54/89/1036945489.db2.gz OYDUPWGMAWRRCV-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398036290 1037105586 /nfs/dbraw/zinc/10/55/86/1037105586.db2.gz QANMETJHPMOMAP-YSIASYRMSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398036290 1037105597 /nfs/dbraw/zinc/10/55/97/1037105597.db2.gz QANMETJHPMOMAP-YSIASYRMSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398041107 1037108116 /nfs/dbraw/zinc/10/81/16/1037108116.db2.gz RWVJKFRAKGYXJQ-HBFSDRIKSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398041107 1037108123 /nfs/dbraw/zinc/10/81/23/1037108123.db2.gz RWVJKFRAKGYXJQ-HBFSDRIKSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398042216 1037111058 /nfs/dbraw/zinc/11/10/58/1037111058.db2.gz SVGOPDMTIILJJH-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398042216 1037111069 /nfs/dbraw/zinc/11/10/69/1037111069.db2.gz SVGOPDMTIILJJH-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C=CCCCCC1 ZINC000398179721 1037270270 /nfs/dbraw/zinc/27/02/70/1037270270.db2.gz WSZZBPSWUOMEDB-HMXCVIKNSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C=CCCCCC1 ZINC000398179721 1037270284 /nfs/dbraw/zinc/27/02/84/1037270284.db2.gz WSZZBPSWUOMEDB-HMXCVIKNSA-N 2 1 312.501 4.376 20 0 DIADMP CC[C@H](CSC)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000580824501 1037321090 /nfs/dbraw/zinc/32/10/90/1037321090.db2.gz UHXWWBOSWNRFHP-LMDPOFIKSA-N 2 1 320.546 4.161 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc3ccccc3s2)C1 ZINC000569347167 1037696650 /nfs/dbraw/zinc/69/66/50/1037696650.db2.gz PFRCVVRERWDSLX-INIZCTEOSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC000569347167 1037696658 /nfs/dbraw/zinc/69/66/58/1037696658.db2.gz PFRCVVRERWDSLX-INIZCTEOSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000569347167 1037696662 /nfs/dbraw/zinc/69/66/62/1037696662.db2.gz PFRCVVRERWDSLX-INIZCTEOSA-N 2 1 314.498 4.065 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000581554131 1037733304 /nfs/dbraw/zinc/73/33/04/1037733304.db2.gz UOUJRTBWGUCPNW-LDQXTDLNSA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000581554131 1037733318 /nfs/dbraw/zinc/73/33/18/1037733318.db2.gz UOUJRTBWGUCPNW-LDQXTDLNSA-N 2 1 324.468 4.181 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000341462010 1038047701 /nfs/dbraw/zinc/04/77/01/1038047701.db2.gz TUBXPUJDGPYXCP-QGZVFWFLSA-N 2 1 303.425 4.098 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000341462008 1038047733 /nfs/dbraw/zinc/04/77/33/1038047733.db2.gz TUBXPUJDGPYXCP-KRWDZBQOSA-N 2 1 303.425 4.098 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc2ccccc2s1 ZINC000126470679 1038107006 /nfs/dbraw/zinc/10/70/06/1038107006.db2.gz ZNGSEJUNTLHCIH-CYBMUJFWSA-N 2 1 300.471 4.179 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000341767736 1038264287 /nfs/dbraw/zinc/26/42/87/1038264287.db2.gz NOWUJIOVJKBMDU-GFCCVEGCSA-N 2 1 317.820 4.017 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)c(F)c2)C1 ZINC000535778079 1038333622 /nfs/dbraw/zinc/33/36/22/1038333622.db2.gz HMEXUGOXLVQFCW-KGLIPLIRSA-N 2 1 312.860 4.250 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ncccc1C)C(C)(C)C ZINC000934292483 1038582649 /nfs/dbraw/zinc/58/26/49/1038582649.db2.gz QFWRTIGCUVWZRJ-SFHVURJKSA-N 2 1 314.477 4.052 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000606432842 1038601812 /nfs/dbraw/zinc/60/18/12/1038601812.db2.gz DWWUXIIZSMTTOI-IBGZPJMESA-N 2 1 306.469 4.329 20 0 DIADMP c1ccc2cc(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447744 1038603276 /nfs/dbraw/zinc/60/32/76/1038603276.db2.gz DDSWEZMLEFLPEC-NRFANRHFSA-N 2 1 308.469 4.290 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557928 1038618728 /nfs/dbraw/zinc/61/87/28/1038618728.db2.gz AGTJPDHLOFJFKH-GOSISDBHSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557928 1038618732 /nfs/dbraw/zinc/61/87/32/1038618732.db2.gz AGTJPDHLOFJFKH-GOSISDBHSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557928 1038618738 /nfs/dbraw/zinc/61/87/38/1038618738.db2.gz AGTJPDHLOFJFKH-GOSISDBHSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557928 1038618742 /nfs/dbraw/zinc/61/87/42/1038618742.db2.gz AGTJPDHLOFJFKH-GOSISDBHSA-N 2 1 318.505 4.028 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ccccc2)cc1 ZINC000342485249 1038630259 /nfs/dbraw/zinc/63/02/59/1038630259.db2.gz VXHXDJLFUUFQRV-MRXNPFEDSA-N 2 1 305.425 4.074 20 0 DIADMP c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCC4)C3)cc2)cc1 ZINC000606901469 1038638332 /nfs/dbraw/zinc/63/83/32/1038638332.db2.gz USIGARPPMIQZJT-FQEVSTJZSA-N 2 1 320.480 4.271 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000672605468 1038659878 /nfs/dbraw/zinc/65/98/78/1038659878.db2.gz LUVGVTYDMJPMKT-AFYVEPGGSA-N 2 1 300.490 4.065 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCOC2CCCCCC2)CC1 ZINC000607152540 1038659932 /nfs/dbraw/zinc/65/99/32/1038659932.db2.gz KIMQEGNGXYLOMU-UHFFFAOYSA-N 2 1 324.553 4.170 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@H]([NH3+])C[C@H]3C)s2)cc1 ZINC000563350716 1038661015 /nfs/dbraw/zinc/66/10/15/1038661015.db2.gz QDUJNWQVGXSQON-ZBFHGGJFSA-N 2 1 300.471 4.035 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000608061143 1038760562 /nfs/dbraw/zinc/76/05/62/1038760562.db2.gz ABCQFCGHOYBLCI-YLJYHZDGSA-N 2 1 308.469 4.234 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000342860094 1038923318 /nfs/dbraw/zinc/92/33/18/1038923318.db2.gz NJRMIFGJGWWXFK-UHFFFAOYSA-N 2 1 319.452 4.399 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000342860094 1038923333 /nfs/dbraw/zinc/92/33/33/1038923333.db2.gz NJRMIFGJGWWXFK-UHFFFAOYSA-N 2 1 319.452 4.399 20 0 DIADMP CCC[N@@H+](CCCn1ccnc1C)[C@@H](C)c1ccccc1OC ZINC000342858608 1038925445 /nfs/dbraw/zinc/92/54/45/1038925445.db2.gz DRLVOIBKMCWVEE-INIZCTEOSA-N 2 1 315.461 4.063 20 0 DIADMP CCC[N@H+](CCCn1cc[nH+]c1C)[C@@H](C)c1ccccc1OC ZINC000342858608 1038925464 /nfs/dbraw/zinc/92/54/64/1038925464.db2.gz DRLVOIBKMCWVEE-INIZCTEOSA-N 2 1 315.461 4.063 20 0 DIADMP CCC[N@@H+](CCCn1cc[nH+]c1C)[C@@H](C)c1ccccc1OC ZINC000342858608 1038925480 /nfs/dbraw/zinc/92/54/80/1038925480.db2.gz DRLVOIBKMCWVEE-INIZCTEOSA-N 2 1 315.461 4.063 20 0 DIADMP CCCC[N@H+](CCCn1cc[nH+]c1C)Cc1ccccc1F ZINC000342862480 1038927444 /nfs/dbraw/zinc/92/74/44/1038927444.db2.gz YWBFWECRSWYBTE-UHFFFAOYSA-N 2 1 303.425 4.023 20 0 DIADMP CCCC[N@@H+](CCCn1cc[nH+]c1C)Cc1ccccc1F ZINC000342862480 1038927454 /nfs/dbraw/zinc/92/74/54/1038927454.db2.gz YWBFWECRSWYBTE-UHFFFAOYSA-N 2 1 303.425 4.023 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000342861622 1038928176 /nfs/dbraw/zinc/92/81/76/1038928176.db2.gz YILRDYQAUANEKR-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000342861622 1038928188 /nfs/dbraw/zinc/92/81/88/1038928188.db2.gz YILRDYQAUANEKR-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1nccn1CCC[N@@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000342866353 1038934536 /nfs/dbraw/zinc/93/45/36/1038934536.db2.gz ZXEJYPLCZYAMLI-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000342866353 1038934549 /nfs/dbraw/zinc/93/45/49/1038934549.db2.gz ZXEJYPLCZYAMLI-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000342866353 1038934565 /nfs/dbraw/zinc/93/45/65/1038934565.db2.gz ZXEJYPLCZYAMLI-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1ccc2c(C)cc(N3C(C)(C)CC([NH3+])CC3(C)C)[nH+]c2c1 ZINC001167625510 1038972409 /nfs/dbraw/zinc/97/24/09/1038972409.db2.gz JWTRPFPJDCUEMP-UHFFFAOYSA-N 2 1 311.473 4.336 20 0 DIADMP CCCCC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167646822 1039078015 /nfs/dbraw/zinc/07/80/15/1039078015.db2.gz HKNZLPJSHUFMMF-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167646822 1039078028 /nfs/dbraw/zinc/07/80/28/1039078028.db2.gz HKNZLPJSHUFMMF-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167646822 1039078044 /nfs/dbraw/zinc/07/80/44/1039078044.db2.gz HKNZLPJSHUFMMF-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167646823 1039079190 /nfs/dbraw/zinc/07/91/90/1039079190.db2.gz HKNZLPJSHUFMMF-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167646823 1039079207 /nfs/dbraw/zinc/07/92/07/1039079207.db2.gz HKNZLPJSHUFMMF-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167646823 1039079225 /nfs/dbraw/zinc/07/92/25/1039079225.db2.gz HKNZLPJSHUFMMF-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000714804002 1039089520 /nfs/dbraw/zinc/08/95/20/1039089520.db2.gz SIWANOXSXAOASP-CZGNIMDHSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000714804002 1039089540 /nfs/dbraw/zinc/08/95/40/1039089540.db2.gz SIWANOXSXAOASP-CZGNIMDHSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccc[nH]1 ZINC000796845848 1039234137 /nfs/dbraw/zinc/23/41/37/1039234137.db2.gz MDHZJPXDZNKOGO-IPJUCJBFSA-N 2 1 311.473 4.109 20 0 DIADMP Cc1ccsc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000080338962 1039321551 /nfs/dbraw/zinc/32/15/51/1039321551.db2.gz AVRPZFCLBXNNJN-AEFFLSMTSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccsc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000080338962 1039321567 /nfs/dbraw/zinc/32/15/67/1039321567.db2.gz AVRPZFCLBXNNJN-AEFFLSMTSA-N 2 1 314.498 4.199 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CC3(CCC3)C2)[C@@H]1c1cccs1 ZINC000448060845 1039342916 /nfs/dbraw/zinc/34/29/16/1039342916.db2.gz OYMSLZYCCOHXCX-RHSMWYFYSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CC3(CCC3)C2)[C@@H]1c1cccs1 ZINC000448060845 1039342926 /nfs/dbraw/zinc/34/29/26/1039342926.db2.gz OYMSLZYCCOHXCX-RHSMWYFYSA-N 2 1 304.503 4.053 20 0 DIADMP c1c2ccccc2sc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000539850872 1039367627 /nfs/dbraw/zinc/36/76/27/1039367627.db2.gz IDHMMOZZTZJTQN-INIZCTEOSA-N 2 1 314.498 4.209 20 0 DIADMP CC(C)CC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000657774322 1039396442 /nfs/dbraw/zinc/39/64/42/1039396442.db2.gz DHDGMDRTVUBGIT-IBGZPJMESA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)CC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC000657774322 1039396460 /nfs/dbraw/zinc/39/64/60/1039396460.db2.gz DHDGMDRTVUBGIT-IBGZPJMESA-N 2 1 312.501 4.352 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H](C)C(F)(F)F)CC1)CC1CC1 ZINC000540049631 1039407106 /nfs/dbraw/zinc/40/71/06/1039407106.db2.gz HJTSUATXUQKOEK-CQSZACIVSA-N 2 1 320.443 4.019 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](c2ccc(C)o2)C2CCCC2)CC1 ZINC000540467322 1039498407 /nfs/dbraw/zinc/49/84/07/1039498407.db2.gz HPUNQNWNMVNMLX-IBGZPJMESA-N 2 1 304.478 4.283 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C ZINC000540521491 1039513611 /nfs/dbraw/zinc/51/36/11/1039513611.db2.gz RHFWTQKAQHQZNE-JEBQAFNWSA-N 2 1 317.864 4.222 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCC(C)(F)F)C1 ZINC000929644409 1039595270 /nfs/dbraw/zinc/59/52/70/1039595270.db2.gz REQUCWMMUYRENV-HOTGVXAUSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000929644409 1039595285 /nfs/dbraw/zinc/59/52/85/1039595285.db2.gz REQUCWMMUYRENV-HOTGVXAUSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCC(C)(F)F)C1 ZINC000929644409 1039595304 /nfs/dbraw/zinc/59/53/04/1039595304.db2.gz REQUCWMMUYRENV-HOTGVXAUSA-N 2 1 302.453 4.008 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c1 ZINC000540982105 1039602619 /nfs/dbraw/zinc/60/26/19/1039602619.db2.gz NYDGAVZEUUGMRI-IBGZPJMESA-N 2 1 308.469 4.046 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349808 1039670638 /nfs/dbraw/zinc/67/06/38/1039670638.db2.gz UMWDSZBXNIVXFE-HNAYVOBHSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)CC2 ZINC000541349808 1039670644 /nfs/dbraw/zinc/67/06/44/1039670644.db2.gz UMWDSZBXNIVXFE-HNAYVOBHSA-N 2 1 318.892 4.135 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000708501025 1039677636 /nfs/dbraw/zinc/67/76/36/1039677636.db2.gz ARXWGDFCCLBLNJ-CMKODMSKSA-N 2 1 302.506 4.026 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000708501033 1039678025 /nfs/dbraw/zinc/67/80/25/1039678025.db2.gz ARXWGDFCCLBLNJ-NSHGMRRFSA-N 2 1 302.506 4.026 20 0 DIADMP CCc1ccc(CC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000541601813 1039717388 /nfs/dbraw/zinc/71/73/88/1039717388.db2.gz QJGCKEKIXSSDAV-XLIONFOSSA-N 2 1 314.517 4.034 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+](CC(C)C)CC2)C2CCC2)o1 ZINC000541746620 1039732773 /nfs/dbraw/zinc/73/27/73/1039732773.db2.gz KHBNVXIQCUPDOK-IBGZPJMESA-N 2 1 304.478 4.139 20 0 DIADMP FC(F)(F)CC[NH+]1CCC(Nc2cccc3cc[nH+]cc32)CC1 ZINC000541881691 1039753547 /nfs/dbraw/zinc/75/35/47/1039753547.db2.gz CZFYKERVROACMO-UHFFFAOYSA-N 2 1 323.362 4.064 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@H](C[NH+](C)C)C3)s2)cc1 ZINC000541909487 1039756239 /nfs/dbraw/zinc/75/62/39/1039756239.db2.gz SAGBYCSUNALMMQ-MRXNPFEDSA-N 2 1 314.498 4.107 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915765 1039759797 /nfs/dbraw/zinc/75/97/97/1039759797.db2.gz ZBBIQHMLMQAWTA-GUYCJALGSA-N 2 1 312.860 4.108 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915765 1039759804 /nfs/dbraw/zinc/75/98/04/1039759804.db2.gz ZBBIQHMLMQAWTA-GUYCJALGSA-N 2 1 312.860 4.108 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)s1 ZINC000090406321 1039795590 /nfs/dbraw/zinc/79/55/90/1039795590.db2.gz KBZQARIMZIQSIE-AWEZNQCLSA-N 2 1 321.534 4.147 20 0 DIADMP C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542151113 1039802396 /nfs/dbraw/zinc/80/23/96/1039802396.db2.gz ADXYQOWMKXKHJF-ZIFCJYIRSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@@H](Cc1ccsc1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542151113 1039802408 /nfs/dbraw/zinc/80/24/08/1039802408.db2.gz ADXYQOWMKXKHJF-ZIFCJYIRSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@@H](Cc1ccsc1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542151113 1039802429 /nfs/dbraw/zinc/80/24/29/1039802429.db2.gz ADXYQOWMKXKHJF-ZIFCJYIRSA-N 2 1 320.546 4.266 20 0 DIADMP CCc1oc2ccccc2c1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000092072403 1039865032 /nfs/dbraw/zinc/86/50/32/1039865032.db2.gz SNNWVRSEHCWDLQ-CQSZACIVSA-N 2 1 309.413 4.098 20 0 DIADMP CCc1oc2ccccc2c1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000092072401 1039867098 /nfs/dbraw/zinc/86/70/98/1039867098.db2.gz SNNWVRSEHCWDLQ-AWEZNQCLSA-N 2 1 309.413 4.098 20 0 DIADMP C/C(=C/c1ccccc1)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066691 1039867824 /nfs/dbraw/zinc/86/78/24/1039867824.db2.gz ORGHDKXWYYXBHH-QGPLMHEWSA-N 2 1 310.485 4.039 20 0 DIADMP C/C(=C/c1ccccc1)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066691 1039867848 /nfs/dbraw/zinc/86/78/48/1039867848.db2.gz ORGHDKXWYYXBHH-QGPLMHEWSA-N 2 1 310.485 4.039 20 0 DIADMP C[C@H](NC1CC[NH+](CCc2ccccc2)CC1)c1ccsc1 ZINC000171405367 1039996871 /nfs/dbraw/zinc/99/68/71/1039996871.db2.gz ASLPJPUFGHXROK-INIZCTEOSA-N 2 1 314.498 4.106 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccsc1 ZINC000171405367 1039996882 /nfs/dbraw/zinc/99/68/82/1039996882.db2.gz ASLPJPUFGHXROK-INIZCTEOSA-N 2 1 314.498 4.106 20 0 DIADMP CC(C)C[C@@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000685443148 1040049287 /nfs/dbraw/zinc/04/92/87/1040049287.db2.gz QTOGOUVLCVWCFC-CBQMWWCCSA-N 2 1 314.517 4.373 20 0 DIADMP CC(C)C[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000685443148 1040049304 /nfs/dbraw/zinc/04/93/04/1040049304.db2.gz QTOGOUVLCVWCFC-CBQMWWCCSA-N 2 1 314.517 4.373 20 0 DIADMP CCC1(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000309693132 1040091744 /nfs/dbraw/zinc/09/17/44/1040091744.db2.gz CGBOUEGVDDNKSQ-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000708575041 1040094492 /nfs/dbraw/zinc/09/44/92/1040094492.db2.gz PQGJXKHVYYYMTN-IZBJGVDFSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309920830 1040099977 /nfs/dbraw/zinc/09/99/77/1040099977.db2.gz QQECRDPRORAZAK-BWPNAZKDSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCSCC2)cc1 ZINC000657903599 1040100982 /nfs/dbraw/zinc/10/09/82/1040100982.db2.gz NBNVUYWLDOUVDF-PBHICJAKSA-N 2 1 315.486 4.117 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC000310069755 1040106120 /nfs/dbraw/zinc/10/61/20/1040106120.db2.gz CVVJJWZINBUHLO-SIKLNZKXSA-N 2 1 320.480 4.094 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccoc1 ZINC000178081940 1040139775 /nfs/dbraw/zinc/13/97/75/1040139775.db2.gz VWJHJXLUTSQFCG-KRWDZBQOSA-N 2 1 312.457 4.362 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000685662430 1040204831 /nfs/dbraw/zinc/20/48/31/1040204831.db2.gz SDRMYIURFSQIHO-YIYPIFLZSA-N 2 1 314.926 4.212 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000685662430 1040204833 /nfs/dbraw/zinc/20/48/33/1040204833.db2.gz SDRMYIURFSQIHO-YIYPIFLZSA-N 2 1 314.926 4.212 20 0 DIADMP C[C@H]([NH2+]CCSC(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309720049 1040214622 /nfs/dbraw/zinc/21/46/22/1040214622.db2.gz NKYJNXOYWLDBGN-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309766818 1040258589 /nfs/dbraw/zinc/25/85/89/1040258589.db2.gz ZQPVOOSZZOVWJE-RLLQIKCJSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658228487 1040370571 /nfs/dbraw/zinc/37/05/71/1040370571.db2.gz IUZUUNWSXCXSRW-KBPBESRZSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658228487 1040370587 /nfs/dbraw/zinc/37/05/87/1040370587.db2.gz IUZUUNWSXCXSRW-KBPBESRZSA-N 2 1 306.416 4.104 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@]2(C)CC2(F)F)cc1 ZINC000658218146 1040376399 /nfs/dbraw/zinc/37/63/99/1040376399.db2.gz CMPDWEVEVNOPTE-SUMWQHHRSA-N 2 1 319.399 4.267 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC000658299961 1040410546 /nfs/dbraw/zinc/41/05/46/1040410546.db2.gz IQZXLTSLJKQSAI-PLACYPQZSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319474 1040419166 /nfs/dbraw/zinc/41/91/66/1040419166.db2.gz BYUDITMRDQNNNM-YLJYHZDGSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319474 1040419173 /nfs/dbraw/zinc/41/91/73/1040419173.db2.gz BYUDITMRDQNNNM-YLJYHZDGSA-N 2 1 324.468 4.233 20 0 DIADMP CCCOc1ccc(CN(C)CC[C@@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204616218 1040473823 /nfs/dbraw/zinc/47/38/23/1040473823.db2.gz QOJPXOFHUYCZGP-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001204616218 1040473837 /nfs/dbraw/zinc/47/38/37/1040473837.db2.gz QOJPXOFHUYCZGP-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001204616218 1040473854 /nfs/dbraw/zinc/47/38/54/1040473854.db2.gz QOJPXOFHUYCZGP-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001204616218 1040473868 /nfs/dbraw/zinc/47/38/68/1040473868.db2.gz QOJPXOFHUYCZGP-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204616218 1040473880 /nfs/dbraw/zinc/47/38/80/1040473880.db2.gz QOJPXOFHUYCZGP-IBGZPJMESA-N 2 1 318.505 4.090 20 0 DIADMP C[C@@H]1CCCCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309583008 1040710875 /nfs/dbraw/zinc/71/08/75/1040710875.db2.gz PFEJAESHZDFKQC-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP Clc1c[nH+]ccc1NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000309694015 1040720079 /nfs/dbraw/zinc/72/00/79/1040720079.db2.gz DPRHJWKRZUESIL-INIZCTEOSA-N 2 1 315.848 4.059 20 0 DIADMP Clc1c[nH+]ccc1NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309694015 1040720091 /nfs/dbraw/zinc/72/00/91/1040720091.db2.gz DPRHJWKRZUESIL-INIZCTEOSA-N 2 1 315.848 4.059 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000309695599 1040721455 /nfs/dbraw/zinc/72/14/55/1040721455.db2.gz DWWUXGQBXKCBNW-WMZOPIPTSA-N 2 1 314.498 4.311 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCc4ccccc43)C2)cc1 ZINC000310074593 1040749469 /nfs/dbraw/zinc/74/94/69/1040749469.db2.gz FUWVUMCAKADQBW-UGKGYDQZSA-N 2 1 320.480 4.176 20 0 DIADMP c1cc2c(o1)CCC[C@H]2[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310078672 1040750296 /nfs/dbraw/zinc/75/02/96/1040750296.db2.gz HPSMSGIKMHUURX-AZUAARDMSA-N 2 1 324.468 4.159 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000414062063 1040803952 /nfs/dbraw/zinc/80/39/52/1040803952.db2.gz CFRAADIPOABJNF-SJLPKXTDSA-N 2 1 317.864 4.161 20 0 DIADMP Clc1ccc(CC2([NH2+]C3CC[NH+](C4CC4)CC3)CCC2)cc1 ZINC000414118729 1040887532 /nfs/dbraw/zinc/88/75/32/1040887532.db2.gz BQQRPOVQCPFHAR-UHFFFAOYSA-N 2 1 318.892 4.022 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299453 1040892808 /nfs/dbraw/zinc/89/28/08/1040892808.db2.gz CPOIOFIQNOTLEU-YLJYHZDGSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299453 1040892818 /nfs/dbraw/zinc/89/28/18/1040892818.db2.gz CPOIOFIQNOTLEU-YLJYHZDGSA-N 2 1 323.484 4.033 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000414169214 1040950312 /nfs/dbraw/zinc/95/03/12/1040950312.db2.gz AUPYWOVZGIDTCP-HOTGVXAUSA-N 2 1 306.519 4.181 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000414169226 1040950777 /nfs/dbraw/zinc/95/07/77/1040950777.db2.gz AWLDWWNNLFBNOP-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cc2ccccc2s1 ZINC000414173115 1040956349 /nfs/dbraw/zinc/95/63/49/1040956349.db2.gz FLDKPWJEINBQAQ-HUUCEWRRSA-N 2 1 302.487 4.284 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000414194490 1040983597 /nfs/dbraw/zinc/98/35/97/1040983597.db2.gz UUSMVRVLUYJXOJ-ZFWWWQNUSA-N 2 1 323.550 4.132 20 0 DIADMP CSCCCCC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000186780683 1041178723 /nfs/dbraw/zinc/17/87/23/1041178723.db2.gz LZOMQYFCECKEOK-HNNXBMFYSA-N 2 1 317.502 4.365 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)ccc1C(F)(F)F ZINC000414371583 1041186181 /nfs/dbraw/zinc/18/61/81/1041186181.db2.gz NAIWLGXPOWEGOT-CQSZACIVSA-N 2 1 323.362 4.117 20 0 DIADMP CCCC[N@@H+](Cc1ncc(CN(C)C)s1)C1CCCCC1 ZINC000809547218 1041189790 /nfs/dbraw/zinc/18/97/90/1041189790.db2.gz NBBWLDAOXZOQIH-UHFFFAOYSA-N 2 1 309.523 4.140 20 0 DIADMP CCCC[N@@H+](Cc1ncc(C[NH+](C)C)s1)C1CCCCC1 ZINC000809547218 1041189814 /nfs/dbraw/zinc/18/98/14/1041189814.db2.gz NBBWLDAOXZOQIH-UHFFFAOYSA-N 2 1 309.523 4.140 20 0 DIADMP C[C@H](CCc1ccc(Cl)s1)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121990 1041358175 /nfs/dbraw/zinc/35/81/75/1041358175.db2.gz HHRWXAAMCMBQCO-ZIAGYGMSSA-N 2 1 314.926 4.044 20 0 DIADMP C[C@@H](CCc1ccc(Cl)s1)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121989 1041359336 /nfs/dbraw/zinc/35/93/36/1041359336.db2.gz HHRWXAAMCMBQCO-UONOGXRCSA-N 2 1 314.926 4.044 20 0 DIADMP C[C@H](C1CC1)[NH+](C/C=C\C[N@H+]([C@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615535 1041384940 /nfs/dbraw/zinc/38/49/40/1041384940.db2.gz BQCYIYVUHISCJG-JGPFYOFESA-N 2 1 302.506 4.068 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309689185 1041400091 /nfs/dbraw/zinc/40/00/91/1041400091.db2.gz CJOHQDDVUDPQNF-AABGKKOBSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000660073664 1041598729 /nfs/dbraw/zinc/59/87/29/1041598729.db2.gz IRMGDPHPAYMSJO-MRXNPFEDSA-N 2 1 324.459 4.264 20 0 DIADMP CC[C@H](CC(F)F)C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000660073664 1041598740 /nfs/dbraw/zinc/59/87/40/1041598740.db2.gz IRMGDPHPAYMSJO-MRXNPFEDSA-N 2 1 324.459 4.264 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000660113654 1041620913 /nfs/dbraw/zinc/62/09/13/1041620913.db2.gz CNFUKYKNBIRQHE-DXIQSLLYSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000660113654 1041620916 /nfs/dbraw/zinc/62/09/16/1041620916.db2.gz CNFUKYKNBIRQHE-DXIQSLLYSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000660113654 1041620918 /nfs/dbraw/zinc/62/09/18/1041620918.db2.gz CNFUKYKNBIRQHE-DXIQSLLYSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000660113654 1041620922 /nfs/dbraw/zinc/62/09/22/1041620922.db2.gz CNFUKYKNBIRQHE-DXIQSLLYSA-N 2 1 324.512 4.055 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417323105 1041657391 /nfs/dbraw/zinc/65/73/91/1041657391.db2.gz NYOOEJMGGYJIBD-XWTMOSNGSA-N 2 1 320.546 4.342 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(Cl)c1F ZINC000364088281 1041660326 /nfs/dbraw/zinc/66/03/26/1041660326.db2.gz XJGJBPNNJJTSBI-XEZPLFJOSA-N 2 1 310.844 4.147 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Cl)c1F ZINC000364088281 1041660329 /nfs/dbraw/zinc/66/03/29/1041660329.db2.gz XJGJBPNNJJTSBI-XEZPLFJOSA-N 2 1 310.844 4.147 20 0 DIADMP CC[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)CC(F)F ZINC000660307331 1041709585 /nfs/dbraw/zinc/70/95/85/1041709585.db2.gz WIIAXNVZSUUDOC-SOLBZPMBSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813789785 1041732376 /nfs/dbraw/zinc/73/23/76/1041732376.db2.gz CURLXBVPKIBIMM-XCDJFROHSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813789783 1041732933 /nfs/dbraw/zinc/73/29/33/1041732933.db2.gz CURLXBVPKIBIMM-FWZVCBSNSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCC1 ZINC000813881667 1041742575 /nfs/dbraw/zinc/74/25/75/1041742575.db2.gz SBNZSDMTCJWEDP-BRIRTLKKSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC000813881648 1041742825 /nfs/dbraw/zinc/74/28/25/1041742825.db2.gz RJTUJKVZEXTOQL-VTHDOGFWSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001170720550 1041758245 /nfs/dbraw/zinc/75/82/45/1041758245.db2.gz MNPIKHGLBJPDIW-RUGGUXRKSA-N 2 1 312.501 4.064 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@H+]1Cc1ccccc1 ZINC001170720550 1041758252 /nfs/dbraw/zinc/75/82/52/1041758252.db2.gz MNPIKHGLBJPDIW-RUGGUXRKSA-N 2 1 312.501 4.064 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc12 ZINC000364439479 1041790525 /nfs/dbraw/zinc/79/05/25/1041790525.db2.gz DZXFPKHNBNFTPQ-YESZJQIVSA-N 2 1 324.468 4.126 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685724 1041880280 /nfs/dbraw/zinc/88/02/80/1041880280.db2.gz BXYMHPDSHVYMBW-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685724 1041880291 /nfs/dbraw/zinc/88/02/91/1041880291.db2.gz BXYMHPDSHVYMBW-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000164617343 1042024604 /nfs/dbraw/zinc/02/46/04/1042024604.db2.gz QQXPYVIRMGGPSU-GFCCVEGCSA-N 2 1 309.816 4.115 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1F ZINC000164625546 1042025781 /nfs/dbraw/zinc/02/57/81/1042025781.db2.gz XMSVHZUASMSDJT-ZDUSSCGKSA-N 2 1 321.465 4.184 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000248879429 1042068150 /nfs/dbraw/zinc/06/81/50/1042068150.db2.gz KIYRADFZZIVLDR-XLIONFOSSA-N 2 1 315.505 4.035 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccccc1SC(C)(C)C ZINC000817970672 1042134966 /nfs/dbraw/zinc/13/49/66/1042134966.db2.gz BULFUBAPUJSKLO-ILXRZTDVSA-N 2 1 306.519 4.368 20 0 DIADMP CCCCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000314782817 1042169090 /nfs/dbraw/zinc/16/90/90/1042169090.db2.gz YIHIGGUXCYNDIF-FXAWDEMLSA-N 2 1 300.490 4.382 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001167824168 1042209702 /nfs/dbraw/zinc/20/97/02/1042209702.db2.gz CAYUANQAYIAKCD-QFBILLFUSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001167824166 1042210128 /nfs/dbraw/zinc/21/01/28/1042210128.db2.gz CAYUANQAYIAKCD-APWZRJJASA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccccc1F ZINC001167824735 1042212014 /nfs/dbraw/zinc/21/20/14/1042212014.db2.gz GBSXBHCYIZGOPV-VQIMIIECSA-N 2 1 306.469 4.473 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000278923912 1042215832 /nfs/dbraw/zinc/21/58/32/1042215832.db2.gz IEJUQEVJYDIELG-HUUCEWRRSA-N 2 1 323.440 4.105 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000278923901 1042216175 /nfs/dbraw/zinc/21/61/75/1042216175.db2.gz IEJUQEVJYDIELG-CABCVRRESA-N 2 1 323.440 4.105 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000643521706 1042222441 /nfs/dbraw/zinc/22/24/41/1042222441.db2.gz XQKBNJLKNZKRNR-ZJUUUORDSA-N 2 1 321.679 4.440 20 0 DIADMP CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)cs1 ZINC000820809603 1042229225 /nfs/dbraw/zinc/22/92/25/1042229225.db2.gz DSACGXNEXSBCHR-UONOGXRCSA-N 2 1 317.502 4.179 20 0 DIADMP CCc1nc([C@@H](C)[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)cs1 ZINC000820809604 1042229627 /nfs/dbraw/zinc/22/96/27/1042229627.db2.gz DSACGXNEXSBCHR-ZIAGYGMSSA-N 2 1 317.502 4.179 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001167838183 1042249799 /nfs/dbraw/zinc/24/97/99/1042249799.db2.gz RIHPEUGACWXKTK-GOSISDBHSA-N 2 1 318.505 4.090 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@@H](C)c1ccc(OC)cc1 ZINC001167838038 1042249891 /nfs/dbraw/zinc/24/98/91/1042249891.db2.gz PAIZIAFCNYUGAU-IRXDYDNUSA-N 2 1 306.494 4.199 20 0 DIADMP CC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000390964814 1042285457 /nfs/dbraw/zinc/28/54/57/1042285457.db2.gz OMWFXQIFIXUVNW-SFHVURJKSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000390964814 1042285460 /nfs/dbraw/zinc/28/54/60/1042285460.db2.gz OMWFXQIFIXUVNW-SFHVURJKSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(C(F)F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000279715290 1042333801 /nfs/dbraw/zinc/33/38/01/1042333801.db2.gz LQWGRIVASVRMEV-PBHICJAKSA-N 2 1 322.443 4.367 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)C1 ZINC000391478029 1042373990 /nfs/dbraw/zinc/37/39/90/1042373990.db2.gz XKHNXXJHLYUFCI-QIJZPMMNSA-N 2 1 314.517 4.279 20 0 DIADMP CC[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)cc1Cl ZINC000401765959 1042409784 /nfs/dbraw/zinc/40/97/84/1042409784.db2.gz GGSSUJLLGRFBLH-OAHLLOKOSA-N 2 1 312.244 4.010 20 0 DIADMP C[N@H+]1CCCC[C@H]1CCN1CCC(c2cccc(F)c2F)CC1 ZINC000576400990 1042486565 /nfs/dbraw/zinc/48/65/65/1042486565.db2.gz PFEIVULXZVJCPV-INIZCTEOSA-N 2 1 322.443 4.019 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000576400990 1042486571 /nfs/dbraw/zinc/48/65/71/1042486571.db2.gz PFEIVULXZVJCPV-INIZCTEOSA-N 2 1 322.443 4.019 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513494122 1042546616 /nfs/dbraw/zinc/54/66/16/1042546616.db2.gz GEBKAWBLIYMRKX-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000513524453 1042550141 /nfs/dbraw/zinc/55/01/41/1042550141.db2.gz GWQOYJWTLPDNLD-KBXCAEBGSA-N 2 1 322.443 4.196 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]C2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC000513545420 1042551952 /nfs/dbraw/zinc/55/19/52/1042551952.db2.gz QQGQINLDFJKZHC-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H](C[NH2+]Cc1ccc(-c2ccccc2)o1)C[NH+]1CCCCC1 ZINC000513642592 1042556076 /nfs/dbraw/zinc/55/60/76/1042556076.db2.gz IZGVRTOUJHXALG-QGZVFWFLSA-N 2 1 312.457 4.158 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@@H]2CCC[C@H]21 ZINC000513690596 1042567588 /nfs/dbraw/zinc/56/75/88/1042567588.db2.gz KYKHOAYLMPFFQL-SDDRHHMPSA-N 2 1 319.301 4.017 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@@H]2CCC[C@H]21 ZINC000513690596 1042567591 /nfs/dbraw/zinc/56/75/91/1042567591.db2.gz KYKHOAYLMPFFQL-SDDRHHMPSA-N 2 1 319.301 4.017 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CC2(C)C)CC1 ZINC000513713622 1042593416 /nfs/dbraw/zinc/59/34/16/1042593416.db2.gz QUKLINWNTCNICD-VIQWUECVSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@@H+](CC[C@@H]1CC[NH2+]C1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000420299793 1042598526 /nfs/dbraw/zinc/59/85/26/1042598526.db2.gz JGRUHHJTJFRQHY-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@H](c1cccs1)[N@@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000420321346 1042599189 /nfs/dbraw/zinc/59/91/89/1042599189.db2.gz RHUHSWNKLBAGSI-SJORKVTESA-N 2 1 314.498 4.311 20 0 DIADMP C[NH+]1CCC([NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)CC1 ZINC000237169303 1042626334 /nfs/dbraw/zinc/62/63/34/1042626334.db2.gz SRCGPEXAUBIQDX-UHFFFAOYSA-N 2 1 320.889 4.252 20 0 DIADMP C[C@H](C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1)C(C)(C)C ZINC000710754677 1042629105 /nfs/dbraw/zinc/62/91/05/1042629105.db2.gz RKRWAPSLHMQDKH-RLLQIKCJSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@H](C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1)C(C)(C)C ZINC000710754677 1042629107 /nfs/dbraw/zinc/62/91/07/1042629107.db2.gz RKRWAPSLHMQDKH-RLLQIKCJSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@H](C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1)C(C)(C)C ZINC000710754677 1042629110 /nfs/dbraw/zinc/62/91/10/1042629110.db2.gz RKRWAPSLHMQDKH-RLLQIKCJSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccncc1Cl ZINC000421819844 1042653377 /nfs/dbraw/zinc/65/33/77/1042653377.db2.gz JHQDORFJDLKERZ-HUUCEWRRSA-N 2 1 309.885 4.040 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3C[C@@H]4CC[C@@H](C4)C3)C2)cc1 ZINC000711147233 1042687339 /nfs/dbraw/zinc/68/73/39/1042687339.db2.gz RMMYOZLSDDSAAD-WOZUAGRISA-N 2 1 312.501 4.067 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422800516 1042690719 /nfs/dbraw/zinc/69/07/19/1042690719.db2.gz CBVFIIYIDWMZRE-JECHBYEQSA-N 2 1 318.367 4.083 20 0 DIADMP COc1ccc([C@H]([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C(C)C)cc1 ZINC000422791798 1042690843 /nfs/dbraw/zinc/69/08/43/1042690843.db2.gz VFDHUTNVBCVIKU-XUVXKRRUSA-N 2 1 310.441 4.127 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1Oc1ccccc1 ZINC000422878580 1042691788 /nfs/dbraw/zinc/69/17/88/1042691788.db2.gz KMJBITMLBMRACJ-HRBLRVMOSA-N 2 1 322.452 4.413 20 0 DIADMP Cc1cc([C@H]([NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C2CC2)ccc1F ZINC000423018131 1042695347 /nfs/dbraw/zinc/69/53/47/1042695347.db2.gz XXZVGGNSDLLDNX-XUVXKRRUSA-N 2 1 310.416 4.320 20 0 DIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423053934 1042697100 /nfs/dbraw/zinc/69/71/00/1042697100.db2.gz BGZJOKQDRLMADD-IAGOWNOFSA-N 2 1 320.358 4.248 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc21 ZINC000423190886 1042700278 /nfs/dbraw/zinc/70/02/78/1042700278.db2.gz RYVMNBWCUHFTKC-NHCUHLMSSA-N 2 1 323.484 4.036 20 0 DIADMP COc1cc([C@H](C)[NH2+]CC2([NH3+])CCCCCC2)ccc1SC ZINC000423201655 1042700761 /nfs/dbraw/zinc/70/07/61/1042700761.db2.gz PKDVKRUFGVWJBI-AWEZNQCLSA-N 2 1 322.518 4.119 20 0 DIADMP CCCC[C@H](C[NH3+])[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423298094 1042705921 /nfs/dbraw/zinc/70/59/21/1042705921.db2.gz NCZOHVGFXJAWGZ-QNWHQSFQSA-N 2 1 300.899 4.001 20 0 DIADMP C[C@H]([NH2+][C@H](C[NH3+])C1CCCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423501057 1042715648 /nfs/dbraw/zinc/71/56/48/1042715648.db2.gz KWONXVWQGFZTFN-SCUASFONSA-N 2 1 312.910 4.001 20 0 DIADMP C[N@@H+](Cc1ccccc1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC000513976096 1042764682 /nfs/dbraw/zinc/76/46/82/1042764682.db2.gz QCQPXIBUBJUKBP-OAQYLSRUSA-N 2 1 308.469 4.173 20 0 DIADMP C[NH+](Cc1ccccc1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC000513976096 1042764685 /nfs/dbraw/zinc/76/46/85/1042764685.db2.gz QCQPXIBUBJUKBP-OAQYLSRUSA-N 2 1 308.469 4.173 20 0 DIADMP C[NH+](Cc1ccccc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000513976096 1042764689 /nfs/dbraw/zinc/76/46/89/1042764689.db2.gz QCQPXIBUBJUKBP-OAQYLSRUSA-N 2 1 308.469 4.173 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000514005120 1042766627 /nfs/dbraw/zinc/76/66/27/1042766627.db2.gz BQLLWIFPKZXHGQ-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000514005120 1042766631 /nfs/dbraw/zinc/76/66/31/1042766631.db2.gz BQLLWIFPKZXHGQ-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000514248546 1042776930 /nfs/dbraw/zinc/77/69/30/1042776930.db2.gz RTDCCQMNEBFQFE-JYJNAYRXSA-N 2 1 314.464 4.055 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]C2CCC(C)(c3ccccc3)CC2)C1 ZINC000514692806 1042788020 /nfs/dbraw/zinc/78/80/20/1042788020.db2.gz FHFZPBJVWVXEKJ-KMFTYDHNSA-N 2 1 314.517 4.207 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144202 1042869126 /nfs/dbraw/zinc/86/91/26/1042869126.db2.gz JUIBCVXRBVIIQG-HKUYNNGSSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144202 1042869132 /nfs/dbraw/zinc/86/91/32/1042869132.db2.gz JUIBCVXRBVIIQG-HKUYNNGSSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C)cs2)cs1 ZINC000425947643 1042883083 /nfs/dbraw/zinc/88/30/83/1042883083.db2.gz VVMNKOMABQIBDM-NWDGAFQWSA-N 2 1 323.531 4.028 20 0 DIADMP CCCOc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000517537247 1042883739 /nfs/dbraw/zinc/88/37/39/1042883739.db2.gz KHKYKZTZPAXTAE-GOSISDBHSA-N 2 1 318.505 4.077 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167962454 1042883950 /nfs/dbraw/zinc/88/39/50/1042883950.db2.gz XZDPXCZDKZXPKM-VCZJPHHKSA-N 2 1 323.484 4.239 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3ccccc3c2)C1 ZINC000517536442 1042885757 /nfs/dbraw/zinc/88/57/57/1042885757.db2.gz IZOGIHDGRYGNJI-GOSISDBHSA-N 2 1 310.485 4.442 20 0 DIADMP Cc1cc(C)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c(C)c1 ZINC001167964675 1042920124 /nfs/dbraw/zinc/92/01/24/1042920124.db2.gz VXSKODNZTBHXOS-IHWFROFDSA-N 2 1 312.501 4.107 20 0 DIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cccc(F)c1 ZINC001167967457 1042954314 /nfs/dbraw/zinc/95/43/14/1042954314.db2.gz DRDFJBZBSQUMPV-YQQQUEKLSA-N 2 1 316.464 4.056 20 0 DIADMP CC(C)[PH+](CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C(C)C ZINC001167978567 1042973469 /nfs/dbraw/zinc/97/34/69/1042973469.db2.gz PDHPBSSTZRGMJC-YQQQUEKLSA-N 3 1 324.493 4.280 20 0 DIADMP CC(C)P(CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C(C)C ZINC001167978567 1042973471 /nfs/dbraw/zinc/97/34/71/1042973471.db2.gz PDHPBSSTZRGMJC-YQQQUEKLSA-N 2 1 324.493 4.280 20 0 DIADMP CC(C)P(CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C(C)C ZINC001167978567 1042973475 /nfs/dbraw/zinc/97/34/75/1042973475.db2.gz PDHPBSSTZRGMJC-YQQQUEKLSA-N 2 1 324.493 4.280 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC[N@@H+]1C ZINC000164399583 1042989662 /nfs/dbraw/zinc/98/96/62/1042989662.db2.gz QPIVLGKDGSUXDF-NIKGAXFTSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC[N@H+]1C ZINC000164399583 1042989664 /nfs/dbraw/zinc/98/96/64/1042989664.db2.gz QPIVLGKDGSUXDF-NIKGAXFTSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)c(F)c1 ZINC000467833452 1042995239 /nfs/dbraw/zinc/99/52/39/1042995239.db2.gz ZQRIVYFSZINLSE-LSDHHAIUSA-N 2 1 310.432 4.128 20 0 DIADMP c1ccc(C2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167987799 1042996923 /nfs/dbraw/zinc/99/69/23/1042996923.db2.gz NFHMDDWYMLTJSV-CBQGHPETSA-N 2 1 324.512 4.271 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cccc(-c3ccccc3)c2)C1 ZINC000520200808 1043024095 /nfs/dbraw/zinc/02/40/95/1043024095.db2.gz XDLGEOYRMXCZKM-LJQANCHMSA-N 2 1 308.469 4.175 20 0 DIADMP CN(CC[C@H]1CCCC[N@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323084 1043041281 /nfs/dbraw/zinc/04/12/81/1043041281.db2.gz JDXHDXRZSWSZET-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323084 1043041285 /nfs/dbraw/zinc/04/12/85/1043041285.db2.gz JDXHDXRZSWSZET-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323084 1043041292 /nfs/dbraw/zinc/04/12/92/1043041292.db2.gz JDXHDXRZSWSZET-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323084 1043041296 /nfs/dbraw/zinc/04/12/96/1043041296.db2.gz JDXHDXRZSWSZET-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cccc(C(F)(F)F)c1 ZINC000441323084 1043041300 /nfs/dbraw/zinc/04/13/00/1043041300.db2.gz JDXHDXRZSWSZET-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441395977 1043043340 /nfs/dbraw/zinc/04/33/40/1043043340.db2.gz BDDSLEJOGCMTNN-WMQCIHAUSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441395977 1043043344 /nfs/dbraw/zinc/04/33/44/1043043344.db2.gz BDDSLEJOGCMTNN-WMQCIHAUSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441395977 1043043348 /nfs/dbraw/zinc/04/33/48/1043043348.db2.gz BDDSLEJOGCMTNN-WMQCIHAUSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441395977 1043043353 /nfs/dbraw/zinc/04/33/53/1043043353.db2.gz BDDSLEJOGCMTNN-WMQCIHAUSA-N 2 1 310.485 4.013 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441393807 1043043852 /nfs/dbraw/zinc/04/38/52/1043043852.db2.gz IAZCJCNFQGTFDD-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441393807 1043043859 /nfs/dbraw/zinc/04/38/59/1043043859.db2.gz IAZCJCNFQGTFDD-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441393807 1043043863 /nfs/dbraw/zinc/04/38/63/1043043863.db2.gz IAZCJCNFQGTFDD-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441393807 1043043870 /nfs/dbraw/zinc/04/38/70/1043043870.db2.gz IAZCJCNFQGTFDD-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccncc1 ZINC000173923625 1043055731 /nfs/dbraw/zinc/05/57/31/1043055731.db2.gz NAVJHPYJFLSDBU-MSOLQXFVSA-N 2 1 323.484 4.307 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC(N1CCC[C@H]3CCCC[C@H]31)C2 ZINC001167994652 1043068783 /nfs/dbraw/zinc/06/87/83/1043068783.db2.gz IZEZTRSPNUNICN-LXKKFAQKSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001167994652 1043068791 /nfs/dbraw/zinc/06/87/91/1043068791.db2.gz IZEZTRSPNUNICN-LXKKFAQKSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001167994652 1043068799 /nfs/dbraw/zinc/06/87/99/1043068799.db2.gz IZEZTRSPNUNICN-LXKKFAQKSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@@H+]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001167994652 1043068807 /nfs/dbraw/zinc/06/88/07/1043068807.db2.gz IZEZTRSPNUNICN-LXKKFAQKSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@H+]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001167994652 1043068817 /nfs/dbraw/zinc/06/88/17/1043068817.db2.gz IZEZTRSPNUNICN-LXKKFAQKSA-N 2 1 302.506 4.046 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cccc(O)c2)cc1 ZINC000178756836 1043136838 /nfs/dbraw/zinc/13/68/38/1043136838.db2.gz ILEICEPHKYFVQY-LSDHHAIUSA-N 2 1 321.424 4.298 20 0 DIADMP COc1ccc(C2CCC([NH2+][C@H](C)C[N@H+](C)C(C)C)CC2)cc1 ZINC000520463898 1043138743 /nfs/dbraw/zinc/13/87/43/1043138743.db2.gz QBZCSIGEQAKNIO-LRYGQEGESA-N 2 1 318.505 4.040 20 0 DIADMP COc1ccc(C2CCC([NH2+][C@H](C)C[N@@H+](C)C(C)C)CC2)cc1 ZINC000520463898 1043138747 /nfs/dbraw/zinc/13/87/47/1043138747.db2.gz QBZCSIGEQAKNIO-LRYGQEGESA-N 2 1 318.505 4.040 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)nc1 ZINC000183191728 1043156735 /nfs/dbraw/zinc/15/67/35/1043156735.db2.gz LXZDGVNISDUFGM-IJEWVQPXSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(Cl)nc1 ZINC000183191728 1043156740 /nfs/dbraw/zinc/15/67/40/1043156740.db2.gz LXZDGVNISDUFGM-IJEWVQPXSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183191745 1043157441 /nfs/dbraw/zinc/15/74/41/1043157441.db2.gz LXZDGVNISDUFGM-SQWLQELKSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183191745 1043157443 /nfs/dbraw/zinc/15/74/43/1043157443.db2.gz LXZDGVNISDUFGM-SQWLQELKSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1cccc(SC(F)(F)F)c1 ZINC000866217173 1043161345 /nfs/dbraw/zinc/16/13/45/1043161345.db2.gz DIZAJRFZDBMBPA-LLVKDONJSA-N 2 1 318.408 4.043 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2sccc2OC)c1 ZINC000186153397 1043217474 /nfs/dbraw/zinc/21/74/74/1043217474.db2.gz AHZHCZHXBQTESI-CQSZACIVSA-N 2 1 318.486 4.059 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)C1 ZINC000427610495 1043243471 /nfs/dbraw/zinc/24/34/71/1043243471.db2.gz VAJIAZLGFABCRU-SJLPKXTDSA-N 2 1 318.530 4.162 20 0 DIADMP CCC(CC)C[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168006722 1043257491 /nfs/dbraw/zinc/25/74/91/1043257491.db2.gz OKAGVRNMDNWFNB-XEMDLRDOSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001168007010 1043260064 /nfs/dbraw/zinc/26/00/64/1043260064.db2.gz QKSVCTOBDVDLRT-NYUBLWNDSA-N 2 1 323.484 4.174 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001168007010 1043260072 /nfs/dbraw/zinc/26/00/72/1043260072.db2.gz QKSVCTOBDVDLRT-NYUBLWNDSA-N 2 1 323.484 4.174 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)cs2)c1 ZINC000193086630 1043279436 /nfs/dbraw/zinc/27/94/36/1043279436.db2.gz INXCHPRRCZVDMR-UHFFFAOYSA-N 2 1 308.878 4.143 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2sccc2Cl)c1 ZINC000193086583 1043280185 /nfs/dbraw/zinc/28/01/85/1043280185.db2.gz GLZINVLCIKHAED-UHFFFAOYSA-N 2 1 308.878 4.143 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)ccc1-c1ccccc1 ZINC000427862907 1043311136 /nfs/dbraw/zinc/31/11/36/1043311136.db2.gz IPDMOXWCQYXBHN-DYESRHJHSA-N 2 1 308.469 4.092 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC000665249805 1043315843 /nfs/dbraw/zinc/31/58/43/1043315843.db2.gz ZQLSROMKSHFYNQ-CYBMUJFWSA-N 2 1 315.486 4.041 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168012123 1043337767 /nfs/dbraw/zinc/33/77/67/1043337767.db2.gz WNHRIEDRHJXQJG-JLVBRIDZSA-N 2 1 322.443 4.063 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1F ZINC000268872452 1043337859 /nfs/dbraw/zinc/33/78/59/1043337859.db2.gz DFHJMTGJTOLUMF-CYBMUJFWSA-N 2 1 322.493 4.215 20 0 DIADMP c1ccc([C@H]2CC[C@H]2[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000665274445 1043359036 /nfs/dbraw/zinc/35/90/36/1043359036.db2.gz QINIKEMZXAPTOE-BQJUDKOJSA-N 2 1 306.453 4.016 20 0 DIADMP Cc1ccc([C@H]2CCCCC[N@@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000442383024 1043378311 /nfs/dbraw/zinc/37/83/11/1043378311.db2.gz PNJWXBCMSHHXSU-GOSISDBHSA-N 2 1 315.461 4.490 20 0 DIADMP Cc1ccc([C@H]2CCCCC[N@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000442383024 1043378322 /nfs/dbraw/zinc/37/83/22/1043378322.db2.gz PNJWXBCMSHHXSU-GOSISDBHSA-N 2 1 315.461 4.490 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2S1 ZINC000872017739 1043419297 /nfs/dbraw/zinc/41/92/97/1043419297.db2.gz FHLSRKSRLVNYNL-QGZVFWFLSA-N 2 1 316.514 4.219 20 0 DIADMP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000442839794 1043433528 /nfs/dbraw/zinc/43/35/28/1043433528.db2.gz YEPOLZCPJMAHAK-CIDNJEQPSA-N 2 1 314.464 4.053 20 0 DIADMP CC[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000872052202 1043435891 /nfs/dbraw/zinc/43/58/91/1043435891.db2.gz MGCWXPWOHZFVHA-HUUCEWRRSA-N 2 1 308.432 4.065 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000558161101 1043446812 /nfs/dbraw/zinc/44/68/12/1043446812.db2.gz WRLFCCCTKJCKKF-LHUKNYEISA-N 2 1 312.501 4.478 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc2[nH]ccc21 ZINC000349012643 1043486763 /nfs/dbraw/zinc/48/67/63/1043486763.db2.gz UABODHLKIJOSJB-UHFFFAOYSA-N 2 1 321.468 4.252 20 0 DIADMP C[C@@H]([NH2+]C1CCC2(CC2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000558408766 1043503640 /nfs/dbraw/zinc/50/36/40/1043503640.db2.gz HIBIVTOWSQAAOI-MJGOQNOKSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]([NH2+]CC1([NH+](C)C)CCCCC1)C1CCC(F)(F)CC1 ZINC000474062979 1043561577 /nfs/dbraw/zinc/56/15/77/1043561577.db2.gz DEQFWSHPFJNRCY-CQSZACIVSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@H]([NH2+]CC1([NH+](C)C)CCCCC1)C1CCC(F)(F)CC1 ZINC000474062978 1043561987 /nfs/dbraw/zinc/56/19/87/1043561987.db2.gz DEQFWSHPFJNRCY-AWEZNQCLSA-N 2 1 302.453 4.055 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)C2CCC(F)(F)CC2)C1 ZINC000474066010 1043566263 /nfs/dbraw/zinc/56/62/63/1043566263.db2.gz NOKCZPUGFYOLCS-JKSUJKDBSA-N 2 1 316.480 4.158 20 0 DIADMP Cc1occc1C[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168019228 1043566585 /nfs/dbraw/zinc/56/65/85/1043566585.db2.gz HPHHVMFABQGLID-HOTGVXAUSA-N 2 1 312.457 4.119 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCC23CCCC3)cc1F ZINC000353272625 1043595209 /nfs/dbraw/zinc/59/52/09/1043595209.db2.gz OGGJAXDHHOYFRK-GOSISDBHSA-N 2 1 313.420 4.132 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1csc(C(F)(F)F)c1 ZINC000926560625 1043598235 /nfs/dbraw/zinc/59/82/35/1043598235.db2.gz UAJFFXVNHDIOON-NSHDSACASA-N 2 1 320.424 4.292 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](CCC(C)C)c1ccoc1 ZINC000353401470 1043604536 /nfs/dbraw/zinc/60/45/36/1043604536.db2.gz IDPILBABTYMZPR-QAPCUYQASA-N 2 1 303.450 4.188 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccoc1 ZINC000353457020 1043608428 /nfs/dbraw/zinc/60/84/28/1043608428.db2.gz YBJCQWQMEKBAQC-LJQANCHMSA-N 2 1 304.478 4.221 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000443605256 1043612702 /nfs/dbraw/zinc/61/27/02/1043612702.db2.gz PTQQNFVDEAUHHR-KXBFYZLASA-N 2 1 318.892 4.135 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000443605256 1043612703 /nfs/dbraw/zinc/61/27/03/1043612703.db2.gz PTQQNFVDEAUHHR-KXBFYZLASA-N 2 1 318.892 4.135 20 0 DIADMP C[N@@H+](CCCn1ccnc1)CC(c1ccccc1)c1ccccc1 ZINC000353525281 1043613549 /nfs/dbraw/zinc/61/35/49/1043613549.db2.gz XQSSYBGPAVLWEW-UHFFFAOYSA-N 2 1 319.452 4.037 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000443613018 1043617637 /nfs/dbraw/zinc/61/76/37/1043617637.db2.gz CEPNNUXEQWWARV-CVEARBPZSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000443613018 1043617644 /nfs/dbraw/zinc/61/76/44/1043617644.db2.gz CEPNNUXEQWWARV-CVEARBPZSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCCC(F)(F)F)C1 ZINC000443613018 1043617652 /nfs/dbraw/zinc/61/76/52/1043617652.db2.gz CEPNNUXEQWWARV-CVEARBPZSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000443613018 1043617659 /nfs/dbraw/zinc/61/76/59/1043617659.db2.gz CEPNNUXEQWWARV-CVEARBPZSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000926811240 1043638210 /nfs/dbraw/zinc/63/82/10/1043638210.db2.gz YOKNONYYZGRTNW-KUHUBIRLSA-N 2 1 318.411 4.249 20 0 DIADMP C[C@H](Nc1ccc([NH+]2CCC(C)CC2)cc1)C1CC[NH+](C)CC1 ZINC000777612976 1043667850 /nfs/dbraw/zinc/66/78/50/1043667850.db2.gz FAMAFMJRFARBRX-KRWDZBQOSA-N 2 1 315.505 4.065 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ccc(F)cc2)cc1 ZINC000354175450 1043687007 /nfs/dbraw/zinc/68/70/07/1043687007.db2.gz AZBGWRLXRKYOIG-HNNXBMFYSA-N 2 1 323.415 4.213 20 0 DIADMP [NH3+]CCCCC[N@@H+]1CC=C(c2cc(Cl)cc(Cl)c2)CC1 ZINC001205002053 1043704557 /nfs/dbraw/zinc/70/45/57/1043704557.db2.gz YJOZRWXYQVWXDO-UHFFFAOYSA-N 2 1 313.272 4.212 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@@H+]1Cc1ccccc1 ZINC000354546271 1043705683 /nfs/dbraw/zinc/70/56/83/1043705683.db2.gz UEWMYFKFMMAWPL-OXQOHEQNSA-N 2 1 321.468 4.035 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@H+]1Cc1ccccc1 ZINC000354546271 1043705696 /nfs/dbraw/zinc/70/56/96/1043705696.db2.gz UEWMYFKFMMAWPL-OXQOHEQNSA-N 2 1 321.468 4.035 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474269047 1043718936 /nfs/dbraw/zinc/71/89/36/1043718936.db2.gz YSOLGJLFVUQJRT-UYAOXDASSA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474269047 1043718944 /nfs/dbraw/zinc/71/89/44/1043718944.db2.gz YSOLGJLFVUQJRT-UYAOXDASSA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474269047 1043718953 /nfs/dbraw/zinc/71/89/53/1043718953.db2.gz YSOLGJLFVUQJRT-UYAOXDASSA-N 2 1 302.506 4.090 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC000354825458 1043720669 /nfs/dbraw/zinc/72/06/69/1043720669.db2.gz CGCFQNWCZDAYDI-HUUCEWRRSA-N 2 1 315.436 4.119 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC000354825458 1043720675 /nfs/dbraw/zinc/72/06/75/1043720675.db2.gz CGCFQNWCZDAYDI-HUUCEWRRSA-N 2 1 315.436 4.119 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168031670 1043724447 /nfs/dbraw/zinc/72/44/47/1043724447.db2.gz BFYWRJGBVCLJHC-XEMDLRDOSA-N 2 1 314.517 4.454 20 0 DIADMP CCCCN(C)c1ccc(N[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000777683703 1043742175 /nfs/dbraw/zinc/74/21/75/1043742175.db2.gz GSAXHXLJFLHJIH-LPHOPBHVSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@H+](C)c1ccc(N[C@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000777683703 1043742180 /nfs/dbraw/zinc/74/21/80/1043742180.db2.gz GSAXHXLJFLHJIH-LPHOPBHVSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@@H+](C)c1ccc(N[C@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000777683703 1043742194 /nfs/dbraw/zinc/74/21/94/1043742194.db2.gz GSAXHXLJFLHJIH-LPHOPBHVSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000777683703 1043742208 /nfs/dbraw/zinc/74/22/08/1043742208.db2.gz GSAXHXLJFLHJIH-LPHOPBHVSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000777683703 1043742218 /nfs/dbraw/zinc/74/22/18/1043742218.db2.gz GSAXHXLJFLHJIH-LPHOPBHVSA-N 2 1 303.494 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(C[NH+](C)C)CCCC2)c2ccsc2S1 ZINC000355055157 1043743449 /nfs/dbraw/zinc/74/34/49/1043743449.db2.gz DDGGZIUZRVMTBI-HIFRSBDPSA-N 2 1 324.559 4.385 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123946 1043747380 /nfs/dbraw/zinc/74/73/80/1043747380.db2.gz GSSNUOZRGQIBIN-RIFZZMRRSA-N 2 1 309.457 4.033 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123946 1043747389 /nfs/dbraw/zinc/74/73/89/1043747389.db2.gz GSSNUOZRGQIBIN-RIFZZMRRSA-N 2 1 309.457 4.033 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474464202 1043791881 /nfs/dbraw/zinc/79/18/81/1043791881.db2.gz LYPKVBNACQFSQQ-HZSPNIEDSA-N 2 1 314.926 4.213 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2cccc3cnccc32)CC1 ZINC000877794510 1043799498 /nfs/dbraw/zinc/79/94/98/1043799498.db2.gz MOJSPDVSPRJTQF-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCCC2(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039204 1043851777 /nfs/dbraw/zinc/85/17/77/1043851777.db2.gz CGPMSNDJGHEFCT-IAGOWNOFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CC([N@H+]2CCCC2(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039204 1043851791 /nfs/dbraw/zinc/85/17/91/1043851791.db2.gz CGPMSNDJGHEFCT-IAGOWNOFSA-N 2 1 300.490 4.302 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000474713743 1043896605 /nfs/dbraw/zinc/89/66/05/1043896605.db2.gz PXZDOTRDVVRBOI-AZUAARDMSA-N 2 1 302.506 4.136 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)C1CCCCC1 ZINC000474729815 1043903527 /nfs/dbraw/zinc/90/35/27/1043903527.db2.gz GUDGEZOTJRTLRC-UYAOXDASSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)C1CCCCC1 ZINC000474729812 1043903732 /nfs/dbraw/zinc/90/37/32/1043903732.db2.gz GUDGEZOTJRTLRC-AZUAARDMSA-N 2 1 314.517 4.109 20 0 DIADMP CC1CC[NH+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168041293 1043904052 /nfs/dbraw/zinc/90/40/52/1043904052.db2.gz RNBNWHMVMNCJHE-ROUUACIJSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC000474794540 1043918712 /nfs/dbraw/zinc/91/87/12/1043918712.db2.gz JYPIFNPIEVIXHH-ICSRJNTNSA-N 2 1 324.553 4.070 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)C1CCSCC1)[N@@H+](C)Cc1ccccc1 ZINC000474811292 1043924036 /nfs/dbraw/zinc/92/40/36/1043924036.db2.gz VRYGSXYOJNZUOQ-IAGOWNOFSA-N 2 1 320.546 4.018 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](C2CC(OC(C)(C)C)C2)CC1 ZINC000880254609 1044024548 /nfs/dbraw/zinc/02/45/48/1044024548.db2.gz IRPMOERIDNGBNP-UHFFFAOYSA-N 2 1 322.537 4.063 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000562023597 1044049234 /nfs/dbraw/zinc/04/92/34/1044049234.db2.gz LWMQOTBIKBMUTR-NXHRZFHOSA-N 2 1 320.546 4.374 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000562023597 1044049250 /nfs/dbraw/zinc/04/92/50/1044049250.db2.gz LWMQOTBIKBMUTR-NXHRZFHOSA-N 2 1 320.546 4.374 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000562023595 1044049630 /nfs/dbraw/zinc/04/96/30/1044049630.db2.gz LWMQOTBIKBMUTR-JQHSSLGASA-N 2 1 320.546 4.374 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000562023595 1044049641 /nfs/dbraw/zinc/04/96/41/1044049641.db2.gz LWMQOTBIKBMUTR-JQHSSLGASA-N 2 1 320.546 4.374 20 0 DIADMP CC[C@H]1CC[C@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000562042138 1044053397 /nfs/dbraw/zinc/05/33/97/1044053397.db2.gz USORTGXMNKERRN-OXJNMPFZSA-N 2 1 312.457 4.190 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000281133363 1044098962 /nfs/dbraw/zinc/09/89/62/1044098962.db2.gz YPMVEIVDNBDIKG-FQEVSTJZSA-N 2 1 323.484 4.070 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3occc32)CC1 ZINC000359101098 1044130591 /nfs/dbraw/zinc/13/05/91/1044130591.db2.gz CQYTYCFLTYKVJS-AYOQOUSVSA-N 2 1 316.489 4.290 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000714784018 1044144308 /nfs/dbraw/zinc/14/43/08/1044144308.db2.gz SIWANOXSXAOASP-OTNPHJDUSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000714784018 1044144315 /nfs/dbraw/zinc/14/43/15/1044144315.db2.gz SIWANOXSXAOASP-OTNPHJDUSA-N 2 1 312.501 4.065 20 0 DIADMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccsc2Cl)c1 ZINC000359770954 1044199419 /nfs/dbraw/zinc/19/94/19/1044199419.db2.gz WNFLWYRVPULHAC-UHFFFAOYSA-N 2 1 308.878 4.143 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccsc2Cl)c1 ZINC000359770954 1044199425 /nfs/dbraw/zinc/19/94/25/1044199425.db2.gz WNFLWYRVPULHAC-UHFFFAOYSA-N 2 1 308.878 4.143 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCOc2ccccc21 ZINC000359949739 1044218829 /nfs/dbraw/zinc/21/88/29/1044218829.db2.gz LMCYDCRDXUNHSX-MJGOQNOKSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCc2sccc21 ZINC000359949319 1044219714 /nfs/dbraw/zinc/21/97/14/1044219714.db2.gz IJVSNMMQKBAIPZ-RDJZCZTQSA-N 2 1 306.519 4.370 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1OC ZINC000360029635 1044227552 /nfs/dbraw/zinc/22/75/52/1044227552.db2.gz QEUQSCIGKJNCEU-VYDXJSESSA-N 2 1 322.880 4.016 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1OC ZINC000360029635 1044227564 /nfs/dbraw/zinc/22/75/64/1044227564.db2.gz QEUQSCIGKJNCEU-VYDXJSESSA-N 2 1 322.880 4.016 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000883250993 1044244990 /nfs/dbraw/zinc/24/49/90/1044244990.db2.gz XWDXXZZAGQADHI-WBVHZDCISA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000883250993 1044245000 /nfs/dbraw/zinc/24/50/00/1044245000.db2.gz XWDXXZZAGQADHI-WBVHZDCISA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2ccsc2S1 ZINC000360494203 1044276259 /nfs/dbraw/zinc/27/62/59/1044276259.db2.gz DBDFNSPTAZFGPO-WBMJQRKESA-N 2 1 322.543 4.280 20 0 DIADMP C[C@H](C[N@H+]1CCCC12CC[NH+](C)CC2)c1cccc(Cl)c1 ZINC000475130728 1044281208 /nfs/dbraw/zinc/28/12/08/1044281208.db2.gz PAUAUKGDWNMKJI-OAHLLOKOSA-N 2 1 306.881 4.004 20 0 DIADMP C[C@@H]1C[N@@H+](C2C[C@H](C)N(Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056844 1044287381 /nfs/dbraw/zinc/28/73/81/1044287381.db2.gz JEBNIVQYUFXMQX-BZSNNMDCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[N@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056844 1044287392 /nfs/dbraw/zinc/28/73/92/1044287392.db2.gz JEBNIVQYUFXMQX-BZSNNMDCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056844 1044287400 /nfs/dbraw/zinc/28/74/00/1044287400.db2.gz JEBNIVQYUFXMQX-BZSNNMDCSA-N 2 1 312.501 4.302 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCC(C)(C)c2ccccc21 ZINC000360654783 1044295604 /nfs/dbraw/zinc/29/56/04/1044295604.db2.gz AFUGYBJWBSLZHT-LJQANCHMSA-N 2 1 311.473 4.374 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H](c1cccnc1)C1CCC1)C(C)C ZINC000360657166 1044296872 /nfs/dbraw/zinc/29/68/72/1044296872.db2.gz MMRMBESPVQAXDV-IBGZPJMESA-N 2 1 303.494 4.021 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475297521 1044348696 /nfs/dbraw/zinc/34/86/96/1044348696.db2.gz XNABGCAMNZMLHT-DJAVKIJBSA-N 2 1 320.480 4.202 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069956 1044353380 /nfs/dbraw/zinc/35/33/80/1044353380.db2.gz SNQJKWMZHUJLGE-YCPHGPKFSA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069956 1044353394 /nfs/dbraw/zinc/35/33/94/1044353394.db2.gz SNQJKWMZHUJLGE-YCPHGPKFSA-N 2 1 324.559 4.384 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1cc(C)ccc1C ZINC000348261546 1044378452 /nfs/dbraw/zinc/37/84/52/1044378452.db2.gz GMWLXCPDQRGQSZ-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1cc(C)ccc1C ZINC000348261546 1044378466 /nfs/dbraw/zinc/37/84/66/1044378466.db2.gz GMWLXCPDQRGQSZ-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](CF)C2)C[C@H](C)N1Cc1ccccc1 ZINC001168062348 1044380445 /nfs/dbraw/zinc/38/04/45/1044380445.db2.gz KDYYYMYLXKBWOT-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](CF)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168062348 1044380461 /nfs/dbraw/zinc/38/04/61/1044380461.db2.gz KDYYYMYLXKBWOT-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](CF)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168062348 1044380476 /nfs/dbraw/zinc/38/04/76/1044380476.db2.gz KDYYYMYLXKBWOT-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168062348 1044380488 /nfs/dbraw/zinc/38/04/88/1044380488.db2.gz KDYYYMYLXKBWOT-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168062348 1044380503 /nfs/dbraw/zinc/38/05/03/1044380503.db2.gz KDYYYMYLXKBWOT-HNJRGHQBSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(CF)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168062705 1044386943 /nfs/dbraw/zinc/38/69/43/1044386943.db2.gz LTEAVDHKKQDDFW-XEMDLRDOSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(CF)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168062705 1044386951 /nfs/dbraw/zinc/38/69/51/1044386951.db2.gz LTEAVDHKKQDDFW-XEMDLRDOSA-N 2 1 318.480 4.110 20 0 DIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1cscc1C(F)(F)F)C(C)(C)C ZINC000564527770 1044389316 /nfs/dbraw/zinc/38/93/16/1044389316.db2.gz GELWTHNVOUKMKJ-CYBMUJFWSA-N 2 1 322.440 4.223 20 0 DIADMP C[C@H]1CC([N@H+]2CCC3(CCC3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168065931 1044416994 /nfs/dbraw/zinc/41/69/94/1044416994.db2.gz ZGSHKNQXSHZMLW-ROUUACIJSA-N 2 1 312.501 4.304 20 0 DIADMP c1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cs1 ZINC000111391658 1044433440 /nfs/dbraw/zinc/43/34/40/1044433440.db2.gz CHEWMZLAPHYLMR-YQQQUEKLSA-N 2 1 312.482 4.033 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000565563623 1044444258 /nfs/dbraw/zinc/44/42/58/1044444258.db2.gz SRLDNCOYXKUSMF-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000565563623 1044444267 /nfs/dbraw/zinc/44/42/67/1044444267.db2.gz SRLDNCOYXKUSMF-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563623 1044444273 /nfs/dbraw/zinc/44/42/73/1044444273.db2.gz SRLDNCOYXKUSMF-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563623 1044444282 /nfs/dbraw/zinc/44/42/82/1044444282.db2.gz SRLDNCOYXKUSMF-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000566039413 1044470447 /nfs/dbraw/zinc/47/04/47/1044470447.db2.gz OVMONCXDCOGDLM-VAMGGRTRSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H](C)c2ccc(Cl)cc2)C1 ZINC000566587742 1044501549 /nfs/dbraw/zinc/50/15/49/1044501549.db2.gz FNJBFTCLAIOGEW-HRCADAONSA-N 2 1 308.897 4.152 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475575429 1044515067 /nfs/dbraw/zinc/51/50/67/1044515067.db2.gz ZECZARKQAXBSPH-RVDMUPIBSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc2cc(Cl)ccc2o1 ZINC000295984436 1044578944 /nfs/dbraw/zinc/57/89/44/1044578944.db2.gz PAHCSWLYYMCKPB-RJPYNODJSA-N 2 1 318.848 4.362 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2cc(Cl)ccc2o1 ZINC000295984436 1044578959 /nfs/dbraw/zinc/57/89/59/1044578959.db2.gz PAHCSWLYYMCKPB-RJPYNODJSA-N 2 1 318.848 4.362 20 0 DIADMP CC[N@H+](CCCc1c[nH+]cn1C)[C@H](C)c1cc2ccccc2o1 ZINC000567747973 1044582863 /nfs/dbraw/zinc/58/28/63/1044582863.db2.gz GICHBUXHZIXNCX-OAHLLOKOSA-N 2 1 311.429 4.182 20 0 DIADMP CC[N@@H+](CCCc1c[nH+]cn1C)[C@H](C)c1cc2ccccc2o1 ZINC000567747973 1044582875 /nfs/dbraw/zinc/58/28/75/1044582875.db2.gz GICHBUXHZIXNCX-OAHLLOKOSA-N 2 1 311.429 4.182 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000567966218 1044594016 /nfs/dbraw/zinc/59/40/16/1044594016.db2.gz VAAXMJSJRFJESL-QRNKSROTSA-N 2 1 320.443 4.064 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315277 1044600869 /nfs/dbraw/zinc/60/08/69/1044600869.db2.gz JQJNSEYCOPNHHC-QZTJIDSGSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315277 1044600872 /nfs/dbraw/zinc/60/08/72/1044600872.db2.gz JQJNSEYCOPNHHC-QZTJIDSGSA-N 2 1 318.480 4.331 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC000444692730 1044605387 /nfs/dbraw/zinc/60/53/87/1044605387.db2.gz MYDSYPULSQXITR-GOSISDBHSA-N 2 1 314.498 4.331 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C3CCC4(CC4)CC3)CC23CC3)cc1 ZINC000568748396 1044645938 /nfs/dbraw/zinc/64/59/38/1044645938.db2.gz GOSMRKLYQIGQEI-HXUWFJFHSA-N 2 1 324.512 4.496 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C3CCC4(CC4)CC3)CC23CC3)cc1 ZINC000568748396 1044645940 /nfs/dbraw/zinc/64/59/40/1044645940.db2.gz GOSMRKLYQIGQEI-HXUWFJFHSA-N 2 1 324.512 4.496 20 0 DIADMP C[C@@H]1CC[C@H]1[NH2+]CC1([N@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233199 1044670186 /nfs/dbraw/zinc/67/01/86/1044670186.db2.gz NYRSJIOLMACFBO-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CC[C@H]1[NH2+]CC1([N@@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233199 1044670195 /nfs/dbraw/zinc/67/01/95/1044670195.db2.gz NYRSJIOLMACFBO-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1nccc(NCC2([N@@H+](C)Cc3ccccc3)CCCCC2)n1 ZINC000714237919 1044671014 /nfs/dbraw/zinc/67/10/14/1044671014.db2.gz DHZSBEHDRVQCPV-UHFFFAOYSA-N 2 1 324.472 4.032 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3ccccc3Cl)CC2)[nH+]c1C ZINC000886660691 1044676226 /nfs/dbraw/zinc/67/62/26/1044676226.db2.gz CYKUBFWSFLSZDB-UHFFFAOYSA-N 2 1 303.837 4.060 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@H](C)c3ccc(F)cc3)CC2)[nH+]c1C ZINC000886667879 1044676261 /nfs/dbraw/zinc/67/62/61/1044676261.db2.gz KDKIXCXJSPEXGQ-CQSZACIVSA-N 2 1 301.409 4.106 20 0 DIADMP CSc1ccc(C[NH+]2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)cc1 ZINC000886670530 1044677367 /nfs/dbraw/zinc/67/73/67/1044677367.db2.gz QXINBBKSFABJBR-UHFFFAOYSA-N 2 1 315.486 4.128 20 0 DIADMP CC(C)[N@@H+](C)CC1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000524156164 1044752578 /nfs/dbraw/zinc/75/25/78/1044752578.db2.gz OEGAYANXQDQXFZ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000524156164 1044752593 /nfs/dbraw/zinc/75/25/93/1044752593.db2.gz OEGAYANXQDQXFZ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000524156164 1044752607 /nfs/dbraw/zinc/75/26/07/1044752607.db2.gz OEGAYANXQDQXFZ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000367997489 1044760564 /nfs/dbraw/zinc/76/05/64/1044760564.db2.gz LXIFBYMCRPTSBS-QINHECLXSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCS2 ZINC000368753952 1044787418 /nfs/dbraw/zinc/78/74/18/1044787418.db2.gz NWKXYHUMTWLKST-LZLYRXPVSA-N 2 1 316.514 4.057 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000571096811 1044797690 /nfs/dbraw/zinc/79/76/90/1044797690.db2.gz UBGOKCKHXHXZGU-OTWHNJEPSA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000571096811 1044797702 /nfs/dbraw/zinc/79/77/02/1044797702.db2.gz UBGOKCKHXHXZGU-OTWHNJEPSA-N 2 1 317.521 4.126 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@H]1c1ccccc1 ZINC000571424824 1044812661 /nfs/dbraw/zinc/81/26/61/1044812661.db2.gz UAXWVWWMEZCDIQ-YADHBBJMSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@H]1c1ccccc1 ZINC000571424824 1044812683 /nfs/dbraw/zinc/81/26/83/1044812683.db2.gz UAXWVWWMEZCDIQ-YADHBBJMSA-N 2 1 320.480 4.489 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(C)cc2C)cn1 ZINC000126435921 1044813937 /nfs/dbraw/zinc/81/39/37/1044813937.db2.gz XMKOVMIZEMNGEZ-MRXNPFEDSA-N 2 1 320.440 4.043 20 0 DIADMP C[C@@H](C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890165 1044882963 /nfs/dbraw/zinc/88/29/63/1044882963.db2.gz QKADYBYNVRGXAA-DOTOQJQBSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890165 1044882982 /nfs/dbraw/zinc/88/29/82/1044882982.db2.gz QKADYBYNVRGXAA-DOTOQJQBSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@@H](C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890165 1044882994 /nfs/dbraw/zinc/88/29/94/1044882994.db2.gz QKADYBYNVRGXAA-DOTOQJQBSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@@H](C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890165 1044883011 /nfs/dbraw/zinc/88/30/11/1044883011.db2.gz QKADYBYNVRGXAA-DOTOQJQBSA-N 2 1 320.908 4.107 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCC12CCC2 ZINC000337469410 1044905348 /nfs/dbraw/zinc/90/53/48/1044905348.db2.gz MYNILYSRUKHSAR-FQEVSTJZSA-N 2 1 324.468 4.334 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC(C)(C)C)cc1 ZINC000372806227 1044927340 /nfs/dbraw/zinc/92/73/40/1044927340.db2.gz UHJPYKIRDVIUAT-CGTJXYLNSA-N 2 1 316.489 4.141 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC000574561696 1044959702 /nfs/dbraw/zinc/95/97/02/1044959702.db2.gz SGHGIIOGUZPPPI-CHWSQXEVSA-N 2 1 302.915 4.041 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC000574561696 1044959722 /nfs/dbraw/zinc/95/97/22/1044959722.db2.gz SGHGIIOGUZPPPI-CHWSQXEVSA-N 2 1 302.915 4.041 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC000574761761 1044968425 /nfs/dbraw/zinc/96/84/25/1044968425.db2.gz NIECAVKKWCNAMN-SJLPKXTDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC000574761761 1044968436 /nfs/dbraw/zinc/96/84/36/1044968436.db2.gz NIECAVKKWCNAMN-SJLPKXTDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000373385865 1044974470 /nfs/dbraw/zinc/97/44/70/1044974470.db2.gz FZNFONCIMIKWKC-LTCOOKNTSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(F)c2ccccc21 ZINC000575213515 1044992873 /nfs/dbraw/zinc/99/28/73/1044992873.db2.gz FQAWGIADOMHKDV-LSDHHAIUSA-N 2 1 300.421 4.114 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000575336981 1044994873 /nfs/dbraw/zinc/99/48/73/1044994873.db2.gz XJYSPCXZYMUARJ-BRWVUGGUSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000575336981 1044994888 /nfs/dbraw/zinc/99/48/88/1044994888.db2.gz XJYSPCXZYMUARJ-BRWVUGGUSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000575336981 1044994900 /nfs/dbraw/zinc/99/49/00/1044994900.db2.gz XJYSPCXZYMUARJ-BRWVUGGUSA-N 2 1 314.464 4.008 20 0 DIADMP Cc1ccncc1C[N@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411666081 1045022231 /nfs/dbraw/zinc/02/22/31/1045022231.db2.gz LIEXYTLDPOUWQK-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP Cc1ccncc1C[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411666081 1045022242 /nfs/dbraw/zinc/02/22/42/1045022242.db2.gz LIEXYTLDPOUWQK-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP c1ccc2cc(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000525274152 1045023633 /nfs/dbraw/zinc/02/36/33/1045023633.db2.gz TYYLVIMCZADIQC-IBGZPJMESA-N 2 1 308.469 4.148 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446761794 1045037552 /nfs/dbraw/zinc/03/75/52/1045037552.db2.gz ZZEYRTSTUASSGI-HXUWFJFHSA-N 2 1 300.490 4.300 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@@H]2CCC[C@H]21 ZINC000576774300 1045079311 /nfs/dbraw/zinc/07/93/11/1045079311.db2.gz DUBREGYITUNZGU-XFUTXVRSSA-N 2 1 318.892 4.048 20 0 DIADMP Cc1ccc(-c2ccc(CN(C)[C@H]3CC[N@@H+](C)C[C@H]3C)o2)cc1 ZINC000577026509 1045094287 /nfs/dbraw/zinc/09/42/87/1045094287.db2.gz PWGNWTLROVAVRO-APWZRJJASA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(CN(C)[C@H]3CC[N@H+](C)C[C@H]3C)o2)cc1 ZINC000577026509 1045094304 /nfs/dbraw/zinc/09/43/04/1045094304.db2.gz PWGNWTLROVAVRO-APWZRJJASA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@H]3CC[N@@H+](C)C[C@H]3C)o2)cc1 ZINC000577026509 1045094317 /nfs/dbraw/zinc/09/43/17/1045094317.db2.gz PWGNWTLROVAVRO-APWZRJJASA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@H]3CC[N@H+](C)C[C@H]3C)o2)cc1 ZINC000577026509 1045094332 /nfs/dbraw/zinc/09/43/32/1045094332.db2.gz PWGNWTLROVAVRO-APWZRJJASA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CC[NH+](C)C[C@H]3C)o2)cc1 ZINC000577026509 1045094345 /nfs/dbraw/zinc/09/43/45/1045094345.db2.gz PWGNWTLROVAVRO-APWZRJJASA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)[C@H]3CC[NH+](C)C[C@H]3C)o2)cc1 ZINC000577026509 1045094358 /nfs/dbraw/zinc/09/43/58/1045094358.db2.gz PWGNWTLROVAVRO-APWZRJJASA-N 2 1 312.457 4.027 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447594173 1045155321 /nfs/dbraw/zinc/15/53/21/1045155321.db2.gz XIOHIFABYXFNPU-RZXSNQJFSA-N 2 1 312.501 4.350 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c2)cc1 ZINC000447580685 1045158946 /nfs/dbraw/zinc/15/89/46/1045158946.db2.gz PZAAKZVVNIEPBU-FRIKZZABSA-N 2 1 320.480 4.377 20 0 DIADMP C[C@@H](CC[NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccc1 ZINC000447822216 1045177941 /nfs/dbraw/zinc/17/79/41/1045177941.db2.gz PCOMNXWAAUOCSZ-RBUKOAKNSA-N 2 1 302.506 4.424 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ncc(C(C)(C)C)s2)C1 ZINC000447935795 1045192675 /nfs/dbraw/zinc/19/26/75/1045192675.db2.gz JUPLMPUBRZICAQ-HNNXBMFYSA-N 2 1 323.550 4.042 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ncccc1Cl ZINC000924949533 1045215216 /nfs/dbraw/zinc/21/52/16/1045215216.db2.gz GUUJUNVBQKVFBX-XJKSGUPXSA-N 2 1 320.868 4.007 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000527637695 1045243438 /nfs/dbraw/zinc/24/34/38/1045243438.db2.gz OAJXVUIWTBPZHX-DFQSSKMNSA-N 2 1 312.501 4.177 20 0 DIADMP Fc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC000578905127 1045278793 /nfs/dbraw/zinc/27/87/93/1045278793.db2.gz PJGUUGKHXIRISS-HXUWFJFHSA-N 2 1 316.464 4.200 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000579010498 1045288065 /nfs/dbraw/zinc/28/80/65/1045288065.db2.gz AAQSWHYNNPUKEP-LMCOJAPRSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000579010498 1045288070 /nfs/dbraw/zinc/28/80/70/1045288070.db2.gz AAQSWHYNNPUKEP-LMCOJAPRSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)C[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000579135643 1045295500 /nfs/dbraw/zinc/29/55/00/1045295500.db2.gz SOCOPFQOHUSYIX-DQXYTYHJSA-N 2 1 320.908 4.500 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352745 1045308731 /nfs/dbraw/zinc/30/87/31/1045308731.db2.gz JFTYHEIYFKIFMU-SFTDATJTSA-N 2 1 324.512 4.352 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352745 1045308738 /nfs/dbraw/zinc/30/87/38/1045308738.db2.gz JFTYHEIYFKIFMU-SFTDATJTSA-N 2 1 324.512 4.352 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC000449090197 1045347730 /nfs/dbraw/zinc/34/77/30/1045347730.db2.gz MKTSXCHGMVCCBV-KXBFYZLASA-N 2 1 318.892 4.207 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@@H+]1C ZINC000449177448 1045354905 /nfs/dbraw/zinc/35/49/05/1045354905.db2.gz VQHWUIFEJMBDGW-ZMYBRWDISA-N 2 1 318.892 4.348 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@H+]1C ZINC000449177448 1045354911 /nfs/dbraw/zinc/35/49/11/1045354911.db2.gz VQHWUIFEJMBDGW-ZMYBRWDISA-N 2 1 318.892 4.348 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CC2)cc1Cl ZINC000449448140 1045394604 /nfs/dbraw/zinc/39/46/04/1045394604.db2.gz FGSXHNZPXNQZEB-RVKKMQEKSA-N 2 1 322.855 4.147 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000449561438 1045415000 /nfs/dbraw/zinc/41/50/00/1045415000.db2.gz VAQFLGQXTZAUKB-ONWWLPHZSA-N 2 1 324.921 4.108 20 0 DIADMP CC[N@@H+](CCCCn1ccnc1C)[C@H](C)c1ccc(F)cc1 ZINC000119420895 1045427037 /nfs/dbraw/zinc/42/70/37/1045427037.db2.gz RVASZJICJHPUJA-OAHLLOKOSA-N 2 1 303.425 4.194 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)[C@H](C)c1ccc(F)cc1 ZINC000119420895 1045427040 /nfs/dbraw/zinc/42/70/40/1045427040.db2.gz RVASZJICJHPUJA-OAHLLOKOSA-N 2 1 303.425 4.194 20 0 DIADMP CC[N@@H+](CCCCn1cc[nH+]c1C)[C@H](C)c1ccc(F)cc1 ZINC000119420895 1045427043 /nfs/dbraw/zinc/42/70/43/1045427043.db2.gz RVASZJICJHPUJA-OAHLLOKOSA-N 2 1 303.425 4.194 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)CC[N@@H+]1C ZINC000389742334 1045427500 /nfs/dbraw/zinc/42/75/00/1045427500.db2.gz SSRRRDPDYPHRTP-ZRSLWSEBSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)CC[N@H+]1C ZINC000389742334 1045427502 /nfs/dbraw/zinc/42/75/02/1045427502.db2.gz SSRRRDPDYPHRTP-ZRSLWSEBSA-N 2 1 300.490 4.031 20 0 DIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)C2)c1 ZINC000449778532 1045436635 /nfs/dbraw/zinc/43/66/35/1045436635.db2.gz WPAFEZGPQTXVTA-BVBHFADKSA-N 2 1 318.892 4.193 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC000449791590 1045438939 /nfs/dbraw/zinc/43/89/39/1045438939.db2.gz PNWUUDOPSVCLCB-MAUKXSAKSA-N 2 1 306.881 4.050 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CC(F)(F)C1 ZINC000529547223 1045492935 /nfs/dbraw/zinc/49/29/35/1045492935.db2.gz VYUCIYVTAKRGGN-MPGHIAIKSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CC(F)(F)C1 ZINC000529547223 1045492939 /nfs/dbraw/zinc/49/29/39/1045492939.db2.gz VYUCIYVTAKRGGN-MPGHIAIKSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728665 1045555485 /nfs/dbraw/zinc/55/54/85/1045555485.db2.gz PKEZILHOBBLSJU-ARFHVFGLSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@@H]([NH2+]CCc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450724601 1045556207 /nfs/dbraw/zinc/55/62/07/1045556207.db2.gz GRIFLYDUGZMGKV-NVXWUHKLSA-N 2 1 320.908 4.125 20 0 DIADMP C[C@@H](NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714737 1045576034 /nfs/dbraw/zinc/57/60/34/1045576034.db2.gz AKISXLIYDAREOV-MJGOQNOKSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714737 1045576046 /nfs/dbraw/zinc/57/60/46/1045576046.db2.gz AKISXLIYDAREOV-MJGOQNOKSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714737 1045576054 /nfs/dbraw/zinc/57/60/54/1045576054.db2.gz AKISXLIYDAREOV-MJGOQNOKSA-N 2 1 312.457 4.233 20 0 DIADMP Clc1ccc(/C=C\C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334957 1045645976 /nfs/dbraw/zinc/64/59/76/1045645976.db2.gz KIHZZHZWIWSGDY-UABKOXTMSA-N 2 1 318.892 4.304 20 0 DIADMP Clc1ccc(/C=C\C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334957 1045645981 /nfs/dbraw/zinc/64/59/81/1045645981.db2.gz KIHZZHZWIWSGDY-UABKOXTMSA-N 2 1 318.892 4.304 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335451 1045646065 /nfs/dbraw/zinc/64/60/65/1045646065.db2.gz OSTCUBWJAPFJTR-LAQIPUCWSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335451 1045646068 /nfs/dbraw/zinc/64/60/68/1045646068.db2.gz OSTCUBWJAPFJTR-LAQIPUCWSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335451 1045646083 /nfs/dbraw/zinc/64/60/83/1045646083.db2.gz OSTCUBWJAPFJTR-LAQIPUCWSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000530335451 1045646093 /nfs/dbraw/zinc/64/60/93/1045646093.db2.gz OSTCUBWJAPFJTR-LAQIPUCWSA-N 2 1 306.881 4.017 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C/c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335381 1045646127 /nfs/dbraw/zinc/64/61/27/1045646127.db2.gz NIFRGSYWKGIIIF-PWSDSBMBSA-N 2 1 306.881 4.158 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C/c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335381 1045646133 /nfs/dbraw/zinc/64/61/33/1045646133.db2.gz NIFRGSYWKGIIIF-PWSDSBMBSA-N 2 1 306.881 4.158 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C/c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335381 1045646137 /nfs/dbraw/zinc/64/61/37/1045646137.db2.gz NIFRGSYWKGIIIF-PWSDSBMBSA-N 2 1 306.881 4.158 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C/c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335381 1045646144 /nfs/dbraw/zinc/64/61/44/1045646144.db2.gz NIFRGSYWKGIIIF-PWSDSBMBSA-N 2 1 306.881 4.158 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394401 1045657068 /nfs/dbraw/zinc/65/70/68/1045657068.db2.gz JFFLIDCRWICHKP-HIFRSBDPSA-N 2 1 304.409 4.097 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394401 1045657072 /nfs/dbraw/zinc/65/70/72/1045657072.db2.gz JFFLIDCRWICHKP-HIFRSBDPSA-N 2 1 304.409 4.097 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1cc2c(ccc3ccccc23)o1 ZINC000530407479 1045660854 /nfs/dbraw/zinc/66/08/54/1045660854.db2.gz MCUFQRCDOJAAHK-CQSZACIVSA-N 2 1 319.408 4.213 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000451971047 1045756809 /nfs/dbraw/zinc/75/68/09/1045756809.db2.gz MNDUNZLFFNGDJT-SFHVURJKSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1ccc(F)cc1F ZINC000451971047 1045756819 /nfs/dbraw/zinc/75/68/19/1045756819.db2.gz MNDUNZLFFNGDJT-SFHVURJKSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)C1CCCCCCC1 ZINC000753531723 1045759280 /nfs/dbraw/zinc/75/92/80/1045759280.db2.gz RNFHXLTWUGZDKG-UHFFFAOYSA-N 2 1 312.461 4.120 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1oc2ccccc2c1Cl ZINC000631080103 1045811660 /nfs/dbraw/zinc/81/16/60/1045811660.db2.gz NPFIHXAVVFQJLW-UHFFFAOYSA-N 2 1 317.820 4.161 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194269 1045832042 /nfs/dbraw/zinc/83/20/42/1045832042.db2.gz WWSWFRVTSKUGEH-RTBURBONSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194269 1045832066 /nfs/dbraw/zinc/83/20/66/1045832066.db2.gz WWSWFRVTSKUGEH-RTBURBONSA-N 2 1 310.485 4.106 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCSC(C)(C)C)C1 ZINC000801921412 1045840849 /nfs/dbraw/zinc/84/08/49/1045840849.db2.gz BYVAOZMLEMFYJP-IAGOWNOFSA-N 2 1 312.567 4.105 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCSC(C)(C)C)C1 ZINC000801921412 1045840859 /nfs/dbraw/zinc/84/08/59/1045840859.db2.gz BYVAOZMLEMFYJP-IAGOWNOFSA-N 2 1 312.567 4.105 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCSC(C)(C)C)C1 ZINC000801921412 1045840869 /nfs/dbraw/zinc/84/08/69/1045840869.db2.gz BYVAOZMLEMFYJP-IAGOWNOFSA-N 2 1 312.567 4.105 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCSC(C)(C)C)C1 ZINC000801921411 1045842120 /nfs/dbraw/zinc/84/21/20/1045842120.db2.gz BYVAOZMLEMFYJP-DLBZAZTESA-N 2 1 312.567 4.105 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCSC(C)(C)C)C1 ZINC000801921411 1045842134 /nfs/dbraw/zinc/84/21/34/1045842134.db2.gz BYVAOZMLEMFYJP-DLBZAZTESA-N 2 1 312.567 4.105 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCSC(C)(C)C)C1 ZINC000801921411 1045842145 /nfs/dbraw/zinc/84/21/45/1045842145.db2.gz BYVAOZMLEMFYJP-DLBZAZTESA-N 2 1 312.567 4.105 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000531704763 1045902288 /nfs/dbraw/zinc/90/22/88/1045902288.db2.gz JPMAPLXBOJZZKK-TZIWHRDSSA-N 2 1 314.517 4.276 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000531711521 1045903961 /nfs/dbraw/zinc/90/39/61/1045903961.db2.gz NCAPMKOXEAAYPM-MBOZVWFJSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CC1 ZINC000531723446 1045912704 /nfs/dbraw/zinc/91/27/04/1045912704.db2.gz AEKDUACSXOSLGG-UXPWSPDFSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CC1 ZINC000531723446 1045912710 /nfs/dbraw/zinc/91/27/10/1045912710.db2.gz AEKDUACSXOSLGG-UXPWSPDFSA-N 2 1 300.490 4.064 20 0 DIADMP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)c1ccncc1 ZINC000453065882 1045915161 /nfs/dbraw/zinc/91/51/61/1045915161.db2.gz VTVKFLJZRSIBJT-HXUWFJFHSA-N 2 1 311.473 4.163 20 0 DIADMP Clc1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCC2)cc1 ZINC000453072723 1045917065 /nfs/dbraw/zinc/91/70/65/1045917065.db2.gz FWNKZZTVEDDAOK-AUUYWEPGSA-N 2 1 318.892 4.255 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccsc1 ZINC000453129666 1045952915 /nfs/dbraw/zinc/95/29/15/1045952915.db2.gz RPGZCIXDRMFULC-KRWDZBQOSA-N 2 1 315.486 4.161 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC000902456684 1046001085 /nfs/dbraw/zinc/00/10/85/1046001085.db2.gz QMLXURDXCVQHFZ-ROUUACIJSA-N 2 1 322.443 4.285 20 0 DIADMP CC[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(F)F ZINC000453252697 1046005186 /nfs/dbraw/zinc/00/51/86/1046005186.db2.gz VJQKFIAJDJFPDR-JCYILVPMSA-N 2 1 310.432 4.063 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)c2ccccc12 ZINC001138016791 1046058908 /nfs/dbraw/zinc/05/89/08/1046058908.db2.gz PHLPXQPZARKNKP-UHFFFAOYSA-N 2 1 308.469 4.066 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21)C1CC1 ZINC000453387829 1046062876 /nfs/dbraw/zinc/06/28/76/1046062876.db2.gz BGZXYUOTZYWMIB-LJQANCHMSA-N 2 1 311.473 4.009 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(-c2ccccc2)o1 ZINC000453365665 1046065654 /nfs/dbraw/zinc/06/56/54/1046065654.db2.gz SRQFNSIIFVRTLQ-CCNLRDMRSA-N 2 1 310.441 4.222 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(-c2ccccc2)o1 ZINC000453365665 1046065667 /nfs/dbraw/zinc/06/56/67/1046065667.db2.gz SRQFNSIIFVRTLQ-CCNLRDMRSA-N 2 1 310.441 4.222 20 0 DIADMP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453378674 1046071785 /nfs/dbraw/zinc/07/17/85/1046071785.db2.gz ZMZYFKIWVXDSHK-AQDPXUSMSA-N 2 1 300.490 4.297 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453377772 1046072388 /nfs/dbraw/zinc/07/23/88/1046072388.db2.gz ZANYFZRSKZAPTP-HNSVSWJLSA-N 2 1 304.503 4.074 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453399279 1046075976 /nfs/dbraw/zinc/07/59/76/1046075976.db2.gz LFZHUOJTILLRLQ-GJZGRUSLSA-N 2 1 308.897 4.296 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000453404279 1046077465 /nfs/dbraw/zinc/07/74/65/1046077465.db2.gz PKYMZOQSHHPDKL-ZDUSSCGKSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccccc1C(F)(F)F ZINC000453419728 1046079316 /nfs/dbraw/zinc/07/93/16/1046079316.db2.gz JRHPGJMEZKDEIV-CYBMUJFWSA-N 2 1 314.395 4.230 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1)C1CC1 ZINC000453393814 1046082002 /nfs/dbraw/zinc/08/20/02/1046082002.db2.gz GLRLSAYXYLHAFA-IBGZPJMESA-N 2 1 316.464 4.226 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H](C2CC2)C2CCC2)C3)cc1 ZINC000453439160 1046084099 /nfs/dbraw/zinc/08/40/99/1046084099.db2.gz VXPDFEXBGCKAMN-KJJMTIBFSA-N 2 1 324.512 4.350 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000532246940 1046120921 /nfs/dbraw/zinc/12/09/21/1046120921.db2.gz HSCHXRUVRWIORX-RVKKMQEKSA-N 2 1 322.924 4.227 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000532233656 1046121008 /nfs/dbraw/zinc/12/10/08/1046121008.db2.gz BYMRDOQDZPGEGA-IKGGRYGDSA-N 2 1 320.546 4.268 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903015739 1046142667 /nfs/dbraw/zinc/14/26/67/1046142667.db2.gz BRBAXWXWOVQFNQ-VXGBXAGGSA-N 2 1 320.424 4.149 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCCC[C@H]1/C=C/c1ccccc1 ZINC001168146251 1046148600 /nfs/dbraw/zinc/14/86/00/1046148600.db2.gz QYGXBTOYAGEUCW-AIGDTVQASA-N 2 1 323.484 4.311 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCCC[C@H]1/C=C/c1ccccc1 ZINC001168146251 1046148606 /nfs/dbraw/zinc/14/86/06/1046148606.db2.gz QYGXBTOYAGEUCW-AIGDTVQASA-N 2 1 323.484 4.311 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(Cl)cc1 ZINC000903055911 1046150279 /nfs/dbraw/zinc/15/02/79/1046150279.db2.gz NDDPWRRZQHQSIV-PGFKPMOBSA-N 2 1 304.865 4.148 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1cc2cccc(F)c2o1 ZINC000475706157 1046163567 /nfs/dbraw/zinc/16/35/67/1046163567.db2.gz NYHBNTIKUROLTH-AWEZNQCLSA-N 2 1 304.409 4.099 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2[nH]c3ccccc3c2C)CC1 ZINC001138401822 1046164189 /nfs/dbraw/zinc/16/41/89/1046164189.db2.gz WKMGMLXBKBBOHQ-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2[nH]c3ccccc3c2C)CC1 ZINC001138401822 1046164193 /nfs/dbraw/zinc/16/41/93/1046164193.db2.gz WKMGMLXBKBBOHQ-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP Cc1oc2ccccc2c1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903153186 1046176446 /nfs/dbraw/zinc/17/64/46/1046176446.db2.gz QUONIZVFXXKWDG-ZNXRZULTSA-N 2 1 324.468 4.031 20 0 DIADMP CCOc1ccc2ccccc2c1C[N@H+](CC)CCC[NH+](C)C ZINC001138444986 1046185398 /nfs/dbraw/zinc/18/53/98/1046185398.db2.gz QBOMZCVBZWSSNH-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP CCOc1ccc2ccccc2c1C[N@@H+](CC)CCC[NH+](C)C ZINC001138444986 1046185402 /nfs/dbraw/zinc/18/54/02/1046185402.db2.gz QBOMZCVBZWSSNH-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP CC[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccccc1F ZINC000903195923 1046191664 /nfs/dbraw/zinc/19/16/64/1046191664.db2.gz DERNXJCFSDRMST-QGGWKKEGSA-N 2 1 302.437 4.024 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccccc1F ZINC000903195923 1046191673 /nfs/dbraw/zinc/19/16/73/1046191673.db2.gz DERNXJCFSDRMST-QGGWKKEGSA-N 2 1 302.437 4.024 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccccc1F ZINC000903195923 1046191677 /nfs/dbraw/zinc/19/16/77/1046191677.db2.gz DERNXJCFSDRMST-QGGWKKEGSA-N 2 1 302.437 4.024 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000151136745 1046205082 /nfs/dbraw/zinc/20/50/82/1046205082.db2.gz DQJBUDXPXIWTJX-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)cc1 ZINC001138543462 1046219588 /nfs/dbraw/zinc/21/95/88/1046219588.db2.gz PHLLKVUBBSVOSN-MRXNPFEDSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)cc1 ZINC001138543462 1046219596 /nfs/dbraw/zinc/21/95/96/1046219596.db2.gz PHLLKVUBBSVOSN-MRXNPFEDSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1 ZINC001138548468 1046221347 /nfs/dbraw/zinc/22/13/47/1046221347.db2.gz DUXYMGARWWCZES-FQEVSTJZSA-N 2 1 303.409 4.128 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC001138548468 1046221353 /nfs/dbraw/zinc/22/13/53/1046221353.db2.gz DUXYMGARWWCZES-FQEVSTJZSA-N 2 1 303.409 4.128 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)cc1 ZINC001138549011 1046222205 /nfs/dbraw/zinc/22/22/05/1046222205.db2.gz NRRBIPFBYCKKBU-ICSRJNTNSA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)cc1 ZINC001138549011 1046222217 /nfs/dbraw/zinc/22/22/17/1046222217.db2.gz NRRBIPFBYCKKBU-ICSRJNTNSA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)C/C=C/c2ccccc2)cc1 ZINC001138548299 1046222611 /nfs/dbraw/zinc/22/26/11/1046222611.db2.gz DIZUSKBDSIBWDR-RMKNXTFCSA-N 2 1 317.436 4.326 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)C/C=C/c2ccccc2)cc1 ZINC001138548299 1046222629 /nfs/dbraw/zinc/22/26/29/1046222629.db2.gz DIZUSKBDSIBWDR-RMKNXTFCSA-N 2 1 317.436 4.326 20 0 DIADMP CC[N@H+](Cc1ccc(-n2cc[nH+]c2C)cc1)Cc1cccc(F)c1 ZINC001138548727 1046223046 /nfs/dbraw/zinc/22/30/46/1046223046.db2.gz INWIWFZFMNPEKM-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CC[N@@H+](Cc1ccc(-n2cc[nH+]c2C)cc1)Cc1cccc(F)c1 ZINC001138548727 1046223056 /nfs/dbraw/zinc/22/30/56/1046223056.db2.gz INWIWFZFMNPEKM-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP Cc1cc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c(C)s1 ZINC001138568778 1046228102 /nfs/dbraw/zinc/22/81/02/1046228102.db2.gz CQXNMWSZJGWRAT-UHFFFAOYSA-N 2 1 318.530 4.205 20 0 DIADMP Cc1cc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c(C)s1 ZINC001138568778 1046228114 /nfs/dbraw/zinc/22/81/14/1046228114.db2.gz CQXNMWSZJGWRAT-UHFFFAOYSA-N 2 1 318.530 4.205 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001168172055 1046249585 /nfs/dbraw/zinc/24/95/85/1046249585.db2.gz ZMHJACDUOBDBGE-DOTOQJQBSA-N 2 1 308.897 4.112 20 0 DIADMP Clc1c2ccccc2oc1C[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000637985556 1046289145 /nfs/dbraw/zinc/28/91/45/1046289145.db2.gz HCEVQACZPCGVRF-UHFFFAOYSA-N 2 1 315.804 4.189 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168180560 1046291378 /nfs/dbraw/zinc/29/13/78/1046291378.db2.gz RTBFWPQRNPNIFG-MRXNPFEDSA-N 2 1 322.924 4.323 20 0 DIADMP [NH3+]CC1([C@H]2CCCC[N@H+]2Cc2ccc(C(F)F)cc2)CCC1 ZINC000903811853 1046326127 /nfs/dbraw/zinc/32/61/27/1046326127.db2.gz OSRVYPUFFHCPJI-MRXNPFEDSA-N 2 1 308.416 4.108 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]([NH3+])CC(F)F)c1cccc(C(F)(F)F)c1 ZINC000903924922 1046339561 /nfs/dbraw/zinc/33/95/61/1046339561.db2.gz KKNUGASOFGVBIA-OLZOCXBDSA-N 2 1 324.337 4.119 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1ccc(F)c(Cl)c1 ZINC001462197568 1046351105 /nfs/dbraw/zinc/35/11/05/1046351105.db2.gz JFZMEQFAFHBGHI-UHFFFAOYSA-N 2 1 300.849 4.033 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1ccc(F)c(Cl)c1 ZINC001462197568 1046351116 /nfs/dbraw/zinc/35/11/16/1046351116.db2.gz JFZMEQFAFHBGHI-UHFFFAOYSA-N 2 1 300.849 4.033 20 0 DIADMP C[N@H+]1CC[C@]2(CCN(Cc3ccc(-c4cccs4)s3)C2)C1 ZINC001139023424 1046361734 /nfs/dbraw/zinc/36/17/34/1046361734.db2.gz VDGMKPYLWGODFL-KRWDZBQOSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(-c4cccs4)s3)C2)C1 ZINC001139023424 1046361771 /nfs/dbraw/zinc/36/17/71/1046361771.db2.gz VDGMKPYLWGODFL-KRWDZBQOSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(-c4cccs4)s3)C2)C1 ZINC001139023424 1046361784 /nfs/dbraw/zinc/36/17/84/1046361784.db2.gz VDGMKPYLWGODFL-KRWDZBQOSA-N 2 1 318.511 4.004 20 0 DIADMP CC(C)(F)CC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639314946 1046380537 /nfs/dbraw/zinc/38/05/37/1046380537.db2.gz AMVLXZFKAFPLGW-AEFFLSMTSA-N 2 1 304.453 4.082 20 0 DIADMP CC(C)(F)CC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639314946 1046380554 /nfs/dbraw/zinc/38/05/54/1046380554.db2.gz AMVLXZFKAFPLGW-AEFFLSMTSA-N 2 1 304.453 4.082 20 0 DIADMP CN1CCC([N@@H+](Cc2ccc3cccnc3c2)C2CCCC2)CC1 ZINC001139173152 1046403315 /nfs/dbraw/zinc/40/33/15/1046403315.db2.gz GQHQHKOVTVYPIS-UHFFFAOYSA-N 2 1 323.484 4.074 20 0 DIADMP CC1CCC([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001168219070 1046429695 /nfs/dbraw/zinc/42/96/95/1046429695.db2.gz CXPYIFJQYJSNQN-SKINQDTJSA-N 2 1 300.490 4.019 20 0 DIADMP CC1CCC([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)CC1 ZINC001168222039 1046432577 /nfs/dbraw/zinc/43/25/77/1046432577.db2.gz VUWJINGKNXDAII-FPGXKEGCSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)CC1 ZINC001168222039 1046432585 /nfs/dbraw/zinc/43/25/85/1046432585.db2.gz VUWJINGKNXDAII-FPGXKEGCSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)CC1 ZINC001168222039 1046432590 /nfs/dbraw/zinc/43/25/90/1046432590.db2.gz VUWJINGKNXDAII-FPGXKEGCSA-N 2 1 312.501 4.019 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2ccccc2)s1)C1CCN(C)CC1 ZINC001139414166 1046445238 /nfs/dbraw/zinc/44/52/38/1046445238.db2.gz KJFFPMOBGCKQNI-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[N@@H+](C)C1CCN(Cc2ccc(-c3ccccc3)s2)CC1 ZINC001139415920 1046446843 /nfs/dbraw/zinc/44/68/43/1046446843.db2.gz HGINXSKIULNSNE-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCc3c2cc(F)cc3F)C1 ZINC000677129145 1046466546 /nfs/dbraw/zinc/46/65/46/1046466546.db2.gz HCGBNWVJFGYFAB-IFXJQAMLSA-N 2 1 322.443 4.054 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCc3c2cc(F)cc3F)C1 ZINC000677129144 1046466711 /nfs/dbraw/zinc/46/67/11/1046466711.db2.gz HCGBNWVJFGYFAB-AUUYWEPGSA-N 2 1 322.443 4.054 20 0 DIADMP C[NH+](CCCC[N@H+](C)Cc1cccs1)Cc1cccs1 ZINC000536540725 1046470587 /nfs/dbraw/zinc/47/05/87/1046470587.db2.gz YDTWNHYPBFEMRG-UHFFFAOYSA-N 2 1 308.516 4.154 20 0 DIADMP c1ccc(C2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCCCC2)cc1 ZINC000677236829 1046474807 /nfs/dbraw/zinc/47/48/07/1046474807.db2.gz VFGBCEMMIVTKIJ-UXHICEINSA-N 2 1 312.501 4.105 20 0 DIADMP c1ccc(C2CCC(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000677240027 1046477137 /nfs/dbraw/zinc/47/71/37/1046477137.db2.gz DESSBGODUADGLT-HXJFWZBSSA-N 2 1 312.501 4.177 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677240335 1046477451 /nfs/dbraw/zinc/47/74/51/1046477451.db2.gz GUSKSCKZQXYCHI-SZMVWBNQSA-N 2 1 318.530 4.465 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677241695 1046477660 /nfs/dbraw/zinc/47/76/60/1046477660.db2.gz TYTNYROZMSMPLQ-XIRDDKMYSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CC2(Cl)Cl)cc1 ZINC000782052113 1046492105 /nfs/dbraw/zinc/49/21/05/1046492105.db2.gz GLPXQXXTAJVKGY-RISCZKNCSA-N 2 1 324.255 4.025 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000782191500 1046499399 /nfs/dbraw/zinc/49/93/99/1046499399.db2.gz WMEKFDPMBRFAJJ-HNAYVOBHSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000782191500 1046499405 /nfs/dbraw/zinc/49/94/05/1046499405.db2.gz WMEKFDPMBRFAJJ-HNAYVOBHSA-N 2 1 318.892 4.135 20 0 DIADMP CN(Cc1ccc2oc3ccccc3c2c1)C1CC[NH+](C)CC1 ZINC001139751271 1046512469 /nfs/dbraw/zinc/51/24/69/1046512469.db2.gz ILWGLOWTBYFGKP-UHFFFAOYSA-N 2 1 308.425 4.112 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000131188604 1046516703 /nfs/dbraw/zinc/51/67/03/1046516703.db2.gz SBKLYVDYMCWPPU-XJKSGUPXSA-N 2 1 324.559 4.384 20 0 DIADMP C[N@@H+]1C[C@@H]2C[NH+](Cc3cccc4c5ccccc5sc43)C[C@@H]2C1 ZINC001139844355 1046532818 /nfs/dbraw/zinc/53/28/18/1046532818.db2.gz XFFWWLZPQQTDJK-IYBDPMFKSA-N 2 1 322.477 4.048 20 0 DIADMP C[NH+]1C[C@@H]2C[N@@H+](Cc3cccc4c5ccccc5sc43)C[C@@H]2C1 ZINC001139844355 1046532831 /nfs/dbraw/zinc/53/28/31/1046532831.db2.gz XFFWWLZPQQTDJK-IYBDPMFKSA-N 2 1 322.477 4.048 20 0 DIADMP CC[NH+](CC)CCCC1CC[NH+](Cc2ncc(C(C)C)o2)CC1 ZINC000782527348 1046532856 /nfs/dbraw/zinc/53/28/56/1046532856.db2.gz KTHPXLZBHUWOPE-UHFFFAOYSA-N 2 1 321.509 4.132 20 0 DIADMP C[NH+]1C[C@@H]2C[N@H+](Cc3cccc4c5ccccc5sc43)C[C@@H]2C1 ZINC001139844355 1046532840 /nfs/dbraw/zinc/53/28/40/1046532840.db2.gz XFFWWLZPQQTDJK-IYBDPMFKSA-N 2 1 322.477 4.048 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)CC(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000694020663 1046536546 /nfs/dbraw/zinc/53/65/46/1046536546.db2.gz FCISDJPJDRKHQH-WBVHZDCISA-N 2 1 324.459 4.168 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccccc2C2CC2)CC1 ZINC001139883015 1046541986 /nfs/dbraw/zinc/54/19/86/1046541986.db2.gz XSDXGNOGAKFZMI-UHFFFAOYSA-N 2 1 300.490 4.116 20 0 DIADMP CC[N@H+](Cc1ccc(F)cc1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026427 1046570577 /nfs/dbraw/zinc/57/05/77/1046570577.db2.gz LEYQBJYFJUMITR-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026427 1046570593 /nfs/dbraw/zinc/57/05/93/1046570593.db2.gz LEYQBJYFJUMITR-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CC(C)c1csc(C[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)n1 ZINC000925283232 1046572160 /nfs/dbraw/zinc/57/21/60/1046572160.db2.gz OAILIXZVROSSSB-AWEZNQCLSA-N 2 1 317.502 4.179 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC000678195036 1046580440 /nfs/dbraw/zinc/58/04/40/1046580440.db2.gz GFBYXKQBOGYMML-UHFFFAOYSA-N 2 1 300.490 4.116 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000195136773 1046589069 /nfs/dbraw/zinc/58/90/69/1046589069.db2.gz LJBRVRZFHBHZFH-TZIWHRDSSA-N 2 1 323.484 4.035 20 0 DIADMP C[NH+](C)CC1CC[NH+](c2ccc(NCCC(C)(C)C)cc2)CC1 ZINC000783585206 1046611986 /nfs/dbraw/zinc/61/19/86/1046611986.db2.gz QRSJBEXYUUWSNG-UHFFFAOYSA-N 2 1 317.521 4.313 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532989347 1046636424 /nfs/dbraw/zinc/63/64/24/1046636424.db2.gz QMRKVQVQFTVTPV-UYAOXDASSA-N 2 1 308.469 4.202 20 0 DIADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000236728396 1046664675 /nfs/dbraw/zinc/66/46/75/1046664675.db2.gz BCFPPKFNUYPVHN-UHFFFAOYSA-N 2 1 322.496 4.218 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1Cl ZINC000643546258 1046671051 /nfs/dbraw/zinc/67/10/51/1046671051.db2.gz LKKMVHCAXZAVKW-NEPJUHHUSA-N 2 1 313.272 4.319 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548792 1046673120 /nfs/dbraw/zinc/67/31/20/1046673120.db2.gz VGKTWBNACSTNEV-LSDHHAIUSA-N 2 1 312.457 4.321 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000678609542 1046678416 /nfs/dbraw/zinc/67/84/16/1046678416.db2.gz PHFABJASGLKEAM-SBHAEUEKSA-N 2 1 312.501 4.404 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000678609543 1046679001 /nfs/dbraw/zinc/67/90/01/1046679001.db2.gz PHFABJASGLKEAM-ZJOUEHCJSA-N 2 1 312.501 4.404 20 0 DIADMP CC[NH+](CC)Cc1ccccc1Nc1[nH+]c2ccccc2n1C ZINC001211986436 1046684519 /nfs/dbraw/zinc/68/45/19/1046684519.db2.gz LWVWRMGOUCGAHI-UHFFFAOYSA-N 2 1 308.429 4.159 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678769170 1046696154 /nfs/dbraw/zinc/69/61/54/1046696154.db2.gz MUCVHXDARDISHY-MBOZVWFJSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2cccc(Cl)c12)C1CCN(C)CC1 ZINC001140438289 1046724040 /nfs/dbraw/zinc/72/40/40/1046724040.db2.gz SIHNKJUVTBUWDT-UHFFFAOYSA-N 2 1 319.880 4.126 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cccc(C(F)(F)F)c1 ZINC000678997715 1046752527 /nfs/dbraw/zinc/75/25/27/1046752527.db2.gz ISPPMXBIWXMDEX-CZUORRHYSA-N 2 1 314.395 4.230 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2csc3ccccc23)CC1 ZINC001140639589 1046828242 /nfs/dbraw/zinc/82/82/42/1046828242.db2.gz INOQMXXZEGJEQH-UHFFFAOYSA-N 2 1 314.498 4.352 20 0 DIADMP CCCCC[C@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C(C)(C)C ZINC000796307228 1046872447 /nfs/dbraw/zinc/87/24/47/1046872447.db2.gz IBSZZTKUPOPCBY-HNNXBMFYSA-N 2 1 311.539 4.289 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)o1 ZINC000067668332 1046891463 /nfs/dbraw/zinc/89/14/63/1046891463.db2.gz MLNJULQSKRUQLI-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)o1 ZINC000067668332 1046891480 /nfs/dbraw/zinc/89/14/80/1046891480.db2.gz MLNJULQSKRUQLI-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1coc2ccccc12 ZINC001140786540 1046899602 /nfs/dbraw/zinc/89/96/02/1046899602.db2.gz FRDOWHBDOKAYKB-ZWKOTPCHSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1coc2ccccc12 ZINC001140786540 1046899612 /nfs/dbraw/zinc/89/96/12/1046899612.db2.gz FRDOWHBDOKAYKB-ZWKOTPCHSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1coc2ccccc12 ZINC001140786540 1046899624 /nfs/dbraw/zinc/89/96/24/1046899624.db2.gz FRDOWHBDOKAYKB-ZWKOTPCHSA-N 2 1 312.457 4.272 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1F ZINC000679773145 1046903874 /nfs/dbraw/zinc/90/38/74/1046903874.db2.gz RCEKCKBTQNEPOI-VKJFTORMSA-N 2 1 324.871 4.393 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1F ZINC000679773145 1046903885 /nfs/dbraw/zinc/90/38/85/1046903885.db2.gz RCEKCKBTQNEPOI-VKJFTORMSA-N 2 1 324.871 4.393 20 0 DIADMP CCC(CC)C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000680478689 1046987479 /nfs/dbraw/zinc/98/74/79/1046987479.db2.gz DXBYGPPMGXEMIK-UHFFFAOYSA-N 2 1 303.494 4.056 20 0 DIADMP CCSc1cccc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)c1 ZINC000798957008 1046992974 /nfs/dbraw/zinc/99/29/74/1046992974.db2.gz ICAMNLAIFJPAML-UHFFFAOYSA-N 2 1 318.530 4.106 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccccc2-c2cccs2)CC1 ZINC001141095709 1047009710 /nfs/dbraw/zinc/00/97/10/1047009710.db2.gz UEZFVNAFIDFZIF-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccccc2-c2cccs2)CC1 ZINC001141095709 1047009724 /nfs/dbraw/zinc/00/97/24/1047009724.db2.gz UEZFVNAFIDFZIF-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP C[C@@H](c1cccc(Cl)c1F)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799179471 1047009702 /nfs/dbraw/zinc/00/97/02/1047009702.db2.gz MBFMRIZFCRUKLM-AWEZNQCLSA-N 2 1 324.871 4.348 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](CCCc3ccc(Cl)cc3)C2)CC1 ZINC000799178198 1047010070 /nfs/dbraw/zinc/01/00/70/1047010070.db2.gz HSRBXBUGDFTEMY-UHFFFAOYSA-N 2 1 320.908 4.080 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1ccccn1 ZINC000270874993 1047010429 /nfs/dbraw/zinc/01/04/29/1047010429.db2.gz CTUDNOZIDBIOAO-ZWKOTPCHSA-N 2 1 323.484 4.307 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH2+]C2(c3cccc(Cl)c3)CCC2)c2ccccc21 ZINC000647804772 1047015658 /nfs/dbraw/zinc/01/56/58/1047015658.db2.gz YMSMFGFKYSYBAH-ROUUACIJSA-N 2 1 312.844 4.454 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661800 1047052608 /nfs/dbraw/zinc/05/26/08/1047052608.db2.gz FERIAAKVVDWDNI-SJLPKXTDSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661800 1047052618 /nfs/dbraw/zinc/05/26/18/1047052618.db2.gz FERIAAKVVDWDNI-SJLPKXTDSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661800 1047052634 /nfs/dbraw/zinc/05/26/34/1047052634.db2.gz FERIAAKVVDWDNI-SJLPKXTDSA-N 2 1 312.457 4.251 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661800 1047052648 /nfs/dbraw/zinc/05/26/48/1047052648.db2.gz FERIAAKVVDWDNI-SJLPKXTDSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661798 1047054421 /nfs/dbraw/zinc/05/44/21/1047054421.db2.gz FERIAAKVVDWDNI-FUHWJXTLSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661798 1047054437 /nfs/dbraw/zinc/05/44/37/1047054437.db2.gz FERIAAKVVDWDNI-FUHWJXTLSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661798 1047054453 /nfs/dbraw/zinc/05/44/53/1047054453.db2.gz FERIAAKVVDWDNI-FUHWJXTLSA-N 2 1 312.457 4.251 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661798 1047054470 /nfs/dbraw/zinc/05/44/70/1047054470.db2.gz FERIAAKVVDWDNI-FUHWJXTLSA-N 2 1 312.457 4.251 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)s1 ZINC000379619969 1047080255 /nfs/dbraw/zinc/08/02/55/1047080255.db2.gz CFZZMKFYPMGHTG-QAPCUYQASA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)s1 ZINC000379619969 1047080267 /nfs/dbraw/zinc/08/02/67/1047080267.db2.gz CFZZMKFYPMGHTG-QAPCUYQASA-N 2 1 314.498 4.199 20 0 DIADMP CC[NH+](Cc1ccsc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536709683 1047082906 /nfs/dbraw/zinc/08/29/06/1047082906.db2.gz LUKMUCQZNBARTP-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP CC[N@@H+](Cc1ccsc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536709683 1047082861 /nfs/dbraw/zinc/08/28/61/1047082861.db2.gz LUKMUCQZNBARTP-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP CC[N@H+](Cc1ccsc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536709683 1047082877 /nfs/dbraw/zinc/08/28/77/1047082877.db2.gz LUKMUCQZNBARTP-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP CC[NH+](Cc1ccsc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536709683 1047082893 /nfs/dbraw/zinc/08/28/93/1047082893.db2.gz LUKMUCQZNBARTP-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379646895 1047089599 /nfs/dbraw/zinc/08/95/99/1047089599.db2.gz JQRIKUFUDAJGET-GHTZIAJQSA-N 2 1 308.469 4.138 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379646895 1047089612 /nfs/dbraw/zinc/08/96/12/1047089612.db2.gz JQRIKUFUDAJGET-GHTZIAJQSA-N 2 1 308.469 4.138 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379646194 1047091092 /nfs/dbraw/zinc/09/10/92/1047091092.db2.gz DYZRNPAXOPNIHS-KNQAVFIVSA-N 2 1 322.496 4.262 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379646194 1047091109 /nfs/dbraw/zinc/09/11/09/1047091109.db2.gz DYZRNPAXOPNIHS-KNQAVFIVSA-N 2 1 322.496 4.262 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379646197 1047091633 /nfs/dbraw/zinc/09/16/33/1047091633.db2.gz DYZRNPAXOPNIHS-SIKLNZKXSA-N 2 1 322.496 4.262 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379646197 1047091648 /nfs/dbraw/zinc/09/16/48/1047091648.db2.gz DYZRNPAXOPNIHS-SIKLNZKXSA-N 2 1 322.496 4.262 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000379653740 1047092527 /nfs/dbraw/zinc/09/25/27/1047092527.db2.gz GNJBRZVVESRXMH-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000379653740 1047092542 /nfs/dbraw/zinc/09/25/42/1047092542.db2.gz GNJBRZVVESRXMH-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CC(C(F)F)C1 ZINC000681090074 1047092816 /nfs/dbraw/zinc/09/28/16/1047092816.db2.gz XBGYNYYVSVFKFJ-RWBZWWBESA-N 2 1 322.443 4.194 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000536828971 1047102875 /nfs/dbraw/zinc/10/28/75/1047102875.db2.gz UWBPMQWTGGSFDS-ZIFCJYIRSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@H+](C)C[C@H]1C)CCC2 ZINC000536835213 1047106640 /nfs/dbraw/zinc/10/66/40/1047106640.db2.gz UHKPUIPMKYEBCC-XPGWFJOJSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@@H+](C)C[C@H]1C)CCC2 ZINC000536835213 1047106649 /nfs/dbraw/zinc/10/66/49/1047106649.db2.gz UHKPUIPMKYEBCC-XPGWFJOJSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C)CCC2 ZINC000536847976 1047109804 /nfs/dbraw/zinc/10/98/04/1047109804.db2.gz UHKPUIPMKYEBCC-CWFSZBLJSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C)CCC2 ZINC000536847976 1047109811 /nfs/dbraw/zinc/10/98/11/1047109811.db2.gz UHKPUIPMKYEBCC-CWFSZBLJSA-N 2 1 300.490 4.117 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000536859506 1047114929 /nfs/dbraw/zinc/11/49/29/1047114929.db2.gz RHVJBVBOFDXTKA-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000536859506 1047114934 /nfs/dbraw/zinc/11/49/34/1047114934.db2.gz RHVJBVBOFDXTKA-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@H+]1CCC[C@H](CN[C@@H](C)c2oc3ccccc3c2C)C1 ZINC001116293264 1047127088 /nfs/dbraw/zinc/12/70/88/1047127088.db2.gz LFIZHXXSMBVTHQ-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC001116293264 1047127099 /nfs/dbraw/zinc/12/70/99/1047127099.db2.gz LFIZHXXSMBVTHQ-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC001116288928 1047127166 /nfs/dbraw/zinc/12/71/66/1047127166.db2.gz PJLQQELJEIIOJF-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC001116288929 1047127346 /nfs/dbraw/zinc/12/73/46/1047127346.db2.gz PJLQQELJEIIOJF-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000537014113 1047131612 /nfs/dbraw/zinc/13/16/12/1047131612.db2.gz CBHAQBXVFRMXLD-YLJYHZDGSA-N 2 1 300.490 4.095 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](CSc2ccccc2)C(C)C)C1 ZINC001116505805 1047150373 /nfs/dbraw/zinc/15/03/73/1047150373.db2.gz SSXYNVDBGUMAAE-PKOBYXMFSA-N 2 1 320.546 4.125 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000537292831 1047159351 /nfs/dbraw/zinc/15/93/51/1047159351.db2.gz QJGLWCUJPSXACU-CQSZACIVSA-N 2 1 319.408 4.442 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC001116604928 1047161014 /nfs/dbraw/zinc/16/10/14/1047161014.db2.gz YNAUDQLVXAQVHH-DLBZAZTESA-N 2 1 318.505 4.246 20 0 DIADMP Cc1ccc(C)c([C@H](N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc2)c1 ZINC000325404462 1047187176 /nfs/dbraw/zinc/18/71/76/1047187176.db2.gz IBJUKPQKFKDQTC-SYYKKAFVSA-N 2 1 322.496 4.465 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@@H]2CCN(C)[C@H](C)C2)c2ccccc2)c1 ZINC000325404462 1047187181 /nfs/dbraw/zinc/18/71/81/1047187181.db2.gz IBJUKPQKFKDQTC-SYYKKAFVSA-N 2 1 322.496 4.465 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCC34CCCC4)C2)cc1 ZINC000682731693 1047216789 /nfs/dbraw/zinc/21/67/89/1047216789.db2.gz GBLKAQGVXJCHLL-PMACEKPBSA-N 2 1 312.501 4.211 20 0 DIADMP C[NH2+]Cc1ccccc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000650718377 1047276665 /nfs/dbraw/zinc/27/66/65/1047276665.db2.gz JCVZSXNEUBFBTJ-UHFFFAOYSA-N 2 1 309.240 4.003 20 0 DIADMP CCCCc1ccc([C@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC001168284401 1047288606 /nfs/dbraw/zinc/28/86/06/1047288606.db2.gz IOZSKZMUVHFFKG-HXUWFJFHSA-N 2 1 313.489 4.292 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390749250 1047300843 /nfs/dbraw/zinc/30/08/43/1047300843.db2.gz RMEMZJFWHYDYPY-UYAOXDASSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000651211001 1047302768 /nfs/dbraw/zinc/30/27/68/1047302768.db2.gz YOBNALZMCVRDKL-CTNGQTDRSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000651829468 1047329575 /nfs/dbraw/zinc/32/95/75/1047329575.db2.gz DCBAROCFJDRERH-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000840809333 1047339117 /nfs/dbraw/zinc/33/91/17/1047339117.db2.gz JHNYWGFXAKNSQX-LSDHHAIUSA-N 2 1 324.896 4.040 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](CC(C)C)c1ccc(F)cc1 ZINC000652141264 1047343459 /nfs/dbraw/zinc/34/34/59/1047343459.db2.gz KKIOVNRKXVQPQJ-SFHVURJKSA-N 2 1 303.425 4.098 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CC[C@@]4(CC[N@H+](C)C4)C3)cc2)cc1 ZINC001142309541 1047428801 /nfs/dbraw/zinc/42/88/01/1047428801.db2.gz GRUKQDMTLZEKFH-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CC[C@@]4(CC[NH+](C)C4)C3)cc2)cc1 ZINC001142309541 1047428805 /nfs/dbraw/zinc/42/88/05/1047428805.db2.gz GRUKQDMTLZEKFH-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@@]4(CC[NH+](C)C4)C3)cc2)cc1 ZINC001142309541 1047428806 /nfs/dbraw/zinc/42/88/06/1047428806.db2.gz GRUKQDMTLZEKFH-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001168322977 1047445829 /nfs/dbraw/zinc/44/58/29/1047445829.db2.gz LAZGJINKLNVGER-RJYAGPCLSA-N 2 1 304.453 4.226 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC001168327358 1047455170 /nfs/dbraw/zinc/45/51/70/1047455170.db2.gz KOJCLOWQSQANLW-ZLPCBKJTSA-N 2 1 306.881 4.002 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001168334072 1047477826 /nfs/dbraw/zinc/47/78/26/1047477826.db2.gz JXLQDYVEYOVCNN-LSJNQWAISA-N 2 1 320.908 4.298 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001168334071 1047478551 /nfs/dbraw/zinc/47/85/51/1047478551.db2.gz JXLQDYVEYOVCNN-DMKPSLHHSA-N 2 1 320.908 4.298 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C1CCC(F)(F)CC1 ZINC000842670527 1047496100 /nfs/dbraw/zinc/49/61/00/1047496100.db2.gz OREFCKZXOJVCDB-UHFFFAOYSA-N 2 1 310.432 4.194 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341923 1047509234 /nfs/dbraw/zinc/50/92/34/1047509234.db2.gz UYXOSIYUCRSIQH-WLHONDITSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341923 1047509238 /nfs/dbraw/zinc/50/92/38/1047509238.db2.gz UYXOSIYUCRSIQH-WLHONDITSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341921 1047509816 /nfs/dbraw/zinc/50/98/16/1047509816.db2.gz UYXOSIYUCRSIQH-LEDLJOFTSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341921 1047509819 /nfs/dbraw/zinc/50/98/19/1047509819.db2.gz UYXOSIYUCRSIQH-LEDLJOFTSA-N 2 1 320.908 4.296 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)C1CCC([NH3+])CC1 ZINC000843054676 1047525869 /nfs/dbraw/zinc/52/58/69/1047525869.db2.gz ASYFQPLCYHOKDL-UHFFFAOYSA-N 2 1 320.786 4.061 20 0 DIADMP COc1ccccc1-c1ccc(C[N@@H+](C)C2CCC([NH3+])CC2)cc1 ZINC000843055324 1047526336 /nfs/dbraw/zinc/52/63/36/1047526336.db2.gz YHUGDDWJEBFWOE-UHFFFAOYSA-N 2 1 324.468 4.064 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843363608 1047543335 /nfs/dbraw/zinc/54/33/35/1047543335.db2.gz BTXXLUQJVUWYFP-LBPRGKRZSA-N 2 1 313.272 4.130 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2OCC)CC1 ZINC000122968515 1047565663 /nfs/dbraw/zinc/56/56/63/1047565663.db2.gz VJKQQXRHVLRIBZ-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccc1N(C)C ZINC000537655603 1047568890 /nfs/dbraw/zinc/56/88/90/1047568890.db2.gz ZLCXMSVDKVJPAS-QZTJIDSGSA-N 2 1 317.521 4.058 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001206632505 1047571899 /nfs/dbraw/zinc/57/18/99/1047571899.db2.gz LVDKNLBOTSLIGK-SFHVURJKSA-N 2 1 308.469 4.223 20 0 DIADMP COc1ccccc1[C@H](C)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000315077276 1047597102 /nfs/dbraw/zinc/59/71/02/1047597102.db2.gz JRXWHZYPGHJWIW-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP COc1ccccc1[C@H](C)[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000315077276 1047597105 /nfs/dbraw/zinc/59/71/05/1047597105.db2.gz JRXWHZYPGHJWIW-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000537950239 1047645762 /nfs/dbraw/zinc/64/57/62/1047645762.db2.gz NOLNSTOZVAOUQA-YJBOKZPZSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000537950239 1047645763 /nfs/dbraw/zinc/64/57/63/1047645763.db2.gz NOLNSTOZVAOUQA-YJBOKZPZSA-N 2 1 322.443 4.207 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000538223887 1047663321 /nfs/dbraw/zinc/66/33/21/1047663321.db2.gz YQTNLQDGQUMZGU-GOSISDBHSA-N 2 1 317.864 4.366 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000538393718 1047673823 /nfs/dbraw/zinc/67/38/23/1047673823.db2.gz QMILHIBIKNRCGD-HOTGVXAUSA-N 2 1 314.473 4.296 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000538393718 1047673828 /nfs/dbraw/zinc/67/38/28/1047673828.db2.gz QMILHIBIKNRCGD-HOTGVXAUSA-N 2 1 314.473 4.296 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3(c4ccccc4)CC3)CC2)C1 ZINC000538524067 1047683493 /nfs/dbraw/zinc/68/34/93/1047683493.db2.gz ZBBOGOOYGHXPSE-YLJYHZDGSA-N 2 1 312.501 4.308 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1F ZINC001168359553 1047694886 /nfs/dbraw/zinc/69/48/86/1047694886.db2.gz BPZKYAZNDLYVAV-HXUWFJFHSA-N 2 1 318.480 4.377 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2csc3ccccc23)C1 ZINC000538722039 1047701069 /nfs/dbraw/zinc/70/10/69/1047701069.db2.gz ULPWOEHXVAAWQY-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2csc3ccccc23)C1 ZINC000538722039 1047701075 /nfs/dbraw/zinc/70/10/75/1047701075.db2.gz ULPWOEHXVAAWQY-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000538722039 1047701079 /nfs/dbraw/zinc/70/10/79/1047701079.db2.gz ULPWOEHXVAAWQY-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CCCCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC)C2)cc1 ZINC000538750214 1047707607 /nfs/dbraw/zinc/70/76/07/1047707607.db2.gz LACFAFLGMWYOKS-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC)C2)cc1 ZINC000538750214 1047707615 /nfs/dbraw/zinc/70/76/15/1047707615.db2.gz LACFAFLGMWYOKS-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCOc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC)C2)cc1 ZINC000538750214 1047707626 /nfs/dbraw/zinc/70/76/26/1047707626.db2.gz LACFAFLGMWYOKS-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCOc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC)C2)cc1 ZINC000538750214 1047707636 /nfs/dbraw/zinc/70/76/36/1047707636.db2.gz LACFAFLGMWYOKS-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1cc(C)ccc1OC ZINC000538985570 1047722620 /nfs/dbraw/zinc/72/26/20/1047722620.db2.gz NLSGXYSFRAGNNW-PKOBYXMFSA-N 2 1 318.505 4.165 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000539062557 1047730713 /nfs/dbraw/zinc/73/07/13/1047730713.db2.gz ZEFOGVLXBPKANR-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000539062557 1047730717 /nfs/dbraw/zinc/73/07/17/1047730717.db2.gz ZEFOGVLXBPKANR-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000539079076 1047734886 /nfs/dbraw/zinc/73/48/86/1047734886.db2.gz RQIUYQGLWZUYCW-KDOFPFPSSA-N 2 1 317.502 4.410 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000539159762 1047739261 /nfs/dbraw/zinc/73/92/61/1047739261.db2.gz XTKFBRMOEYXPOM-PXNSSMCTSA-N 2 1 300.490 4.239 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)cc1 ZINC000539300908 1047745550 /nfs/dbraw/zinc/74/55/50/1047745550.db2.gz QRQHKGUSUGAKSE-RDJZCZTQSA-N 2 1 306.519 4.322 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643522251 1047751257 /nfs/dbraw/zinc/75/12/57/1047751257.db2.gz KNSMXAXLFKUWPV-GXSJLCMTSA-N 2 1 319.301 4.164 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc2ccccc2n1 ZINC000477919641 1047759699 /nfs/dbraw/zinc/75/96/99/1047759699.db2.gz SODJLIQLPYKLOK-MRXNPFEDSA-N 2 1 311.473 4.007 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CCCCCC2)[C@H]1c1cccs1 ZINC000553514298 1047868103 /nfs/dbraw/zinc/86/81/03/1047868103.db2.gz LMUJTBCJUFXAPH-QAPCUYQASA-N 2 1 306.519 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCCCCC2)[C@H]1c1cccs1 ZINC000553514298 1047868118 /nfs/dbraw/zinc/86/81/18/1047868118.db2.gz LMUJTBCJUFXAPH-QAPCUYQASA-N 2 1 306.519 4.443 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@@H](C)CCc3ccccc3)CC2)[nH+]c1C ZINC001197844476 1047886276 /nfs/dbraw/zinc/88/62/76/1047886276.db2.gz GTTDUUNIOHNHNF-HNNXBMFYSA-N 2 1 311.473 4.227 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001205257941 1047907447 /nfs/dbraw/zinc/90/74/47/1047907447.db2.gz YWUGCXSPGHAVHK-INIZCTEOSA-N 2 1 315.288 4.129 20 0 DIADMP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cc2c(s1)CCCC2 ZINC000479511625 1047917703 /nfs/dbraw/zinc/91/77/03/1047917703.db2.gz LMGLKIRLGIFZEW-OOHWJJMZSA-N 2 1 318.530 4.294 20 0 DIADMP Cc1cc(C[N@@H+](C)CCCC[NH+]2CCCCC2)ccc1Cl ZINC001183511339 1047940768 /nfs/dbraw/zinc/94/07/68/1047940768.db2.gz LRUNALZGIZPBLK-UHFFFAOYSA-N 2 1 308.897 4.346 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878855 1047990780 /nfs/dbraw/zinc/99/07/80/1047990780.db2.gz DJLSDLYWIUORFR-CHWSQXEVSA-N 2 1 314.395 4.019 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878855 1047990789 /nfs/dbraw/zinc/99/07/89/1047990789.db2.gz DJLSDLYWIUORFR-CHWSQXEVSA-N 2 1 314.395 4.019 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000479908502 1048003319 /nfs/dbraw/zinc/00/33/19/1048003319.db2.gz AKESXAAWLDERPH-LSDHHAIUSA-N 2 1 323.550 4.490 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC000479908502 1048003333 /nfs/dbraw/zinc/00/33/33/1048003333.db2.gz AKESXAAWLDERPH-LSDHHAIUSA-N 2 1 323.550 4.490 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCC2(C)C)CC1 ZINC000554085534 1048004825 /nfs/dbraw/zinc/00/48/25/1048004825.db2.gz LEJZITYKOFIZMQ-CTWPCTMYSA-N 2 1 300.490 4.208 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@H]2C1 ZINC001184304045 1048022743 /nfs/dbraw/zinc/02/27/43/1048022743.db2.gz UTSANQYYJUXGQY-ULQDDVLXSA-N 2 1 320.908 4.065 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000480035506 1048031522 /nfs/dbraw/zinc/03/15/22/1048031522.db2.gz CACZBBQWAMDERT-SFHVURJKSA-N 2 1 306.881 4.181 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2sc(Cl)c3ccccc32)CC1 ZINC001205296329 1048034916 /nfs/dbraw/zinc/03/49/16/1048034916.db2.gz MKFGMIPUSUPKRS-MRXNPFEDSA-N 2 1 308.878 4.258 20 0 DIADMP c1ccc2c(c1)cccc2C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001203271729 1048035464 /nfs/dbraw/zinc/03/54/64/1048035464.db2.gz XEGQADQKSKQBHE-SFHVURJKSA-N 2 1 308.469 4.051 20 0 DIADMP CC[C@@H](C[NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccccc1 ZINC001199238893 1048047244 /nfs/dbraw/zinc/04/72/44/1048047244.db2.gz VVYNEDYTYREDSU-IBGZPJMESA-N 2 1 322.496 4.218 20 0 DIADMP CC[C@@H](C[NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccccc1 ZINC001199238893 1048047253 /nfs/dbraw/zinc/04/72/53/1048047253.db2.gz VVYNEDYTYREDSU-IBGZPJMESA-N 2 1 322.496 4.218 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]CC2(C)CCC2)C1 ZINC001199265752 1048049274 /nfs/dbraw/zinc/04/92/74/1048049274.db2.gz DOMJXKLSUAJMEK-KRWDZBQOSA-N 2 1 300.490 4.198 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001203319502 1048050260 /nfs/dbraw/zinc/05/02/60/1048050260.db2.gz ZGFIUOLGRHBHMY-FGZHOGPDSA-N 2 1 320.480 4.031 20 0 DIADMP CC(C)c1cnc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC001199320102 1048055947 /nfs/dbraw/zinc/05/59/47/1048055947.db2.gz HMQLMBDEZRHOKD-IYBDPMFKSA-N 2 1 323.550 4.114 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC001199336869 1048056435 /nfs/dbraw/zinc/05/64/35/1048056435.db2.gz ZATRMBODYSKGMJ-PMACEKPBSA-N 2 1 316.533 4.357 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1Cl ZINC001199346368 1048057025 /nfs/dbraw/zinc/05/70/25/1048057025.db2.gz ZXPPKBRNPZBNRC-OAHLLOKOSA-N 2 1 308.897 4.250 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c1 ZINC001199345207 1048057117 /nfs/dbraw/zinc/05/71/17/1048057117.db2.gz PCEYAUNSTUZBPR-HNNXBMFYSA-N 2 1 308.897 4.250 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(C2CC2)cc1 ZINC001199336185 1048057459 /nfs/dbraw/zinc/05/74/59/1048057459.db2.gz IPPQSJKJWSXEIT-QGZVFWFLSA-N 2 1 300.490 4.308 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001199329587 1048058618 /nfs/dbraw/zinc/05/86/18/1048058618.db2.gz WMXDLDWRDUSDNF-HZPDHXFCSA-N 2 1 314.473 4.199 20 0 DIADMP CC(C)[C@H](C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1 ZINC001199329336 1048058861 /nfs/dbraw/zinc/05/88/61/1048058861.db2.gz QRUBWTJISWMQSP-ZVDOUQERSA-N 2 1 316.533 4.384 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)CCCC(F)(F)F)C1 ZINC000480145678 1048067749 /nfs/dbraw/zinc/06/77/49/1048067749.db2.gz HNZHCWWYODJRAR-CABCVRRESA-N 2 1 308.432 4.065 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)CCCC(F)(F)F)C1 ZINC000480145679 1048068310 /nfs/dbraw/zinc/06/83/10/1048068310.db2.gz HNZHCWWYODJRAR-GJZGRUSLSA-N 2 1 308.432 4.065 20 0 DIADMP CC(C)(C)[C@H]1CC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000554348391 1048073644 /nfs/dbraw/zinc/07/36/44/1048073644.db2.gz ATEAXITYRFTVNG-OALUTQOASA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)(C)[C@H]1CC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000554348392 1048073770 /nfs/dbraw/zinc/07/37/70/1048073770.db2.gz ATEAXITYRFTVNG-RBUKOAKNSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C[N@@H+]1CCCC[C@H]1C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000480186990 1048086034 /nfs/dbraw/zinc/08/60/34/1048086034.db2.gz YLTDECKLGFHJQJ-GJZGRUSLSA-N 2 1 308.432 4.208 20 0 DIADMP CC(C)C[N@H+]1CCCC[C@H]1C[NH2+][C@@H](C)CCCC(F)(F)F ZINC000480186990 1048086049 /nfs/dbraw/zinc/08/60/49/1048086049.db2.gz YLTDECKLGFHJQJ-GJZGRUSLSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@@H](NCc1ccsc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000480275590 1048108963 /nfs/dbraw/zinc/10/89/63/1048108963.db2.gz RWVFEIKQGIZJJV-TZMCWYRMSA-N 2 1 312.910 4.144 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc2c(c1)COC2 ZINC000480262499 1048110692 /nfs/dbraw/zinc/11/06/92/1048110692.db2.gz KOAHDWMYYXRWAZ-INIZCTEOSA-N 2 1 316.489 4.022 20 0 DIADMP Fc1cc(F)cc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1 ZINC001199926580 1048120260 /nfs/dbraw/zinc/12/02/60/1048120260.db2.gz WMFKHTFQPMRTJV-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP Cc1cccc2c1cc[nH+]c2N1CCC([NH3+])(CC2CCC2)CC1 ZINC001161571717 1048141203 /nfs/dbraw/zinc/14/12/03/1048141203.db2.gz QSCGDAYSRWRRIM-UHFFFAOYSA-N 2 1 309.457 4.031 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000554742128 1048169947 /nfs/dbraw/zinc/16/99/47/1048169947.db2.gz QCAMGROJWNLADG-FHWLQOOXSA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000554742128 1048169955 /nfs/dbraw/zinc/16/99/55/1048169955.db2.gz QCAMGROJWNLADG-FHWLQOOXSA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000554742145 1048170098 /nfs/dbraw/zinc/17/00/98/1048170098.db2.gz QCAMGROJWNLADG-GBESFXJTSA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000554742145 1048170103 /nfs/dbraw/zinc/17/01/03/1048170103.db2.gz QCAMGROJWNLADG-GBESFXJTSA-N 2 1 317.521 4.126 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc(F)ccc1F ZINC000480608632 1048191784 /nfs/dbraw/zinc/19/17/84/1048191784.db2.gz KKOGQSXTHKIIFC-GJZGRUSLSA-N 2 1 310.432 4.128 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000480616873 1048192173 /nfs/dbraw/zinc/19/21/73/1048192173.db2.gz WNTGBXLPRZBDFW-SNRMKQJTSA-N 2 1 318.530 4.465 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000480616873 1048192175 /nfs/dbraw/zinc/19/21/75/1048192175.db2.gz WNTGBXLPRZBDFW-SNRMKQJTSA-N 2 1 318.530 4.465 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000480618001 1048193551 /nfs/dbraw/zinc/19/35/51/1048193551.db2.gz ZZTLTTIFSYCREE-DLBZAZTESA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000480606264 1048193724 /nfs/dbraw/zinc/19/37/24/1048193724.db2.gz CEZJVMGPAZKMMQ-GHTZIAJQSA-N 2 1 314.517 4.252 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)c2ccccc12 ZINC000480633700 1048202423 /nfs/dbraw/zinc/20/24/23/1048202423.db2.gz YNTSJNIQDNVAMG-YSSFQJQWSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)c2ccccc12 ZINC000480633700 1048202436 /nfs/dbraw/zinc/20/24/36/1048202436.db2.gz YNTSJNIQDNVAMG-YSSFQJQWSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccccc1[C@@H](C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000480630526 1048202717 /nfs/dbraw/zinc/20/27/17/1048202717.db2.gz MIOLMOZGWRGYLI-IAGOWNOFSA-N 2 1 304.478 4.000 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@H]1CC[NH+](C)C[C@@H]1C)c1ccccc1 ZINC000554890891 1048220069 /nfs/dbraw/zinc/22/00/69/1048220069.db2.gz ZQIOHDZQDJRUOY-SXLOBPIMSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@H]1CC[NH+](C)C[C@@H]1C)c1ccccc1 ZINC000554890891 1048220084 /nfs/dbraw/zinc/22/00/84/1048220084.db2.gz ZQIOHDZQDJRUOY-SXLOBPIMSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@H+](C)C[C@@H]1C)c1ccccc1 ZINC000554890891 1048220101 /nfs/dbraw/zinc/22/01/01/1048220101.db2.gz ZQIOHDZQDJRUOY-SXLOBPIMSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@@H+](C)C[C@@H]1C)c1ccccc1 ZINC000554890891 1048220111 /nfs/dbraw/zinc/22/01/11/1048220111.db2.gz ZQIOHDZQDJRUOY-SXLOBPIMSA-N 2 1 302.506 4.088 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000480718796 1048228175 /nfs/dbraw/zinc/22/81/75/1048228175.db2.gz FSRCKDINVKYJDH-MJGOQNOKSA-N 2 1 320.546 4.020 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000480718796 1048228190 /nfs/dbraw/zinc/22/81/90/1048228190.db2.gz FSRCKDINVKYJDH-MJGOQNOKSA-N 2 1 320.546 4.020 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000480770391 1048242241 /nfs/dbraw/zinc/24/22/41/1048242241.db2.gz RMPVGXRISFOKLQ-IFXJQAMLSA-N 2 1 318.892 4.181 20 0 DIADMP Cc1cc[nH+]c(N[C@@H](CC2CC[NH2+]CC2)c2ccccc2F)c1 ZINC001162231749 1048245214 /nfs/dbraw/zinc/24/52/14/1048245214.db2.gz ZKMDCWHCYFKNOL-SFHVURJKSA-N 2 1 313.420 4.072 20 0 DIADMP Cc1cc[nH+]c(N[C@H](CC2CC[NH2+]CC2)c2ccccc2F)c1 ZINC001162231748 1048245749 /nfs/dbraw/zinc/24/57/49/1048245749.db2.gz ZKMDCWHCYFKNOL-GOSISDBHSA-N 2 1 313.420 4.072 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](CC2CCCCC2)CC1 ZINC001201401535 1048249973 /nfs/dbraw/zinc/24/99/73/1048249973.db2.gz LGQMKEBTZBWLFM-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](CC2CCCCC2)CC1 ZINC001201401535 1048249992 /nfs/dbraw/zinc/24/99/92/1048249992.db2.gz LGQMKEBTZBWLFM-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@@H]3C2)cc1 ZINC001201426330 1048264389 /nfs/dbraw/zinc/26/43/89/1048264389.db2.gz JAFLHSGTYWTDNR-BHDDXSALSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]3C2)cc1 ZINC001201426330 1048264400 /nfs/dbraw/zinc/26/44/00/1048264400.db2.gz JAFLHSGTYWTDNR-BHDDXSALSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]3C2)cc1 ZINC001201426330 1048264409 /nfs/dbraw/zinc/26/44/09/1048264409.db2.gz JAFLHSGTYWTDNR-BHDDXSALSA-N 2 1 324.512 4.187 20 0 DIADMP [NH3+][C@@H]1CCC[C@@H](Nc2[nH+]ccc3cc(-c4ccc(F)cc4)[nH]c32)C1 ZINC001162394246 1048272185 /nfs/dbraw/zinc/27/21/85/1048272185.db2.gz OLPCKMNQEUFJCK-HZPDHXFCSA-N 2 1 324.403 4.051 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CC(C)(C)C)C[C@@H]21 ZINC001201435939 1048272722 /nfs/dbraw/zinc/27/27/22/1048272722.db2.gz YLAFHGVHNBFSDL-RYQLBKOJSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CC(C)(C)C)C[C@@H]21 ZINC001201435939 1048272731 /nfs/dbraw/zinc/27/27/31/1048272731.db2.gz YLAFHGVHNBFSDL-RYQLBKOJSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](CC(C)(C)C)C[C@@H]21 ZINC001201435939 1048272739 /nfs/dbraw/zinc/27/27/39/1048272739.db2.gz YLAFHGVHNBFSDL-RYQLBKOJSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](CC(C)(C)C)C[C@@H]21 ZINC001201440594 1048275225 /nfs/dbraw/zinc/27/52/25/1048275225.db2.gz VVZNHPBBGZFVHT-FHWLQOOXSA-N 2 1 300.490 4.143 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](CC(C)(C)C)C[C@@H]21 ZINC001201440594 1048275237 /nfs/dbraw/zinc/27/52/37/1048275237.db2.gz VVZNHPBBGZFVHT-FHWLQOOXSA-N 2 1 300.490 4.143 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+](CC(C)(C)C)C[C@@H]21 ZINC001201440594 1048275253 /nfs/dbraw/zinc/27/52/53/1048275253.db2.gz VVZNHPBBGZFVHT-FHWLQOOXSA-N 2 1 300.490 4.143 20 0 DIADMP CC(C)(C)C[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001201441386 1048275543 /nfs/dbraw/zinc/27/55/43/1048275543.db2.gz DNFKHWDVMFEJDF-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)C[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001201441386 1048275547 /nfs/dbraw/zinc/27/55/47/1048275547.db2.gz DNFKHWDVMFEJDF-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)C[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001201441386 1048275550 /nfs/dbraw/zinc/27/55/50/1048275550.db2.gz DNFKHWDVMFEJDF-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026110 1048293374 /nfs/dbraw/zinc/29/33/74/1048293374.db2.gz SBHUHBFYYONIMJ-DLBZAZTESA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026110 1048293387 /nfs/dbraw/zinc/29/33/87/1048293387.db2.gz SBHUHBFYYONIMJ-DLBZAZTESA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCC(C)C)cc2)C1 ZINC000481029411 1048295123 /nfs/dbraw/zinc/29/51/23/1048295123.db2.gz YHEGRWSXJQKDGV-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)C1 ZINC000481035351 1048297224 /nfs/dbraw/zinc/29/72/24/1048297224.db2.gz KTZQABQVVXOHTP-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044707 1048297743 /nfs/dbraw/zinc/29/77/43/1048297743.db2.gz YPUCYWNMIUVLJC-PBHICJAKSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044707 1048297756 /nfs/dbraw/zinc/29/77/56/1048297756.db2.gz YPUCYWNMIUVLJC-PBHICJAKSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccccc2SCC)C1 ZINC000481041830 1048298168 /nfs/dbraw/zinc/29/81/68/1048298168.db2.gz AXPLQJLHRCEGFN-HZPDHXFCSA-N 2 1 306.519 4.181 20 0 DIADMP CCC(CC)C[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201534735 1048298626 /nfs/dbraw/zinc/29/86/26/1048298626.db2.gz PYYMFBRRRVWZOR-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP CCC(CC)C[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201534735 1048298642 /nfs/dbraw/zinc/29/86/42/1048298642.db2.gz PYYMFBRRRVWZOR-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001205922833 1048311375 /nfs/dbraw/zinc/31/13/75/1048311375.db2.gz BLILRRIWGBGLGW-VXGBXAGGSA-N 2 1 308.878 4.114 20 0 DIADMP CC(C)(C)C(=[NH2+])Nc1nccc2c1CC[N@@H+](Cc1ccccc1)C2 ZINC001162662304 1048331712 /nfs/dbraw/zinc/33/17/12/1048331712.db2.gz SNVKJIBTFMAVBI-UHFFFAOYSA-N 2 1 322.456 4.075 20 0 DIADMP CC(C)CC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201617034 1048332887 /nfs/dbraw/zinc/33/28/87/1048332887.db2.gz FFHFDCKXUJKDQT-UHOSZYNNSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201617034 1048332902 /nfs/dbraw/zinc/33/29/02/1048332902.db2.gz FFHFDCKXUJKDQT-UHOSZYNNSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201617034 1048332915 /nfs/dbraw/zinc/33/29/15/1048332915.db2.gz FFHFDCKXUJKDQT-UHOSZYNNSA-N 2 1 320.546 4.327 20 0 DIADMP CCCCC[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201727901 1048357258 /nfs/dbraw/zinc/35/72/58/1048357258.db2.gz ZFQHQBRRROBFHU-GOSISDBHSA-N 2 1 304.478 4.146 20 0 DIADMP CCCCC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201737357 1048359888 /nfs/dbraw/zinc/35/98/88/1048359888.db2.gz KEXGJFPPGCBZJU-UHFFFAOYSA-N 2 1 308.897 4.426 20 0 DIADMP CCCCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201737357 1048359901 /nfs/dbraw/zinc/35/99/01/1048359901.db2.gz KEXGJFPPGCBZJU-UHFFFAOYSA-N 2 1 308.897 4.426 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](CCC(C)C)c2ccc(OC)cc2)C1 ZINC000481301214 1048362668 /nfs/dbraw/zinc/36/26/68/1048362668.db2.gz XZTDOXZKAZAIQU-FXAWDEMLSA-N 2 1 318.505 4.104 20 0 DIADMP CCCCCC[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001201751038 1048365154 /nfs/dbraw/zinc/36/51/54/1048365154.db2.gz RUNDVWCXHIAVOJ-UHFFFAOYSA-N 2 1 304.478 4.148 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)c1 ZINC001175601283 1048369405 /nfs/dbraw/zinc/36/94/05/1048369405.db2.gz JDDAUJHVESJHTJ-UHFFFAOYSA-N 2 1 302.506 4.103 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2-c2ccc([C@@H]3CC[N@@H+](C)C3)cc2)c1 ZINC001162913290 1048385989 /nfs/dbraw/zinc/38/59/89/1048385989.db2.gz DZCUBKGJAHZOEQ-HNAYVOBHSA-N 2 1 319.452 4.069 20 0 DIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC001206680606 1048402539 /nfs/dbraw/zinc/40/25/39/1048402539.db2.gz NZYWOWLYDASBLU-MSOLQXFVSA-N 2 1 302.506 4.064 20 0 DIADMP CSc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001201947257 1048407950 /nfs/dbraw/zinc/40/79/50/1048407950.db2.gz VOWVRSZZKDCDNL-WBVHZDCISA-N 2 1 318.530 4.151 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CCCC2)CC[N@H+]1C ZINC000481554237 1048427920 /nfs/dbraw/zinc/42/79/20/1048427920.db2.gz ASWGMHNMEIVOSV-YJBOKZPZSA-N 2 1 320.908 4.224 20 0 DIADMP CC1(C)CCC[C@@H](C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202227573 1048488474 /nfs/dbraw/zinc/48/84/74/1048488474.db2.gz MVZBRIKNYMUCMY-WOJBJXKFSA-N 2 1 314.517 4.315 20 0 DIADMP CC(C)c1[nH+]ccn1Cc1cccc(Nc2ccc(C[NH3+])cc2)c1 ZINC001175968512 1048510105 /nfs/dbraw/zinc/51/01/05/1048510105.db2.gz JKEVPSMUHFKKHW-UHFFFAOYSA-N 2 1 320.440 4.257 20 0 DIADMP C[C@]12C[NH+]([C@H]3C=CCCCCC3)C[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001175975265 1048513610 /nfs/dbraw/zinc/51/36/10/1048513610.db2.gz XCVGHVNCVDNKSC-FSSWDIPSSA-N 2 1 324.512 4.329 20 0 DIADMP C[C@]12C[NH+]([C@H]3C=CCCCCC3)C[C@H]1C[N@H+](Cc1ccccc1)C2 ZINC001175975265 1048513626 /nfs/dbraw/zinc/51/36/26/1048513626.db2.gz XCVGHVNCVDNKSC-FSSWDIPSSA-N 2 1 324.512 4.329 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@@H+]([C@H]1C=CCCCCC1)C2 ZINC001175975265 1048513641 /nfs/dbraw/zinc/51/36/41/1048513641.db2.gz XCVGHVNCVDNKSC-FSSWDIPSSA-N 2 1 324.512 4.329 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@H+]([C@H]1C=CCCCCC1)C2 ZINC001175975265 1048513656 /nfs/dbraw/zinc/51/36/56/1048513656.db2.gz XCVGHVNCVDNKSC-FSSWDIPSSA-N 2 1 324.512 4.329 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccccc32)C[C@H]1c1ccccc1 ZINC000556039307 1048520735 /nfs/dbraw/zinc/52/07/35/1048520735.db2.gz UYCNXKFWFRXTDX-NNWRFLSQSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccccc32)C[C@H]1c1ccccc1 ZINC000556039307 1048520748 /nfs/dbraw/zinc/52/07/48/1048520748.db2.gz UYCNXKFWFRXTDX-NNWRFLSQSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H](c1cccnc1)C1CCC1)C1CCCCC1 ZINC000481913317 1048526389 /nfs/dbraw/zinc/52/63/89/1048526389.db2.gz MGHBFOURZAJLLA-HXUWFJFHSA-N 2 1 315.505 4.167 20 0 DIADMP [NH2+]=C(Nc1ccc([C@@H]2CCC[NH2+]2)cn1)C12CC3CC(CC(C3)C1)C2 ZINC001163838779 1048534738 /nfs/dbraw/zinc/53/47/38/1048534738.db2.gz BIXRAXDZSPFHKV-SOZFHFLDSA-N 2 1 324.472 4.112 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2ccccc21 ZINC000481989029 1048540464 /nfs/dbraw/zinc/54/04/64/1048540464.db2.gz DWQVPFMGIVHRNO-LBXVMSDZSA-N 2 1 312.501 4.406 20 0 DIADMP c1ccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000567851525 1048540860 /nfs/dbraw/zinc/54/08/60/1048540860.db2.gz NMGCCCVZFCQXKS-NRFANRHFSA-N 2 1 320.480 4.016 20 0 DIADMP c1ccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000567851525 1048540870 /nfs/dbraw/zinc/54/08/70/1048540870.db2.gz NMGCCCVZFCQXKS-NRFANRHFSA-N 2 1 320.480 4.016 20 0 DIADMP CC(C)CCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000482011509 1048541477 /nfs/dbraw/zinc/54/14/77/1048541477.db2.gz SRQKNWXQSJBBOF-LNLFQRSKSA-N 2 1 318.505 4.245 20 0 DIADMP CC(C)CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000482011508 1048542793 /nfs/dbraw/zinc/54/27/93/1048542793.db2.gz SRQKNWXQSJBBOF-JENIJYKNSA-N 2 1 318.505 4.245 20 0 DIADMP Cc1ccc(C[C@@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000482321610 1048588266 /nfs/dbraw/zinc/58/82/66/1048588266.db2.gz PTWVKQNZXZQYPW-PZJWPPBQSA-N 2 1 314.517 4.026 20 0 DIADMP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000482352179 1048591962 /nfs/dbraw/zinc/59/19/62/1048591962.db2.gz AIVMOGZNBUIYGH-AZUAARDMSA-N 2 1 320.496 4.103 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000482448288 1048609374 /nfs/dbraw/zinc/60/93/74/1048609374.db2.gz FSCJAPCJWSDSRQ-FPOVZHCZSA-N 2 1 322.496 4.210 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC001176282403 1048617535 /nfs/dbraw/zinc/61/75/35/1048617535.db2.gz XLZRGNUEWIFZKF-CABCVRRESA-N 2 1 315.848 4.007 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC001176282403 1048617539 /nfs/dbraw/zinc/61/75/39/1048617539.db2.gz XLZRGNUEWIFZKF-CABCVRRESA-N 2 1 315.848 4.007 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000482569354 1048635993 /nfs/dbraw/zinc/63/59/93/1048635993.db2.gz NWNAAIGBTHETDX-SFHVURJKSA-N 2 1 306.881 4.255 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000850381624 1048645149 /nfs/dbraw/zinc/64/51/49/1048645149.db2.gz HUXKJJCVSZVIBI-RBSFLKMASA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000850381624 1048645152 /nfs/dbraw/zinc/64/51/52/1048645152.db2.gz HUXKJJCVSZVIBI-RBSFLKMASA-N 2 1 318.427 4.104 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(Nc2cccc(C[NH2+]C)c2)nc1 ZINC001165141179 1048661034 /nfs/dbraw/zinc/66/10/34/1048661034.db2.gz OIRQQKWOUYRNQU-IBGZPJMESA-N 2 1 324.472 4.092 20 0 DIADMP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc2ccccc2n1 ZINC000483149793 1048748047 /nfs/dbraw/zinc/74/80/47/1048748047.db2.gz BNCOXWMRXMCHJA-BEFAXECRSA-N 2 1 313.489 4.252 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@]1(C)Cc1cccs1 ZINC001176665752 1048753061 /nfs/dbraw/zinc/75/30/61/1048753061.db2.gz XZQBKYLYNUSSLJ-SFHVURJKSA-N 2 1 317.502 4.130 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@]1(C)Cc1cccs1 ZINC001176665752 1048753072 /nfs/dbraw/zinc/75/30/72/1048753072.db2.gz XZQBKYLYNUSSLJ-SFHVURJKSA-N 2 1 317.502 4.130 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001206715503 1048753563 /nfs/dbraw/zinc/75/35/63/1048753563.db2.gz STTBLYFVALWRNF-XBMUEBEBSA-N 2 1 312.501 4.238 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001206715503 1048753579 /nfs/dbraw/zinc/75/35/79/1048753579.db2.gz STTBLYFVALWRNF-XBMUEBEBSA-N 2 1 312.501 4.238 20 0 DIADMP CCC[C@@H](C)[C@H](CC)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000483202808 1048754887 /nfs/dbraw/zinc/75/48/87/1048754887.db2.gz RLGSFRXSYRGDCJ-QAPCUYQASA-N 2 1 303.494 4.163 20 0 DIADMP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1cc(F)c(F)c(F)c1 ZINC000483205035 1048754925 /nfs/dbraw/zinc/75/49/25/1048754925.db2.gz UDYRKXMIDFUSEF-NHYWBVRUSA-N 2 1 316.411 4.121 20 0 DIADMP CC(C)Cc1ccccc1C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC001190732166 1048781467 /nfs/dbraw/zinc/78/14/67/1048781467.db2.gz WYCBJYASAHZWRK-UHFFFAOYSA-N 2 1 302.506 4.190 20 0 DIADMP CCC[C@H]1CCC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001176782417 1048786670 /nfs/dbraw/zinc/78/66/70/1048786670.db2.gz CUWQFVFGPXMOSP-FQEVSTJZSA-N 2 1 300.490 4.437 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCc3cccc4ccccc43)CC[C@@H]21 ZINC000483494400 1048807745 /nfs/dbraw/zinc/80/77/45/1048807745.db2.gz USAFJNDUOPKTFG-UNMCSNQZSA-N 2 1 322.496 4.189 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCc3cccc4ccccc43)CC[C@@H]21 ZINC000483494400 1048807757 /nfs/dbraw/zinc/80/77/57/1048807757.db2.gz USAFJNDUOPKTFG-UNMCSNQZSA-N 2 1 322.496 4.189 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)C1CCCCC1 ZINC000483500272 1048809457 /nfs/dbraw/zinc/80/94/57/1048809457.db2.gz HCQFQIQSFBECMM-LJQANCHMSA-N 2 1 315.505 4.307 20 0 DIADMP Cc1cc(-n2ccnc2)ccc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000483531109 1048814506 /nfs/dbraw/zinc/81/45/06/1048814506.db2.gz LJPXQCFAFINQLM-OAHLLOKOSA-N 2 1 311.454 4.435 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000483724067 1048847607 /nfs/dbraw/zinc/84/76/07/1048847607.db2.gz GBPCVQVJOUVGFW-QRFRQXIXSA-N 2 1 318.505 4.245 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000483724067 1048847621 /nfs/dbraw/zinc/84/76/21/1048847621.db2.gz GBPCVQVJOUVGFW-QRFRQXIXSA-N 2 1 318.505 4.245 20 0 DIADMP CCC(CC)C[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC001177257214 1048858241 /nfs/dbraw/zinc/85/82/41/1048858241.db2.gz RGJBXBSGHTUNHH-KRWDZBQOSA-N 2 1 302.506 4.444 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@H](C)[N@@H+]1CCCC[C@H]1C ZINC001177278364 1048865935 /nfs/dbraw/zinc/86/59/35/1048865935.db2.gz WSZSKBBKKISGQU-QRVBRYPASA-N 2 1 302.506 4.108 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@H](C)[N@H+]1CCCC[C@H]1C ZINC001177278364 1048865951 /nfs/dbraw/zinc/86/59/51/1048865951.db2.gz WSZSKBBKKISGQU-QRVBRYPASA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000163383411 1048893379 /nfs/dbraw/zinc/89/33/79/1048893379.db2.gz VXEAFZVPIZNYIE-ILXRZTDVSA-N 2 1 308.432 4.208 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CC[C@H]2CCC[NH+]2C)o1 ZINC001191260077 1048900795 /nfs/dbraw/zinc/90/07/95/1048900795.db2.gz ZFSWUDGQLRVLJI-JZXOWHBKSA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[NH+]2CC[C@H]2CCC[N@@H+]2C)o1 ZINC001191260077 1048900804 /nfs/dbraw/zinc/90/08/04/1048900804.db2.gz ZFSWUDGQLRVLJI-JZXOWHBKSA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[NH+]2CC[C@H]2CCC[N@H+]2C)o1 ZINC001191260077 1048900814 /nfs/dbraw/zinc/90/08/14/1048900814.db2.gz ZFSWUDGQLRVLJI-JZXOWHBKSA-N 2 1 304.478 4.099 20 0 DIADMP C[N@@H+](CCC1=CCCCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191234393 1048905186 /nfs/dbraw/zinc/90/51/86/1048905186.db2.gz SWMLZPBTMBLQFI-OAQYLSRUSA-N 2 1 312.501 4.331 20 0 DIADMP C[NH+](CCC1=CCCCC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191234393 1048905198 /nfs/dbraw/zinc/90/51/98/1048905198.db2.gz SWMLZPBTMBLQFI-OAQYLSRUSA-N 2 1 312.501 4.331 20 0 DIADMP C[NH+](CCC1=CCCCC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191234393 1048905218 /nfs/dbraw/zinc/90/52/18/1048905218.db2.gz SWMLZPBTMBLQFI-OAQYLSRUSA-N 2 1 312.501 4.331 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@@H+]1Cc1ccccc1 ZINC001203504016 1048913956 /nfs/dbraw/zinc/91/39/56/1048913956.db2.gz NPPQEFGYPAFXPC-RKFFNLMFSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@H+]1Cc1ccccc1 ZINC001203504016 1048913963 /nfs/dbraw/zinc/91/39/63/1048913963.db2.gz NPPQEFGYPAFXPC-RKFFNLMFSA-N 2 1 312.501 4.208 20 0 DIADMP Cc1ccccc1C1CC([NH+](CC[C@@H]2CCC[N@@H+]2C)C2CC2)C1 ZINC001191329830 1048927712 /nfs/dbraw/zinc/92/77/12/1048927712.db2.gz KJGINSLRTKQJPC-FDYSRKEFSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1ccccc1C1CC([N@H+](CC[C@@H]2CCC[NH+]2C)C2CC2)C1 ZINC001191329830 1048927720 /nfs/dbraw/zinc/92/77/20/1048927720.db2.gz KJGINSLRTKQJPC-FDYSRKEFSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1ccccc1C1CC([N@@H+](CC[C@@H]2CCC[NH+]2C)C2CC2)C1 ZINC001191329830 1048927730 /nfs/dbraw/zinc/92/77/30/1048927730.db2.gz KJGINSLRTKQJPC-FDYSRKEFSA-N 2 1 312.501 4.190 20 0 DIADMP CC(C)CCC[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001191382376 1048930422 /nfs/dbraw/zinc/93/04/22/1048930422.db2.gz WPBRLVGERLIMKM-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001191382376 1048930429 /nfs/dbraw/zinc/93/04/29/1048930429.db2.gz WPBRLVGERLIMKM-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001191382376 1048930436 /nfs/dbraw/zinc/93/04/36/1048930436.db2.gz WPBRLVGERLIMKM-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001191382376 1048930443 /nfs/dbraw/zinc/93/04/43/1048930443.db2.gz WPBRLVGERLIMKM-UYAOXDASSA-N 2 1 302.506 4.408 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001191382389 1048930470 /nfs/dbraw/zinc/93/04/70/1048930470.db2.gz WQVJDEBPIKLVTI-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001191382389 1048930473 /nfs/dbraw/zinc/93/04/73/1048930473.db2.gz WQVJDEBPIKLVTI-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382389 1048930476 /nfs/dbraw/zinc/93/04/76/1048930476.db2.gz WQVJDEBPIKLVTI-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382389 1048930479 /nfs/dbraw/zinc/93/04/79/1048930479.db2.gz WQVJDEBPIKLVTI-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001191368035 1048935958 /nfs/dbraw/zinc/93/59/58/1048935958.db2.gz WMNSFFYKRAFIED-MOPGFXCFSA-N 2 1 302.506 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001191368035 1048935972 /nfs/dbraw/zinc/93/59/72/1048935972.db2.gz WMNSFFYKRAFIED-MOPGFXCFSA-N 2 1 302.506 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001191368035 1048935986 /nfs/dbraw/zinc/93/59/86/1048935986.db2.gz WMNSFFYKRAFIED-MOPGFXCFSA-N 2 1 302.506 4.337 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001177733554 1048936433 /nfs/dbraw/zinc/93/64/33/1048936433.db2.gz NTICDWSDQLNEBZ-ROUUACIJSA-N 2 1 318.549 4.483 20 0 DIADMP CC[NH+](CC)C[C@@H](C)[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001177733553 1048936811 /nfs/dbraw/zinc/93/68/11/1048936811.db2.gz NTICDWSDQLNEBZ-QZTJIDSGSA-N 2 1 318.549 4.483 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(OC(C)(C)C)c2)C1 ZINC001177744651 1048939529 /nfs/dbraw/zinc/93/95/29/1048939529.db2.gz YTUCSAGXOQCMRX-GOSISDBHSA-N 2 1 318.505 4.074 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000484486097 1048944808 /nfs/dbraw/zinc/94/48/08/1048944808.db2.gz FCRABZDRBBVSHN-ARFHVFGLSA-N 2 1 300.446 4.265 20 0 DIADMP CC(C)CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191522075 1048956729 /nfs/dbraw/zinc/95/67/29/1048956729.db2.gz ZUOMUALVNQSYEQ-WOJBJXKFSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191522075 1048956743 /nfs/dbraw/zinc/95/67/43/1048956743.db2.gz ZUOMUALVNQSYEQ-WOJBJXKFSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191522075 1048956757 /nfs/dbraw/zinc/95/67/57/1048956757.db2.gz ZUOMUALVNQSYEQ-WOJBJXKFSA-N 2 1 300.490 4.019 20 0 DIADMP CC[N@H+](Cc1ccccc1)C1CC[NH+](Cc2ccccc2C)CC1 ZINC001203706506 1048970693 /nfs/dbraw/zinc/97/06/93/1048970693.db2.gz GKLPRKHDNQFIOA-UHFFFAOYSA-N 2 1 322.496 4.482 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](Cc2ccccc2C)CC1 ZINC001203706506 1048970707 /nfs/dbraw/zinc/97/07/07/1048970707.db2.gz GKLPRKHDNQFIOA-UHFFFAOYSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c1 ZINC001203747403 1048989077 /nfs/dbraw/zinc/98/90/77/1048989077.db2.gz FSNWXECESWGZEK-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c1 ZINC001203747403 1048989088 /nfs/dbraw/zinc/98/90/88/1048989088.db2.gz FSNWXECESWGZEK-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc(Cl)c1 ZINC001203801388 1048999875 /nfs/dbraw/zinc/99/98/75/1048999875.db2.gz RCDFYKOUUZZXOT-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc(Cl)c1 ZINC001203801388 1048999891 /nfs/dbraw/zinc/99/98/91/1048999891.db2.gz RCDFYKOUUZZXOT-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1 ZINC001203801388 1048999903 /nfs/dbraw/zinc/99/99/03/1048999903.db2.gz RCDFYKOUUZZXOT-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC001203801388 1048999915 /nfs/dbraw/zinc/99/99/15/1048999915.db2.gz RCDFYKOUUZZXOT-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH2+]C[C@H]4CC=CCC4)[C@H]3C2)cc1 ZINC001178285412 1049012783 /nfs/dbraw/zinc/01/27/83/1049012783.db2.gz QELSUCHLRVGEFG-JKLQHZFJSA-N 2 1 324.512 4.233 20 0 DIADMP Cc1c2ccccc2sc1[C@@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001178436395 1049031548 /nfs/dbraw/zinc/03/15/48/1049031548.db2.gz HMUJGASCWFEOOG-OAGGEKHMSA-N 2 1 314.498 4.487 20 0 DIADMP Cc1cc2cc(C[NH2+]CC[C@@H](C)[NH+]3CCCCC3)oc2cc1C ZINC001178463398 1049043408 /nfs/dbraw/zinc/04/34/08/1049043408.db2.gz OPAGIYPFZOKZKM-QGZVFWFLSA-N 2 1 314.473 4.404 20 0 DIADMP Cc1ccc(CN2CCC([N@@H+](C)Cc3ccccc3)CC2)s1 ZINC001204033300 1049065763 /nfs/dbraw/zinc/06/57/63/1049065763.db2.gz POIRTPJPSZLOHM-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001178629684 1049068793 /nfs/dbraw/zinc/06/87/93/1049068793.db2.gz SBSXSLXSHOVYPG-ZWKOTPCHSA-N 2 1 318.549 4.483 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001192326980 1049079262 /nfs/dbraw/zinc/07/92/62/1049079262.db2.gz YRBSMVXUFLAAJZ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001192326980 1049079276 /nfs/dbraw/zinc/07/92/76/1049079276.db2.gz YRBSMVXUFLAAJZ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001192326980 1049079291 /nfs/dbraw/zinc/07/92/91/1049079291.db2.gz YRBSMVXUFLAAJZ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001192326980 1049079302 /nfs/dbraw/zinc/07/93/02/1049079302.db2.gz YRBSMVXUFLAAJZ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001204174650 1049104735 /nfs/dbraw/zinc/10/47/35/1049104735.db2.gz ZMOSXPYDDAAHCB-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC001204174650 1049104739 /nfs/dbraw/zinc/10/47/39/1049104739.db2.gz ZMOSXPYDDAAHCB-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC001204174650 1049104747 /nfs/dbraw/zinc/10/47/47/1049104747.db2.gz ZMOSXPYDDAAHCB-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(-c3ccccc3)s2)C1 ZINC001178916610 1049109241 /nfs/dbraw/zinc/10/92/41/1049109241.db2.gz JTHVLQNJEZCLQP-INIZCTEOSA-N 2 1 314.498 4.237 20 0 DIADMP c1cc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc(C2CCCC2)c1 ZINC001204196257 1049109797 /nfs/dbraw/zinc/10/97/97/1049109797.db2.gz SVJDFZMCHDRAJU-IBGZPJMESA-N 2 1 312.501 4.262 20 0 DIADMP c1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc(C2CCCC2)c1 ZINC001204196257 1049109805 /nfs/dbraw/zinc/10/98/05/1049109805.db2.gz SVJDFZMCHDRAJU-IBGZPJMESA-N 2 1 312.501 4.262 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC[C@@H]2CCC[N@@H+](C)C2)C1 ZINC001178917148 1049109874 /nfs/dbraw/zinc/10/98/74/1049109874.db2.gz UXAYZDNLVHUAMV-MMKMLUHNSA-N 2 1 314.517 4.280 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(C)cc(Cl)cc2C)C[C@H]1C ZINC001204238197 1049118640 /nfs/dbraw/zinc/11/86/40/1049118640.db2.gz OZCPPJHOUHPMPY-WBVHZDCISA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@H]1C ZINC001204238197 1049118644 /nfs/dbraw/zinc/11/86/44/1049118644.db2.gz OZCPPJHOUHPMPY-WBVHZDCISA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@H]1C ZINC001204238197 1049118647 /nfs/dbraw/zinc/11/86/47/1049118647.db2.gz OZCPPJHOUHPMPY-WBVHZDCISA-N 2 1 308.897 4.261 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH2+]CCC[N@H+](C)CC(C)C)c(C)c1 ZINC001179081137 1049128630 /nfs/dbraw/zinc/12/86/30/1049128630.db2.gz ASPKQQOWNYOILV-VQHVLOKHSA-N 2 1 302.506 4.193 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001192909248 1049146795 /nfs/dbraw/zinc/14/67/95/1049146795.db2.gz GRWKRHUIAUYEDQ-FQEVSTJZSA-N 2 1 314.448 4.470 20 0 DIADMP Cc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC001192917281 1049148684 /nfs/dbraw/zinc/14/86/84/1049148684.db2.gz ABLUBMIZJWSITC-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP Cc1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC001192917281 1049148688 /nfs/dbraw/zinc/14/86/88/1049148688.db2.gz ABLUBMIZJWSITC-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@@H+]1C ZINC001204608911 1049198576 /nfs/dbraw/zinc/19/85/76/1049198576.db2.gz LIGDXASZJRXRCP-KXBFYZLASA-N 2 1 312.501 4.356 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@H+]1C ZINC001204608911 1049198579 /nfs/dbraw/zinc/19/85/79/1049198579.db2.gz LIGDXASZJRXRCP-KXBFYZLASA-N 2 1 312.501 4.356 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608911 1049198583 /nfs/dbraw/zinc/19/85/83/1049198583.db2.gz LIGDXASZJRXRCP-KXBFYZLASA-N 2 1 312.501 4.356 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608911 1049198585 /nfs/dbraw/zinc/19/85/85/1049198585.db2.gz LIGDXASZJRXRCP-KXBFYZLASA-N 2 1 312.501 4.356 20 0 DIADMP CC(C)(C)[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccccc1 ZINC001204604420 1049198811 /nfs/dbraw/zinc/19/88/11/1049198811.db2.gz NIYBKFDHLJZWRX-UHFFFAOYSA-N 2 1 314.498 4.195 20 0 DIADMP C[N@@H+](Cc1ccc(C[NH3+])cc1)C(c1ccccc1)c1ccccc1 ZINC001204646613 1049211832 /nfs/dbraw/zinc/21/18/32/1049211832.db2.gz WWMNBDLSAVKQDU-UHFFFAOYSA-N 2 1 316.448 4.367 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@@H]3CC[C@H]4C[N@H+](C)C[C@H]43)c2)cc1 ZINC001179815311 1049211895 /nfs/dbraw/zinc/21/18/95/1049211895.db2.gz FXQWNFBTOPEUNU-BHDDXSALSA-N 2 1 320.480 4.092 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1csc2ccccc12 ZINC000858128158 1049220439 /nfs/dbraw/zinc/22/04/39/1049220439.db2.gz CIRVMHXBTNFFBV-KBPBESRZSA-N 2 1 302.487 4.425 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](C3c4ccccc4-c4ccccc43)CC[C@@H]21 ZINC000485335776 1049222660 /nfs/dbraw/zinc/22/26/60/1049222660.db2.gz GQCAAPFTYMNWOC-IERDGZPVSA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](C3c4ccccc4-c4ccccc43)CC[C@@H]21 ZINC000485335776 1049222671 /nfs/dbraw/zinc/22/26/71/1049222671.db2.gz GQCAAPFTYMNWOC-IERDGZPVSA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](C3c4ccccc4-c4ccccc43)CC[C@@H]21 ZINC000485335776 1049222683 /nfs/dbraw/zinc/22/26/83/1049222683.db2.gz GQCAAPFTYMNWOC-IERDGZPVSA-N 2 1 318.464 4.173 20 0 DIADMP C[C@@H](CC1CCCCC1)C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001179878331 1049225069 /nfs/dbraw/zinc/22/50/69/1049225069.db2.gz OIVJZOHLSATOHT-AZUAARDMSA-N 2 1 306.538 4.401 20 0 DIADMP C[N@H+]1CCc2ccc(Nc3ccc(C[NH2+]C(C)(C)C)cc3)cc2C1 ZINC001204706460 1049233648 /nfs/dbraw/zinc/23/36/48/1049233648.db2.gz VVJZLMCBZJQBOI-UHFFFAOYSA-N 2 1 323.484 4.306 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@H](C)c2nccc3ccccc32)CC1 ZINC001204713368 1049237445 /nfs/dbraw/zinc/23/74/45/1049237445.db2.gz CTAHLYMFKGIPQD-MRXNPFEDSA-N 2 1 311.473 4.102 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@H](C)c2nccc3ccccc32)CC1 ZINC001204713368 1049237455 /nfs/dbraw/zinc/23/74/55/1049237455.db2.gz CTAHLYMFKGIPQD-MRXNPFEDSA-N 2 1 311.473 4.102 20 0 DIADMP CC(C)(C)C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000195651631 1049245048 /nfs/dbraw/zinc/24/50/48/1049245048.db2.gz AYGFKBGUGFIVOD-LPHOPBHVSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)cc2)o1 ZINC001204743000 1049248773 /nfs/dbraw/zinc/24/87/73/1049248773.db2.gz WORZWOLEQBBDEB-UHFFFAOYSA-N 2 1 324.468 4.221 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H](C)C2CCCCC2)CC1 ZINC001193869987 1049276857 /nfs/dbraw/zinc/27/68/57/1049276857.db2.gz CAHSRMSKXCQXJP-QGZVFWFLSA-N 2 1 316.489 4.450 20 0 DIADMP C[N@H+](Cc1ccc(C[NH3+])cc1)Cc1ccc(Cl)cc1Cl ZINC001204869790 1049291618 /nfs/dbraw/zinc/29/16/18/1049291618.db2.gz JJFGAWDSHZDHOW-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP C[N@@H+](Cc1ccc(C[NH3+])cc1)Cc1ccc(Cl)cc1Cl ZINC001204869790 1049291626 /nfs/dbraw/zinc/29/16/26/1049291626.db2.gz JJFGAWDSHZDHOW-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2C(C)=CCC[C@@H]2C)CC1 ZINC001180125293 1049293080 /nfs/dbraw/zinc/29/30/80/1049293080.db2.gz XBNDWXROYYGJCP-AZUAARDMSA-N 2 1 306.538 4.423 20 0 DIADMP C[C@@H]1CCC[N@H+]1Cc1cccc(-c2cncc([C@H]3CCC[NH2+]3)c2)c1 ZINC000906157201 1049293287 /nfs/dbraw/zinc/29/32/87/1049293287.db2.gz DOAFLNHTWIFXJE-IIBYNOLFSA-N 2 1 321.468 4.157 20 0 DIADMP CC(C)[C@@H](C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001180147114 1049298181 /nfs/dbraw/zinc/29/81/81/1049298181.db2.gz DOCXVJOZSAANTL-LEWJYISDSA-N 2 1 314.517 4.377 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001204924882 1049311795 /nfs/dbraw/zinc/31/17/95/1049311795.db2.gz CRIUYICGBUCHDL-KRWDZBQOSA-N 2 1 319.452 4.148 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001204924882 1049311800 /nfs/dbraw/zinc/31/18/00/1049311800.db2.gz CRIUYICGBUCHDL-KRWDZBQOSA-N 2 1 319.452 4.148 20 0 DIADMP C[C@@H](c1nc2ccccc2o1)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859213516 1049319121 /nfs/dbraw/zinc/31/91/21/1049319121.db2.gz WIOPFXWBHXAKIK-HNNXBMFYSA-N 2 1 323.440 4.082 20 0 DIADMP C[C@@H](c1nc2ccccc2o1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859213516 1049319131 /nfs/dbraw/zinc/31/91/31/1049319131.db2.gz WIOPFXWBHXAKIK-HNNXBMFYSA-N 2 1 323.440 4.082 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@@H](C)C(C)(C)C)C2)s1 ZINC001194152404 1049329250 /nfs/dbraw/zinc/32/92/50/1049329250.db2.gz AHAIHVHYWMVENF-WBVHZDCISA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@@H](C)C(C)(C)C)C2)s1 ZINC001194152404 1049329257 /nfs/dbraw/zinc/32/92/57/1049329257.db2.gz AHAIHVHYWMVENF-WBVHZDCISA-N 2 1 322.562 4.492 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](C[C@H]2CC=C(CCC=C(C)C)CC2)C1 ZINC001205001192 1049337713 /nfs/dbraw/zinc/33/77/13/1049337713.db2.gz PBSSNCHGUXDPHL-PMACEKPBSA-N 2 1 304.522 4.391 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](C[C@@H]2CC=C(CCC=C(C)C)CC2)C1 ZINC001205001195 1049337823 /nfs/dbraw/zinc/33/78/23/1049337823.db2.gz PBSSNCHGUXDPHL-WOJBJXKFSA-N 2 1 304.522 4.391 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CCC[C@H](C[NH2+]C)C2)s1 ZINC001205016239 1049344194 /nfs/dbraw/zinc/34/41/94/1049344194.db2.gz HJKKTNOZFSGUNS-MRXNPFEDSA-N 2 1 308.535 4.302 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001205018351 1049344328 /nfs/dbraw/zinc/34/43/28/1049344328.db2.gz TVGNHJWNNSMZEG-GOSISDBHSA-N 2 1 300.490 4.166 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2sc3scc(C)c3c2C)C1 ZINC001205016177 1049344528 /nfs/dbraw/zinc/34/45/28/1049344528.db2.gz GDUXATDSWNTKGA-CYBMUJFWSA-N 2 1 308.516 4.011 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CCC[C@@H](C[NH2+]C)C2)s1 ZINC001205016237 1049344675 /nfs/dbraw/zinc/34/46/75/1049344675.db2.gz HJKKTNOZFSGUNS-INIZCTEOSA-N 2 1 308.535 4.302 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000485871604 1049358657 /nfs/dbraw/zinc/35/86/57/1049358657.db2.gz QDKALBRYKRIHOZ-NJDAHSKKSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000485871604 1049358668 /nfs/dbraw/zinc/35/86/68/1049358668.db2.gz QDKALBRYKRIHOZ-NJDAHSKKSA-N 2 1 323.484 4.240 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001205068721 1049360274 /nfs/dbraw/zinc/36/02/74/1049360274.db2.gz NERMVZJHYWXVMJ-RDJZCZTQSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001205068721 1049360286 /nfs/dbraw/zinc/36/02/86/1049360286.db2.gz NERMVZJHYWXVMJ-RDJZCZTQSA-N 2 1 319.452 4.147 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)CC1 ZINC001205109064 1049379667 /nfs/dbraw/zinc/37/96/67/1049379667.db2.gz ADMMVQDGOINCEY-MHNQQFQPSA-N 2 1 306.453 4.170 20 0 DIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CCC[C@@H]([NH3+])CC2)cc1 ZINC001205117150 1049383835 /nfs/dbraw/zinc/38/38/35/1049383835.db2.gz LYGADLIBARGQFT-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP CC[C@H](Cc1cccs1)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001180795320 1049404856 /nfs/dbraw/zinc/40/48/56/1049404856.db2.gz VAOFBKHSIWGBLT-GVDBMIGSSA-N 2 1 320.546 4.312 20 0 DIADMP Cc1ccc(-c2ccccc2C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c(C)c1 ZINC001180792797 1049405318 /nfs/dbraw/zinc/40/53/18/1049405318.db2.gz DWHWOPGHHWYPOG-LJQANCHMSA-N 2 1 322.496 4.354 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)CC1 ZINC001205266673 1049421468 /nfs/dbraw/zinc/42/14/68/1049421468.db2.gz VTWOXFGHMFMQBX-FQEVSTJZSA-N 2 1 312.432 4.196 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC001205274311 1049423430 /nfs/dbraw/zinc/42/34/30/1049423430.db2.gz VFIGZRYJXOLDJW-GOSISDBHSA-N 2 1 300.471 4.118 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)CC1 ZINC001205273282 1049423527 /nfs/dbraw/zinc/42/35/27/1049423527.db2.gz JLWVQCYQPUCCCX-FQEVSTJZSA-N 2 1 308.425 4.289 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccccc2-c2cccs2)CC1 ZINC001205273228 1049423624 /nfs/dbraw/zinc/42/36/24/1049423624.db2.gz IJVFEFGHMDLLPX-GOSISDBHSA-N 2 1 300.471 4.118 20 0 DIADMP COc1ccccc1-c1ccc(C[N@H+]2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205274572 1049423999 /nfs/dbraw/zinc/42/39/99/1049423999.db2.gz XXYAXYZOKCGFMS-NRFANRHFSA-N 2 1 324.468 4.066 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccccc2CCc2ccccc2)CC1 ZINC001205288183 1049428921 /nfs/dbraw/zinc/42/89/21/1049428921.db2.gz HUVPCUIAJWLPIH-QFIPXVFZSA-N 2 1 322.496 4.175 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C[C@@H]1C[NH3+] ZINC001205304779 1049432795 /nfs/dbraw/zinc/43/27/95/1049432795.db2.gz PQUYSVDVFUFLLP-HIFRSBDPSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc2ccccc2[nH]1 ZINC000775621356 1049446165 /nfs/dbraw/zinc/44/61/65/1049446165.db2.gz KRFMVHXUCXSHRY-IRXDYDNUSA-N 2 1 313.489 4.331 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H](C2CC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385831 1049455958 /nfs/dbraw/zinc/45/59/58/1049455958.db2.gz RRTLIPQRFTWZPZ-DSLXNQLJSA-N 2 1 304.522 4.198 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486699166 1049457672 /nfs/dbraw/zinc/45/76/72/1049457672.db2.gz WOHJFCPXZMTTJZ-OAHLLOKOSA-N 2 1 317.452 4.051 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)C/C=C\c1ccc(F)cc1F ZINC001181506913 1049486516 /nfs/dbraw/zinc/48/65/16/1049486516.db2.gz WYOSAGJRSYOEEF-CLFYSBASSA-N 2 1 310.432 4.032 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)C/C=C\c1ccc(F)cc1F ZINC001181506913 1049486524 /nfs/dbraw/zinc/48/65/24/1049486524.db2.gz WYOSAGJRSYOEEF-CLFYSBASSA-N 2 1 310.432 4.032 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccccc2)C1(C)C ZINC001195250620 1049502774 /nfs/dbraw/zinc/50/27/74/1049502774.db2.gz MUXYQQVBILIKLH-LJQANCHMSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccccc2)C1(C)C ZINC001195250620 1049502787 /nfs/dbraw/zinc/50/27/87/1049502787.db2.gz MUXYQQVBILIKLH-LJQANCHMSA-N 2 1 311.473 4.240 20 0 DIADMP C[C@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)CC[C@@H]1C[NH3+] ZINC001205599844 1049506671 /nfs/dbraw/zinc/50/66/71/1049506671.db2.gz AIQTXPYRVQRCCY-GHTZIAJQSA-N 2 1 322.496 4.125 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC[C@H]1C[NH3+] ZINC001205604447 1049509436 /nfs/dbraw/zinc/50/94/36/1049509436.db2.gz VROGDSQVSUUWDL-MJGOQNOKSA-N 2 1 324.468 4.286 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+]CCCc1c(Cl)cccc1Cl ZINC001205640103 1049519032 /nfs/dbraw/zinc/51/90/32/1049519032.db2.gz WIBPRGWWLDJHMZ-CYBMUJFWSA-N 2 1 317.304 4.246 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)c1Cl ZINC001205672157 1049528894 /nfs/dbraw/zinc/52/88/94/1049528894.db2.gz UCDAURZILNZIBS-ZDUSSCGKSA-N 2 1 315.288 4.122 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@@H]2CC[N@H+](C(C)C)C2)c1Cl ZINC001205672157 1049528908 /nfs/dbraw/zinc/52/89/08/1049528908.db2.gz UCDAURZILNZIBS-ZDUSSCGKSA-N 2 1 315.288 4.122 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205678913 1049530686 /nfs/dbraw/zinc/53/06/86/1049530686.db2.gz WKPGSNCNNJNUIC-FXAWDEMLSA-N 2 1 300.490 4.172 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)[C@@H](C)c1nccc2ccccc21 ZINC001205685227 1049532272 /nfs/dbraw/zinc/53/22/72/1049532272.db2.gz RTUYGONXIKNVPE-KRWDZBQOSA-N 2 1 313.489 4.350 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702946 1049538099 /nfs/dbraw/zinc/53/80/99/1049538099.db2.gz RYBIFXCSSIBDKO-QUCCMNQESA-N 2 1 314.517 4.409 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702946 1049538112 /nfs/dbraw/zinc/53/81/12/1049538112.db2.gz RYBIFXCSSIBDKO-QUCCMNQESA-N 2 1 314.517 4.409 20 0 DIADMP C[C@@H](C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1)C(C)(C)C ZINC001205702802 1049538277 /nfs/dbraw/zinc/53/82/77/1049538277.db2.gz OPRROTLIHHBADD-KRWDZBQOSA-N 2 1 302.506 4.265 20 0 DIADMP C[C@@H](C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1)C(C)(C)C ZINC001205702802 1049538285 /nfs/dbraw/zinc/53/82/85/1049538285.db2.gz OPRROTLIHHBADD-KRWDZBQOSA-N 2 1 302.506 4.265 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703140 1049538807 /nfs/dbraw/zinc/53/88/07/1049538807.db2.gz WTCWQDQUDHBVHY-DNVCBOLYSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703140 1049538822 /nfs/dbraw/zinc/53/88/22/1049538822.db2.gz WTCWQDQUDHBVHY-DNVCBOLYSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703140 1049538840 /nfs/dbraw/zinc/53/88/40/1049538840.db2.gz WTCWQDQUDHBVHY-DNVCBOLYSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703140 1049538855 /nfs/dbraw/zinc/53/88/55/1049538855.db2.gz WTCWQDQUDHBVHY-DNVCBOLYSA-N 2 1 322.452 4.358 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H](C)CC[C@H]1C[NH3+] ZINC001205826925 1049575685 /nfs/dbraw/zinc/57/56/85/1049575685.db2.gz DMXNXRIUUBAYRI-APWZRJJASA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1C[C@H](C)CC[C@H]1C[NH3+] ZINC001205826925 1049575697 /nfs/dbraw/zinc/57/56/97/1049575697.db2.gz DMXNXRIUUBAYRI-APWZRJJASA-N 2 1 308.469 4.221 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001205904724 1049596073 /nfs/dbraw/zinc/59/60/73/1049596073.db2.gz WSPZEDGHCWAMJZ-SJORKVTESA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001205903627 1049596471 /nfs/dbraw/zinc/59/64/71/1049596471.db2.gz QJKQSECGOOLPPL-UKRRQHHQSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001205903869 1049597789 /nfs/dbraw/zinc/59/77/89/1049597789.db2.gz RLVVEMLEKFHZBZ-CABCVRRESA-N 2 1 308.425 4.145 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@H](C[NH3+])[C@H]1C ZINC001205902840 1049598324 /nfs/dbraw/zinc/59/83/24/1049598324.db2.gz LYBDFVRKINKUJY-QZTJIDSGSA-N 2 1 318.505 4.205 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]CC[C@H](C)c1ccccc1 ZINC001205927897 1049605007 /nfs/dbraw/zinc/60/50/07/1049605007.db2.gz ZQFVQIYNRXNKQB-ICSRJNTNSA-N 2 1 302.506 4.280 20 0 DIADMP C[C@H](Nc1cccc2cc[nH+]cc21)c1cccc(C[NH+](C)C)c1 ZINC000864004135 1049613241 /nfs/dbraw/zinc/61/32/41/1049613241.db2.gz KVDQFUVWWFXGEQ-HNNXBMFYSA-N 2 1 305.425 4.470 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(Oc3ccccc3)c2)CCC[C@H]1C[NH3+] ZINC001205995805 1049620904 /nfs/dbraw/zinc/62/09/04/1049620904.db2.gz QPGWHGSPAKDTDV-MJGOQNOKSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2-c2cccs2)CCC[C@H]1C[NH3+] ZINC001206004788 1049626083 /nfs/dbraw/zinc/62/60/83/1049626083.db2.gz VKVOTWFHOYPYTQ-HOTGVXAUSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c1Cl ZINC001206027319 1049631865 /nfs/dbraw/zinc/63/18/65/1049631865.db2.gz WDQQWDHGKGDYIU-OLZOCXBDSA-N 2 1 315.288 4.109 20 0 DIADMP CC1(C)CCC[C@H]1[C@H]1CC[N@@H+](Cc2cc3c(s2)CC[NH2+]C3)C1 ZINC000864049272 1049638073 /nfs/dbraw/zinc/63/80/73/1049638073.db2.gz CYXXXGSHERKCEL-YOEHRIQHSA-N 2 1 318.530 4.042 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC000488368225 1049642591 /nfs/dbraw/zinc/64/25/91/1049642591.db2.gz QBTMEUXZVXMAAA-AFYVEPGGSA-N 2 1 300.490 4.033 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+]C[C@@H](C)CSc1ccccc1C ZINC001196367573 1049646515 /nfs/dbraw/zinc/64/65/15/1049646515.db2.gz MDJFQLYVBFKYGD-MRXNPFEDSA-N 2 1 322.562 4.433 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]C[C@@H](C)CSc1ccccc1C ZINC001196367573 1049646522 /nfs/dbraw/zinc/64/65/22/1049646522.db2.gz MDJFQLYVBFKYGD-MRXNPFEDSA-N 2 1 322.562 4.433 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+]C[C@H](C)CSc1ccccc1C ZINC001196367572 1049647380 /nfs/dbraw/zinc/64/73/80/1049647380.db2.gz MDJFQLYVBFKYGD-INIZCTEOSA-N 2 1 322.562 4.433 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]C[C@H](C)CSc1ccccc1C ZINC001196367572 1049647384 /nfs/dbraw/zinc/64/73/84/1049647384.db2.gz MDJFQLYVBFKYGD-INIZCTEOSA-N 2 1 322.562 4.433 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)CS1 ZINC000488419028 1049648181 /nfs/dbraw/zinc/64/81/81/1049648181.db2.gz ZJBGOBONBXENCW-OALUTQOASA-N 2 1 320.546 4.147 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001182713965 1049704256 /nfs/dbraw/zinc/70/42/56/1049704256.db2.gz IVTPBDIXBDHOES-HXUWFJFHSA-N 2 1 318.480 4.329 20 0 DIADMP CC(C)Oc1ccc(Cl)cc1C[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206304352 1049705506 /nfs/dbraw/zinc/70/55/06/1049705506.db2.gz JCSLHFBPPCHROL-SFHVURJKSA-N 2 1 324.896 4.078 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC1 ZINC001206311028 1049708364 /nfs/dbraw/zinc/70/83/64/1049708364.db2.gz GOTDDVWNNSDFBR-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP CC(C)CCC[NH+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001196961727 1049709380 /nfs/dbraw/zinc/70/93/80/1049709380.db2.gz LLTMGNDNNWNRPX-NHCUHLMSSA-N 2 1 314.517 4.267 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206318908 1049709540 /nfs/dbraw/zinc/70/95/40/1049709540.db2.gz VBQMEPJOENBBLT-MRXNPFEDSA-N 2 1 312.910 4.013 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001206317032 1049710409 /nfs/dbraw/zinc/71/04/09/1049710409.db2.gz BGOYYVUMPITCHC-JOCHJYFZSA-N 2 1 322.496 4.228 20 0 DIADMP COc1cc(C)c(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)cc1C(C)C ZINC001206318952 1049712631 /nfs/dbraw/zinc/71/26/31/1049712631.db2.gz VNVSYYVMLCVYKT-HXUWFJFHSA-N 2 1 318.505 4.078 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)cnc1-c1ccccc1 ZINC001206326456 1049713521 /nfs/dbraw/zinc/71/35/21/1049713521.db2.gz NULDJRAUBZJBEM-NRFANRHFSA-N 2 1 323.484 4.008 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC001206335315 1049715659 /nfs/dbraw/zinc/71/56/59/1049715659.db2.gz GDNXKOOKHXSJIU-YCEFEEMOSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC001206335315 1049715663 /nfs/dbraw/zinc/71/56/63/1049715663.db2.gz GDNXKOOKHXSJIU-YCEFEEMOSA-N 2 1 320.908 4.439 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2ccc(-c3cccs3)cc2)C1 ZINC001206363593 1049721452 /nfs/dbraw/zinc/72/14/52/1049721452.db2.gz YFZVXMJWSWKUPP-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2ccc(-c3cccs3)cc2)C1 ZINC001206363593 1049721458 /nfs/dbraw/zinc/72/14/58/1049721458.db2.gz YFZVXMJWSWKUPP-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[N@H+]1CCCc1cncn1C ZINC001197246816 1049731392 /nfs/dbraw/zinc/73/13/92/1049731392.db2.gz VNJGISSNUJFMBP-VQIMIIECSA-N 2 1 311.473 4.009 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[N@@H+]1CCCc1c[nH+]cn1C ZINC001197246816 1049731399 /nfs/dbraw/zinc/73/13/99/1049731399.db2.gz VNJGISSNUJFMBP-VQIMIIECSA-N 2 1 311.473 4.009 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[N@H+]1CCCc1c[nH+]cn1C ZINC001197246816 1049731406 /nfs/dbraw/zinc/73/14/06/1049731406.db2.gz VNJGISSNUJFMBP-VQIMIIECSA-N 2 1 311.473 4.009 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3cccs3)s2)C1 ZINC001206549377 1049752742 /nfs/dbraw/zinc/75/27/42/1049752742.db2.gz MDEALKFGZQTTPV-KRWDZBQOSA-N 2 1 320.527 4.428 20 0 DIADMP CC(C)Oc1ccc(Cl)cc1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206550037 1049753830 /nfs/dbraw/zinc/75/38/30/1049753830.db2.gz UAQIIKZYPTYGAT-GOSISDBHSA-N 2 1 324.896 4.078 20 0 DIADMP CC(C)Oc1ccc(Cl)cc1C[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206550037 1049753837 /nfs/dbraw/zinc/75/38/37/1049753837.db2.gz UAQIIKZYPTYGAT-GOSISDBHSA-N 2 1 324.896 4.078 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC001206556901 1049755923 /nfs/dbraw/zinc/75/59/23/1049755923.db2.gz ZLQOGQQKOWVCTI-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP CC(C)[N@@H+](Cc1cc2c(cccc2Cl)[nH]1)[C@@H]1CCC[NH2+]CC1 ZINC001206579922 1049760189 /nfs/dbraw/zinc/76/01/89/1049760189.db2.gz AZKZPLCJYUZANF-OAHLLOKOSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206581490 1049761767 /nfs/dbraw/zinc/76/17/67/1049761767.db2.gz JLOYCAUAZBZKJW-MRXNPFEDSA-N 2 1 314.395 4.058 20 0 DIADMP CC(C)[N@@H+](Cc1cc2ccccc2s1)[C@H]1CCC[NH2+]CC1 ZINC001206582257 1049762041 /nfs/dbraw/zinc/76/20/41/1049762041.db2.gz NDLNUZSGPWDXKE-INIZCTEOSA-N 2 1 302.487 4.254 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)CCCO2 ZINC000489518102 1049762702 /nfs/dbraw/zinc/76/27/02/1049762702.db2.gz RLZQBRXDJVQCOA-HHXXYDBFSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)CCCO2 ZINC000489518102 1049762708 /nfs/dbraw/zinc/76/27/08/1049762708.db2.gz RLZQBRXDJVQCOA-HHXXYDBFSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)CCCO2 ZINC000489518102 1049762716 /nfs/dbraw/zinc/76/27/16/1049762716.db2.gz RLZQBRXDJVQCOA-HHXXYDBFSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc(CC[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001206582970 1049762561 /nfs/dbraw/zinc/76/25/61/1049762561.db2.gz QYTLHQSGWPKALX-HXUWFJFHSA-N 2 1 302.506 4.205 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206583835 1049762602 /nfs/dbraw/zinc/76/26/02/1049762602.db2.gz XDEXIJSLKDLSRX-MRXNPFEDSA-N 2 1 314.395 4.058 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2cccc(Cl)c12)[C@@H]1CCC[NH2+]CC1 ZINC001206590039 1049764144 /nfs/dbraw/zinc/76/41/44/1049764144.db2.gz LCKUXJQPWAXXGV-OAHLLOKOSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)COc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001206591066 1049764641 /nfs/dbraw/zinc/76/46/41/1049764641.db2.gz QCKCNZYWFGPITL-LJQANCHMSA-N 2 1 318.505 4.074 20 0 DIADMP Cc1cc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)ccc1OC(C)C ZINC001206599273 1049766010 /nfs/dbraw/zinc/76/60/10/1049766010.db2.gz PVCLZZFOILKSBW-LJQANCHMSA-N 2 1 318.505 4.135 20 0 DIADMP Cc1cc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc(C)c1Cl ZINC001206598736 1049766057 /nfs/dbraw/zinc/76/60/57/1049766057.db2.gz LWXRKAOZFHFQIO-QGZVFWFLSA-N 2 1 308.897 4.309 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1OC(C)(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206599933 1049767553 /nfs/dbraw/zinc/76/75/53/1049767553.db2.gz ZJGMLXYXUIVZPV-SFHVURJKSA-N 2 1 318.505 4.216 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1OC(C)(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206599932 1049767761 /nfs/dbraw/zinc/76/77/61/1049767761.db2.gz ZJGMLXYXUIVZPV-GOSISDBHSA-N 2 1 318.505 4.216 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001206615562 1049769939 /nfs/dbraw/zinc/76/99/39/1049769939.db2.gz IYDQARLSKWVKTC-KRWDZBQOSA-N 2 1 312.432 4.054 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCCC[C@H](C[NH3+])C3)cc2)cc1 ZINC001206624854 1049772662 /nfs/dbraw/zinc/77/26/62/1049772662.db2.gz YZNBQKBWXSFIJD-LJQANCHMSA-N 2 1 308.469 4.223 20 0 DIADMP C1CCC2(C1)CCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001206715756 1049782916 /nfs/dbraw/zinc/78/29/16/1049782916.db2.gz WWIKCATXIPGCDV-MJGOQNOKSA-N 2 1 304.522 4.486 20 0 DIADMP C1CCC2(C1)CCCC[C@@H]2[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001206715756 1049782920 /nfs/dbraw/zinc/78/29/20/1049782920.db2.gz WWIKCATXIPGCDV-MJGOQNOKSA-N 2 1 304.522 4.486 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@@H]3C)cc2)cc1 ZINC001206769669 1049795320 /nfs/dbraw/zinc/79/53/20/1049795320.db2.gz PEIRKWYGUANVRK-HKUYNNGSSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001206769052 1049795421 /nfs/dbraw/zinc/79/54/21/1049795421.db2.gz MZHGNELOLRGWSW-RDJZCZTQSA-N 2 1 312.432 4.052 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490058946 1049797586 /nfs/dbraw/zinc/79/75/86/1049797586.db2.gz TYVLFGICNNOSKP-FXAWDEMLSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490058946 1049797592 /nfs/dbraw/zinc/79/75/92/1049797592.db2.gz TYVLFGICNNOSKP-FXAWDEMLSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)[N@H+](CC[C@@H]3CCCC[NH+]3C)C2)cc1 ZINC000490105580 1049799042 /nfs/dbraw/zinc/79/90/42/1049799042.db2.gz XBPWEQSPNAXYPY-SXLOBPIMSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)[NH+](CC[C@@H]3CCCC[N@@H+]3C)C2)cc1 ZINC000490105580 1049799049 /nfs/dbraw/zinc/79/90/49/1049799049.db2.gz XBPWEQSPNAXYPY-SXLOBPIMSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)[NH+](CC[C@@H]3CCCC[N@H+]3C)C2)cc1 ZINC000490105580 1049799055 /nfs/dbraw/zinc/79/90/55/1049799055.db2.gz XBPWEQSPNAXYPY-SXLOBPIMSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@@H]3C)c2)cc1 ZINC001206806540 1049803034 /nfs/dbraw/zinc/80/30/34/1049803034.db2.gz GNBHMYUTKYWETC-HKUYNNGSSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1C[C@H](C[NH3+])CC[C@@H]1C ZINC001206808150 1049804858 /nfs/dbraw/zinc/80/48/58/1049804858.db2.gz JVUSKSYXGIKUBY-ROUUACIJSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001206810543 1049806625 /nfs/dbraw/zinc/80/66/25/1049806625.db2.gz NUXWHHYTCGIELQ-RYUDHWBXSA-N 2 1 308.878 4.114 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CSc2ccccc2)C(C)C)C1 ZINC000490171208 1049807852 /nfs/dbraw/zinc/80/78/52/1049807852.db2.gz AQBSDVDPTLWIGL-HKUYNNGSSA-N 2 1 320.546 4.125 20 0 DIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167559 1049808825 /nfs/dbraw/zinc/80/88/25/1049808825.db2.gz KQDULMMXUBGWKY-RXVVDRJESA-N 2 1 308.469 4.016 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167559 1049808836 /nfs/dbraw/zinc/80/88/36/1049808836.db2.gz KQDULMMXUBGWKY-RXVVDRJESA-N 2 1 308.469 4.016 20 0 DIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167558 1049809146 /nfs/dbraw/zinc/80/91/46/1049809146.db2.gz KQDULMMXUBGWKY-NQIIRXRSSA-N 2 1 308.469 4.016 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167558 1049809159 /nfs/dbraw/zinc/80/91/59/1049809159.db2.gz KQDULMMXUBGWKY-NQIIRXRSSA-N 2 1 308.469 4.016 20 0 DIADMP Fc1cccc2c1C[N@H+](CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001207291984 1049875233 /nfs/dbraw/zinc/87/52/33/1049875233.db2.gz HRSLCJKGTCDHPA-UHFFFAOYSA-N 2 1 324.443 4.054 20 0 DIADMP Fc1cccc2c1C[N@@H+](CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001207291984 1049875238 /nfs/dbraw/zinc/87/52/38/1049875238.db2.gz HRSLCJKGTCDHPA-UHFFFAOYSA-N 2 1 324.443 4.054 20 0 DIADMP C[C@H]1CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)[C@H]1C ZINC001207290385 1049876094 /nfs/dbraw/zinc/87/60/94/1049876094.db2.gz AYRNYUDKAPWXSG-ROUUACIJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@]1(F)CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001207287639 1049876123 /nfs/dbraw/zinc/87/61/23/1049876123.db2.gz VJSXTALLKLQOSC-FQEVSTJZSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@H]1CCCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207288027 1049876306 /nfs/dbraw/zinc/87/63/06/1049876306.db2.gz ZEDCWSUFWYEHMW-SFHVURJKSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC001207292736 1049876354 /nfs/dbraw/zinc/87/63/54/1049876354.db2.gz YDVYNCIXRULNQA-JOCHJYFZSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491059035 1049883314 /nfs/dbraw/zinc/88/33/14/1049883314.db2.gz QTFJCUCQWDNUEH-QZTJIDSGSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491059035 1049883320 /nfs/dbraw/zinc/88/33/20/1049883320.db2.gz QTFJCUCQWDNUEH-QZTJIDSGSA-N 2 1 318.480 4.475 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)CCc2cccc(Cl)c2)CC1 ZINC001207425752 1049892538 /nfs/dbraw/zinc/89/25/38/1049892538.db2.gz RFGHNPVPMFZPQX-UHFFFAOYSA-N 2 1 308.897 4.079 20 0 DIADMP CCO[C@H](C[NH2+]C1CCCCCCCCCCC1)C[NH+](C)C ZINC001207501771 1049901522 /nfs/dbraw/zinc/90/15/22/1049901522.db2.gz JIGWEFQBUPCZHZ-LJQANCHMSA-N 2 1 312.542 4.216 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)CCCCc2ccccc2)CC1 ZINC001207610714 1049916735 /nfs/dbraw/zinc/91/67/35/1049916735.db2.gz KVUXEZASKZJSIZ-UHFFFAOYSA-N 2 1 302.506 4.062 20 0 DIADMP C[N@@H+](C[C@H]1C[C@H]2C=C[C@@H]1C2)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207626359 1049918420 /nfs/dbraw/zinc/91/84/20/1049918420.db2.gz BGMJMPGFTUVQBX-BHDDXSALSA-N 2 1 324.512 4.043 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000571222465 1049927290 /nfs/dbraw/zinc/92/72/90/1049927290.db2.gz NKQWOXDSPKSTSR-QGZVFWFLSA-N 2 1 321.415 4.008 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168379115 1049936551 /nfs/dbraw/zinc/93/65/51/1049936551.db2.gz DRHIGGRZRVHGTP-IBGZPJMESA-N 2 1 318.892 4.351 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168379115 1049936558 /nfs/dbraw/zinc/93/65/58/1049936558.db2.gz DRHIGGRZRVHGTP-IBGZPJMESA-N 2 1 318.892 4.351 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)c1ccccc1 ZINC001207907760 1049952169 /nfs/dbraw/zinc/95/21/69/1049952169.db2.gz XPJZAOKEIDQFGN-AZUAARDMSA-N 2 1 300.490 4.131 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC001207936197 1049957112 /nfs/dbraw/zinc/95/71/12/1049957112.db2.gz CTZFQXVGKYQQHR-GOSISDBHSA-N 2 1 316.533 4.262 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)CC1 ZINC001207937129 1049958615 /nfs/dbraw/zinc/95/86/15/1049958615.db2.gz HAGZEQUXYYIVGY-RTWAWAEBSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937129 1049958619 /nfs/dbraw/zinc/95/86/19/1049958619.db2.gz HAGZEQUXYYIVGY-RTWAWAEBSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937129 1049958624 /nfs/dbraw/zinc/95/86/24/1049958624.db2.gz HAGZEQUXYYIVGY-RTWAWAEBSA-N 2 1 316.533 4.487 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)o1 ZINC001208155754 1049979120 /nfs/dbraw/zinc/97/91/20/1049979120.db2.gz OKMYHZPEKBZLMO-HKUYNNGSSA-N 2 1 318.505 4.422 20 0 DIADMP C[N@@H+](CCc1cccc(F)c1)C1CC[NH+](C2CCCCC2)CC1 ZINC001208203329 1049985229 /nfs/dbraw/zinc/98/52/29/1049985229.db2.gz QGWIFONBIGKBTQ-UHFFFAOYSA-N 2 1 318.480 4.097 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](CC[C@@H](C)CCCC(C)(C)OC)CC1 ZINC001208214598 1049986790 /nfs/dbraw/zinc/98/67/90/1049986790.db2.gz UYJIVCURSXEGDK-KRWDZBQOSA-N 2 1 312.542 4.024 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)CC[C@@H](C)CCCC(C)(C)OC ZINC001208213862 1049986885 /nfs/dbraw/zinc/98/68/85/1049986885.db2.gz PYAFIFWMKHOQBE-SFHVURJKSA-N 2 1 314.558 4.272 20 0 DIADMP CC[N@H+](Cc1c(F)cccc1Cl)CC1CC[NH+](CC)CC1 ZINC001208599791 1049997520 /nfs/dbraw/zinc/99/75/20/1049997520.db2.gz BQKSRBZVQFYJJD-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP CC(C)(C)C1CC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000572416016 1050001652 /nfs/dbraw/zinc/00/16/52/1050001652.db2.gz JRSMZFFWWQBIHR-UHFFFAOYSA-N 2 1 314.517 4.108 20 0 DIADMP CC/C=C\CC[NH+]1CCC([N@H+](CC)Cc2ccccc2)CC1 ZINC001208729062 1050006582 /nfs/dbraw/zinc/00/65/82/1050006582.db2.gz ISRYYUSPZFOBOZ-WAYWQWQTSA-N 2 1 300.490 4.329 20 0 DIADMP CC/C=C\CC[NH+]1CCC([N@@H+](CC)Cc2ccccc2)CC1 ZINC001208729062 1050006588 /nfs/dbraw/zinc/00/65/88/1050006588.db2.gz ISRYYUSPZFOBOZ-WAYWQWQTSA-N 2 1 300.490 4.329 20 0 DIADMP CC/C=C\CC[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001208733862 1050006673 /nfs/dbraw/zinc/00/66/73/1050006673.db2.gz KSEGSANVUUMGEI-PLNGDYQASA-N 2 1 304.453 4.078 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1CCc1ccc(Cl)cc1 ZINC001208742381 1050008147 /nfs/dbraw/zinc/00/81/47/1050008147.db2.gz QDJGBFYGQLAAIM-RBUKOAKNSA-N 2 1 320.908 4.221 20 0 DIADMP C[C@@H]1CCCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931797 1050024278 /nfs/dbraw/zinc/02/42/78/1050024278.db2.gz MVMFFXHRURRPMO-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931797 1050024283 /nfs/dbraw/zinc/02/42/83/1050024283.db2.gz MVMFFXHRURRPMO-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931797 1050024290 /nfs/dbraw/zinc/02/42/90/1050024290.db2.gz MVMFFXHRURRPMO-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1cccc(C[N@@H+](C)C[C@@H]2CCC[NH+](Cc3ccccc3)C2)c1 ZINC001208934332 1050024407 /nfs/dbraw/zinc/02/44/07/1050024407.db2.gz ZXXHDFYLJWRBAF-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC001208934332 1050024415 /nfs/dbraw/zinc/02/44/15/1050024415.db2.gz ZXXHDFYLJWRBAF-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC001208934332 1050024422 /nfs/dbraw/zinc/02/44/22/1050024422.db2.gz ZXXHDFYLJWRBAF-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP C[N@H+](C[C@H]1CCC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928332 1050024860 /nfs/dbraw/zinc/02/48/60/1050024860.db2.gz FWTJSQOCJBBHBP-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](C[C@H]1CCC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928332 1050024866 /nfs/dbraw/zinc/02/48/66/1050024866.db2.gz FWTJSQOCJBBHBP-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@H]1CCC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928332 1050024873 /nfs/dbraw/zinc/02/48/73/1050024873.db2.gz FWTJSQOCJBBHBP-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928332 1050024877 /nfs/dbraw/zinc/02/48/77/1050024877.db2.gz FWTJSQOCJBBHBP-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP Clc1cccc([C@H]2CCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168388075 1050025870 /nfs/dbraw/zinc/02/58/70/1050025870.db2.gz AONQJYMNAWSDFW-LJQANCHMSA-N 2 1 318.892 4.351 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947045 1050026751 /nfs/dbraw/zinc/02/67/51/1050026751.db2.gz YBWBMEBSVJGWFI-UXHICEINSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947045 1050026758 /nfs/dbraw/zinc/02/67/58/1050026758.db2.gz YBWBMEBSVJGWFI-UXHICEINSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208947045 1050026765 /nfs/dbraw/zinc/02/67/65/1050026765.db2.gz YBWBMEBSVJGWFI-UXHICEINSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208947045 1050026772 /nfs/dbraw/zinc/02/67/72/1050026772.db2.gz YBWBMEBSVJGWFI-UXHICEINSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC[C@@H]4CCC[C@H]43)C2)cc1 ZINC001208939920 1050026995 /nfs/dbraw/zinc/02/69/95/1050026995.db2.gz LHPPAQALTNZKKE-PCCBWWKXSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCC[C@@H]4CCC[C@H]43)C2)cc1 ZINC001208939920 1050027004 /nfs/dbraw/zinc/02/70/04/1050027004.db2.gz LHPPAQALTNZKKE-PCCBWWKXSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCC[C@@H]4CCC[C@H]43)C2)cc1 ZINC001208939920 1050027007 /nfs/dbraw/zinc/02/70/07/1050027007.db2.gz LHPPAQALTNZKKE-PCCBWWKXSA-N 2 1 312.501 4.163 20 0 DIADMP CCCC1CC[NH+](C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208947727 1050028921 /nfs/dbraw/zinc/02/89/21/1050028921.db2.gz CEEQXZMABRNBRF-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC001208949277 1050029818 /nfs/dbraw/zinc/02/98/18/1050029818.db2.gz JULHFFWZFVPNBE-RBBKRZOGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC001208949277 1050029826 /nfs/dbraw/zinc/02/98/26/1050029826.db2.gz JULHFFWZFVPNBE-RBBKRZOGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC001208949277 1050029831 /nfs/dbraw/zinc/02/98/31/1050029831.db2.gz JULHFFWZFVPNBE-RBBKRZOGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCC[C@H]4CCCC[C@@H]43)C2)cc1 ZINC001208952147 1050030057 /nfs/dbraw/zinc/03/00/57/1050030057.db2.gz DAEIYJURFZIXDV-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@@H+]3CCC[C@H]4CCCC[C@@H]43)C2)cc1 ZINC001208952147 1050030061 /nfs/dbraw/zinc/03/00/61/1050030061.db2.gz DAEIYJURFZIXDV-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@H+]3CCC[C@H]4CCCC[C@@H]43)C2)cc1 ZINC001208952147 1050030065 /nfs/dbraw/zinc/03/00/65/1050030065.db2.gz DAEIYJURFZIXDV-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCCCCC3)C2)cc1 ZINC001208960254 1050030192 /nfs/dbraw/zinc/03/01/92/1050030192.db2.gz VESHNVXKWNTUCT-FQEVSTJZSA-N 2 1 300.490 4.165 20 0 DIADMP CC(C)(C)C1CC[NH+](C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208949459 1050030523 /nfs/dbraw/zinc/03/05/23/1050030523.db2.gz VTVUPNDLBJHJOU-IBGZPJMESA-N 2 1 314.517 4.267 20 0 DIADMP c1ccc(C[N@H+](CCC[NH+]2CCCCC2)C2CCCCC2)nc1 ZINC001209450506 1050061341 /nfs/dbraw/zinc/06/13/41/1050061341.db2.gz KQCHWMIHLIVXDL-UHFFFAOYSA-N 2 1 315.505 4.092 20 0 DIADMP Cc1cccc2c(C[N@H+](C)CC3CC[NH+](C(C)C)CC3)c[nH]c21 ZINC001209491874 1050062703 /nfs/dbraw/zinc/06/27/03/1050062703.db2.gz YETSUPAVJFBLDF-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP CN1CCC([N@@H+](Cc2ccc3cc[nH]c3c2)C2CCCC2)CC1 ZINC001209519626 1050066090 /nfs/dbraw/zinc/06/60/90/1050066090.db2.gz YWFMTQACJQOWSG-UHFFFAOYSA-N 2 1 311.473 4.007 20 0 DIADMP CC[NH+](CC)Cc1ccc(Nc2ccc3c(c2)C[N@H+](C)CC3)cc1 ZINC001209827013 1050090966 /nfs/dbraw/zinc/09/09/66/1050090966.db2.gz VBFDKRVQGHBMAN-UHFFFAOYSA-N 2 1 323.484 4.260 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]CCCc2c[nH+]cn2C)cc1 ZINC000572971590 1050095114 /nfs/dbraw/zinc/09/51/14/1050095114.db2.gz GGAYREGFGQOYTJ-OAHLLOKOSA-N 2 1 317.502 4.204 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000378880835 1050191648 /nfs/dbraw/zinc/19/16/48/1050191648.db2.gz GJFDKRWFRMLAGO-CYBMUJFWSA-N 2 1 314.395 4.229 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000591695700 1050196979 /nfs/dbraw/zinc/19/69/79/1050196979.db2.gz UVURHKZLDNFIRW-SFTDATJTSA-N 2 1 320.480 4.378 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)CC[NH2+]1 ZINC001210496376 1050268162 /nfs/dbraw/zinc/26/81/62/1050268162.db2.gz GWPFAXZDOGXSSF-CQSZACIVSA-N 2 1 310.466 4.238 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)CC[NH2+]1 ZINC001210499278 1050269535 /nfs/dbraw/zinc/26/95/35/1050269535.db2.gz UOIDXHIRGIXUHR-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)CC[NH2+]1 ZINC001210499278 1050269551 /nfs/dbraw/zinc/26/95/51/1050269551.db2.gz UOIDXHIRGIXUHR-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP [NH3+]CC1C[NH+](Cc2ccc(-c3cc(Cl)cc(Cl)c3)cc2)C1 ZINC001210546327 1050290063 /nfs/dbraw/zinc/29/00/63/1050290063.db2.gz XDWXQVYYUBDWDW-UHFFFAOYSA-N 2 1 321.251 4.051 20 0 DIADMP CCC1CC([NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000573986941 1050299738 /nfs/dbraw/zinc/29/97/38/1050299738.db2.gz JBGLSLYZQSSKCL-PYXOFJJQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2cc(Cl)ccc2C1 ZINC001171096622 1050337961 /nfs/dbraw/zinc/33/79/61/1050337961.db2.gz UPUICNGJKDXDMN-HNAYVOBHSA-N 2 1 320.908 4.051 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+][C@@H](C)c1nccc2ccccc21 ZINC000574086880 1050368788 /nfs/dbraw/zinc/36/87/88/1050368788.db2.gz RZQBEJMOJVYZEK-KRWDZBQOSA-N 2 1 313.489 4.398 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000574204192 1050376058 /nfs/dbraw/zinc/37/60/58/1050376058.db2.gz UBGOKCKHXHXZGU-QRVBRYPASA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000574204192 1050376069 /nfs/dbraw/zinc/37/60/69/1050376069.db2.gz UBGOKCKHXHXZGU-QRVBRYPASA-N 2 1 317.521 4.126 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000574581007 1050494919 /nfs/dbraw/zinc/49/49/19/1050494919.db2.gz LYEXJGNYPZAVOB-CHWSQXEVSA-N 2 1 320.889 4.380 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(C)c1ccc2ccccc2c1 ZINC000626115853 1050504361 /nfs/dbraw/zinc/50/43/61/1050504361.db2.gz HWBUKVJAUONTOQ-UHFFFAOYSA-N 2 1 307.441 4.260 20 0 DIADMP CCCCCC[C@@H](CCCC)[N@H+]1CCC(F)(F)[C@@H](C[NH3+])C1 ZINC001246558058 1050546809 /nfs/dbraw/zinc/54/68/09/1050546809.db2.gz NXGKWRPTDGFBBG-JKSUJKDBSA-N 2 1 304.469 4.432 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@@H+]1C ZINC000575171827 1050652016 /nfs/dbraw/zinc/65/20/16/1050652016.db2.gz JFXVCUOPEDQEQM-XLIONFOSSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@H+]1C ZINC000575171827 1050652027 /nfs/dbraw/zinc/65/20/27/1050652027.db2.gz JFXVCUOPEDQEQM-XLIONFOSSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171827 1050652041 /nfs/dbraw/zinc/65/20/41/1050652041.db2.gz JFXVCUOPEDQEQM-XLIONFOSSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171827 1050652052 /nfs/dbraw/zinc/65/20/52/1050652052.db2.gz JFXVCUOPEDQEQM-XLIONFOSSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCCCCC[NH3+] ZINC000846218766 1050696666 /nfs/dbraw/zinc/69/66/66/1050696666.db2.gz UROZESNXGDQEHS-CYBMUJFWSA-N 2 1 302.384 4.217 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCSC(C)(C)C)cc1 ZINC000772950217 1050742700 /nfs/dbraw/zinc/74/27/00/1050742700.db2.gz GLWSDKRFZFMXHL-AWEZNQCLSA-N 2 1 317.502 4.363 20 0 DIADMP CC(C)(C)[N@@H+]1CCCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000601513902 1050816189 /nfs/dbraw/zinc/81/61/89/1050816189.db2.gz MWTNWEQVRFXBKT-UHFFFAOYSA-N 2 1 317.864 4.199 20 0 DIADMP CC(C)(C)[N@H+]1CCCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000601513902 1050816207 /nfs/dbraw/zinc/81/62/07/1050816207.db2.gz MWTNWEQVRFXBKT-UHFFFAOYSA-N 2 1 317.864 4.199 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001170109371 1050839461 /nfs/dbraw/zinc/83/94/61/1050839461.db2.gz OJXJARCTJQSDJW-TVLUASMKSA-N 2 1 312.501 4.303 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170121080 1050886526 /nfs/dbraw/zinc/88/65/26/1050886526.db2.gz KZVKYUOQXOVFSP-QZHFEQFPSA-N 2 1 304.453 4.086 20 0 DIADMP Cc1ccccc1C[N@H+]([C@@H]1CC[C@H](C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170121722 1050892143 /nfs/dbraw/zinc/89/21/43/1050892143.db2.gz NREREZHVEGJVGA-MVJPYGJCSA-N 2 1 300.490 4.256 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccoc2)cc1 ZINC000348099906 1050986421 /nfs/dbraw/zinc/98/64/21/1050986421.db2.gz XOJHTYCHTHHAPE-HUUCEWRRSA-N 2 1 309.413 4.056 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccoc2)cc1 ZINC000348099907 1050986656 /nfs/dbraw/zinc/98/66/56/1050986656.db2.gz XOJHTYCHTHHAPE-LSDHHAIUSA-N 2 1 309.413 4.056 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000348218005 1051003701 /nfs/dbraw/zinc/00/37/01/1051003701.db2.gz FLRKTLWCZYPEPH-LJQANCHMSA-N 2 1 315.436 4.338 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000348218005 1051003709 /nfs/dbraw/zinc/00/37/09/1051003709.db2.gz FLRKTLWCZYPEPH-LJQANCHMSA-N 2 1 315.436 4.338 20 0 DIADMP C[C@@H]1CC[C@@H]([N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC001170149200 1051030138 /nfs/dbraw/zinc/03/01/38/1051030138.db2.gz AUUDRHHVGGIULS-UYAOXDASSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]1CC[C@@H]([NH+]2CCC([N@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156277 1051060128 /nfs/dbraw/zinc/06/01/28/1051060128.db2.gz CDKYFUGIRKTDBW-HNAYVOBHSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156277 1051060135 /nfs/dbraw/zinc/06/01/35/1051060135.db2.gz CDKYFUGIRKTDBW-HNAYVOBHSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170260340 1051165742 /nfs/dbraw/zinc/16/57/42/1051165742.db2.gz IMWROHKTKCSVMO-WBAXXEDZSA-N 2 1 320.908 4.253 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001170265783 1051167430 /nfs/dbraw/zinc/16/74/30/1051167430.db2.gz JPNGNDOMBMIJIG-HOTGVXAUSA-N 2 1 308.897 4.112 20 0 DIADMP C(=C/C[N@H+]1CCC2(CCCC2)C1)\C[NH+]1CCC2(CCCC2)C1 ZINC000744420317 1051173110 /nfs/dbraw/zinc/17/31/10/1051173110.db2.gz JBNJXNIATREJMF-AATRIKPKSA-N 2 1 302.506 4.075 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3c(C)cccc3C2)CC1 ZINC001171577407 1051173109 /nfs/dbraw/zinc/17/31/09/1051173109.db2.gz DTRZLQMRJHIGFP-HXUWFJFHSA-N 2 1 314.517 4.049 20 0 DIADMP C[C@H]1C[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)Cc2ccccc21 ZINC001171631608 1051174432 /nfs/dbraw/zinc/17/44/32/1051174432.db2.gz KZJQKUGMLFWAJH-HNNXBMFYSA-N 2 1 300.490 4.257 20 0 DIADMP CC(C)Oc1cccc(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171618815 1051177600 /nfs/dbraw/zinc/17/76/00/1051177600.db2.gz DDAXCHYLCZQSGE-UHFFFAOYSA-N 2 1 318.505 4.215 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ccccn1 ZINC001171625301 1051179221 /nfs/dbraw/zinc/17/92/21/1051179221.db2.gz GOSFCPXNFKECIQ-SFHVURJKSA-N 2 1 317.521 4.410 20 0 DIADMP Cc1ccc(C2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)cc1 ZINC001171623400 1051179593 /nfs/dbraw/zinc/17/95/93/1051179593.db2.gz XKFFCJIRTSXEGD-UHFFFAOYSA-N 2 1 300.490 4.225 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H](C)Cc2ccccc2Cl)CC1 ZINC001170284464 1051181812 /nfs/dbraw/zinc/18/18/12/1051181812.db2.gz NTXVPXWKYRURRC-INIZCTEOSA-N 2 1 322.924 4.323 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCCC[C@@H](CCC[NH3+])C2)cc1 ZINC001171664475 1051187272 /nfs/dbraw/zinc/18/72/72/1051187272.db2.gz AKDQHQJPNJLFHL-ICSRJNTNSA-N 2 1 302.506 4.157 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@H](c3cccc(F)c3)C2)CC1(C)C ZINC001171639440 1051195476 /nfs/dbraw/zinc/19/54/76/1051195476.db2.gz JXIOXOFQOVYYPT-INIZCTEOSA-N 2 1 318.480 4.266 20 0 DIADMP CC[N@@H+](Cc1ccc(OC)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642824 1051197524 /nfs/dbraw/zinc/19/75/24/1051197524.db2.gz NULLNDJNTYAIHK-UHFFFAOYSA-N 2 1 318.505 4.169 20 0 DIADMP CC1(C)C[C@H]([NH2+]CC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171966278 1051247462 /nfs/dbraw/zinc/24/74/62/1051247462.db2.gz UNJMNMALYXHAGO-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966021 1051248857 /nfs/dbraw/zinc/24/88/57/1051248857.db2.gz SDYBQQRGWBKNDR-PXNSSMCTSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966021 1051248867 /nfs/dbraw/zinc/24/88/67/1051248867.db2.gz SDYBQQRGWBKNDR-PXNSSMCTSA-N 2 1 323.484 4.175 20 0 DIADMP CC1CC(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171963555 1051249002 /nfs/dbraw/zinc/24/90/02/1051249002.db2.gz IBNPLOIQCWLNNX-NKELODKYSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@H]2CC[C@@H](F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171966643 1051250139 /nfs/dbraw/zinc/25/01/39/1051250139.db2.gz VYFWSYVNIPPPSV-CEXWTWQISA-N 2 1 318.480 4.300 20 0 DIADMP C[C@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975414 1051264867 /nfs/dbraw/zinc/26/48/67/1051264867.db2.gz CTTYJRDRLRHVBS-HKUYNNGSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975414 1051264881 /nfs/dbraw/zinc/26/48/81/1051264881.db2.gz CTTYJRDRLRHVBS-HKUYNNGSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975414 1051264895 /nfs/dbraw/zinc/26/48/95/1051264895.db2.gz CTTYJRDRLRHVBS-HKUYNNGSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975414 1051264910 /nfs/dbraw/zinc/26/49/10/1051264910.db2.gz CTTYJRDRLRHVBS-HKUYNNGSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983925 1051267580 /nfs/dbraw/zinc/26/75/80/1051267580.db2.gz BAVJOLVRUYVVJY-IEBWSBKVSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1C[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983925 1051267593 /nfs/dbraw/zinc/26/75/93/1051267593.db2.gz BAVJOLVRUYVVJY-IEBWSBKVSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983925 1051267606 /nfs/dbraw/zinc/26/76/06/1051267606.db2.gz BAVJOLVRUYVVJY-IEBWSBKVSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983925 1051267613 /nfs/dbraw/zinc/26/76/13/1051267613.db2.gz BAVJOLVRUYVVJY-IEBWSBKVSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CC3(C2)CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171981368 1051269155 /nfs/dbraw/zinc/26/91/55/1051269155.db2.gz KZNGQXZSOHXZCC-IBGZPJMESA-N 2 1 312.501 4.306 20 0 DIADMP CC1CC([N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977317 1051270053 /nfs/dbraw/zinc/27/00/53/1051270053.db2.gz PYUHMGISESHEEO-CUYAVPTFSA-N 2 1 300.490 4.160 20 0 DIADMP CC1CC([N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977317 1051270065 /nfs/dbraw/zinc/27/00/65/1051270065.db2.gz PYUHMGISESHEEO-CUYAVPTFSA-N 2 1 300.490 4.160 20 0 DIADMP CC1CC([NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977317 1051270073 /nfs/dbraw/zinc/27/00/73/1051270073.db2.gz PYUHMGISESHEEO-CUYAVPTFSA-N 2 1 300.490 4.160 20 0 DIADMP CC1CC([NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977317 1051270082 /nfs/dbraw/zinc/27/00/82/1051270082.db2.gz PYUHMGISESHEEO-CUYAVPTFSA-N 2 1 300.490 4.160 20 0 DIADMP C[N@@H+](CC(C)(C)C)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985239 1051272894 /nfs/dbraw/zinc/27/28/94/1051272894.db2.gz ULLNMRMTYHDBBF-SFHVURJKSA-N 2 1 302.506 4.408 20 0 DIADMP C[NH+](CC(C)(C)C)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985239 1051272910 /nfs/dbraw/zinc/27/29/10/1051272910.db2.gz ULLNMRMTYHDBBF-SFHVURJKSA-N 2 1 302.506 4.408 20 0 DIADMP C[NH+](CC(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985239 1051272923 /nfs/dbraw/zinc/27/29/23/1051272923.db2.gz ULLNMRMTYHDBBF-SFHVURJKSA-N 2 1 302.506 4.408 20 0 DIADMP CC1(C)[C@@H]2C[N@@H+]([C@H]3CC[NH+](Cc4ccccc4)C(C)(C)C3)C[C@@H]21 ZINC001171986258 1051273298 /nfs/dbraw/zinc/27/32/98/1051273298.db2.gz GHLCOSAZJSQPIF-GBESFXJTSA-N 2 1 312.501 4.017 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@H]3CC[N@H+](Cc4ccccc4)C(C)(C)C3)C[C@@H]21 ZINC001171986258 1051273306 /nfs/dbraw/zinc/27/33/06/1051273306.db2.gz GHLCOSAZJSQPIF-GBESFXJTSA-N 2 1 312.501 4.017 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@H]3CC[N@@H+](Cc4ccccc4)C(C)(C)C3)C[C@@H]21 ZINC001171986258 1051273317 /nfs/dbraw/zinc/27/33/17/1051273317.db2.gz GHLCOSAZJSQPIF-GBESFXJTSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCC1 ZINC001172070887 1051275300 /nfs/dbraw/zinc/27/53/00/1051275300.db2.gz SBNZSDMTCJWEDP-OTNPHJDUSA-N 2 1 312.501 4.350 20 0 DIADMP CCCC[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080691 1051279369 /nfs/dbraw/zinc/27/93/69/1051279369.db2.gz WCDZMRRPOMBJAA-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172080691 1051279383 /nfs/dbraw/zinc/27/93/83/1051279383.db2.gz WCDZMRRPOMBJAA-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172080691 1051279395 /nfs/dbraw/zinc/27/93/95/1051279395.db2.gz WCDZMRRPOMBJAA-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@@H]4CCC[C@H]4C2)C3)cc1 ZINC001172079698 1051279707 /nfs/dbraw/zinc/27/97/07/1051279707.db2.gz PNAGUUBCLMTEKL-RTOMLYRKSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@@H]4CCC[C@H]4C2)C3)cc1 ZINC001172079698 1051279722 /nfs/dbraw/zinc/27/97/22/1051279722.db2.gz PNAGUUBCLMTEKL-RTOMLYRKSA-N 2 1 324.512 4.304 20 0 DIADMP C[N@@H+](CC1CCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075715 1051280174 /nfs/dbraw/zinc/28/01/74/1051280174.db2.gz SLUAMPAZTASQOU-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172075715 1051280191 /nfs/dbraw/zinc/28/01/91/1051280191.db2.gz SLUAMPAZTASQOU-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172075715 1051280201 /nfs/dbraw/zinc/28/02/01/1051280201.db2.gz SLUAMPAZTASQOU-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP FC[C@H]1CCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172086447 1051282860 /nfs/dbraw/zinc/28/28/60/1051282860.db2.gz GFCYWPAXSOVFEY-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP FC[C@H]1CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172086447 1051282872 /nfs/dbraw/zinc/28/28/72/1051282872.db2.gz GFCYWPAXSOVFEY-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP FC[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172086447 1051282885 /nfs/dbraw/zinc/28/28/85/1051282885.db2.gz GFCYWPAXSOVFEY-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP FC[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172086447 1051282901 /nfs/dbraw/zinc/28/29/01/1051282901.db2.gz GFCYWPAXSOVFEY-IYWMVGAKSA-N 2 1 316.464 4.006 20 0 DIADMP FC[C@H]1CCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172086450 1051282988 /nfs/dbraw/zinc/28/29/88/1051282988.db2.gz GFCYWPAXSOVFEY-WCIQWLHISA-N 2 1 316.464 4.006 20 0 DIADMP FC[C@H]1CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172086450 1051283001 /nfs/dbraw/zinc/28/30/01/1051283001.db2.gz GFCYWPAXSOVFEY-WCIQWLHISA-N 2 1 316.464 4.006 20 0 DIADMP FC[C@H]1CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172086450 1051283008 /nfs/dbraw/zinc/28/30/08/1051283008.db2.gz GFCYWPAXSOVFEY-WCIQWLHISA-N 2 1 316.464 4.006 20 0 DIADMP FC[C@H]1CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172086450 1051283020 /nfs/dbraw/zinc/28/30/20/1051283020.db2.gz GFCYWPAXSOVFEY-WCIQWLHISA-N 2 1 316.464 4.006 20 0 DIADMP CC(C)(C)C(=[NH2+])N[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172063684 1051283616 /nfs/dbraw/zinc/28/36/16/1051283616.db2.gz BJSYHKWMVJURDG-BCDXTJNWSA-N 2 1 313.489 4.185 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CCC2CCC2)C3)cc1 ZINC001172066683 1051283643 /nfs/dbraw/zinc/28/36/43/1051283643.db2.gz FCRPHAYEBFSCSR-WKCHPHFGSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100254 1051284375 /nfs/dbraw/zinc/28/43/75/1051284375.db2.gz CBRPBKQNKPAJLX-DOVSJBTNSA-N 2 1 312.501 4.231 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100254 1051284386 /nfs/dbraw/zinc/28/43/86/1051284386.db2.gz CBRPBKQNKPAJLX-DOVSJBTNSA-N 2 1 312.501 4.231 20 0 DIADMP CCC(CC)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172064057 1051284886 /nfs/dbraw/zinc/28/48/86/1051284886.db2.gz DZQSBAXQBKTMQF-ACDBMABISA-N 2 1 300.490 4.350 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc3ccccc3s1)C2 ZINC001172100167 1051285892 /nfs/dbraw/zinc/28/58/92/1051285892.db2.gz AAVMTSCRCMFAQZ-PHZGNYQRSA-N 2 1 300.471 4.006 20 0 DIADMP CC[C@H](C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067754 1051286571 /nfs/dbraw/zinc/28/65/71/1051286571.db2.gz NQNGWZULUXCUFY-FRYIKTPZSA-N 2 1 300.490 4.208 20 0 DIADMP C[N@H+](Cc1ccc2ccccc2c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127686 1051287383 /nfs/dbraw/zinc/28/73/83/1051287383.db2.gz JJMPXOSERSOITO-AERCQKQUSA-N 2 1 308.469 4.287 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127686 1051287402 /nfs/dbraw/zinc/28/74/02/1051287402.db2.gz JJMPXOSERSOITO-AERCQKQUSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1ccc2ccccc2c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172127686 1051287410 /nfs/dbraw/zinc/28/74/10/1051287410.db2.gz JJMPXOSERSOITO-AERCQKQUSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1ccc2ccccc2c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172127686 1051287418 /nfs/dbraw/zinc/28/74/18/1051287418.db2.gz JJMPXOSERSOITO-AERCQKQUSA-N 2 1 308.469 4.287 20 0 DIADMP CC(C)[C@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067807 1051287749 /nfs/dbraw/zinc/28/77/49/1051287749.db2.gz OAIKSJJDHIUAKS-FFGOWVMKSA-N 2 1 300.490 4.206 20 0 DIADMP CC[N@H+](Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127918 1051288284 /nfs/dbraw/zinc/28/82/84/1051288284.db2.gz LQRMDNUAKBKHAE-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127918 1051288295 /nfs/dbraw/zinc/28/82/95/1051288295.db2.gz LQRMDNUAKBKHAE-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172127918 1051288305 /nfs/dbraw/zinc/28/83/05/1051288305.db2.gz LQRMDNUAKBKHAE-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1ccc(Cl)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172127918 1051288316 /nfs/dbraw/zinc/28/83/16/1051288316.db2.gz LQRMDNUAKBKHAE-BCDXTJNWSA-N 2 1 306.881 4.177 20 0 DIADMP C[C@@H]1C[C@H](F)C[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070065 1051289630 /nfs/dbraw/zinc/28/96/30/1051289630.db2.gz WLIVRYIJUBRUMN-XZEJUNMKSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@H](F)C[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070065 1051289643 /nfs/dbraw/zinc/28/96/43/1051289643.db2.gz WLIVRYIJUBRUMN-XZEJUNMKSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@H](F)C[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070065 1051289658 /nfs/dbraw/zinc/28/96/58/1051289658.db2.gz WLIVRYIJUBRUMN-XZEJUNMKSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@H](F)C[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070065 1051289672 /nfs/dbraw/zinc/28/96/72/1051289672.db2.gz WLIVRYIJUBRUMN-XZEJUNMKSA-N 2 1 316.464 4.004 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001172130997 1051291785 /nfs/dbraw/zinc/29/17/85/1051291785.db2.gz SRULFNCHZNZUGL-MANSERQUSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001172130997 1051291796 /nfs/dbraw/zinc/29/17/96/1051291796.db2.gz SRULFNCHZNZUGL-MANSERQUSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001172130997 1051291804 /nfs/dbraw/zinc/29/18/04/1051291804.db2.gz SRULFNCHZNZUGL-MANSERQUSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1cc(F)cc(F)c1)C2 ZINC001172133240 1051292882 /nfs/dbraw/zinc/29/28/82/1051292882.db2.gz QEQKXZUPKFEHLB-FCGDIQPGSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1)C2 ZINC001172133240 1051292890 /nfs/dbraw/zinc/29/28/90/1051292890.db2.gz QEQKXZUPKFEHLB-FCGDIQPGSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1)C2 ZINC001172133240 1051292895 /nfs/dbraw/zinc/29/28/95/1051292895.db2.gz QEQKXZUPKFEHLB-FCGDIQPGSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1CCC(c3ccccc3)CC1)C2 ZINC001172102834 1051295294 /nfs/dbraw/zinc/29/52/94/1051295294.db2.gz PIYHTVFSSBLUOU-ZHLPAPNQSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1CCC(c3ccccc3)CC1)C2 ZINC001172102834 1051295305 /nfs/dbraw/zinc/29/53/05/1051295305.db2.gz PIYHTVFSSBLUOU-ZHLPAPNQSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)C2 ZINC001172102307 1051296790 /nfs/dbraw/zinc/29/67/90/1051296790.db2.gz LWRZZDSZEIJMHY-QKDCVEJESA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)C2 ZINC001172102307 1051296804 /nfs/dbraw/zinc/29/68/04/1051296804.db2.gz LWRZZDSZEIJMHY-QKDCVEJESA-N 2 1 313.272 4.098 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C2 ZINC001172106991 1051298450 /nfs/dbraw/zinc/29/84/50/1051298450.db2.gz RLLZMHADIGWSAE-HGJUEJDCSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C2 ZINC001172106991 1051298462 /nfs/dbraw/zinc/29/84/62/1051298462.db2.gz RLLZMHADIGWSAE-HGJUEJDCSA-N 2 1 312.501 4.318 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172111151 1051299289 /nfs/dbraw/zinc/29/92/89/1051299289.db2.gz QKRZEFKLZPIEJJ-FCGDIQPGSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172111151 1051299302 /nfs/dbraw/zinc/29/93/02/1051299302.db2.gz QKRZEFKLZPIEJJ-FCGDIQPGSA-N 2 1 304.453 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110194 1051299352 /nfs/dbraw/zinc/29/93/52/1051299352.db2.gz IUDFMLPMZZCHMU-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110194 1051299359 /nfs/dbraw/zinc/29/93/59/1051299359.db2.gz IUDFMLPMZZCHMU-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1Cl ZINC001172111894 1051300728 /nfs/dbraw/zinc/30/07/28/1051300728.db2.gz XXEKXBTXQBBEQD-YIYPIFLZSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1Cl ZINC001172111894 1051300740 /nfs/dbraw/zinc/30/07/40/1051300740.db2.gz XXEKXBTXQBBEQD-YIYPIFLZSA-N 2 1 310.844 4.145 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110192 1051300751 /nfs/dbraw/zinc/30/07/51/1051300751.db2.gz IUDFMLPMZZCHMU-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110192 1051300761 /nfs/dbraw/zinc/30/07/61/1051300761.db2.gz IUDFMLPMZZCHMU-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP CSc1ccc([C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172110642 1051301277 /nfs/dbraw/zinc/30/12/77/1051301277.db2.gz PQVKARYYJVRJDL-LLLHUVSDSA-N 2 1 304.503 4.074 20 0 DIADMP CSc1ccc([C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172110642 1051301286 /nfs/dbraw/zinc/30/12/86/1051301286.db2.gz PQVKARYYJVRJDL-LLLHUVSDSA-N 2 1 304.503 4.074 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c([C@H]3CCC[NH2+]3)cc3ccccc31)C2 ZINC001172124299 1051303706 /nfs/dbraw/zinc/30/37/06/1051303706.db2.gz KNJSVMBLLARBFS-FCGDIQPGSA-N 2 1 323.484 4.254 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3ccc(F)cc3)CC1)C2 ZINC001172120906 1051303728 /nfs/dbraw/zinc/30/37/28/1051303728.db2.gz HAJLVZKMQZWNQL-PMOLBWCYSA-N 2 1 316.464 4.020 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC(c3ccc(F)cc3)CC1)C2 ZINC001172120906 1051303738 /nfs/dbraw/zinc/30/37/38/1051303738.db2.gz HAJLVZKMQZWNQL-PMOLBWCYSA-N 2 1 316.464 4.020 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121783 1051304021 /nfs/dbraw/zinc/30/40/21/1051304021.db2.gz MLIBZZVJJLZRRQ-XLSPSMHOSA-N 2 1 316.464 4.368 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121783 1051304030 /nfs/dbraw/zinc/30/40/30/1051304030.db2.gz MLIBZZVJJLZRRQ-XLSPSMHOSA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121783 1051304038 /nfs/dbraw/zinc/30/40/38/1051304038.db2.gz MLIBZZVJJLZRRQ-XLSPSMHOSA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121783 1051304045 /nfs/dbraw/zinc/30/40/45/1051304045.db2.gz MLIBZZVJJLZRRQ-XLSPSMHOSA-N 2 1 316.464 4.368 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1cc(F)ccc1F)C2 ZINC001172124356 1051304656 /nfs/dbraw/zinc/30/46/56/1051304656.db2.gz KTNJFEUGUWBKEK-YYAJDYIMSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1cc(F)ccc1F)C2 ZINC001172124356 1051304669 /nfs/dbraw/zinc/30/46/69/1051304669.db2.gz KTNJFEUGUWBKEK-YYAJDYIMSA-N 2 1 320.427 4.117 20 0 DIADMP CCCC[N@H+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172121461 1051304754 /nfs/dbraw/zinc/30/47/54/1051304754.db2.gz JQWMLOMBSKVXAU-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172121461 1051304760 /nfs/dbraw/zinc/30/47/60/1051304760.db2.gz JQWMLOMBSKVXAU-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172121461 1051304770 /nfs/dbraw/zinc/30/47/70/1051304770.db2.gz JQWMLOMBSKVXAU-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](Cc1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172121461 1051304773 /nfs/dbraw/zinc/30/47/73/1051304773.db2.gz JQWMLOMBSKVXAU-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120268 1051306872 /nfs/dbraw/zinc/30/68/72/1051306872.db2.gz CEHVPUIIPBXLEG-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120268 1051306880 /nfs/dbraw/zinc/30/68/80/1051306880.db2.gz CEHVPUIIPBXLEG-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120268 1051306891 /nfs/dbraw/zinc/30/68/91/1051306891.db2.gz CEHVPUIIPBXLEG-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120268 1051306899 /nfs/dbraw/zinc/30/68/99/1051306899.db2.gz CEHVPUIIPBXLEG-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC001172379407 1051355542 /nfs/dbraw/zinc/35/55/42/1051355542.db2.gz ODWCIHDMZBLXRQ-QCFAMHMHSA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC001172379407 1051355553 /nfs/dbraw/zinc/35/55/53/1051355553.db2.gz ODWCIHDMZBLXRQ-QCFAMHMHSA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC001172379407 1051355562 /nfs/dbraw/zinc/35/55/62/1051355562.db2.gz ODWCIHDMZBLXRQ-QCFAMHMHSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172337933 1051360192 /nfs/dbraw/zinc/36/01/92/1051360192.db2.gz XHSOSRNUNZGLLD-SOAMZJECSA-N 2 1 324.553 4.485 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000380956181 1051365724 /nfs/dbraw/zinc/36/57/24/1051365724.db2.gz UOYIRPGFNPCJIP-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001172362238 1051374872 /nfs/dbraw/zinc/37/48/72/1051374872.db2.gz SBIJLVISTICIPK-MSOLQXFVSA-N 2 1 324.553 4.309 20 0 DIADMP CC[C@H](CC(C)C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001172398037 1051398063 /nfs/dbraw/zinc/39/80/63/1051398063.db2.gz DXFBNOGLCCSARP-LJQANCHMSA-N 2 1 302.506 4.455 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001170450700 1051402329 /nfs/dbraw/zinc/40/23/29/1051402329.db2.gz FFYVJBUXTQEZPW-JOCHJYFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001170450700 1051402335 /nfs/dbraw/zinc/40/23/35/1051402335.db2.gz FFYVJBUXTQEZPW-JOCHJYFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001170450700 1051402344 /nfs/dbraw/zinc/40/23/44/1051402344.db2.gz FFYVJBUXTQEZPW-JOCHJYFZSA-N 2 1 322.496 4.320 20 0 DIADMP CC1(C)CC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390643889 1051403454 /nfs/dbraw/zinc/40/34/54/1051403454.db2.gz LRHNBDGNRFIDAA-MSOLQXFVSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390643889 1051403459 /nfs/dbraw/zinc/40/34/59/1051403459.db2.gz LRHNBDGNRFIDAA-MSOLQXFVSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000390905899 1051406093 /nfs/dbraw/zinc/40/60/93/1051406093.db2.gz RSBJVNFDZWPMSK-IHWFROFDSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c(C)c1 ZINC001170452291 1051416255 /nfs/dbraw/zinc/41/62/55/1051416255.db2.gz UXEKSVOEHGRYMI-UYAOXDASSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)c(C)c1 ZINC001170452291 1051416260 /nfs/dbraw/zinc/41/62/60/1051416260.db2.gz UXEKSVOEHGRYMI-UYAOXDASSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+]2CCC[C@]3(CC[N@@H+](C)C3)C2)c(C)c1 ZINC001170452291 1051416268 /nfs/dbraw/zinc/41/62/68/1051416268.db2.gz UXEKSVOEHGRYMI-UYAOXDASSA-N 2 1 300.490 4.091 20 0 DIADMP c1[nH+]cn([C@H]2CCC[C@@H](c3ccccc3)C2)c1C1CC[NH2+]CC1 ZINC001172549349 1051433075 /nfs/dbraw/zinc/43/30/75/1051433075.db2.gz OMMMRUPQWUMHST-MOPGFXCFSA-N 2 1 309.457 4.249 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172558158 1051440348 /nfs/dbraw/zinc/44/03/48/1051440348.db2.gz SMIMEMLJWUPSTD-QYZOEREBSA-N 2 1 300.490 4.175 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172558158 1051440357 /nfs/dbraw/zinc/44/03/57/1051440357.db2.gz SMIMEMLJWUPSTD-QYZOEREBSA-N 2 1 300.490 4.175 20 0 DIADMP [NH3+]CCC[N@@H+]([C@@H]1CC[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC001172547640 1051457193 /nfs/dbraw/zinc/45/71/93/1051457193.db2.gz YBOVFGZDZGHRLR-UYAOXDASSA-N 2 1 300.490 4.306 20 0 DIADMP [NH3+]CCC[N@@H+]([C@H]1CC[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC001172547638 1051457498 /nfs/dbraw/zinc/45/74/98/1051457498.db2.gz YBOVFGZDZGHRLR-QUCCMNQESA-N 2 1 300.490 4.306 20 0 DIADMP CC(C)c1ccc([C@@H]2CCC[N@H+]2CC[C@H]2CCC[NH+]2C)cc1 ZINC001168919117 1051468457 /nfs/dbraw/zinc/46/84/57/1051468457.db2.gz VNTVFXUWANWPKP-UXHICEINSA-N 2 1 300.490 4.431 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC(c1ccccc1)c1ccccc1)C2 ZINC001169079715 1051513368 /nfs/dbraw/zinc/51/33/68/1051513368.db2.gz KQTAGXMJSXDBAA-MZADTFQBSA-N 2 1 320.480 4.033 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1)C2 ZINC001169081271 1051515703 /nfs/dbraw/zinc/51/57/03/1051515703.db2.gz PNHAHCQELJAGRW-YUMYIRISSA-N 2 1 320.480 4.185 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](NCc1ccccc1Oc1ccccc1)C2 ZINC001169089343 1051520907 /nfs/dbraw/zinc/52/09/07/1051520907.db2.gz BWTCUXCIUAJHAT-LDLYASANSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccccc1Oc1ccccc1)C2 ZINC001169089343 1051520916 /nfs/dbraw/zinc/52/09/16/1051520916.db2.gz BWTCUXCIUAJHAT-LDLYASANSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccccc1Oc1ccccc1)C2 ZINC001169089343 1051520923 /nfs/dbraw/zinc/52/09/23/1051520923.db2.gz BWTCUXCIUAJHAT-LDLYASANSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001169124441 1051522090 /nfs/dbraw/zinc/52/20/90/1051522090.db2.gz CNXLBFWSKUOKAZ-REPLKXPHSA-N 2 1 316.876 4.054 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001169124441 1051522102 /nfs/dbraw/zinc/52/21/02/1051522102.db2.gz CNXLBFWSKUOKAZ-REPLKXPHSA-N 2 1 316.876 4.054 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CC=C(c3ccc(Cl)cc3)CC1)C2 ZINC001169124441 1051522112 /nfs/dbraw/zinc/52/21/12/1051522112.db2.gz CNXLBFWSKUOKAZ-REPLKXPHSA-N 2 1 316.876 4.054 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001169140125 1051526161 /nfs/dbraw/zinc/52/61/61/1051526161.db2.gz HNACMMNRAXQYQL-MLHJIOFPSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001169140125 1051526172 /nfs/dbraw/zinc/52/61/72/1051526172.db2.gz HNACMMNRAXQYQL-MLHJIOFPSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001169140125 1051526176 /nfs/dbraw/zinc/52/61/76/1051526176.db2.gz HNACMMNRAXQYQL-MLHJIOFPSA-N 2 1 304.865 4.102 20 0 DIADMP Cc1ccc([C@@H]2CCCC[NH+]2[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC001169155080 1051537685 /nfs/dbraw/zinc/53/76/85/1051537685.db2.gz XNBCIQCDSVPYMW-BQJUDKOJSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001169155080 1051537706 /nfs/dbraw/zinc/53/77/06/1051537706.db2.gz XNBCIQCDSVPYMW-BQJUDKOJSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2[C@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001169155080 1051537719 /nfs/dbraw/zinc/53/77/19/1051537719.db2.gz XNBCIQCDSVPYMW-BQJUDKOJSA-N 2 1 312.501 4.456 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC001172859027 1051544765 /nfs/dbraw/zinc/54/47/65/1051544765.db2.gz QPLYBHOPWDJXMK-XJKSGUPXSA-N 2 1 324.871 4.017 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1CC[N@H+](C2CCCC2)C1 ZINC001172859027 1051544770 /nfs/dbraw/zinc/54/47/70/1051544770.db2.gz QPLYBHOPWDJXMK-XJKSGUPXSA-N 2 1 324.871 4.017 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@H]1CCC[C@@H](C)C1 ZINC001169224303 1051556837 /nfs/dbraw/zinc/55/68/37/1051556837.db2.gz GQLBHUPSKPOMKZ-QZTJIDSGSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@H]1CCC[C@@H](C)C1 ZINC001169224303 1051556853 /nfs/dbraw/zinc/55/68/53/1051556853.db2.gz GQLBHUPSKPOMKZ-QZTJIDSGSA-N 2 1 305.510 4.374 20 0 DIADMP CC[NH+]1CCC([NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)CC1 ZINC001169229883 1051557514 /nfs/dbraw/zinc/55/75/14/1051557514.db2.gz JHPYRRKREQLKFQ-UHFFFAOYSA-N 2 1 314.395 4.014 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CC)CC1)c1cccc(C(F)(F)F)c1 ZINC001169237890 1051558783 /nfs/dbraw/zinc/55/87/83/1051558783.db2.gz BLXDGOVXZMHYES-MRXNPFEDSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001172877482 1051560943 /nfs/dbraw/zinc/56/09/43/1051560943.db2.gz BYALLYKADRDPNR-ZDUSSCGKSA-N 2 1 324.921 4.037 20 0 DIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc2ccccc2n1 ZINC000178408888 1051571194 /nfs/dbraw/zinc/57/11/94/1051571194.db2.gz ASXZBIPJAGLXFX-DLBZAZTESA-N 2 1 311.473 4.007 20 0 DIADMP CO[C@H]1CCC[C@@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928453 1051574579 /nfs/dbraw/zinc/57/45/79/1051574579.db2.gz LDBAEWCSSDBUTD-WTGUMLROSA-N 2 1 322.537 4.096 20 0 DIADMP FC1(F)CCC[C@H]1CC[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC001170469745 1051583154 /nfs/dbraw/zinc/58/31/54/1051583154.db2.gz RCYHDNKPBGHGCB-KRWDZBQOSA-N 2 1 322.443 4.066 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](C)C(F)(F)CC2)CC1 ZINC001173109947 1051609746 /nfs/dbraw/zinc/60/97/46/1051609746.db2.gz LZRNKKZLKUUWMB-FHERZECASA-N 2 1 302.453 4.007 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](Cc3ccccc3)C2)CC1 ZINC001173112123 1051610016 /nfs/dbraw/zinc/61/00/16/1051610016.db2.gz QQFQEJOWUWSPMH-QNGMFEMESA-N 2 1 314.517 4.204 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3ccccc3[C@H]2C)CC1 ZINC001173108422 1051610279 /nfs/dbraw/zinc/61/02/79/1051610279.db2.gz JZHSYIPXYYOEOA-IPJUCJBFSA-N 2 1 300.490 4.259 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3cccc(Cl)c3C2)CC1 ZINC001173112542 1051610628 /nfs/dbraw/zinc/61/06/28/1051610628.db2.gz BZQPPRGACAJTER-UHFFFAOYSA-N 2 1 320.908 4.351 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)CC1 ZINC001173113154 1051611780 /nfs/dbraw/zinc/61/17/80/1051611780.db2.gz JKVUKFYJMAOBHQ-LPOKXYRGSA-N 2 1 312.501 4.226 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2cccc(OC)c2)CC1 ZINC001173113576 1051611869 /nfs/dbraw/zinc/61/18/69/1051611869.db2.gz VLZWETQFOWITSZ-UHFFFAOYSA-N 2 1 318.505 4.170 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2ccc(F)cc2)CC1 ZINC001173113524 1051611976 /nfs/dbraw/zinc/61/19/76/1051611976.db2.gz SEMCCCWSWVBNKF-UHFFFAOYSA-N 2 1 306.469 4.301 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)CCc2ccc(Cl)cc2)CC1 ZINC001173114709 1051612153 /nfs/dbraw/zinc/61/21/53/1051612153.db2.gz QXWPKVWDACZSMU-UHFFFAOYSA-N 2 1 322.924 4.467 20 0 DIADMP CCc1ccc(C[N@H+](C)C2CCC([NH+](CC)CC)CC2)cc1 ZINC001173113478 1051612312 /nfs/dbraw/zinc/61/23/12/1051612312.db2.gz QGUSMWUCVCRIOS-UHFFFAOYSA-N 2 1 302.506 4.334 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](C)C1 ZINC001173204819 1051643503 /nfs/dbraw/zinc/64/35/03/1051643503.db2.gz LNZGAOCJABOCSR-MOPGFXCFSA-N 2 1 322.496 4.138 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCCC2CCCCC2)[C@@H](C)C1 ZINC001169557749 1051644625 /nfs/dbraw/zinc/64/46/25/1051644625.db2.gz ZHSCVWBUYHBWRV-ICSRJNTNSA-N 2 1 324.553 4.074 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173269091 1051667595 /nfs/dbraw/zinc/66/75/95/1051667595.db2.gz SSLCWTOHNDBEMO-MLZLACJZSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173269090 1051667829 /nfs/dbraw/zinc/66/78/29/1051667829.db2.gz SSLCWTOHNDBEMO-DARKYYSBSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001173270345 1051667848 /nfs/dbraw/zinc/66/78/48/1051667848.db2.gz NRFWOEPBLIWSMG-PBHICJAKSA-N 2 1 306.881 4.169 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@H](C[NH3+])[C@@H](C)C3)c(C)c12 ZINC001206014575 1051670132 /nfs/dbraw/zinc/67/01/32/1051670132.db2.gz XSNAVRNQCRNJII-SMDDNHRTSA-N 2 1 322.543 4.386 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293177 1051675262 /nfs/dbraw/zinc/67/52/62/1051675262.db2.gz JZCRHGJIFWHCQY-UWJYYQICSA-N 2 1 312.501 4.088 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293177 1051675273 /nfs/dbraw/zinc/67/52/73/1051675273.db2.gz JZCRHGJIFWHCQY-UWJYYQICSA-N 2 1 312.501 4.088 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293435 1051675462 /nfs/dbraw/zinc/67/54/62/1051675462.db2.gz LLRTULYBRNAWKZ-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293435 1051675471 /nfs/dbraw/zinc/67/54/71/1051675471.db2.gz LLRTULYBRNAWKZ-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP CCSC[C@@H](C)[NH+]1CCC([N@H+](CC)Cc2ccccc2)CC1 ZINC001173303875 1051682016 /nfs/dbraw/zinc/68/20/16/1051682016.db2.gz BJVROJFPISFAAF-QGZVFWFLSA-N 2 1 320.546 4.115 20 0 DIADMP CCSC[C@@H](C)[NH+]1CCC([N@@H+](CC)Cc2ccccc2)CC1 ZINC001173303875 1051682019 /nfs/dbraw/zinc/68/20/19/1051682019.db2.gz BJVROJFPISFAAF-QGZVFWFLSA-N 2 1 320.546 4.115 20 0 DIADMP CC(C)[N@@H+](CCC[NH3+])[C@@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001173543558 1051738551 /nfs/dbraw/zinc/73/85/51/1051738551.db2.gz MNGYQMSXSHATFX-ZDUSSCGKSA-N 2 1 317.304 4.374 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+](C)CCC[NH+](C)C ZINC001173547788 1051747725 /nfs/dbraw/zinc/74/77/25/1051747725.db2.gz SWLALDVLVGUTKR-ZDUSSCGKSA-N 2 1 317.304 4.198 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(Cl)c2ccccc21 ZINC000184969027 1051751706 /nfs/dbraw/zinc/75/17/06/1051751706.db2.gz RRTYQBHWSWNXQC-CYBMUJFWSA-N 2 1 302.849 4.238 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000186299902 1051806993 /nfs/dbraw/zinc/80/69/93/1051806993.db2.gz JPALNPSUSBGLLT-RDJZCZTQSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000186299902 1051807001 /nfs/dbraw/zinc/80/70/01/1051807001.db2.gz JPALNPSUSBGLLT-RDJZCZTQSA-N 2 1 306.519 4.128 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccccc2Cl)cc1 ZINC000768169742 1051892797 /nfs/dbraw/zinc/89/27/97/1051892797.db2.gz IGXJWQIBUSTTFO-UHFFFAOYSA-N 2 1 302.849 4.034 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccccc2Cl)cc1 ZINC000768169742 1051892802 /nfs/dbraw/zinc/89/28/02/1051892802.db2.gz IGXJWQIBUSTTFO-UHFFFAOYSA-N 2 1 302.849 4.034 20 0 DIADMP Cc1[nH+]ccn1Cc1ccc(Nc2ccccc2C[NH+](C)C)cc1 ZINC001173931028 1051902221 /nfs/dbraw/zinc/90/22/21/1051902221.db2.gz DHQNJTWELRMVKB-UHFFFAOYSA-N 2 1 320.440 4.045 20 0 DIADMP C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)o1 ZINC000768215788 1051903287 /nfs/dbraw/zinc/90/32/87/1051903287.db2.gz YIPYLNKBCPJNJS-BEFAXECRSA-N 2 1 312.457 4.097 20 0 DIADMP C[NH+]1CCC(c2ccc(Nc3cc[nH+]c4ccccc34)cc2)CC1 ZINC001174038613 1051961918 /nfs/dbraw/zinc/96/19/18/1051961918.db2.gz PVYSSSHCVUYANZ-UHFFFAOYSA-N 2 1 317.436 4.210 20 0 DIADMP C[C@H]([NH2+]Cc1cc(Cl)cs1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206600 1052034831 /nfs/dbraw/zinc/03/48/31/1052034831.db2.gz ADJKPMGGYUXKKA-QWHCGFSZSA-N 2 1 312.910 4.144 20 0 DIADMP CCCCC[C@@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)C(C)(C)C ZINC000808692737 1052062960 /nfs/dbraw/zinc/06/29/60/1052062960.db2.gz SKUDBXYVUWKHHG-GOSISDBHSA-N 2 1 324.553 4.216 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000769473512 1052066527 /nfs/dbraw/zinc/06/65/27/1052066527.db2.gz OQLIPRXEAPIZGQ-LJQANCHMSA-N 2 1 320.480 4.271 20 0 DIADMP c1ccc(C[N@@H+]2CCC=C(Nc3ccc4c[nH+]ccc4c3)C2)cc1 ZINC001174396162 1052118236 /nfs/dbraw/zinc/11/82/36/1052118236.db2.gz FBIOHYHCNYVDBO-UHFFFAOYSA-N 2 1 315.420 4.437 20 0 DIADMP c1ccc(C[N@H+]2CCC=C(Nc3ccc4c[nH+]ccc4c3)C2)cc1 ZINC001174396162 1052118241 /nfs/dbraw/zinc/11/82/41/1052118241.db2.gz FBIOHYHCNYVDBO-UHFFFAOYSA-N 2 1 315.420 4.437 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](c2ccccc2C)C2CCCC2)CC1 ZINC000494871796 1052155991 /nfs/dbraw/zinc/15/59/91/1052155991.db2.gz CLYKIYFXWSXUIP-FQEVSTJZSA-N 2 1 300.490 4.300 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)[C@H]1C ZINC000495077909 1052211023 /nfs/dbraw/zinc/21/10/23/1052211023.db2.gz HISVIZFLVKYFFV-GQIGUUNPSA-N 2 1 312.457 4.046 20 0 DIADMP Cc1ccccc1[C@@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218295563 1052218383 /nfs/dbraw/zinc/21/83/83/1052218383.db2.gz OJEWIOSNOZEJRV-QGZVFWFLSA-N 2 1 324.468 4.058 20 0 DIADMP Cc1ccccc1[C@@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218295359 1052218437 /nfs/dbraw/zinc/21/84/37/1052218437.db2.gz MTDIBIWSWIFHSY-QGZVFWFLSA-N 2 1 324.468 4.058 20 0 DIADMP CC(C)=CCC[C@@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218317440 1052224172 /nfs/dbraw/zinc/22/41/72/1052224172.db2.gz MZMAOMOTLLAPLP-QGZVFWFLSA-N 2 1 316.489 4.123 20 0 DIADMP CC(C)=CCC[C@@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218318437 1052224425 /nfs/dbraw/zinc/22/44/25/1052224425.db2.gz WQAAYTQKZDCTAX-QGZVFWFLSA-N 2 1 316.489 4.123 20 0 DIADMP CC(C)CCC[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309645022 1052229489 /nfs/dbraw/zinc/22/94/89/1052229489.db2.gz QCTJCFVUKNBLLO-SFHVURJKSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC/C=C/[C@@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218355501 1052230198 /nfs/dbraw/zinc/23/01/98/1052230198.db2.gz POKBKLXKZYKDOL-DKRLNXSXSA-N 2 1 316.489 4.123 20 0 DIADMP CCCC/C=C/[C@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218355502 1052231038 /nfs/dbraw/zinc/23/10/38/1052231038.db2.gz POKBKLXKZYKDOL-LXXRFIIISA-N 2 1 316.489 4.123 20 0 DIADMP CC(C)C(C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000309668928 1052231784 /nfs/dbraw/zinc/23/17/84/1052231784.db2.gz RJORFHAWBKIICW-FQEVSTJZSA-N 2 1 316.533 4.416 20 0 DIADMP CC/C=C(\C)[C@@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218437676 1052239237 /nfs/dbraw/zinc/23/92/37/1052239237.db2.gz DQYOJVYKOQLGGD-KYGRHTAQSA-N 2 1 316.489 4.123 20 0 DIADMP CC1(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCCC1 ZINC000310032185 1052254326 /nfs/dbraw/zinc/25/43/26/1052254326.db2.gz YFGRKMDMZQKGPN-FQEVSTJZSA-N 2 1 314.517 4.459 20 0 DIADMP c1ccc(CC2(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCCC2)cc1 ZINC000495401272 1052335703 /nfs/dbraw/zinc/33/57/03/1052335703.db2.gz KQJZVEVWTQLXNW-PMACEKPBSA-N 2 1 312.501 4.006 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)[C@@H](C)C1 ZINC000495400497 1052336285 /nfs/dbraw/zinc/33/62/85/1052336285.db2.gz BQTUBEAKDVSCDA-YSSFQJQWSA-N 2 1 316.464 4.082 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001168492425 1052407272 /nfs/dbraw/zinc/40/72/72/1052407272.db2.gz RLPPFISNMUMMIE-FXAWDEMLSA-N 2 1 318.480 4.097 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@H](C)c2ccccc2)CC1 ZINC000237336025 1052439124 /nfs/dbraw/zinc/43/91/24/1052439124.db2.gz GFKDJONOLMTRER-IBGZPJMESA-N 2 1 322.496 4.353 20 0 DIADMP Cc1ccccc1C1CC([NH2+]CCC[N@@H+]2CCCC[C@@H]2C)C1 ZINC000237505028 1052441954 /nfs/dbraw/zinc/44/19/54/1052441954.db2.gz RRAMZMHNJVYWJH-VIQWUECVSA-N 2 1 300.490 4.095 20 0 DIADMP Cc1ccccc1C1CC([NH2+]CCC[N@@H+]2CCCC[C@H]2C)C1 ZINC000237674412 1052443954 /nfs/dbraw/zinc/44/39/54/1052443954.db2.gz RRAMZMHNJVYWJH-LMDPOFIKSA-N 2 1 300.490 4.095 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC001222141088 1052449312 /nfs/dbraw/zinc/44/93/12/1052449312.db2.gz DPGIIWDYFCBUIJ-RXVVDRJESA-N 2 1 314.517 4.064 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222154443 1052453192 /nfs/dbraw/zinc/45/31/92/1052453192.db2.gz MMJABODLBXVVOF-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)[nH]1 ZINC001222161613 1052454063 /nfs/dbraw/zinc/45/40/63/1052454063.db2.gz QFZMLFMPVWMJPJ-HXUWFJFHSA-N 2 1 317.521 4.058 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)[nH]1 ZINC001222161613 1052454067 /nfs/dbraw/zinc/45/40/67/1052454067.db2.gz QFZMLFMPVWMJPJ-HXUWFJFHSA-N 2 1 317.521 4.058 20 0 DIADMP Clc1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)s1 ZINC001222160271 1052454176 /nfs/dbraw/zinc/45/41/76/1052454176.db2.gz DMSORKYXDJNNQE-MRXNPFEDSA-N 2 1 312.910 4.147 20 0 DIADMP Clc1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)s1 ZINC001222160271 1052454177 /nfs/dbraw/zinc/45/41/77/1052454177.db2.gz DMSORKYXDJNNQE-MRXNPFEDSA-N 2 1 312.910 4.147 20 0 DIADMP CCc1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)s1 ZINC001222166913 1052454931 /nfs/dbraw/zinc/45/49/31/1052454931.db2.gz FXHMJTBNPUIKKI-SFHVURJKSA-N 2 1 306.519 4.056 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167348 1052455920 /nfs/dbraw/zinc/45/59/20/1052455920.db2.gz KOQDBGFPACQZRL-IBGZPJMESA-N 2 1 322.443 4.019 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167348 1052455923 /nfs/dbraw/zinc/45/59/23/1052455923.db2.gz KOQDBGFPACQZRL-IBGZPJMESA-N 2 1 322.443 4.019 20 0 DIADMP Cc1cc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc(F)c1F ZINC001222167250 1052456117 /nfs/dbraw/zinc/45/61/17/1052456117.db2.gz IXWXCRUHFUELIQ-IBGZPJMESA-N 2 1 322.443 4.019 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc(F)c1F ZINC001222167250 1052456120 /nfs/dbraw/zinc/45/61/20/1052456120.db2.gz IXWXCRUHFUELIQ-IBGZPJMESA-N 2 1 322.443 4.019 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@]23CCC[NH2+]C3)CC1 ZINC001222192554 1052458898 /nfs/dbraw/zinc/45/88/98/1052458898.db2.gz WWJSLERHEPEJAT-PMACEKPBSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@]23CCC[NH2+]C3)CC1 ZINC001222192554 1052458900 /nfs/dbraw/zinc/45/89/00/1052458900.db2.gz WWJSLERHEPEJAT-PMACEKPBSA-N 2 1 302.506 4.287 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@]12CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222231624 1052464804 /nfs/dbraw/zinc/46/48/04/1052464804.db2.gz OJYMUIRFRWGWPX-UWJYYQICSA-N 2 1 308.469 4.161 20 0 DIADMP Fc1ccc(-c2ccc(C[N@@H+]3CCC[C@]34CCC[NH2+]C4)cc2)cc1 ZINC001222243985 1052468117 /nfs/dbraw/zinc/46/81/17/1052468117.db2.gz RRNKHATXVSZHGT-NRFANRHFSA-N 2 1 324.443 4.211 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]C4)cc2)cc1 ZINC001222243985 1052468118 /nfs/dbraw/zinc/46/81/18/1052468118.db2.gz RRNKHATXVSZHGT-NRFANRHFSA-N 2 1 324.443 4.211 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222258461 1052470181 /nfs/dbraw/zinc/47/01/81/1052470181.db2.gz ATBAEWFOXMGRRK-UYAOXDASSA-N 2 1 324.553 4.074 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222265610 1052470833 /nfs/dbraw/zinc/47/08/33/1052470833.db2.gz WTKRNWWHBWGXGL-IBGZPJMESA-N 2 1 314.498 4.175 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222265614 1052471295 /nfs/dbraw/zinc/47/12/95/1052471295.db2.gz WTKRNWWHBWGXGL-LJQANCHMSA-N 2 1 314.498 4.175 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222272235 1052471969 /nfs/dbraw/zinc/47/19/69/1052471969.db2.gz ORUQWBSYFRTELY-NRFANRHFSA-N 2 1 308.469 4.114 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001168498576 1052475435 /nfs/dbraw/zinc/47/54/35/1052475435.db2.gz URCAVKRXBBBFAU-LSTHTHJFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001168498576 1052475436 /nfs/dbraw/zinc/47/54/36/1052475436.db2.gz URCAVKRXBBBFAU-LSTHTHJFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001168498576 1052475439 /nfs/dbraw/zinc/47/54/39/1052475439.db2.gz URCAVKRXBBBFAU-LSTHTHJFSA-N 2 1 318.480 4.096 20 0 DIADMP Clc1cc(Cl)cc(C[N@@H+]2CCC[C@]23CCC[NH2+]CC3)c1 ZINC001222308254 1052478456 /nfs/dbraw/zinc/47/84/56/1052478456.db2.gz IGCIFAIEFOABSN-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1cc(Cl)cc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c1 ZINC001222308254 1052478459 /nfs/dbraw/zinc/47/84/59/1052478459.db2.gz IGCIFAIEFOABSN-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP Fc1ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c2ccccc12 ZINC001222314818 1052479588 /nfs/dbraw/zinc/47/95/88/1052479588.db2.gz IUHZNEZSGACRAS-FQEVSTJZSA-N 2 1 312.432 4.087 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)c2)cc1 ZINC001222315265 1052479767 /nfs/dbraw/zinc/47/97/67/1052479767.db2.gz LZMGWGPVXXWSHJ-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222314530 1052479835 /nfs/dbraw/zinc/47/98/35/1052479835.db2.gz HCGHORJEQCMPCV-FQEVSTJZSA-N 2 1 310.441 4.055 20 0 DIADMP c1sc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1-c1ccccc1 ZINC000317107810 1052480432 /nfs/dbraw/zinc/48/04/32/1052480432.db2.gz BWDLMYCTEOWNAX-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP c1sc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1-c1ccccc1 ZINC000317107813 1052480503 /nfs/dbraw/zinc/48/05/03/1052480503.db2.gz BWDLMYCTEOWNAX-ZWKOTPCHSA-N 2 1 312.482 4.132 20 0 DIADMP Fc1cccc2c(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)cccc12 ZINC001222320695 1052481896 /nfs/dbraw/zinc/48/18/96/1052481896.db2.gz KXLSLRKHNCNBHB-HXUWFJFHSA-N 2 1 312.432 4.087 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320294 1052482027 /nfs/dbraw/zinc/48/20/27/1052482027.db2.gz GEQVNVGDOSYXGY-KRWDZBQOSA-N 2 1 324.921 4.170 20 0 DIADMP c1ccc(C(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000393551929 1052486075 /nfs/dbraw/zinc/48/60/75/1052486075.db2.gz SYEXMGFSHWIBHT-RTWAWAEBSA-N 2 1 320.480 4.035 20 0 DIADMP c1ccc(C(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)C2)c2ccccc2)cc1 ZINC001222345194 1052487669 /nfs/dbraw/zinc/48/76/69/1052487669.db2.gz IPXRRZGVIKSCLV-JOCHJYFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc(C(C[N@H+]2CCC[C@]3(CCC[NH2+]3)C2)c2ccccc2)cc1 ZINC001222345194 1052487672 /nfs/dbraw/zinc/48/76/72/1052487672.db2.gz IPXRRZGVIKSCLV-JOCHJYFZSA-N 2 1 320.480 4.037 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222385929 1052494148 /nfs/dbraw/zinc/49/41/48/1052494148.db2.gz ZZFQAJGQAYCBRG-AZUAARDMSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222385929 1052494151 /nfs/dbraw/zinc/49/41/51/1052494151.db2.gz ZZFQAJGQAYCBRG-AZUAARDMSA-N 2 1 324.553 4.216 20 0 DIADMP C[C@@H](C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421149 1052498442 /nfs/dbraw/zinc/49/84/42/1052498442.db2.gz JFTOWHWIHYOWSR-LAUBAEHRSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421149 1052498444 /nfs/dbraw/zinc/49/84/44/1052498444.db2.gz JFTOWHWIHYOWSR-LAUBAEHRSA-N 2 1 308.469 4.161 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322914584 1052500029 /nfs/dbraw/zinc/50/00/29/1052500029.db2.gz KINDAMIPKRBWAC-JZIBPQBNSA-N 2 1 321.534 4.025 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000322914584 1052500033 /nfs/dbraw/zinc/50/00/33/1052500033.db2.gz KINDAMIPKRBWAC-JZIBPQBNSA-N 2 1 321.534 4.025 20 0 DIADMP CC1=CC[C@H](CC[N@H+]2C[C@H](c3ccccc3)C3(C[NH2+]C3)C2)C1(C)C ZINC001222596054 1052514812 /nfs/dbraw/zinc/51/48/12/1052514812.db2.gz PCLLSASAVMSCOZ-WOJBJXKFSA-N 2 1 324.512 4.058 20 0 DIADMP CC(C)=CCC[C@H](C)C[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222596029 1052515315 /nfs/dbraw/zinc/51/53/15/1052515315.db2.gz OSFDDFLGXVCUNK-ICSRJNTNSA-N 2 1 312.501 4.058 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC001222630022 1052520380 /nfs/dbraw/zinc/52/03/80/1052520380.db2.gz WQJDQZRDQBRWQM-KDURUIRLSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)c2)cc1 ZINC001222629497 1052520690 /nfs/dbraw/zinc/52/06/90/1052520690.db2.gz JYNWJWUTULEPOU-SZPZYZBQSA-N 2 1 320.480 4.093 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)[C@H]1CC1(C)C ZINC000397602574 1052530136 /nfs/dbraw/zinc/53/01/36/1052530136.db2.gz ALOWXFALOIXGGM-UKBAYJJMSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)[C@H]1CC1(C)C ZINC000397602574 1052530140 /nfs/dbraw/zinc/53/01/40/1052530140.db2.gz ALOWXFALOIXGGM-UKBAYJJMSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1 ZINC000398024650 1052562364 /nfs/dbraw/zinc/56/23/64/1052562364.db2.gz LONIPBNYVRKZLP-SIKLNZKXSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1 ZINC000398024650 1052562366 /nfs/dbraw/zinc/56/23/66/1052562366.db2.gz LONIPBNYVRKZLP-SIKLNZKXSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000398157315 1052565702 /nfs/dbraw/zinc/56/57/02/1052565702.db2.gz RBSMTKGNSVLMML-WFXMLNOXSA-N 2 1 308.469 4.248 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000398157315 1052565709 /nfs/dbraw/zinc/56/57/09/1052565709.db2.gz RBSMTKGNSVLMML-WFXMLNOXSA-N 2 1 308.469 4.248 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649132 1052627944 /nfs/dbraw/zinc/62/79/44/1052627944.db2.gz PWNZGQAVMARMGW-NEPJUHHUSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649132 1052627946 /nfs/dbraw/zinc/62/79/46/1052627946.db2.gz PWNZGQAVMARMGW-NEPJUHHUSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000037649032 1052628059 /nfs/dbraw/zinc/62/80/59/1052628059.db2.gz DDAQXDZMMXAYPU-VXGBXAGGSA-N 2 1 313.272 4.128 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649062 1052628365 /nfs/dbraw/zinc/62/83/65/1052628365.db2.gz XKWFXHLZDUYONE-KBXCAEBGSA-N 2 1 306.881 4.255 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2)c1 ZINC000123949160 1052636244 /nfs/dbraw/zinc/63/62/44/1052636244.db2.gz QMTCZORGCYVNQY-AWEZNQCLSA-N 2 1 318.411 4.267 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccs2)cc1)CC1CC[NH+](C)CC1 ZINC000683520306 1052640987 /nfs/dbraw/zinc/64/09/87/1052640987.db2.gz QWYMWYHPZIBJKH-UHFFFAOYSA-N 2 1 314.498 4.189 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000125521900 1052649058 /nfs/dbraw/zinc/64/90/58/1052649058.db2.gz DHYSMBHKYKGRNM-HNNXBMFYSA-N 2 1 319.880 4.188 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000125521900 1052649061 /nfs/dbraw/zinc/64/90/61/1052649061.db2.gz DHYSMBHKYKGRNM-HNNXBMFYSA-N 2 1 319.880 4.188 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2C)C[C@H]1C ZINC000125523858 1052649185 /nfs/dbraw/zinc/64/91/85/1052649185.db2.gz MJMCVVVXVYOVON-IEBWSBKVSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2C)C[C@H]1C ZINC000125523858 1052649186 /nfs/dbraw/zinc/64/91/86/1052649186.db2.gz MJMCVVVXVYOVON-IEBWSBKVSA-N 2 1 311.473 4.158 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2ccccc2s1 ZINC000125522557 1052649196 /nfs/dbraw/zinc/64/91/96/1052649196.db2.gz NMZWOYLEEKHMDS-CWRNSKLLSA-N 2 1 300.471 4.179 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000125475653 1052649823 /nfs/dbraw/zinc/64/98/23/1052649823.db2.gz LQMLJRJMVNHHDS-CQSZACIVSA-N 2 1 305.853 4.318 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000125475653 1052649825 /nfs/dbraw/zinc/64/98/25/1052649825.db2.gz LQMLJRJMVNHHDS-CQSZACIVSA-N 2 1 305.853 4.318 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1F ZINC000125810470 1052654779 /nfs/dbraw/zinc/65/47/79/1052654779.db2.gz JRZIHEWPSXLLLB-GJZGRUSLSA-N 2 1 324.509 4.319 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3c(s2)CCC3)C1 ZINC000125863295 1052656096 /nfs/dbraw/zinc/65/60/96/1052656096.db2.gz UERMLNNJTMUWLX-LSDHHAIUSA-N 2 1 306.519 4.008 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1)c1cccc(O)c1 ZINC000126638138 1052672438 /nfs/dbraw/zinc/67/24/38/1052672438.db2.gz DCVHOVNAYTVMAP-FTRWYGJKSA-N 2 1 316.489 4.086 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556062247 1052794901 /nfs/dbraw/zinc/79/49/01/1052794901.db2.gz RKWSUBMAWIOFFZ-KRFUXDQASA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556062247 1052794904 /nfs/dbraw/zinc/79/49/04/1052794904.db2.gz RKWSUBMAWIOFFZ-KRFUXDQASA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587391 1052797379 /nfs/dbraw/zinc/79/73/79/1052797379.db2.gz FVLAAJNPEJEFGM-GMXVVIOVSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587391 1052797381 /nfs/dbraw/zinc/79/73/81/1052797381.db2.gz FVLAAJNPEJEFGM-GMXVVIOVSA-N 2 1 301.261 4.127 20 0 DIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556118480 1052803127 /nfs/dbraw/zinc/80/31/27/1052803127.db2.gz DAIPHDPEWLCYTF-RBUKOAKNSA-N 2 1 320.546 4.191 20 0 DIADMP CC(C)CSCCC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556118480 1052803121 /nfs/dbraw/zinc/80/31/21/1052803121.db2.gz DAIPHDPEWLCYTF-RBUKOAKNSA-N 2 1 320.546 4.191 20 0 DIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556118478 1052803473 /nfs/dbraw/zinc/80/34/73/1052803473.db2.gz DAIPHDPEWLCYTF-MOPGFXCFSA-N 2 1 320.546 4.191 20 0 DIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556118478 1052803478 /nfs/dbraw/zinc/80/34/78/1052803478.db2.gz DAIPHDPEWLCYTF-MOPGFXCFSA-N 2 1 320.546 4.191 20 0 DIADMP CC(C)CC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000556117656 1052803750 /nfs/dbraw/zinc/80/37/50/1052803750.db2.gz FGJDRCJZZDFPAM-RTBURBONSA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)CC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000556117656 1052803756 /nfs/dbraw/zinc/80/37/56/1052803756.db2.gz FGJDRCJZZDFPAM-RTBURBONSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC000556172736 1052816467 /nfs/dbraw/zinc/81/64/67/1052816467.db2.gz VXCQDYHPGGLEHZ-MEBIHWHUSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C[C@@H]1C ZINC000556172736 1052816469 /nfs/dbraw/zinc/81/64/69/1052816469.db2.gz VXCQDYHPGGLEHZ-MEBIHWHUSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000556225498 1052823113 /nfs/dbraw/zinc/82/31/13/1052823113.db2.gz VLDFXBCZOFYNPW-FNAHDJPLSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000556225498 1052823115 /nfs/dbraw/zinc/82/31/15/1052823115.db2.gz VLDFXBCZOFYNPW-FNAHDJPLSA-N 2 1 320.480 4.358 20 0 DIADMP CC(C)C[C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000556260129 1052828784 /nfs/dbraw/zinc/82/87/84/1052828784.db2.gz CWAQKZAZPHBKAM-KKXNLOMOSA-N 2 1 302.506 4.454 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@H]2CCC[C@@H]21 ZINC000556880241 1052893701 /nfs/dbraw/zinc/89/37/01/1052893701.db2.gz XYQARARHDBSPJU-DBDQLMEASA-N 2 1 318.892 4.048 20 0 DIADMP Cc1cc(C)cc(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000237634083 1053016352 /nfs/dbraw/zinc/01/63/52/1053016352.db2.gz XHASOCHWYRLPPL-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000179841520 1053031396 /nfs/dbraw/zinc/03/13/96/1053031396.db2.gz YEPBTZFWNUYJDF-JKSUJKDBSA-N 2 1 303.494 4.064 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)C1 ZINC000323396915 1053052381 /nfs/dbraw/zinc/05/23/81/1053052381.db2.gz MEZCGHKUTLJRNO-JOZSIVFUSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)C1 ZINC000323396915 1053052384 /nfs/dbraw/zinc/05/23/84/1053052384.db2.gz MEZCGHKUTLJRNO-JOZSIVFUSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@H+](C)C2CCCC2)C[C@@H](c2ccccc2)C1 ZINC000323422098 1053064275 /nfs/dbraw/zinc/06/42/75/1053064275.db2.gz SYRGNHMMGRFXHR-YSIASYRMSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@@H+](C)C2CCCC2)C[C@@H](c2ccccc2)C1 ZINC000323422098 1053064283 /nfs/dbraw/zinc/06/42/83/1053064283.db2.gz SYRGNHMMGRFXHR-YSIASYRMSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000518946911 1053105627 /nfs/dbraw/zinc/10/56/27/1053105627.db2.gz AAVZKRKQAHQMJJ-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000518946911 1053105628 /nfs/dbraw/zinc/10/56/28/1053105628.db2.gz AAVZKRKQAHQMJJ-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccccn1 ZINC000090586173 1053237572 /nfs/dbraw/zinc/23/75/72/1053237572.db2.gz CCSSGXPPWSOLKS-QUCCMNQESA-N 2 1 317.521 4.126 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccn1 ZINC000090586173 1053237584 /nfs/dbraw/zinc/23/75/84/1053237584.db2.gz CCSSGXPPWSOLKS-QUCCMNQESA-N 2 1 317.521 4.126 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000091266429 1053258852 /nfs/dbraw/zinc/25/88/52/1053258852.db2.gz YWORZWIHNUVAAA-MRXNPFEDSA-N 2 1 313.272 4.128 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC001319756497 1053271377 /nfs/dbraw/zinc/27/13/77/1053271377.db2.gz XRFICXOHMJYUCX-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000572538997 1053290071 /nfs/dbraw/zinc/29/00/71/1053290071.db2.gz QWBSGACBAWCWJT-NRFANRHFSA-N 2 1 319.452 4.343 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000572538997 1053290075 /nfs/dbraw/zinc/29/00/75/1053290075.db2.gz QWBSGACBAWCWJT-NRFANRHFSA-N 2 1 319.452 4.343 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC001200255936 1053503057 /nfs/dbraw/zinc/50/30/57/1053503057.db2.gz RSZBMIMBIBFSIT-HNNXBMFYSA-N 2 1 308.897 4.112 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001200255936 1053503068 /nfs/dbraw/zinc/50/30/68/1053503068.db2.gz RSZBMIMBIBFSIT-HNNXBMFYSA-N 2 1 308.897 4.112 20 0 DIADMP CC[N@@H+](C[C@H]1CCC[NH2+]C1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000262535918 1053576964 /nfs/dbraw/zinc/57/69/64/1053576964.db2.gz QHVHGAUJFNASPZ-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940220 1053613374 /nfs/dbraw/zinc/61/33/74/1053613374.db2.gz DRRRXPZZGJNKFE-CJNGLKHVSA-N 2 1 312.860 4.252 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940220 1053613378 /nfs/dbraw/zinc/61/33/78/1053613378.db2.gz DRRRXPZZGJNKFE-CJNGLKHVSA-N 2 1 312.860 4.252 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2)CC1 ZINC000763612889 1053614477 /nfs/dbraw/zinc/61/44/77/1053614477.db2.gz HHQBSKQVYALPIW-HXUWFJFHSA-N 2 1 308.469 4.270 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(-c2ccccc2)o1)C(C)(C)C ZINC001200413298 1053641429 /nfs/dbraw/zinc/64/14/29/1053641429.db2.gz XFVYEWOJDGFFMG-IBGZPJMESA-N 2 1 314.473 4.403 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCSc3c(Cl)cccc32)C1 ZINC000414170849 1053672854 /nfs/dbraw/zinc/67/28/54/1053672854.db2.gz CLDANKWFWROPPA-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC001325038758 1053697204 /nfs/dbraw/zinc/69/72/04/1053697204.db2.gz NFDNWAFJFLQFIS-INIZCTEOSA-N 2 1 306.453 4.078 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC001325038758 1053697212 /nfs/dbraw/zinc/69/72/12/1053697212.db2.gz NFDNWAFJFLQFIS-INIZCTEOSA-N 2 1 306.453 4.078 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccn2C2CC2)CC1 ZINC001325117956 1053699616 /nfs/dbraw/zinc/69/96/16/1053699616.db2.gz PKNIVQPLGAQXLC-KRWDZBQOSA-N 2 1 323.484 4.138 20 0 DIADMP C[NH2+][C@H](C)CC[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001326035939 1053746011 /nfs/dbraw/zinc/74/60/11/1053746011.db2.gz MSFHUULLRVKMDL-RDTXWAMCSA-N 2 1 302.849 4.017 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000154733581 1053746414 /nfs/dbraw/zinc/74/64/14/1053746414.db2.gz IFNGXFCZYMCLPV-MRXNPFEDSA-N 2 1 313.272 4.055 20 0 DIADMP Cc1c(C)c(C)c(C[NH+]2CCC([N@H+](C)C3CC3)CC2)c(C)c1C ZINC001231494189 1053768435 /nfs/dbraw/zinc/76/84/35/1053768435.db2.gz KATQGLNHJYENIT-UHFFFAOYSA-N 2 1 314.517 4.287 20 0 DIADMP Cc1c(C)c(C)c(C[NH+]2CCC([N@@H+](C)C3CC3)CC2)c(C)c1C ZINC001231494189 1053768441 /nfs/dbraw/zinc/76/84/41/1053768441.db2.gz KATQGLNHJYENIT-UHFFFAOYSA-N 2 1 314.517 4.287 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2ccc(C)o2)cc1)C1CCN(C)CC1 ZINC001231598503 1053798818 /nfs/dbraw/zinc/79/88/18/1053798818.db2.gz VRNZYIOAUICYFM-UHFFFAOYSA-N 2 1 312.457 4.171 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+](C)CCC[NH+]1CCCC1 ZINC001231644068 1053812396 /nfs/dbraw/zinc/81/23/96/1053812396.db2.gz OMCCNROPJHZNKS-UHFFFAOYSA-N 2 1 302.487 4.127 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C)CCC[NH+]1CCCC1 ZINC001231644068 1053812416 /nfs/dbraw/zinc/81/24/16/1053812416.db2.gz OMCCNROPJHZNKS-UHFFFAOYSA-N 2 1 302.487 4.127 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001327090366 1053835038 /nfs/dbraw/zinc/83/50/38/1053835038.db2.gz VSWWNFAJAHVABZ-UHFFFAOYSA-N 2 1 318.464 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccco1 ZINC000157646567 1053861287 /nfs/dbraw/zinc/86/12/87/1053861287.db2.gz AXSFWADWUHJDNE-IRXDYDNUSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccco1 ZINC000157646567 1053861301 /nfs/dbraw/zinc/86/13/01/1053861301.db2.gz AXSFWADWUHJDNE-IRXDYDNUSA-N 2 1 312.457 4.362 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@H]1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001327569894 1053863299 /nfs/dbraw/zinc/86/32/99/1053863299.db2.gz OUGRYRPGDRBSSY-WBVHZDCISA-N 2 1 303.837 4.173 20 0 DIADMP CC[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3-c3ccccc3C)C[C@@H]2C1 ZINC001231809002 1053867024 /nfs/dbraw/zinc/86/70/24/1053867024.db2.gz CHGQUTUVAFVXTI-BGYRXZFFSA-N 2 1 320.480 4.046 20 0 DIADMP CC[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3-c3ccccc3C)C[C@@H]2C1 ZINC001231809002 1053867034 /nfs/dbraw/zinc/86/70/34/1053867034.db2.gz CHGQUTUVAFVXTI-BGYRXZFFSA-N 2 1 320.480 4.046 20 0 DIADMP CC[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3-c3ccccc3C)C[C@@H]2C1 ZINC001231809002 1053867043 /nfs/dbraw/zinc/86/70/43/1053867043.db2.gz CHGQUTUVAFVXTI-BGYRXZFFSA-N 2 1 320.480 4.046 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001327616482 1053867395 /nfs/dbraw/zinc/86/73/95/1053867395.db2.gz MLASSWCULNZZBS-WBVHZDCISA-N 2 1 318.530 4.181 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001327616472 1053868645 /nfs/dbraw/zinc/86/86/45/1053868645.db2.gz MLASSWCULNZZBS-DOTOQJQBSA-N 2 1 318.530 4.181 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccccn1 ZINC000158648719 1053914968 /nfs/dbraw/zinc/91/49/68/1053914968.db2.gz AKSSKYADNILGMY-GOSISDBHSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC001200713678 1053916720 /nfs/dbraw/zinc/91/67/20/1053916720.db2.gz FOVWHJMAWCIOTA-YOEHRIQHSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC001200713678 1053916735 /nfs/dbraw/zinc/91/67/35/1053916735.db2.gz FOVWHJMAWCIOTA-YOEHRIQHSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC001200713675 1053917108 /nfs/dbraw/zinc/91/71/08/1053917108.db2.gz FOVWHJMAWCIOTA-RHSMWYFYSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC001200713675 1053917117 /nfs/dbraw/zinc/91/71/17/1053917117.db2.gz FOVWHJMAWCIOTA-RHSMWYFYSA-N 2 1 320.527 4.291 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2Cc2cc3c[nH+]ccc3[nH]2)cc1 ZINC001232013547 1053938988 /nfs/dbraw/zinc/93/89/88/1053938988.db2.gz BJVKZZNZOMCLDR-FQEVSTJZSA-N 2 1 321.424 4.299 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232013939 1053939363 /nfs/dbraw/zinc/93/93/63/1053939363.db2.gz IEHDTMVEUROPAO-CYBMUJFWSA-N 2 1 311.816 4.206 20 0 DIADMP Fc1ccc(C[C@@H]2CCC[N@@H+](Cc3cc4c[nH+]ccc4[nH]3)C2)cc1 ZINC001232015221 1053943954 /nfs/dbraw/zinc/94/39/54/1053943954.db2.gz DDSQTBVGYUXQBL-INIZCTEOSA-N 2 1 323.415 4.157 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c1 ZINC001232145952 1053972586 /nfs/dbraw/zinc/97/25/86/1053972586.db2.gz FUDZWBFZOAZHEQ-MJGOQNOKSA-N 2 1 304.453 4.042 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1ccc(F)c(Cl)c1 ZINC000159215386 1054017005 /nfs/dbraw/zinc/01/70/05/1054017005.db2.gz SXVMAZMDHNUYCQ-GFCCVEGCSA-N 2 1 309.816 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1ccc(F)c(Cl)c1 ZINC000159215386 1054017022 /nfs/dbraw/zinc/01/70/22/1054017022.db2.gz SXVMAZMDHNUYCQ-GFCCVEGCSA-N 2 1 309.816 4.067 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CCCC1 ZINC000165006450 1054067872 /nfs/dbraw/zinc/06/78/72/1054067872.db2.gz LOYMCARCJTXPFY-LESCRADOSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CCCC1 ZINC000165006450 1054067882 /nfs/dbraw/zinc/06/78/82/1054067882.db2.gz LOYMCARCJTXPFY-LESCRADOSA-N 2 1 306.519 4.299 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001333000172 1054135845 /nfs/dbraw/zinc/13/58/45/1054135845.db2.gz ISPXWIKKPZUDLI-RMJJICAUSA-N 2 1 316.464 4.225 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001333000172 1054135851 /nfs/dbraw/zinc/13/58/51/1054135851.db2.gz ISPXWIKKPZUDLI-RMJJICAUSA-N 2 1 316.464 4.225 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001333000168 1054136017 /nfs/dbraw/zinc/13/60/17/1054136017.db2.gz ISPXWIKKPZUDLI-DOADOZAASA-N 2 1 316.464 4.225 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001333000168 1054136021 /nfs/dbraw/zinc/13/60/21/1054136021.db2.gz ISPXWIKKPZUDLI-DOADOZAASA-N 2 1 316.464 4.225 20 0 DIADMP c1cc(C2CC2)ccc1C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001232981541 1054162727 /nfs/dbraw/zinc/16/27/27/1054162727.db2.gz CYZSBLGMXDWFIA-UHFFFAOYSA-N 2 1 324.512 4.404 20 0 DIADMP c1cc(C2CC2)ccc1C[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001232981541 1054162734 /nfs/dbraw/zinc/16/27/34/1054162734.db2.gz CYZSBLGMXDWFIA-UHFFFAOYSA-N 2 1 324.512 4.404 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]CCCC(F)(F)F)CC1 ZINC001333723406 1054169082 /nfs/dbraw/zinc/16/90/82/1054169082.db2.gz GRQNHHKTVHAWBX-CQSZACIVSA-N 2 1 314.395 4.144 20 0 DIADMP CC1CC[NH+](c2ccc(N[C@@H]3CC[N@H+](C)C(C)(C)C3)cc2)CC1 ZINC001334890180 1054203579 /nfs/dbraw/zinc/20/35/79/1054203579.db2.gz HRYXPIOIWOYXBT-GOSISDBHSA-N 2 1 315.505 4.208 20 0 DIADMP CC1CC[NH+](c2ccc(N[C@@H]3CC[N@@H+](C)C(C)(C)C3)cc2)CC1 ZINC001334890180 1054203588 /nfs/dbraw/zinc/20/35/88/1054203588.db2.gz HRYXPIOIWOYXBT-GOSISDBHSA-N 2 1 315.505 4.208 20 0 DIADMP CC(C)[C@H]1CC[C@@H](C)C[C@@H]1C[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC001340977201 1054372743 /nfs/dbraw/zinc/37/27/43/1054372743.db2.gz QFWLJMLFPMYGTN-BFYDXBDKSA-N 2 1 323.550 4.003 20 0 DIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000339293406 1054496494 /nfs/dbraw/zinc/49/64/94/1054496494.db2.gz MYETZFMHPYFXLC-HNAYVOBHSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000339293406 1054496505 /nfs/dbraw/zinc/49/65/05/1054496505.db2.gz MYETZFMHPYFXLC-HNAYVOBHSA-N 2 1 314.498 4.199 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267226 1054562044 /nfs/dbraw/zinc/56/20/44/1054562044.db2.gz WGDUCIZWVNVASS-HOTGVXAUSA-N 2 1 308.535 4.232 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267226 1054562052 /nfs/dbraw/zinc/56/20/52/1054562052.db2.gz WGDUCIZWVNVASS-HOTGVXAUSA-N 2 1 308.535 4.232 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000192677601 1054566792 /nfs/dbraw/zinc/56/67/92/1054566792.db2.gz KIYRADFZZIVLDR-FXAWDEMLSA-N 2 1 315.505 4.035 20 0 DIADMP C[C@@H](CC1CC1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001347529138 1054572202 /nfs/dbraw/zinc/57/22/02/1054572202.db2.gz XOUCAXVEYUZEEO-BRIRTLKKSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623379470 1054580273 /nfs/dbraw/zinc/58/02/73/1054580273.db2.gz RWSKLCQGSZSPCP-AEFFLSMTSA-N 2 1 302.506 4.205 20 0 DIADMP CC[C@@H](N[C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419650 1054589170 /nfs/dbraw/zinc/58/91/70/1054589170.db2.gz RHPHDOAYGVHKDB-NWDGAFQWSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419650 1054589181 /nfs/dbraw/zinc/58/91/81/1054589181.db2.gz RHPHDOAYGVHKDB-NWDGAFQWSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419650 1054589198 /nfs/dbraw/zinc/58/91/98/1054589198.db2.gz RHPHDOAYGVHKDB-NWDGAFQWSA-N 2 1 300.899 4.315 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485195 1054603785 /nfs/dbraw/zinc/60/37/85/1054603785.db2.gz RCRBPKPFEBAQCO-ZBFHGGJFSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485195 1054603798 /nfs/dbraw/zinc/60/37/98/1054603798.db2.gz RCRBPKPFEBAQCO-ZBFHGGJFSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485192 1054604936 /nfs/dbraw/zinc/60/49/36/1054604936.db2.gz RCRBPKPFEBAQCO-GDBMZVCRSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485192 1054604941 /nfs/dbraw/zinc/60/49/41/1054604941.db2.gz RCRBPKPFEBAQCO-GDBMZVCRSA-N 2 1 322.880 4.016 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1 ZINC000177295340 1054617566 /nfs/dbraw/zinc/61/75/66/1054617566.db2.gz MRNYBBQLNUMOLL-HOTGVXAUSA-N 2 1 307.441 4.332 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cccc2ccccc21 ZINC000177295316 1054617788 /nfs/dbraw/zinc/61/77/88/1054617788.db2.gz UQAQHYLJTDDMFJ-HZPDHXFCSA-N 2 1 307.441 4.332 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc2ccccc2c1 ZINC000177370441 1054619494 /nfs/dbraw/zinc/61/94/94/1054619494.db2.gz GNJHEPTVGPFYTD-MRXNPFEDSA-N 2 1 307.441 4.476 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)cc12 ZINC001234993000 1054637127 /nfs/dbraw/zinc/63/71/27/1054637127.db2.gz NVSJRYUOPYCWNG-OAQYLSRUSA-N 2 1 320.436 4.162 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235037906 1054643328 /nfs/dbraw/zinc/64/33/28/1054643328.db2.gz IUUSNABQYUSTOQ-KRWDZBQOSA-N 2 1 324.921 4.170 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235037906 1054643337 /nfs/dbraw/zinc/64/33/37/1054643337.db2.gz IUUSNABQYUSTOQ-KRWDZBQOSA-N 2 1 324.921 4.170 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001235039033 1054644241 /nfs/dbraw/zinc/64/42/41/1054644241.db2.gz MMPFEYFTRHEADH-FQEVSTJZSA-N 2 1 300.490 4.137 20 0 DIADMP CSc1cccc(Cl)c1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235036677 1054644502 /nfs/dbraw/zinc/64/45/02/1054644502.db2.gz AQZQDRYLXNIHEA-KRWDZBQOSA-N 2 1 324.921 4.170 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235036677 1054644508 /nfs/dbraw/zinc/64/45/08/1054644508.db2.gz AQZQDRYLXNIHEA-KRWDZBQOSA-N 2 1 324.921 4.170 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235045648 1054646118 /nfs/dbraw/zinc/64/61/18/1054646118.db2.gz LEWINJJPUQXVOZ-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)cc2s1 ZINC001235040553 1054646178 /nfs/dbraw/zinc/64/61/78/1054646178.db2.gz SYQNYTNLRUQPBX-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)cc2)o1 ZINC001235048706 1054646495 /nfs/dbraw/zinc/64/64/95/1054646495.db2.gz ZQQJJNWZTCBWOY-OAQYLSRUSA-N 2 1 324.468 4.363 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c2ccccc12 ZINC001235047321 1054647422 /nfs/dbraw/zinc/64/74/22/1054647422.db2.gz VHPOEEFRVMUIKN-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP C[C@H](C[N@H+]1CCC2(C1)CC[NH2+]CC2)c1cccc2ccccc21 ZINC001235093889 1054653063 /nfs/dbraw/zinc/65/30/63/1054653063.db2.gz UNNYQLZUMNVPPX-QGZVFWFLSA-N 2 1 308.469 4.019 20 0 DIADMP CC/C=C\CCCCCC[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001235093001 1054653718 /nfs/dbraw/zinc/65/37/18/1054653718.db2.gz YDFYQSXEDPOVBC-CWIOURORSA-N 2 1 314.464 4.224 20 0 DIADMP Clc1sc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)c2ccccc12 ZINC001235093533 1054654957 /nfs/dbraw/zinc/65/49/57/1054654957.db2.gz DZEMRNXUSWPIOV-UHFFFAOYSA-N 2 1 320.889 4.130 20 0 DIADMP CCCCCCc1ccc(C[NH+]2CCC3(CC[NH2+]3)CC2)s1 ZINC001235112181 1054658870 /nfs/dbraw/zinc/65/88/70/1054658870.db2.gz XYNMGGUTYRLZLM-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CCC[C@]23CC[NH2+]C3)CC1 ZINC001235111702 1054659099 /nfs/dbraw/zinc/65/90/99/1054659099.db2.gz SJEYPIAVPXSRFC-VQTJNVASSA-N 2 1 302.506 4.287 20 0 DIADMP c1ccc(C(C[N@@H+]2CCCC[C@@]23CC[NH2+]C3)c2ccccc2)cc1 ZINC001235120448 1054661421 /nfs/dbraw/zinc/66/14/21/1054661421.db2.gz BSHZEKBNRKAFNY-QFIPXVFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc(C(C[N@H+]2CCCC[C@@]23CC[NH2+]C3)c2ccccc2)cc1 ZINC001235120448 1054661426 /nfs/dbraw/zinc/66/14/26/1054661426.db2.gz BSHZEKBNRKAFNY-QFIPXVFZSA-N 2 1 320.480 4.037 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCCc2c(C)ccc(C)c21 ZINC000349408215 1054661826 /nfs/dbraw/zinc/66/18/26/1054661826.db2.gz JJKMPYURHALPGD-AUUYWEPGSA-N 2 1 311.473 4.112 20 0 DIADMP Clc1sc(C[N@@H+]2CCCC23CC[NH2+]CC3)c2ccccc12 ZINC001235143974 1054664065 /nfs/dbraw/zinc/66/40/65/1054664065.db2.gz NLIJKLFKLXRBPK-UHFFFAOYSA-N 2 1 320.889 4.273 20 0 DIADMP Clc1sc(C[N@H+]2CCCC23CC[NH2+]CC3)c2ccccc12 ZINC001235143974 1054664069 /nfs/dbraw/zinc/66/40/69/1054664069.db2.gz NLIJKLFKLXRBPK-UHFFFAOYSA-N 2 1 320.889 4.273 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CCCC34CC[NH2+]CC4)c2)cc1 ZINC001235140182 1054664390 /nfs/dbraw/zinc/66/43/90/1054664390.db2.gz GAIJHQRQNNFCHI-UHFFFAOYSA-N 2 1 324.443 4.211 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCCC34CC[NH2+]CC4)cc2)c1 ZINC001235144029 1054664777 /nfs/dbraw/zinc/66/47/77/1054664777.db2.gz IKLIGWYKMLTYBR-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CCCC23CC[NH2+]CC3)cc1 ZINC001235143548 1054665055 /nfs/dbraw/zinc/66/50/55/1054665055.db2.gz FGXHZUNVCIHKPS-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCCC34CC[NH2+]CC4)c2)cc1 ZINC001235144709 1054665227 /nfs/dbraw/zinc/66/52/27/1054665227.db2.gz NWSCGPWEMQVPMG-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1 ZINC001235156961 1054666597 /nfs/dbraw/zinc/66/65/97/1054666597.db2.gz OIFDKGXPUNLPSM-HXUWFJFHSA-N 2 1 300.490 4.164 20 0 DIADMP Cc1cccc(Cl)c1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235155679 1054666825 /nfs/dbraw/zinc/66/68/25/1054666825.db2.gz PFRPAFXKQYGRNL-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CCCC23CC[NH2+]CC3)cc1 ZINC001235145240 1054667290 /nfs/dbraw/zinc/66/72/90/1054667290.db2.gz RRDHPIDJHOFBRT-UHFFFAOYSA-N 2 1 324.443 4.211 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c(F)cc1Cl ZINC001235156135 1054667396 /nfs/dbraw/zinc/66/73/96/1054667396.db2.gz MUQTXGJBPVMOOT-SFHVURJKSA-N 2 1 324.871 4.142 20 0 DIADMP c1cc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c2cccccc1-2 ZINC001235154699 1054667818 /nfs/dbraw/zinc/66/78/18/1054667818.db2.gz KIXHOBLSWBEEEZ-NRFANRHFSA-N 2 1 308.469 4.146 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1F ZINC001235154646 1054667945 /nfs/dbraw/zinc/66/79/45/1054667945.db2.gz JLXLOHRUBGRUGB-KRWDZBQOSA-N 2 1 324.871 4.142 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235158709 1054668952 /nfs/dbraw/zinc/66/89/52/1054668952.db2.gz MRTPSLKMTUCRDS-HXUWFJFHSA-N 2 1 300.490 4.164 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCCC[C@@]23CCC[NH2+]C3)cc1 ZINC001235167431 1054669432 /nfs/dbraw/zinc/66/94/32/1054669432.db2.gz JCWTUMVZZOKYJI-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCCC[C@@]23CCC[NH2+]C3)cc1 ZINC001235167431 1054669436 /nfs/dbraw/zinc/66/94/36/1054669436.db2.gz JCWTUMVZZOKYJI-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235159965 1054670251 /nfs/dbraw/zinc/67/02/51/1054670251.db2.gz ZHOIBVXQLGJTDI-LJQANCHMSA-N 2 1 320.908 4.311 20 0 DIADMP Cc1ccc(C[N@@H+]2CCCC[C@@]23CCC[NH2+]C3)c2ccccc12 ZINC001235168776 1054670333 /nfs/dbraw/zinc/67/03/33/1054670333.db2.gz UIELDAUVYNEGQJ-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@@]23CCC[NH2+]C3)c2ccccc12 ZINC001235168776 1054670341 /nfs/dbraw/zinc/67/03/41/1054670341.db2.gz UIELDAUVYNEGQJ-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP c1cc2c(cccc2C[N@@H+]2CCCC[C@@]23CCC[NH2+]C3)s1 ZINC001235177838 1054675646 /nfs/dbraw/zinc/67/56/46/1054675646.db2.gz LIQBVKRUYPHKNC-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCC[C@@]23CCC[NH2+]C3)s1 ZINC001235177838 1054675654 /nfs/dbraw/zinc/67/56/54/1054675654.db2.gz LIQBVKRUYPHKNC-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235177460 1054676490 /nfs/dbraw/zinc/67/64/90/1054676490.db2.gz JLVHOVKKQUTKDO-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235177460 1054676496 /nfs/dbraw/zinc/67/64/96/1054676496.db2.gz JLVHOVKKQUTKDO-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCCCC34CC[NH2+]CC4)cc2)cc1 ZINC001235189756 1054680421 /nfs/dbraw/zinc/68/04/21/1054680421.db2.gz APULMOXCTMXNCD-UHFFFAOYSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1ccc(C[N@@H+]2CCCCC23CC[NH2+]CC3)c(C)c1Cl ZINC001235190013 1054680727 /nfs/dbraw/zinc/68/07/27/1054680727.db2.gz CAOXYGASKLEJMC-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1ccc(C[N@H+]2CCCCC23CC[NH2+]CC3)c(C)c1Cl ZINC001235190013 1054680730 /nfs/dbraw/zinc/68/07/30/1054680730.db2.gz CAOXYGASKLEJMC-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@@H+]2CCCCC23CC[NH2+]CC3)c1 ZINC001235190672 1054682100 /nfs/dbraw/zinc/68/21/00/1054682100.db2.gz HGCKTCCLXXKJMX-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@H+]2CCCCC23CC[NH2+]CC3)c1 ZINC001235190672 1054682108 /nfs/dbraw/zinc/68/21/08/1054682108.db2.gz HGCKTCCLXXKJMX-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@H]2[NH2+]CC[C@H]2C1 ZINC001235272710 1054697230 /nfs/dbraw/zinc/69/72/30/1054697230.db2.gz QVDPMNUJIPGRFG-KBXCAEBGSA-N 2 1 322.477 4.238 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)CCN1C ZINC000179906105 1054713737 /nfs/dbraw/zinc/71/37/37/1054713737.db2.gz MLQWHLCZGIRVPY-WMLDXEAASA-N 2 1 316.420 4.000 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)s1 ZINC001235425898 1054715553 /nfs/dbraw/zinc/71/55/53/1054715553.db2.gz JSQQIGIVFPCDIL-JKSUJKDBSA-N 2 1 314.498 4.113 20 0 DIADMP c1ccc2cc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)ccc2c1 ZINC001235426710 1054716499 /nfs/dbraw/zinc/71/64/99/1054716499.db2.gz QNIBDDZHBIZNGX-SFTDATJTSA-N 2 1 308.469 4.051 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC001235428548 1054717456 /nfs/dbraw/zinc/71/74/56/1054717456.db2.gz QQCLKHXDSMSNMK-PMACEKPBSA-N 2 1 300.490 4.022 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235428210 1054719016 /nfs/dbraw/zinc/71/90/16/1054719016.db2.gz ULAJZRQMSYZWDU-MOPGFXCFSA-N 2 1 308.469 4.051 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c(C)c1Cl ZINC001235430093 1054719920 /nfs/dbraw/zinc/71/99/20/1054719920.db2.gz DFOSFTBXEXKXHL-SJLPKXTDSA-N 2 1 320.908 4.168 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cc2c(s1)C[NH2+]CC2 ZINC001235445958 1054721715 /nfs/dbraw/zinc/72/17/15/1054721715.db2.gz WHMXRNWSTZYNML-GOSISDBHSA-N 2 1 312.482 4.039 20 0 DIADMP C[N@H+](CCC[NH3+])Cc1ccccc1Sc1ccc(Cl)cc1 ZINC001235435607 1054723133 /nfs/dbraw/zinc/72/31/33/1054723133.db2.gz SMKPCUALKBWLSA-UHFFFAOYSA-N 2 1 320.889 4.272 20 0 DIADMP C[N@@H+](CCC[NH3+])Cc1ccccc1Sc1ccc(Cl)cc1 ZINC001235435607 1054723149 /nfs/dbraw/zinc/72/31/49/1054723149.db2.gz SMKPCUALKBWLSA-UHFFFAOYSA-N 2 1 320.889 4.272 20 0 DIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)C(C)(C)c1ccccc1 ZINC000180013110 1054726230 /nfs/dbraw/zinc/72/62/30/1054726230.db2.gz LGWYSMHLCBDROX-LJQANCHMSA-N 2 1 313.489 4.318 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000180093577 1054733762 /nfs/dbraw/zinc/73/37/62/1054733762.db2.gz LDWSOLQAJFBVLM-SCLBCKFNSA-N 2 1 317.864 4.222 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1F ZINC000180404155 1054754857 /nfs/dbraw/zinc/75/48/57/1054754857.db2.gz SAELCCCQOZKAFX-ZDUSSCGKSA-N 2 1 310.482 4.071 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001235677014 1054770494 /nfs/dbraw/zinc/77/04/94/1054770494.db2.gz WBMPRIYFEONRGQ-INIZCTEOSA-N 2 1 314.860 4.178 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccc2c(c1)C[NH2+]CC2 ZINC001235677618 1054772193 /nfs/dbraw/zinc/77/21/93/1054772193.db2.gz HOJATIOKKUSAEL-NRFANRHFSA-N 2 1 324.443 4.199 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1ccc2c(c1)CC[NH2+]C2 ZINC001235677879 1054774478 /nfs/dbraw/zinc/77/44/78/1054774478.db2.gz JGWJJMHQGNTVCP-OAQYLSRUSA-N 2 1 324.443 4.199 20 0 DIADMP c1csc(C2CC[NH+](CCC[NH2+]C3CCCCC3)CC2)c1 ZINC001235690608 1054777186 /nfs/dbraw/zinc/77/71/86/1054777186.db2.gz BAQLPDALKJXNHL-UHFFFAOYSA-N 2 1 306.519 4.240 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC001235713007 1054785385 /nfs/dbraw/zinc/78/53/85/1054785385.db2.gz VJRSVIGOELHBKA-OAHLLOKOSA-N 2 1 314.395 4.014 20 0 DIADMP C(=C/c1ccc(C[N@@H+]2CCCC3(C[NH2+]C3)C2)cc1)\c1ccccc1 ZINC001235713205 1054786092 /nfs/dbraw/zinc/78/60/92/1054786092.db2.gz JQQCFHMQZNCEJR-BQYQJAHWSA-N 2 1 318.464 4.042 20 0 DIADMP C(=C/c1ccc(C[N@H+]2CCCC3(C[NH2+]C3)C2)cc1)\c1ccccc1 ZINC001235713205 1054786108 /nfs/dbraw/zinc/78/61/08/1054786108.db2.gz JQQCFHMQZNCEJR-BQYQJAHWSA-N 2 1 318.464 4.042 20 0 DIADMP Cc1c(C[N@@H+](C)CCC2CC[NH2+]CC2)cccc1-c1ccccc1 ZINC001235717987 1054787729 /nfs/dbraw/zinc/78/77/29/1054787729.db2.gz QYRKEAHQUVMOJS-UHFFFAOYSA-N 2 1 322.496 4.484 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccccc1Oc1ccccc1 ZINC001235716726 1054789204 /nfs/dbraw/zinc/78/92/04/1054789204.db2.gz ICLNMOBBFHHBDN-UHFFFAOYSA-N 2 1 324.468 4.300 20 0 DIADMP COc1cccc([C@@H]2CCCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC001235727995 1054791181 /nfs/dbraw/zinc/79/11/81/1054791181.db2.gz WTMAAHVXFYVCGB-NRFANRHFSA-N 2 1 322.452 4.026 20 0 DIADMP CC1(C)CCC(c2ccc(C[N@H+]3CC[C@@H](C[NH3+])C3)cc2)CC1 ZINC001235748651 1054798210 /nfs/dbraw/zinc/79/82/10/1054798210.db2.gz DBDKWNSDSLTKAV-KRWDZBQOSA-N 2 1 300.490 4.151 20 0 DIADMP [NH3+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2oc3ccccc3c2c1 ZINC001235808346 1054808976 /nfs/dbraw/zinc/80/89/76/1054808976.db2.gz BEDHJSOSQSCZFP-MUJYYYPQSA-N 2 1 306.409 4.040 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+](CCC[NH2+]C2CCCCC2)C1 ZINC001235825881 1054814267 /nfs/dbraw/zinc/81/42/67/1054814267.db2.gz QWRAIZAMFJLWSA-MRXNPFEDSA-N 2 1 320.908 4.442 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@@H+](CCC[NH2+]C2CCCCC2)C1 ZINC001235825881 1054814276 /nfs/dbraw/zinc/81/42/76/1054814276.db2.gz QWRAIZAMFJLWSA-MRXNPFEDSA-N 2 1 320.908 4.442 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)s1 ZINC001235839221 1054818149 /nfs/dbraw/zinc/81/81/49/1054818149.db2.gz OBPQPJZGMXXKPY-HNNXBMFYSA-N 2 1 318.873 4.342 20 0 DIADMP CC(C)C[C@@H](C)C[C@@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001474595451 1054837677 /nfs/dbraw/zinc/83/76/77/1054837677.db2.gz LJHBBUCJECKALF-UKAVVXHISA-N 2 1 316.533 4.382 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906856 1054842105 /nfs/dbraw/zinc/84/21/05/1054842105.db2.gz OZVOESBSVQDIRG-HIFRSBDPSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906856 1054842115 /nfs/dbraw/zinc/84/21/15/1054842115.db2.gz OZVOESBSVQDIRG-HIFRSBDPSA-N 2 1 310.466 4.366 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1ccc2sc3ccccc3c2c1 ZINC001235925299 1054848890 /nfs/dbraw/zinc/84/88/90/1054848890.db2.gz GDDIQSYROBHPDY-HNNXBMFYSA-N 2 1 310.466 4.368 20 0 DIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CCC[C@H]2CC[NH3+])cc1 ZINC001235925222 1054849216 /nfs/dbraw/zinc/84/92/16/1054849216.db2.gz FXIBDZUAVXRDDZ-FQEVSTJZSA-N 2 1 323.484 4.076 20 0 DIADMP Clc1ccc([C@@H]2CC[N@@H+](CCC[NH2+]C3CCCCC3)C2)cc1 ZINC001235948924 1054864562 /nfs/dbraw/zinc/86/45/62/1054864562.db2.gz XQBZMLWZLUOSRR-QGZVFWFLSA-N 2 1 320.908 4.442 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC001235951318 1054866350 /nfs/dbraw/zinc/86/63/50/1054866350.db2.gz PWWFPPCSLOYBGY-LBPRGKRZSA-N 2 1 320.889 4.240 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3oc21)C[C@@H]1CCC[NH2+]C1 ZINC001235950649 1054866422 /nfs/dbraw/zinc/86/64/22/1054866422.db2.gz KGLRQZSOYOSWIU-OAHLLOKOSA-N 2 1 308.425 4.017 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)CC1(C)CC[NH2+]CC1 ZINC001235950107 1054866651 /nfs/dbraw/zinc/86/66/51/1054866651.db2.gz PGUDHHGHOSHBDI-UHFFFAOYSA-N 2 1 324.468 4.300 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@H]1CCC[NH2+]C1 ZINC001235951364 1054867272 /nfs/dbraw/zinc/86/72/72/1054867272.db2.gz RLDUPVPFZCMGFD-INIZCTEOSA-N 2 1 308.425 4.017 20 0 DIADMP COc1ccc([C@@H](C)[N@@H+](C)CCC[NH2+]C2CCCCC2)cc1 ZINC001235950182 1054867898 /nfs/dbraw/zinc/86/78/98/1054867898.db2.gz TWVDPAWPUPDQFR-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC001235951317 1054868320 /nfs/dbraw/zinc/86/83/20/1054868320.db2.gz PWWFPPCSLOYBGY-GFCCVEGCSA-N 2 1 320.889 4.240 20 0 DIADMP C[N@H+](Cc1ccc2sc3ccccc3c2c1)C[C@H]1CCC[NH2+]C1 ZINC001235957868 1054870168 /nfs/dbraw/zinc/87/01/68/1054870168.db2.gz VKVACPGRRGEJLX-INIZCTEOSA-N 2 1 324.493 4.486 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)c1 ZINC001235956401 1054870618 /nfs/dbraw/zinc/87/06/18/1054870618.db2.gz CMJWUZDDZJJLAC-HXUWFJFHSA-N 2 1 322.496 4.402 20 0 DIADMP C[N@@H+](CCC12CC([NH3+])(C1)C2)Cc1ccccc1Oc1ccccc1 ZINC001235968957 1054876525 /nfs/dbraw/zinc/87/65/25/1054876525.db2.gz MGQMJGBZZYYTKP-UHFFFAOYSA-N 2 1 322.452 4.182 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)CC1 ZINC001235975809 1054878580 /nfs/dbraw/zinc/87/85/80/1054878580.db2.gz WZEYMVMYGPNDCP-OALUTQOASA-N 2 1 324.512 4.116 20 0 DIADMP C[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124073 1054885553 /nfs/dbraw/zinc/88/55/53/1054885553.db2.gz WJQGOMQOBFKLLA-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124073 1054885566 /nfs/dbraw/zinc/88/55/66/1054885566.db2.gz WJQGOMQOBFKLLA-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124073 1054885578 /nfs/dbraw/zinc/88/55/78/1054885578.db2.gz WJQGOMQOBFKLLA-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045329 1054911493 /nfs/dbraw/zinc/91/14/93/1054911493.db2.gz BXKMKSXOWGYJNI-WBVHZDCISA-N 2 1 319.452 4.004 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045329 1054911507 /nfs/dbraw/zinc/91/15/07/1054911507.db2.gz BXKMKSXOWGYJNI-WBVHZDCISA-N 2 1 319.452 4.004 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051346 1054916567 /nfs/dbraw/zinc/91/65/67/1054916567.db2.gz WAXMOXSRLCARTO-KSSFIOAISA-N 2 1 314.860 4.176 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051346 1054916578 /nfs/dbraw/zinc/91/65/78/1054916578.db2.gz WAXMOXSRLCARTO-KSSFIOAISA-N 2 1 314.860 4.176 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000181527428 1054920618 /nfs/dbraw/zinc/92/06/18/1054920618.db2.gz UUSQQUDIARSCOU-QWHCGFSZSA-N 2 1 306.837 4.079 20 0 DIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000181527428 1054920608 /nfs/dbraw/zinc/92/06/08/1054920608.db2.gz UUSQQUDIARSCOU-QWHCGFSZSA-N 2 1 306.837 4.079 20 0 DIADMP Clc1ccccc1C1CC[NH+](CC[C@H]2CCCC[NH2+]2)CC1 ZINC001236070960 1054925739 /nfs/dbraw/zinc/92/57/39/1054925739.db2.gz DFQHKIDSAZEKMJ-MRXNPFEDSA-N 2 1 306.881 4.052 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)CCC[NH2+]1 ZINC001236094766 1054939768 /nfs/dbraw/zinc/93/97/68/1054939768.db2.gz IRRZUHMOASUOPH-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)CCC[NH2+]1 ZINC001236094766 1054939776 /nfs/dbraw/zinc/93/97/76/1054939776.db2.gz IRRZUHMOASUOPH-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccc3sc4ccccc4c3c2)CCC[NH2+]1 ZINC001236101065 1054946130 /nfs/dbraw/zinc/94/61/30/1054946130.db2.gz SPIBEWGCGMLSHD-AWEZNQCLSA-N 2 1 310.466 4.238 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc3sc4ccccc4c3c2)CCC[NH2+]1 ZINC001236101065 1054946138 /nfs/dbraw/zinc/94/61/38/1054946138.db2.gz SPIBEWGCGMLSHD-AWEZNQCLSA-N 2 1 310.466 4.238 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC001236152541 1054971285 /nfs/dbraw/zinc/97/12/85/1054971285.db2.gz RVJNMFFUZCUUBE-GOSISDBHSA-N 2 1 300.833 4.136 20 0 DIADMP CCC[N@@H+](Cc1c(C)sc2ccccc21)C1CC[NH2+]CC1 ZINC001236182477 1054981071 /nfs/dbraw/zinc/98/10/71/1054981071.db2.gz PRQYBWXBLFNEMJ-UHFFFAOYSA-N 2 1 302.487 4.174 20 0 DIADMP C[N@H+](Cc1ccc2ccccc2c1)CC1CC2(C1)CC[NH2+]CC2 ZINC001236184959 1054985098 /nfs/dbraw/zinc/98/50/98/1054985098.db2.gz YLLNHDPMSJIQPJ-UHFFFAOYSA-N 2 1 308.469 4.051 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2C)cc1 ZINC000182444129 1054987876 /nfs/dbraw/zinc/98/78/76/1054987876.db2.gz YYCVDRZKTWWGEO-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP C[N@H+](Cc1ccc(SC(F)(F)F)cc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236211111 1055001514 /nfs/dbraw/zinc/00/15/14/1055001514.db2.gz GZGHASUISWLGRZ-UONOGXRCSA-N 2 1 318.408 4.000 20 0 DIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236211111 1055001526 /nfs/dbraw/zinc/00/15/26/1055001526.db2.gz GZGHASUISWLGRZ-UONOGXRCSA-N 2 1 318.408 4.000 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cccc(-c3ccsc3)c2)CC1 ZINC001236212173 1055002466 /nfs/dbraw/zinc/00/24/66/1055002466.db2.gz FTNDFEKJTPABIZ-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001236214841 1055003068 /nfs/dbraw/zinc/00/30/68/1055003068.db2.gz HWHOQCFHYFUNPC-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(Cl)ccc(C)c2Cl)CC1 ZINC001236215916 1055006955 /nfs/dbraw/zinc/00/69/55/1055006955.db2.gz SIIFAFFSAFSTSM-UHFFFAOYSA-N 2 1 315.288 4.264 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236218447 1055007196 /nfs/dbraw/zinc/00/71/96/1055007196.db2.gz RXSQBYQXPDJFPC-VQTJNVASSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236218447 1055007212 /nfs/dbraw/zinc/00/72/12/1055007212.db2.gz RXSQBYQXPDJFPC-VQTJNVASSA-N 2 1 312.432 4.194 20 0 DIADMP COc1ccc(-c2ccc(C[N@H+](C)[C@H]3CCCC[C@@H]3[NH3+])cc2)cc1 ZINC001236218733 1055007727 /nfs/dbraw/zinc/00/77/27/1055007727.db2.gz SXSZYYZFUMBMQG-SFTDATJTSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CCCC[C@@H]3[NH3+])cc2)cc1 ZINC001236218733 1055007737 /nfs/dbraw/zinc/00/77/37/1055007737.db2.gz SXSZYYZFUMBMQG-SFTDATJTSA-N 2 1 324.468 4.064 20 0 DIADMP Cc1cc(C[N@H+](C)[C@H]2CC[C@H]([NH3+])CC2)ccc1Oc1ccccc1 ZINC001236222205 1055012168 /nfs/dbraw/zinc/01/21/68/1055012168.db2.gz GSJYZKIEDIWQAD-WGSAOQKQSA-N 2 1 324.468 4.489 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1cccs1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236225059 1055014499 /nfs/dbraw/zinc/01/44/99/1055014499.db2.gz ZOCAQPQGKBKHDA-WKILWMFISA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224864 1055014577 /nfs/dbraw/zinc/01/45/77/1055014577.db2.gz YLXOIYWYBGPGIU-HAQNSBGRSA-N 2 1 321.679 4.349 20 0 DIADMP C[N@@H+](Cc1ccc2oc3ccccc3c2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224898 1055014772 /nfs/dbraw/zinc/01/47/72/1055014772.db2.gz YEULDZSOYVLSIJ-WKILWMFISA-N 2 1 308.425 4.288 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C1(C)CC[NH2+]CC1 ZINC001236224817 1055015258 /nfs/dbraw/zinc/01/52/58/1055015258.db2.gz XDVTYUGFSDZILA-QGZVFWFLSA-N 2 1 316.533 4.237 20 0 DIADMP CCc1ccc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)o1 ZINC001236227359 1055016508 /nfs/dbraw/zinc/01/65/08/1055016508.db2.gz CXNOMCYWFSBAAL-UHFFFAOYSA-N 2 1 312.457 4.114 20 0 DIADMP C[NH+](C)Cc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000183326625 1055041597 /nfs/dbraw/zinc/04/15/97/1055041597.db2.gz VZGPWEFMLIOYNP-NRFANRHFSA-N 2 1 320.436 4.220 20 0 DIADMP CC[N@@H+](CCC12CC([NH3+])(C1)C2)Cc1ccc(Cl)cc1Cl ZINC001236266362 1055045779 /nfs/dbraw/zinc/04/57/79/1055045779.db2.gz QJDWSMHQBLITFT-UHFFFAOYSA-N 2 1 313.272 4.087 20 0 DIADMP CC[N@H+](Cc1cccc(C[NH3+])c1)Cc1ccc(Cl)cc1Cl ZINC001236266507 1055046287 /nfs/dbraw/zinc/04/62/87/1055046287.db2.gz STUFLTLCCKOCPU-UHFFFAOYSA-N 2 1 323.267 4.474 20 0 DIADMP CC[N@@H+](Cc1cccc(C[NH3+])c1)Cc1ccc(Cl)cc1Cl ZINC001236266507 1055046298 /nfs/dbraw/zinc/04/62/98/1055046298.db2.gz STUFLTLCCKOCPU-UHFFFAOYSA-N 2 1 323.267 4.474 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC001236303349 1055049173 /nfs/dbraw/zinc/04/91/73/1055049173.db2.gz PCZYLKUQVJSWAN-INIZCTEOSA-N 2 1 314.395 4.361 20 0 DIADMP Fc1ccccc1C[N@H+](CCC1CCCCC1)C1CC[NH2+]CC1 ZINC001236367958 1055076653 /nfs/dbraw/zinc/07/66/53/1055076653.db2.gz QCOJWAMPGPGTRX-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP Fc1ccccc1C[N@@H+](CCC1CCCCC1)C1CC[NH2+]CC1 ZINC001236367958 1055076668 /nfs/dbraw/zinc/07/66/68/1055076668.db2.gz QCOJWAMPGPGTRX-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP C[C@@H](C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1)c1ccccc1 ZINC001236373501 1055078989 /nfs/dbraw/zinc/07/89/89/1055078989.db2.gz XUROYHKHQKMTQV-ZWKOTPCHSA-N 2 1 300.490 4.034 20 0 DIADMP Fc1ccccc1CCC[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236371261 1055079359 /nfs/dbraw/zinc/07/93/59/1055079359.db2.gz JFIMARBTYFEWIN-QGZVFWFLSA-N 2 1 318.480 4.003 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1C ZINC001236373707 1055079512 /nfs/dbraw/zinc/07/95/12/1055079512.db2.gz JODCHULXPNJHON-SFHVURJKSA-N 2 1 300.490 4.048 20 0 DIADMP FC(F)c1cccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374052 1055079893 /nfs/dbraw/zinc/07/98/93/1055079893.db2.gz OMLKWNIMLQDTAI-INIZCTEOSA-N 2 1 322.443 4.368 20 0 DIADMP Clc1cccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373429 1055080531 /nfs/dbraw/zinc/08/05/31/1055080531.db2.gz HXBMULHTUVQELS-MRXNPFEDSA-N 2 1 306.881 4.084 20 0 DIADMP FC(F)c1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236375026 1055081640 /nfs/dbraw/zinc/08/16/40/1055081640.db2.gz HJYWSLRUQWPDPM-INIZCTEOSA-N 2 1 322.443 4.368 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374899 1055082573 /nfs/dbraw/zinc/08/25/73/1055082573.db2.gz GFZLYKIPJLNLIZ-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374637 1055082675 /nfs/dbraw/zinc/08/26/75/1055082675.db2.gz FRMVHLZOXPOVBV-INIZCTEOSA-N 2 1 317.521 4.056 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376969 1055083889 /nfs/dbraw/zinc/08/38/89/1055083889.db2.gz WYWJHLLQRGFYRW-HNNXBMFYSA-N 2 1 322.443 4.017 20 0 DIADMP Fc1cccc(C[N@@H+](CCC2CCCCC2)C2CC[NH2+]CC2)c1 ZINC001236401287 1055094650 /nfs/dbraw/zinc/09/46/50/1055094650.db2.gz NSWZUOLYQZNDQK-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP C[C@@H]([NH2+]CCCc1cccc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185755456 1055096318 /nfs/dbraw/zinc/09/63/18/1055096318.db2.gz PXVHMGZPXPNHIT-SJLPKXTDSA-N 2 1 318.480 4.001 20 0 DIADMP CC[N@H+](Cc1ccc(-c2cccc(C)c2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236407368 1055099550 /nfs/dbraw/zinc/09/95/50/1055099550.db2.gz DSXNZNXLUUSJNG-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@@H+](C[C@@H]1CC[NH2+]C1)C[C@H]1CC=C(CCC=C(C)C)CC1 ZINC001236409097 1055100550 /nfs/dbraw/zinc/10/05/50/1055100550.db2.gz XDFIWRGPKWZOGS-VQTJNVASSA-N 2 1 304.522 4.391 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccccc2Cl)o1)C[C@H]1CC[NH2+]C1 ZINC001236409017 1055100829 /nfs/dbraw/zinc/10/08/29/1055100829.db2.gz RBIGKPMDOPXJMX-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CC[N@@H+](C[C@@H](C)Cc1ccc(C(C)(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC001236409179 1055101074 /nfs/dbraw/zinc/10/10/74/1055101074.db2.gz YGOFHOVYRFRADS-HKUYNNGSSA-N 2 1 316.533 4.094 20 0 DIADMP C[NH+](Cc1ccco1)Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000193610340 1055106622 /nfs/dbraw/zinc/10/66/22/1055106622.db2.gz FOVYSKJFIILNSJ-UHFFFAOYSA-N 2 1 324.424 4.137 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2CC2CC3(C2)CC[NH2+]CC3)c1 ZINC001236428849 1055110507 /nfs/dbraw/zinc/11/05/07/1055110507.db2.gz PFICZDWNRYNLOZ-FQEVSTJZSA-N 2 1 312.501 4.220 20 0 DIADMP CC(C)=CCC[C@H](C)C[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001236448287 1055117575 /nfs/dbraw/zinc/11/75/75/1055117575.db2.gz SNWFHLOJHORKID-SFHVURJKSA-N 2 1 315.505 4.018 20 0 DIADMP Clc1ccc(C[N@@H+](CC2CCCC2)C2CC[NH2+]CC2)cc1 ZINC001236454028 1055122750 /nfs/dbraw/zinc/12/27/50/1055122750.db2.gz UPQJNCIRWPCPNL-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP Cc1cccc2[nH]cc(C[N@@H+](CC(C)(C)C)C3CC[NH2+]CC3)c21 ZINC001236456393 1055123894 /nfs/dbraw/zinc/12/38/94/1055123894.db2.gz DGRCJWVMBFYASG-UHFFFAOYSA-N 2 1 313.489 4.076 20 0 DIADMP Cc1cc(C)c(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1C ZINC001236457959 1055124990 /nfs/dbraw/zinc/12/49/90/1055124990.db2.gz RYCZEHRPRVHKGR-UHFFFAOYSA-N 2 1 302.506 4.212 20 0 DIADMP Cc1ccc([C@H](C)CC[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)o1 ZINC001236458809 1055126242 /nfs/dbraw/zinc/12/62/42/1055126242.db2.gz YRBSVOZSUNGFFH-OAHLLOKOSA-N 2 1 306.494 4.182 20 0 DIADMP [NH3+]CCc1ccccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001236475621 1055135639 /nfs/dbraw/zinc/13/56/39/1055135639.db2.gz NJENLPDMHNHPPB-RTWAWAEBSA-N 2 1 318.464 4.008 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236480487 1055136632 /nfs/dbraw/zinc/13/66/32/1055136632.db2.gz GAMKHRKWNYSVNS-OAHLLOKOSA-N 2 1 306.469 4.124 20 0 DIADMP CCCCCC[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236480325 1055137198 /nfs/dbraw/zinc/13/71/98/1055137198.db2.gz BSOVJMSNONFKIY-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP CC(C)C[N@@H+](Cc1ccsc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551829 1055180020 /nfs/dbraw/zinc/18/00/20/1055180020.db2.gz LXDOFFJIBZBNPJ-HDJSIYSDSA-N 2 1 300.899 4.129 20 0 DIADMP Fc1ccc(C[N@@H+](CC2CCCCC2)C2CC[NH2+]CC2)cc1F ZINC001236499686 1055150635 /nfs/dbraw/zinc/15/06/35/1055150635.db2.gz PCHCJGJYBWKXOZ-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](CCC1CCCC1)C1CC[NH2+]CC1 ZINC001236508820 1055152714 /nfs/dbraw/zinc/15/27/14/1055152714.db2.gz CDBDLYHDEABRAP-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP CCCCCC[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236509122 1055152978 /nfs/dbraw/zinc/15/29/78/1055152978.db2.gz GVJKOEXMBSPVCR-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP CCC(CC)C[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236509205 1055153130 /nfs/dbraw/zinc/15/31/30/1055153130.db2.gz KFLREFMHECHSPO-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP CC(C)(C)CC[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236534159 1055165290 /nfs/dbraw/zinc/16/52/90/1055165290.db2.gz PQZCUDSBDHWIPN-QAQDUYKDSA-N 2 1 306.469 4.334 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2F)CC2CCCCC2)CC1 ZINC001236534670 1055166834 /nfs/dbraw/zinc/16/68/34/1055166834.db2.gz ZLIKASLBQOVVQW-WGSAOQKQSA-N 2 1 318.480 4.478 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(C3CC3)cc2)CC2CCC2)CC1 ZINC001236542178 1055170081 /nfs/dbraw/zinc/17/00/81/1055170081.db2.gz YSNJCAVSXXJVLA-MEMLXQNLSA-N 2 1 312.501 4.436 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236541656 1055171187 /nfs/dbraw/zinc/17/11/87/1055171187.db2.gz IGWKMIYWVNNZGX-WGSAOQKQSA-N 2 1 304.453 4.006 20 0 DIADMP COc1ccc(C[N@@H+](CCCC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236543479 1055172941 /nfs/dbraw/zinc/17/29/41/1055172941.db2.gz VIHLGMHGAXPBNW-WGSAOQKQSA-N 2 1 318.505 4.203 20 0 DIADMP CCOc1ccc(C)cc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550141 1055178430 /nfs/dbraw/zinc/17/84/30/1055178430.db2.gz HIJBQGZPGYUZOO-WGSAOQKQSA-N 2 1 318.505 4.122 20 0 DIADMP CC(C)C[N@@H+](Cc1coc2ccccc12)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552358 1055179486 /nfs/dbraw/zinc/17/94/86/1055179486.db2.gz PIUWWNXOYDJRPQ-QAQDUYKDSA-N 2 1 300.446 4.161 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(F)c(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551255 1055179663 /nfs/dbraw/zinc/17/96/63/1055179663.db2.gz PJNYQXDAHQVUHV-SHTZXODSSA-N 2 1 312.860 4.207 20 0 DIADMP CC(C)Cc1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236553103 1055179858 /nfs/dbraw/zinc/17/98/58/1055179858.db2.gz MWSVQDUERIILEX-MEMLXQNLSA-N 2 1 314.517 4.367 20 0 DIADMP COc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1C ZINC001236552578 1055179945 /nfs/dbraw/zinc/17/99/45/1055179945.db2.gz XZUFFYPYJSOWMX-WGSAOQKQSA-N 2 1 318.505 4.040 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc2ncsc2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551887 1055180308 /nfs/dbraw/zinc/18/03/08/1055180308.db2.gz NOQCQNNROJZHMK-WKILWMFISA-N 2 1 317.502 4.024 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(F)c(C2CC2)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554749 1055181811 /nfs/dbraw/zinc/18/18/11/1055181811.db2.gz UDJWDZFLWCPDIC-IYARVYRRSA-N 2 1 318.480 4.431 20 0 DIADMP COc1cccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236554590 1055182429 /nfs/dbraw/zinc/18/24/29/1055182429.db2.gz MFBBWJMJOBWITL-WKILWMFISA-N 2 1 324.896 4.077 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccc(F)cc2)C2CCCCC2)CC1 ZINC001236566284 1055185682 /nfs/dbraw/zinc/18/56/82/1055185682.db2.gz VZODHICZFMAAMR-KESTWPANSA-N 2 1 318.480 4.273 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)C2CCCCC2)CC1 ZINC001236565331 1055186039 /nfs/dbraw/zinc/18/60/39/1055186039.db2.gz FAMVENWHTXBXGY-UAPYVXQJSA-N 2 1 304.453 4.230 20 0 DIADMP C[C@H]1CC(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@H](C)O1 ZINC001236565485 1055186051 /nfs/dbraw/zinc/18/60/51/1055186051.db2.gz HYABALSSSHXRQT-DUPRYPCISA-N 2 1 322.537 4.095 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)C2CCCCC2)CC1 ZINC001236566254 1055186629 /nfs/dbraw/zinc/18/66/29/1055186629.db2.gz UWMZQHYZSUAAKD-UAPYVXQJSA-N 2 1 304.453 4.230 20 0 DIADMP CCc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236567070 1055187857 /nfs/dbraw/zinc/18/78/57/1055187857.db2.gz RZKCYEJGRIBNJY-KESTWPANSA-N 2 1 300.490 4.264 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2sccc2Cl)C2CCCC2)CC1 ZINC001236566893 1055188270 /nfs/dbraw/zinc/18/82/70/1055188270.db2.gz OOCKQPVCAABUIH-MQMHXKEQSA-N 2 1 312.910 4.416 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236567130 1055188506 /nfs/dbraw/zinc/18/85/06/1055188506.db2.gz UDPBXRRYDSCGDM-JPLJXNOCSA-N 2 1 304.522 4.493 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cccc(Cl)c2)C2CCCC2)CC1 ZINC001236567008 1055188554 /nfs/dbraw/zinc/18/85/54/1055188554.db2.gz QVUDVVSPIVJUET-UAPYVXQJSA-N 2 1 320.908 4.397 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(F)cc(Cl)c2)C2CCCC2)CC1 ZINC001236571902 1055192899 /nfs/dbraw/zinc/19/28/99/1055192899.db2.gz MMCRJWVORCDLFE-SAABIXHNSA-N 2 1 324.871 4.494 20 0 DIADMP Cc1cc(C)c(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236572155 1055192926 /nfs/dbraw/zinc/19/29/26/1055192926.db2.gz MZGOFPGQIFZIKV-UAPYVXQJSA-N 2 1 300.490 4.236 20 0 DIADMP CC(C)(CC[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236572086 1055193051 /nfs/dbraw/zinc/19/30/51/1055193051.db2.gz MELCCLVFHXRDSE-KESTWPANSA-N 2 1 314.517 4.479 20 0 DIADMP CSc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236572579 1055193110 /nfs/dbraw/zinc/19/31/10/1055193110.db2.gz ZYMUYHSLJLBMQN-CTYIDZIISA-N 2 1 324.559 4.485 20 0 DIADMP COc1cccc(C)c1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571603 1055193281 /nfs/dbraw/zinc/19/32/81/1055193281.db2.gz KKHGZJSUJPJTOA-SAABIXHNSA-N 2 1 316.489 4.018 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572476 1055193765 /nfs/dbraw/zinc/19/37/65/1055193765.db2.gz NEIYXWFWZBQJIU-SAABIXHNSA-N 2 1 306.881 4.273 20 0 DIADMP Cc1ccc([C@H](C)CC[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236572603 1055195130 /nfs/dbraw/zinc/19/51/30/1055195130.db2.gz TXCSTYKFQKTYID-QGPMSJSTSA-N 2 1 304.478 4.206 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3ccoc32)C2CCCC2)CC1 ZINC001236574485 1055195613 /nfs/dbraw/zinc/19/56/13/1055195613.db2.gz OZZUEVQZLZXGGX-UAPYVXQJSA-N 2 1 312.457 4.447 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(O)c2Cl)C2CCCC2)CC1 ZINC001236574982 1055197162 /nfs/dbraw/zinc/19/71/62/1055197162.db2.gz ZRWMRDFEEAWOMA-KOMQPUFPSA-N 2 1 322.880 4.060 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2c3ccoc3ccc2F)C2CCC2)CC1 ZINC001236576563 1055197623 /nfs/dbraw/zinc/19/76/23/1055197623.db2.gz NRAANSQUDWPWEA-CTYIDZIISA-N 2 1 316.420 4.196 20 0 DIADMP c1sc2ccccc2c1C[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001236636351 1055208529 /nfs/dbraw/zinc/20/85/29/1055208529.db2.gz DCFVAEBKSWHAAN-UHFFFAOYSA-N 2 1 300.471 4.008 20 0 DIADMP CCc1cc(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)ccc1Cl ZINC001236637727 1055209279 /nfs/dbraw/zinc/20/92/79/1055209279.db2.gz UPCRNJCOLGJNRM-UHFFFAOYSA-N 2 1 306.881 4.009 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C3CCC3)C3CC[NH2+]CC3)cc2)o1 ZINC001236638243 1055209550 /nfs/dbraw/zinc/20/95/50/1055209550.db2.gz XESLWTFFLQYCEZ-UHFFFAOYSA-N 2 1 324.468 4.362 20 0 DIADMP CCCCc1ccc(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)cc1 ZINC001236637481 1055209906 /nfs/dbraw/zinc/20/99/06/1055209906.db2.gz QQZRDKAYWQWSKA-UHFFFAOYSA-N 2 1 300.490 4.136 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001236649685 1055211896 /nfs/dbraw/zinc/21/18/96/1055211896.db2.gz YRRXACFKNJBPOY-UHFFFAOYSA-N 2 1 324.921 4.168 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001236649685 1055211901 /nfs/dbraw/zinc/21/19/01/1055211901.db2.gz YRRXACFKNJBPOY-UHFFFAOYSA-N 2 1 324.921 4.168 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)CC1(F)CC[NH2+]CC1 ZINC001236662545 1055219124 /nfs/dbraw/zinc/21/91/24/1055219124.db2.gz KNCNKISXWBMAGZ-IBGZPJMESA-N 2 1 320.496 4.202 20 0 DIADMP CS[C@@H](C)CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236714243 1055238269 /nfs/dbraw/zinc/23/82/69/1055238269.db2.gz KYIUHJQLGHKCIQ-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236726191 1055240984 /nfs/dbraw/zinc/24/09/84/1055240984.db2.gz GVKSFSPXWHTOFV-KVEDYDLGSA-N 2 1 324.512 4.279 20 0 DIADMP Cc1ccc(C[N@@H+](CCc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236714326 1055242085 /nfs/dbraw/zinc/24/20/85/1055242085.db2.gz MITTVFLSRRDOAF-HZCBDIJESA-N 2 1 322.496 4.310 20 0 DIADMP c1cc2c(cccc2C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)o1 ZINC001236738103 1055249447 /nfs/dbraw/zinc/24/94/47/1055249447.db2.gz SEMBGUUQQBQQGK-UHFFFAOYSA-N 2 1 324.468 4.273 20 0 DIADMP c1cc2c(cccc2C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)o1 ZINC001236738103 1055249458 /nfs/dbraw/zinc/24/94/58/1055249458.db2.gz SEMBGUUQQBQQGK-UHFFFAOYSA-N 2 1 324.468 4.273 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(O)cc2)CC2CCCCC2)CC1 ZINC001236755397 1055250624 /nfs/dbraw/zinc/25/06/24/1055250624.db2.gz PEBMAFNPARXLGE-WGSAOQKQSA-N 2 1 316.489 4.044 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc(C)c1O ZINC001236766798 1055250646 /nfs/dbraw/zinc/25/06/46/1055250646.db2.gz GTKWTCPRXULUBK-IYARVYRRSA-N 2 1 318.505 4.127 20 0 DIADMP CCOc1cccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236767219 1055251094 /nfs/dbraw/zinc/25/10/94/1055251094.db2.gz LBHRXGRKZJOCDW-IYARVYRRSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc2ccccc2[nH]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236766945 1055252376 /nfs/dbraw/zinc/25/23/76/1055252376.db2.gz IREKJXPFVZXITL-SAABIXHNSA-N 2 1 313.489 4.286 20 0 DIADMP C[C@@H](C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C(F)(F)F ZINC001236756635 1055252489 /nfs/dbraw/zinc/25/24/89/1055252489.db2.gz ZAEQTFCKDFUVMD-BPUTZDHNSA-N 2 1 320.443 4.337 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccco2)cc1 ZINC000764776122 1055253493 /nfs/dbraw/zinc/25/34/93/1055253493.db2.gz YGZMVOODUVAFNH-GJZGRUSLSA-N 2 1 309.413 4.056 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(N)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236779462 1055253779 /nfs/dbraw/zinc/25/37/79/1055253779.db2.gz JUHCAVMMXKWTEG-KOMQPUFPSA-N 2 1 323.912 4.040 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236779856 1055254310 /nfs/dbraw/zinc/25/43/10/1055254310.db2.gz LFMNBLVCCHRNLB-QAQDUYKDSA-N 2 1 324.459 4.391 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236769476 1055254610 /nfs/dbraw/zinc/25/46/10/1055254610.db2.gz WDFHJKZYYJFMHJ-QAQDUYKDSA-N 2 1 308.897 4.458 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)c(O)cc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781137 1055255611 /nfs/dbraw/zinc/25/56/11/1055255611.db2.gz ACHHBKWHESEPGO-UAPYVXQJSA-N 2 1 318.505 4.270 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(F)cc1F ZINC001236778919 1055255694 /nfs/dbraw/zinc/25/56/94/1055255694.db2.gz CBOCQVXPRWDGEU-WKILWMFISA-N 2 1 324.459 4.391 20 0 DIADMP CCC(CC)[N@@H+](Cc1c(F)cccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783762 1055257964 /nfs/dbraw/zinc/25/79/64/1055257964.db2.gz YYJZCJLLKUADJJ-CTYIDZIISA-N 2 1 310.432 4.225 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc2cc[nH]c2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782071 1055258793 /nfs/dbraw/zinc/25/87/93/1055258793.db2.gz LLBQWTSQDMBGAI-UAPYVXQJSA-N 2 1 313.489 4.428 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(F)c1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782567 1055259128 /nfs/dbraw/zinc/25/91/28/1055259128.db2.gz UQAKLUHSUOZKTL-SAABIXHNSA-N 2 1 306.469 4.395 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccc(SC(F)F)cc1 ZINC000764806677 1055265047 /nfs/dbraw/zinc/26/50/47/1055265047.db2.gz PKDAMIABGDUWQM-CYBMUJFWSA-N 2 1 316.461 4.382 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(SC(F)F)cc1 ZINC000764806677 1055265067 /nfs/dbraw/zinc/26/50/67/1055265067.db2.gz PKDAMIABGDUWQM-CYBMUJFWSA-N 2 1 316.461 4.382 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)c(Cl)cn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236797740 1055268804 /nfs/dbraw/zinc/26/88/04/1055268804.db2.gz HAFORVWAHVPQLG-CZIWCDLHSA-N 2 1 323.912 4.304 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3cccc4c5ccccc5sc43)C[C@@H]12 ZINC001236822110 1055275084 /nfs/dbraw/zinc/27/50/84/1055275084.db2.gz YGASEWOVONYHOP-MORSLUCNSA-N 2 1 322.477 4.224 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3cccc4c5ccccc5sc43)C[C@H]12 ZINC001236822107 1055276716 /nfs/dbraw/zinc/27/67/16/1055276716.db2.gz YGASEWOVONYHOP-JEBQAFNWSA-N 2 1 322.477 4.224 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1 ZINC001236829502 1055278645 /nfs/dbraw/zinc/27/86/45/1055278645.db2.gz KVJVRIALXGVKKY-HBMCJLEFSA-N 2 1 320.480 4.140 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc(/C=C/c4ccccc4)cc3)C[C@H]12 ZINC001236826272 1055280481 /nfs/dbraw/zinc/28/04/81/1055280481.db2.gz BFHYOMCWFPLQDH-MFFWPKEDSA-N 2 1 318.464 4.026 20 0 DIADMP CCC[N@H+](Cc1ccccc1-c1cccs1)C[C@@H]1CC[NH2+]C1 ZINC001236834015 1055282525 /nfs/dbraw/zinc/28/25/25/1055282525.db2.gz DZLJSLOGPLPZRY-MRXNPFEDSA-N 2 1 314.498 4.237 20 0 DIADMP CCC[N@H+](Cc1sc2ccccc2c1C)C[C@@H]1CC[NH2+]C1 ZINC001236835330 1055284915 /nfs/dbraw/zinc/28/49/15/1055284915.db2.gz LHKKTZYUZZEQPA-OAHLLOKOSA-N 2 1 302.487 4.031 20 0 DIADMP CCC[N@H+](Cc1c(C)sc2ccccc21)C[C@@H]1CC[NH2+]C1 ZINC001236842321 1055286803 /nfs/dbraw/zinc/28/68/03/1055286803.db2.gz DYOCAUACDGPSDY-OAHLLOKOSA-N 2 1 302.487 4.031 20 0 DIADMP CCC[N@H+](Cc1cc(-c2ccsc2)cs1)C[C@@H]1CC[NH2+]C1 ZINC001236843741 1055287585 /nfs/dbraw/zinc/28/75/85/1055287585.db2.gz QPPCQBNRILSZTL-CQSZACIVSA-N 2 1 320.527 4.298 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2ccc(C)o2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236844604 1055289625 /nfs/dbraw/zinc/28/96/25/1055289625.db2.gz WQHZHJITAODILA-GOSISDBHSA-N 2 1 312.457 4.077 20 0 DIADMP C[C@H]([NH2+]C/C=C\c1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383944353 1055308559 /nfs/dbraw/zinc/30/85/59/1055308559.db2.gz VQHYBIOYLBHOTP-URGCHDPTSA-N 2 1 320.480 4.200 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236907254 1055312935 /nfs/dbraw/zinc/31/29/35/1055312935.db2.gz AUMAMTFHTQBAKM-INIZCTEOSA-N 2 1 303.837 4.146 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC001237059286 1055358793 /nfs/dbraw/zinc/35/87/93/1055358793.db2.gz SIMRPAXROCOPNA-GOSISDBHSA-N 2 1 318.848 4.161 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@](C)(C[NH3+])C1 ZINC001237079809 1055362790 /nfs/dbraw/zinc/36/27/90/1055362790.db2.gz BSAIPQWTIJLSPX-OAQYLSRUSA-N 2 1 308.469 4.223 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(Oc2ccccc2)c1 ZINC001237083865 1055369072 /nfs/dbraw/zinc/36/90/72/1055369072.db2.gz ZDSJQRSHGRIWAM-YQQQUEKLSA-N 2 1 322.452 4.181 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+](C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237156665 1055386627 /nfs/dbraw/zinc/38/66/27/1055386627.db2.gz QMKXDXPMHVCCBA-MRXNPFEDSA-N 2 1 314.498 4.316 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237156665 1055386641 /nfs/dbraw/zinc/38/66/41/1055386641.db2.gz QMKXDXPMHVCCBA-MRXNPFEDSA-N 2 1 314.498 4.316 20 0 DIADMP CC1=C[C@H](C)[C@H](C[NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)CC1 ZINC001237274973 1055412446 /nfs/dbraw/zinc/41/24/46/1055412446.db2.gz IIVRWHYAKHBRHX-ICSRJNTNSA-N 2 1 324.512 4.116 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](C)Cc1ccc(-n2ccnc2)cc1 ZINC001237327047 1055426517 /nfs/dbraw/zinc/42/65/17/1055426517.db2.gz XTZFJHGFONKNNG-UHFFFAOYSA-N 2 1 323.415 4.260 20 0 DIADMP CC1=C[C@H](C)[C@H](C[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC1 ZINC001237359452 1055439133 /nfs/dbraw/zinc/43/91/33/1055439133.db2.gz OPGZRXYLSQWIMB-HKUYNNGSSA-N 2 1 310.485 4.073 20 0 DIADMP Cc1cc(C)c(C[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)c(C)c1 ZINC001237359574 1055439162 /nfs/dbraw/zinc/43/91/62/1055439162.db2.gz PRJHUIWMSFDSAN-UHFFFAOYSA-N 2 1 320.480 4.206 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)cc2)cc1 ZINC001237383104 1055444251 /nfs/dbraw/zinc/44/42/51/1055444251.db2.gz OENYWLMHLPKJDS-WIYYLYMNSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)cc2)cc1 ZINC001237383104 1055444259 /nfs/dbraw/zinc/44/42/59/1055444259.db2.gz OENYWLMHLPKJDS-WIYYLYMNSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)cc2)cc1 ZINC001237383101 1055444532 /nfs/dbraw/zinc/44/45/32/1055444532.db2.gz OENYWLMHLPKJDS-GHTZIAJQSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)cc2)cc1 ZINC001237383101 1055444534 /nfs/dbraw/zinc/44/45/34/1055444534.db2.gz OENYWLMHLPKJDS-GHTZIAJQSA-N 2 1 322.452 4.053 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2cccc(C(C)C)c2)CC1 ZINC001237458284 1055456274 /nfs/dbraw/zinc/45/62/74/1055456274.db2.gz NTSVQSYTRFYSEY-UHFFFAOYSA-N 2 1 323.484 4.252 20 0 DIADMP CC(C)c1cccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1 ZINC001237459945 1055456464 /nfs/dbraw/zinc/45/64/64/1055456464.db2.gz YALPHQVURRSNES-UHFFFAOYSA-N 2 1 302.506 4.362 20 0 DIADMP Cc1c(C[NH+]2CCC([NH+](C)C)CC2)cccc1-c1ccccc1 ZINC001237579343 1055475419 /nfs/dbraw/zinc/47/54/19/1055475419.db2.gz KDYAIXIORQYAQN-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP Cc1c(C[N@@H+](C)C2CC[NH+](C)CC2)cccc1-c1ccccc1 ZINC001237583485 1055477208 /nfs/dbraw/zinc/47/72/08/1055477208.db2.gz ZTLCSEDMQDNZNY-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP Cc1c(C[N@H+](C)C2CC[NH+](C)CC2)cccc1-c1ccccc1 ZINC001237583485 1055477212 /nfs/dbraw/zinc/47/72/12/1055477212.db2.gz ZTLCSEDMQDNZNY-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP Cc1c(C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)cccc1-c1ccccc1 ZINC001237581983 1055478456 /nfs/dbraw/zinc/47/84/56/1055478456.db2.gz SXYOPPXMMVBNEQ-RTWAWAEBSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1c(C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)cccc1-c1ccccc1 ZINC001237581983 1055478465 /nfs/dbraw/zinc/47/84/65/1055478465.db2.gz SXYOPPXMMVBNEQ-RTWAWAEBSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1c(C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)cccc1-c1ccccc1 ZINC001237581983 1055478476 /nfs/dbraw/zinc/47/84/76/1055478476.db2.gz SXYOPPXMMVBNEQ-RTWAWAEBSA-N 2 1 320.480 4.046 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2)C1 ZINC001620868689 1055495874 /nfs/dbraw/zinc/49/58/74/1055495874.db2.gz MGWGWGBTOGWWKQ-LJQANCHMSA-N 2 1 310.485 4.297 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001620872959 1055501380 /nfs/dbraw/zinc/50/13/80/1055501380.db2.gz LLIZUYUQANHCJX-PCCBWWKXSA-N 2 1 314.517 4.313 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001620921241 1055543572 /nfs/dbraw/zinc/54/35/72/1055543572.db2.gz RPBDRMXVUJKFFM-CEWLAPEOSA-N 2 1 312.501 4.091 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CC[C@@H]4CCC[C@H]4C3)cc21 ZINC001237875561 1055547362 /nfs/dbraw/zinc/54/73/62/1055547362.db2.gz APZDLNBREZTJRG-HKUYNNGSSA-N 2 1 310.485 4.310 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2cccc3c[nH+]cn32)C2CC2)c1C ZINC001238116184 1055609116 /nfs/dbraw/zinc/60/91/16/1055609116.db2.gz PQAHIDGESNGWHW-UHFFFAOYSA-N 2 1 305.425 4.116 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001238120617 1055609358 /nfs/dbraw/zinc/60/93/58/1055609358.db2.gz YZUQEZKJTWRPNP-SFHVURJKSA-N 2 1 305.425 4.104 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001238120617 1055609363 /nfs/dbraw/zinc/60/93/63/1055609363.db2.gz YZUQEZKJTWRPNP-SFHVURJKSA-N 2 1 305.425 4.104 20 0 DIADMP CC(C)c1cc(C[N@@H+](C)CC2CC[NH+](C)CC2)ccc1Cl ZINC001238228794 1055626633 /nfs/dbraw/zinc/62/66/33/1055626633.db2.gz NJYYOZFDXHKLSM-UHFFFAOYSA-N 2 1 308.897 4.237 20 0 DIADMP Cc1ccc(Cl)c(CN2CC[C@H](Oc3ccncc3C)C2)c1 ZINC001238566355 1055689214 /nfs/dbraw/zinc/68/92/14/1055689214.db2.gz LIXFEAKFSVTORF-INIZCTEOSA-N 2 1 316.832 4.005 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCC[C@@]2(CCC[NH+](CCOC)C2)C1 ZINC001278273477 1055736849 /nfs/dbraw/zinc/73/68/49/1055736849.db2.gz XOMCWZWDWWHDND-WOJBJXKFSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCC[C@@]2(CCC[N@H+](CCOC)C2)C1 ZINC001278273477 1055736859 /nfs/dbraw/zinc/73/68/59/1055736859.db2.gz XOMCWZWDWWHDND-WOJBJXKFSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCC[C@@]2(CCC[N@@H+](CCOC)C2)C1 ZINC001278273477 1055736870 /nfs/dbraw/zinc/73/68/70/1055736870.db2.gz XOMCWZWDWWHDND-WOJBJXKFSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC2(C1)CCC[N@@H+](CCCCOC)C2 ZINC001278278223 1055748205 /nfs/dbraw/zinc/74/82/05/1055748205.db2.gz NOJORYKICBWAHP-IBGZPJMESA-N 2 1 324.553 4.027 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(-c3ccccc3)c2)C1 ZINC000062426917 1055877297 /nfs/dbraw/zinc/87/72/97/1055877297.db2.gz BLZAWXAYWPVZBL-IBGZPJMESA-N 2 1 308.469 4.174 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[N@H+](CC)CCCc1c[nH+]cn1C ZINC001615645442 1055928365 /nfs/dbraw/zinc/92/83/65/1055928365.db2.gz YRKVCWVLNCIELX-IBGZPJMESA-N 2 1 313.489 4.004 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)CCCc1c[nH+]cn1C ZINC001615645442 1055928379 /nfs/dbraw/zinc/92/83/79/1055928379.db2.gz YRKVCWVLNCIELX-IBGZPJMESA-N 2 1 313.489 4.004 20 0 DIADMP CCCc1cccc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1 ZINC001620983739 1055948042 /nfs/dbraw/zinc/94/80/42/1055948042.db2.gz ROGXZRFVRADJHP-YADHBBJMSA-N 2 1 322.496 4.074 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC001620779959 1055948265 /nfs/dbraw/zinc/94/82/65/1055948265.db2.gz UYXMJJPRDASLNX-SFHVURJKSA-N 2 1 300.490 4.164 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC001620786080 1055959566 /nfs/dbraw/zinc/95/95/66/1055959566.db2.gz XKHLUBCWFYIXKX-HOJAQTOUSA-N 2 1 300.490 4.034 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)C1CCCCC1 ZINC001620997121 1055965078 /nfs/dbraw/zinc/96/50/78/1055965078.db2.gz XMAHXOBLYVPJIA-PKOBYXMFSA-N 2 1 324.553 4.214 20 0 DIADMP CC[N@@H+](CCCNCc1cc(F)cc(F)c1)C1CCCCC1 ZINC001620997085 1055966078 /nfs/dbraw/zinc/96/60/78/1055966078.db2.gz WIZYGBQITGEDRH-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1cc(F)cc(F)c1)C1CCCCC1 ZINC001620997085 1055966084 /nfs/dbraw/zinc/96/60/84/1055966084.db2.gz WIZYGBQITGEDRH-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cc(F)cc(F)c1)C1CCCCC1 ZINC001620997085 1055966089 /nfs/dbraw/zinc/96/60/89/1055966089.db2.gz WIZYGBQITGEDRH-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c1Cl ZINC001621006844 1055975961 /nfs/dbraw/zinc/97/59/61/1055975961.db2.gz XCXANXWIVWODOK-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1Cl ZINC001621006844 1055975979 /nfs/dbraw/zinc/97/59/79/1055975979.db2.gz XCXANXWIVWODOK-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP CCCc1cccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC001620724946 1055987175 /nfs/dbraw/zinc/98/71/75/1055987175.db2.gz QIWLPSHFCISBCK-SFHVURJKSA-N 2 1 302.506 4.383 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCC(F)(F)C2)CC1 ZINC000671757924 1055991875 /nfs/dbraw/zinc/99/18/75/1055991875.db2.gz STIITFZPRGRNBZ-LXPRWKDFSA-N 2 1 322.443 4.207 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cccc(CC2CCC2)c1 ZINC001620810057 1056004384 /nfs/dbraw/zinc/00/43/84/1056004384.db2.gz BJUNJFRACIXULQ-UHFFFAOYSA-N 2 1 311.473 4.104 20 0 DIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000671766337 1056006728 /nfs/dbraw/zinc/00/67/28/1056006728.db2.gz GXFUUOWUSUGPLM-ZWKOTPCHSA-N 2 1 315.505 4.270 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)cc1 ZINC000166376822 1056147769 /nfs/dbraw/zinc/14/77/69/1056147769.db2.gz ZMOXGXOGLCEUJI-VAMGGRTRSA-N 2 1 316.464 4.273 20 0 DIADMP CCC[C@H](C[NH2+][C@@H]1CC[N@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821214 1056209558 /nfs/dbraw/zinc/20/95/58/1056209558.db2.gz OJTNDPICRRAMOV-NHCUHLMSSA-N 2 1 314.517 4.424 20 0 DIADMP CCC[C@H](C[NH2+][C@@H]1CC[N@@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821214 1056209575 /nfs/dbraw/zinc/20/95/75/1056209575.db2.gz OJTNDPICRRAMOV-NHCUHLMSSA-N 2 1 314.517 4.424 20 0 DIADMP CC[NH+](CC)C[C@@H](C)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474723145 1056342815 /nfs/dbraw/zinc/34/28/15/1056342815.db2.gz DAECDYSIVYPASR-LMRVLLHPSA-N 2 1 308.432 4.064 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCSc2ccccc2)CC1 ZINC000303689942 1056401971 /nfs/dbraw/zinc/40/19/71/1056401971.db2.gz LSWDIASXAZLBSL-UHFFFAOYSA-N 2 1 320.546 4.223 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC001615539900 1056529146 /nfs/dbraw/zinc/52/91/46/1056529146.db2.gz MDQKQPYKGCKDRU-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615539900 1056529160 /nfs/dbraw/zinc/52/91/60/1056529160.db2.gz MDQKQPYKGCKDRU-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615539900 1056529164 /nfs/dbraw/zinc/52/91/64/1056529164.db2.gz MDQKQPYKGCKDRU-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2CC(C)C)[C@H](C)C1 ZINC001615896640 1056591772 /nfs/dbraw/zinc/59/17/72/1056591772.db2.gz YZEJGEMLSDCJND-XLIONFOSSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2CC(C)C)[C@H](C)C1 ZINC001615896640 1056591786 /nfs/dbraw/zinc/59/17/86/1056591786.db2.gz YZEJGEMLSDCJND-XLIONFOSSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2CC(C)C)[C@H](C)C1 ZINC001615896640 1056591798 /nfs/dbraw/zinc/59/17/98/1056591798.db2.gz YZEJGEMLSDCJND-XLIONFOSSA-N 2 1 302.506 4.047 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CCCCC1(C)C ZINC001617168681 1056787782 /nfs/dbraw/zinc/78/77/82/1056787782.db2.gz CYCFZETXVKUNBE-KRWDZBQOSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CCCCC1(C)C ZINC001617168681 1056787798 /nfs/dbraw/zinc/78/77/98/1056787798.db2.gz CYCFZETXVKUNBE-KRWDZBQOSA-N 2 1 305.510 4.374 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001618048268 1056918732 /nfs/dbraw/zinc/91/87/32/1056918732.db2.gz KROQCOCRWXVEPE-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001618048268 1056918737 /nfs/dbraw/zinc/91/87/37/1056918737.db2.gz KROQCOCRWXVEPE-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001618048268 1056918741 /nfs/dbraw/zinc/91/87/41/1056918741.db2.gz KROQCOCRWXVEPE-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001618048268 1056918747 /nfs/dbraw/zinc/91/87/47/1056918747.db2.gz KROQCOCRWXVEPE-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[NH+](CC)Cc1ccc(C)c(-c2c[nH+]c(N(C)C)cc2C)c1 ZINC001241251324 1056980394 /nfs/dbraw/zinc/98/03/94/1056980394.db2.gz HRNXGPYBQNAUSP-UHFFFAOYSA-N 2 1 311.473 4.273 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000390791449 1057050244 /nfs/dbraw/zinc/05/02/44/1057050244.db2.gz WTJYVYOLBYSZJC-UYAOXDASSA-N 2 1 308.469 4.249 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCSc3c(Cl)cccc32)C1 ZINC000361964805 1057103250 /nfs/dbraw/zinc/10/32/50/1057103250.db2.gz CKZCFALXBYDORT-IOASZLSFSA-N 2 1 324.921 4.339 20 0 DIADMP C[NH+](C)C1(C[NH2+][C@@H](CCC2CCCC2)C(C)(C)C)CCOCC1 ZINC000675747194 1057409009 /nfs/dbraw/zinc/40/90/09/1057409009.db2.gz HZLGIWGHRVJUTR-SFHVURJKSA-N 2 1 324.553 4.072 20 0 DIADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc3c(c2)C[NH2+]C3)nc1 ZINC001242676171 1057443463 /nfs/dbraw/zinc/44/34/63/1057443463.db2.gz OBJXOCLZLPYZJA-OAQYLSRUSA-N 2 1 321.468 4.289 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366763 1057502275 /nfs/dbraw/zinc/50/22/75/1057502275.db2.gz XHIJNPBGYAODJH-WBVHZDCISA-N 2 1 324.459 4.168 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366763 1057502278 /nfs/dbraw/zinc/50/22/78/1057502278.db2.gz XHIJNPBGYAODJH-WBVHZDCISA-N 2 1 324.459 4.168 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1scnc1C1CC1 ZINC000487269939 1057571752 /nfs/dbraw/zinc/57/17/52/1057571752.db2.gz IYWWITIWCNAOSL-HOTGVXAUSA-N 2 1 321.534 4.011 20 0 DIADMP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1scnc1C1CC1 ZINC000487269936 1057572374 /nfs/dbraw/zinc/57/23/74/1057572374.db2.gz IYWWITIWCNAOSL-CVEARBPZSA-N 2 1 321.534 4.011 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C(C)(C)C)c1 ZINC000166788576 1057676376 /nfs/dbraw/zinc/67/63/76/1057676376.db2.gz JDCLZKVMQXDUBH-OTWHNJEPSA-N 2 1 300.490 4.299 20 0 DIADMP c1ccc(-c2cccc(CC[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000166850635 1057678472 /nfs/dbraw/zinc/67/84/72/1057678472.db2.gz NKUAGEGYBRNWMX-FGZHOGPDSA-N 2 1 320.480 4.113 20 0 DIADMP CCCCCCOc1cccc(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)c1 ZINC000731041629 1057733397 /nfs/dbraw/zinc/73/33/97/1057733397.db2.gz KXYFRBULENIMQV-LJQANCHMSA-N 2 1 318.505 4.077 20 0 DIADMP Cc1ccccc1C1([NH2+][C@@H]2CC[C@@H](c3[nH+]ccn3C)C2)CCC1 ZINC001550512553 1058340860 /nfs/dbraw/zinc/34/08/60/1058340860.db2.gz AGRCEEZECUPSSL-IAGOWNOFSA-N 2 1 309.457 4.034 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@@H]([NH2+][C@@H](C2CCC2)C2CCCC2)C1 ZINC001550511506 1058341649 /nfs/dbraw/zinc/34/16/49/1058341649.db2.gz FIJDIZREENZWBG-KZNAEPCWSA-N 2 1 301.478 4.005 20 0 DIADMP c1ccc([C@@H]2CC[C@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001552219494 1058430438 /nfs/dbraw/zinc/43/04/38/1058430438.db2.gz QINIKEMZXAPTOE-MHTWAQMVSA-N 2 1 306.453 4.016 20 0 DIADMP C[N@H+]1CCCC[C@H]1c1ccc(-c2ccc(C(C)(C)[NH3+])cc2)nc1 ZINC001245907390 1058611305 /nfs/dbraw/zinc/61/13/05/1058611305.db2.gz RCZCHVSUZOCIKY-IBGZPJMESA-N 2 1 309.457 4.099 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC001246065918 1058659829 /nfs/dbraw/zinc/65/98/29/1058659829.db2.gz OZERWMBDQRERMD-IEBWSBKVSA-N 2 1 304.453 4.240 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C2CCC(C)CC2)CC[NH2+]1 ZINC001246066476 1058660382 /nfs/dbraw/zinc/66/03/82/1058660382.db2.gz QYOLWRVKKXHAFU-ZRPLWEQMSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1ccccc1C[NH2+][C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246073448 1058662358 /nfs/dbraw/zinc/66/23/58/1058662358.db2.gz YFJBUQDCUNSJTB-ICSRJNTNSA-N 2 1 312.432 4.025 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076785 1058665777 /nfs/dbraw/zinc/66/57/77/1058665777.db2.gz PNGJRPJSAWGDAT-DLBZAZTESA-N 2 1 306.881 4.230 20 0 DIADMP Fc1cc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)ccc1Cl ZINC001246087562 1058669578 /nfs/dbraw/zinc/66/95/78/1058669578.db2.gz PASFSYKRKSGWHZ-QAPCUYQASA-N 2 1 318.823 4.062 20 0 DIADMP Cc1ccsc1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246083723 1058670904 /nfs/dbraw/zinc/67/09/04/1058670904.db2.gz IUPDYIMDDCDFJD-DOTOQJQBSA-N 2 1 318.461 4.087 20 0 DIADMP CC[C@H]1CC([NH2+]C2(c3ccc(Cl)cc3)CC2)C[C@H](CC)[NH2+]1 ZINC001246078875 1058671817 /nfs/dbraw/zinc/67/18/17/1058671817.db2.gz XRSRVRNPETVOOE-HOTGVXAUSA-N 2 1 306.881 4.228 20 0 DIADMP Fc1cc(C[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)ccc1Cl ZINC001246085798 1058671961 /nfs/dbraw/zinc/67/19/61/1058671961.db2.gz IZLLNEKXBNRZKM-AWEZNQCLSA-N 2 1 310.844 4.024 20 0 DIADMP Fc1cc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)ccc1Cl ZINC001246087559 1058672046 /nfs/dbraw/zinc/67/20/46/1058672046.db2.gz PASFSYKRKSGWHZ-CRAIPNDOSA-N 2 1 318.823 4.062 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246092035 1058674901 /nfs/dbraw/zinc/67/49/01/1058674901.db2.gz BXOGOUVNEFTTNZ-CAUGKJMWSA-N 2 1 318.480 4.343 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC001246113447 1058683702 /nfs/dbraw/zinc/68/37/02/1058683702.db2.gz AUFNMFHQEXBYHQ-NOHGZBONSA-N 2 1 301.261 4.173 20 0 DIADMP FC(F)c1cccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246124266 1058686662 /nfs/dbraw/zinc/68/66/62/1058686662.db2.gz DSUXAKGYZHAHBX-ZWKOTPCHSA-N 2 1 316.395 4.207 20 0 DIADMP FC(F)c1cccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246124262 1058687184 /nfs/dbraw/zinc/68/71/84/1058687184.db2.gz DSUXAKGYZHAHBX-MSOLQXFVSA-N 2 1 316.395 4.207 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246154849 1058699089 /nfs/dbraw/zinc/69/90/89/1058699089.db2.gz ROCNQUAAUFRUCD-JKSUJKDBSA-N 2 1 315.288 4.394 20 0 DIADMP Fc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1Cl ZINC001246157383 1058702026 /nfs/dbraw/zinc/70/20/26/1058702026.db2.gz HRILEDKFMKWLGT-CQSZACIVSA-N 2 1 310.844 4.024 20 0 DIADMP CC(C)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246163123 1058705813 /nfs/dbraw/zinc/70/58/13/1058705813.db2.gz VUSKCOTUAZVGJD-RTWAWAEBSA-N 2 1 308.469 4.393 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]CC34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246174501 1058718115 /nfs/dbraw/zinc/71/81/15/1058718115.db2.gz XDOOJQIGMTYEDF-QUCGMDCGSA-N 2 1 324.512 4.286 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2)CC[NH2+]1 ZINC001246176754 1058719240 /nfs/dbraw/zinc/71/92/40/1058719240.db2.gz QHTDZJZVOHGYJR-BPAFIMBUSA-N 2 1 312.432 4.278 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@@H]1CCCC[NH2+]1 ZINC001246182317 1058726616 /nfs/dbraw/zinc/72/66/16/1058726616.db2.gz ZLEVECZKQQUFCR-RXVVDRJESA-N 2 1 322.496 4.329 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246190278 1058729387 /nfs/dbraw/zinc/72/93/87/1058729387.db2.gz GINANHNIWUXFFF-QZTJIDSGSA-N 2 1 310.441 4.099 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246189337 1058731631 /nfs/dbraw/zinc/73/16/31/1058731631.db2.gz CCSMZLNHMPTWGW-ICSRJNTNSA-N 2 1 324.468 4.345 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246191556 1058732908 /nfs/dbraw/zinc/73/29/08/1058732908.db2.gz WEBFENQSQISXQT-DUXKGJEZSA-N 2 1 324.443 4.204 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246196899 1058736433 /nfs/dbraw/zinc/73/64/33/1058736433.db2.gz WUNSSYANLHCODU-UONOGXRCSA-N 2 1 315.288 4.394 20 0 DIADMP CC1(C)C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246194735 1058736837 /nfs/dbraw/zinc/73/68/37/1058736837.db2.gz XXGGHWHOIHGWRT-QGZVFWFLSA-N 2 1 310.441 4.099 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1Cl ZINC001246195800 1058736883 /nfs/dbraw/zinc/73/68/83/1058736883.db2.gz PVVUWWBQMTWTQM-IEBWSBKVSA-N 2 1 314.860 4.231 20 0 DIADMP CCCC(CCC)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246196895 1058737240 /nfs/dbraw/zinc/73/72/40/1058737240.db2.gz IKSNOIBQOZRWOS-IEBWSBKVSA-N 2 1 306.469 4.486 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246196901 1058737465 /nfs/dbraw/zinc/73/74/65/1058737465.db2.gz WUNSSYANLHCODU-ZIAGYGMSSA-N 2 1 315.288 4.394 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246196006 1058738398 /nfs/dbraw/zinc/73/83/98/1058738398.db2.gz CXOVGSIDXSNONJ-XJKSGUPXSA-N 2 1 315.288 4.168 20 0 DIADMP C[C@]1(C[NH2+]C2CCC3(CCCCC3)CC2)CC[NH2+]CC1(F)F ZINC001246221417 1058747960 /nfs/dbraw/zinc/74/79/60/1058747960.db2.gz OEHYVBJAIIKQDG-MRXNPFEDSA-N 2 1 314.464 4.104 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]CCC3CCCCCC3)CC[NH2+]2)cc1 ZINC001246230466 1058753253 /nfs/dbraw/zinc/75/32/53/1058753253.db2.gz BLBQCVZBGVOGGL-UXHICEINSA-N 2 1 300.490 4.430 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CCCC2CCCC2)CC[NH2+]1 ZINC001246237920 1058761407 /nfs/dbraw/zinc/76/14/07/1058761407.db2.gz JYBIZJLXWROTBT-QUCCMNQESA-N 2 1 318.480 4.487 20 0 DIADMP Cc1ccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246237814 1058762166 /nfs/dbraw/zinc/76/21/66/1058762166.db2.gz IINCDEZCLOUXEB-VQTJNVASSA-N 2 1 308.469 4.313 20 0 DIADMP Fc1cc(Cl)ccc1C[NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246236913 1058762887 /nfs/dbraw/zinc/76/28/87/1058762887.db2.gz UMPRNANMSARIIC-HNNXBMFYSA-N 2 1 310.844 4.024 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246251538 1058769251 /nfs/dbraw/zinc/76/92/51/1058769251.db2.gz DQQVWUBVYBDLGA-IUIKQTSFSA-N 2 1 315.288 4.421 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246251847 1058770657 /nfs/dbraw/zinc/77/06/57/1058770657.db2.gz FLIRLJVEVVEYRO-JNIYBQFBSA-N 2 1 301.261 4.173 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@H](C)C2CCCCC2)CC[NH2+]1 ZINC001246252349 1058772157 /nfs/dbraw/zinc/77/21/57/1058772157.db2.gz VNAZQYLRVATTEM-MOXGXCLJSA-N 2 1 318.480 4.486 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c2ccccc21 ZINC001246260332 1058779370 /nfs/dbraw/zinc/77/93/70/1058779370.db2.gz RZDLTYRSCVDZIZ-JKMAKKBCSA-N 2 1 306.453 4.318 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)ccc1F ZINC001246262357 1058779620 /nfs/dbraw/zinc/77/96/20/1058779620.db2.gz BAFIWUOBJUXOHW-YJBOKZPZSA-N 2 1 322.443 4.460 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246262010 1058780707 /nfs/dbraw/zinc/78/07/07/1058780707.db2.gz GQEBVPHVIGGHPE-RBUKOAKNSA-N 2 1 312.432 4.144 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c2ccccc21 ZINC001246260334 1058780798 /nfs/dbraw/zinc/78/07/98/1058780798.db2.gz RZDLTYRSCVDZIZ-UWGQAIRJSA-N 2 1 306.453 4.318 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1F ZINC001246267618 1058785152 /nfs/dbraw/zinc/78/51/52/1058785152.db2.gz UWLWYQCBUOQLTA-YJBOKZPZSA-N 2 1 304.453 4.321 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)C)C1)c1ccccc1F ZINC001246274329 1058788775 /nfs/dbraw/zinc/78/87/75/1058788775.db2.gz WBDDZQZTYPYZAA-SNRMKQJTSA-N 2 1 306.469 4.279 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1F ZINC001246272157 1058789386 /nfs/dbraw/zinc/78/93/86/1058789386.db2.gz LEBIVDGWHQAQCT-YJBOKZPZSA-N 2 1 304.453 4.177 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccccc1F ZINC001246277265 1058795916 /nfs/dbraw/zinc/79/59/16/1058795916.db2.gz QKWRLNFQMVWPSE-FHLIZLRMSA-N 2 1 306.469 4.423 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246282255 1058798328 /nfs/dbraw/zinc/79/83/28/1058798328.db2.gz UUVBSJCUIIGJIJ-AYOQOUSVSA-N 2 1 304.453 4.033 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1(C[NH3+])CCCC1 ZINC001246288309 1058803493 /nfs/dbraw/zinc/80/34/93/1058803493.db2.gz PZIJLSQVPWTFGQ-GOSISDBHSA-N 2 1 322.496 4.458 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1(C[NH3+])CCCC1 ZINC001246288325 1058804254 /nfs/dbraw/zinc/80/42/54/1058804254.db2.gz PZIJLSQVPWTFGQ-SFHVURJKSA-N 2 1 322.496 4.458 20 0 DIADMP CCOc1cccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246294709 1058807908 /nfs/dbraw/zinc/80/79/08/1058807908.db2.gz HOMRITRQNVHFAO-LKUPVBHCSA-N 2 1 324.468 4.229 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246309247 1058817350 /nfs/dbraw/zinc/81/73/50/1058817350.db2.gz JEBUKQNABJUZPB-CABCVRRESA-N 2 1 308.897 4.476 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246310036 1058818721 /nfs/dbraw/zinc/81/87/21/1058818721.db2.gz LYSQRTDHTISBDS-BBRMVZONSA-N 2 1 308.897 4.331 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@@H](CC)c2ccccc2OC)CC[NH2+]1 ZINC001246312226 1058820186 /nfs/dbraw/zinc/82/01/86/1058820186.db2.gz CCJFRWXVGOVGHM-JZXOWHBKSA-N 2 1 304.478 4.047 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246310042 1058821451 /nfs/dbraw/zinc/82/14/51/1058821451.db2.gz LYSQRTDHTISBDS-XJKSGUPXSA-N 2 1 308.897 4.331 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)cc1 ZINC001246313092 1058821609 /nfs/dbraw/zinc/82/16/09/1058821609.db2.gz IUOMOKRXZVODLP-PCCBWWKXSA-N 2 1 324.443 4.360 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](CC)c2ccccc2OC)CC[NH2+]1 ZINC001246312228 1058822335 /nfs/dbraw/zinc/82/23/35/1058822335.db2.gz CCJFRWXVGOVGHM-RYRKJORJSA-N 2 1 304.478 4.047 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@@H](CC)[NH2+][C@H](CC)C1)c1ccc(F)cc1F ZINC001246317323 1058828869 /nfs/dbraw/zinc/82/88/69/1058828869.db2.gz MPSHBDDHVOYUKX-HBUWYVDXSA-N 2 1 310.432 4.315 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccc(F)cc1F ZINC001246319357 1058832048 /nfs/dbraw/zinc/83/20/48/1058832048.db2.gz WUSJASIICKWGJW-XKQJLSEDSA-N 2 1 310.432 4.172 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1CCC[NH2+][C@@H]1C ZINC001246324905 1058834741 /nfs/dbraw/zinc/83/47/41/1058834741.db2.gz HMVHYIVWHSVUGD-SVMVAKDDSA-N 2 1 322.496 4.327 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]CCCC3CCCCC3)CC[NH2+]2)cc1 ZINC001246329098 1058838539 /nfs/dbraw/zinc/83/85/39/1058838539.db2.gz OMEMHPCHFBHFFB-WOJBJXKFSA-N 2 1 300.490 4.430 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246330995 1058842861 /nfs/dbraw/zinc/84/28/61/1058842861.db2.gz AVEQQSJIVRYDMA-HQJJXPTPSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246330141 1058843040 /nfs/dbraw/zinc/84/30/40/1058843040.db2.gz AVEQQSJIVRYDMA-UONJOCPKSA-N 2 1 304.453 4.096 20 0 DIADMP c1cc2ccc(C[NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)cc2o1 ZINC001246330867 1058844099 /nfs/dbraw/zinc/84/40/99/1058844099.db2.gz ZAFGTVDTPSTEKD-OALUTQOASA-N 2 1 306.409 4.016 20 0 DIADMP FC(F)(F)[C@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246340806 1058848244 /nfs/dbraw/zinc/84/82/44/1058848244.db2.gz LTPOWMVAMJCJNZ-LSDHHAIUSA-N 2 1 318.427 4.010 20 0 DIADMP CCCCCC[C@H](CCC)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C(F)(F)F ZINC001246344433 1058857322 /nfs/dbraw/zinc/85/73/22/1058857322.db2.gz ZCFSDDXEBBUATB-SOUVJXGZSA-N 2 1 308.432 4.256 20 0 DIADMP Cc1ccc(Cl)c(C[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246345183 1058857692 /nfs/dbraw/zinc/85/76/92/1058857692.db2.gz VGMGPRQBOBKRCX-INIZCTEOSA-N 2 1 306.881 4.193 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246349708 1058863655 /nfs/dbraw/zinc/86/36/55/1058863655.db2.gz NYOYWEOCMOCUCK-OALUTQOASA-N 2 1 312.432 4.144 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]Cc3cccc(C4CC4)c3)CC[NH2+]2)cc1 ZINC001246361831 1058871486 /nfs/dbraw/zinc/87/14/86/1058871486.db2.gz JPPHADNNSHLGQC-RTWAWAEBSA-N 2 1 306.453 4.147 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C1 ZINC001246376176 1058881720 /nfs/dbraw/zinc/88/17/20/1058881720.db2.gz SSKXESJOSRGXFY-OAHLLOKOSA-N 2 1 320.908 4.477 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)CC[NH2+]1 ZINC001246396571 1058900869 /nfs/dbraw/zinc/90/08/69/1058900869.db2.gz CDRCDYXLVVGVHH-KZNAEPCWSA-N 2 1 321.896 4.087 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246404076 1058906349 /nfs/dbraw/zinc/90/63/49/1058906349.db2.gz LYTRUEUXMJWGLN-QAPCUYQASA-N 2 1 304.453 4.177 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246406684 1058908192 /nfs/dbraw/zinc/90/81/92/1058908192.db2.gz RGJPTULNZAYMQP-JTDSTZFVSA-N 2 1 304.453 4.177 20 0 DIADMP CCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246414915 1058918797 /nfs/dbraw/zinc/91/87/97/1058918797.db2.gz VDSNDAKDFZEPGE-BSIFCXSSSA-N 2 1 324.468 4.229 20 0 DIADMP CCC1([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246417952 1058918891 /nfs/dbraw/zinc/91/88/91/1058918891.db2.gz WXNRBOGFHRQAIL-SJORKVTESA-N 2 1 322.443 4.427 20 0 DIADMP CCCCC[C@@H](CC)[NH2+]C1(c2ccccc2F)CC[NH2+]CC1 ZINC001246429321 1058923752 /nfs/dbraw/zinc/92/37/52/1058923752.db2.gz LWIZXCBHDYRKCQ-MRXNPFEDSA-N 2 1 306.469 4.353 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C1C[C@@H](CC)[NH2+][C@H](CC)C1 ZINC001246453231 1058939630 /nfs/dbraw/zinc/93/96/30/1058939630.db2.gz AYONPBZRAQNVMJ-ARFHVFGLSA-N 2 1 304.478 4.045 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2OCC)CC[NH2+]1 ZINC001246453261 1058940462 /nfs/dbraw/zinc/94/04/62/1058940462.db2.gz BGAIZYMGFKNDQX-BBWFWOEESA-N 2 1 304.478 4.047 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](c2cccnc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246455784 1058942143 /nfs/dbraw/zinc/94/21/43/1058942143.db2.gz HOYRKTMHURPUPX-WBTNSWJXSA-N 2 1 321.896 4.085 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](CC)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246463421 1058949069 /nfs/dbraw/zinc/94/90/69/1058949069.db2.gz RTLZXYYCMZXLTN-KZNAEPCWSA-N 2 1 310.432 4.316 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1C ZINC001246469370 1058956766 /nfs/dbraw/zinc/95/67/66/1058956766.db2.gz CRZZYNGGJCWJLW-YFVAEKQCSA-N 2 1 308.469 4.447 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+]CC[C@@H]1CC[NH2+]CC1(F)F ZINC001246486531 1058963289 /nfs/dbraw/zinc/96/32/89/1058963289.db2.gz KDTAEZJHIGNPDA-ROUUACIJSA-N 2 1 324.459 4.012 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(F)cc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246489294 1058967321 /nfs/dbraw/zinc/96/73/21/1058967321.db2.gz MZFXPEOWKAJMGX-JKEMJCCQSA-N 2 1 312.860 4.439 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccc(C(F)(F)F)c(Cl)c1 ZINC001246493097 1058970181 /nfs/dbraw/zinc/97/01/81/1058970181.db2.gz YKUQDMRGVHSJJO-HOSYDEDBSA-N 2 1 320.786 4.150 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H](C)CSc1ccc(C)cc1 ZINC001246496520 1058970765 /nfs/dbraw/zinc/97/07/65/1058970765.db2.gz OOLRCVIKGGQMEJ-MRXNPFEDSA-N 2 1 308.535 4.363 20 0 DIADMP C[C@@H]1CC([N@@H+](C)C(c2ccccc2)c2ccccc2)C[C@@H](C)[NH2+]1 ZINC001246521954 1058984562 /nfs/dbraw/zinc/98/45/62/1058984562.db2.gz DEXZRDVNHGFESA-IAGOWNOFSA-N 2 1 308.469 4.237 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001246523680 1058986377 /nfs/dbraw/zinc/98/63/77/1058986377.db2.gz ONFDLOSWYJVAPW-FQEVSTJZSA-N 2 1 314.517 4.109 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCc3ccc(Cl)cc3C2)C[C@H](CC)[NH2+]1 ZINC001246536464 1058986420 /nfs/dbraw/zinc/98/64/20/1058986420.db2.gz FTXHUUJLFLQKFB-PIIMJCKOSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCc3ccc(Cl)cc3C2)C[C@H](CC)[NH2+]1 ZINC001246536464 1058986437 /nfs/dbraw/zinc/98/64/37/1058986437.db2.gz FTXHUUJLFLQKFB-PIIMJCKOSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(C)c2)C[C@H](CC)[NH2+]1 ZINC001246536433 1058987731 /nfs/dbraw/zinc/98/77/31/1058987731.db2.gz FLMCZNFNDLESLV-FUMNGEBKSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[N@H+]([C@H](C)CC)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532122 1058989953 /nfs/dbraw/zinc/98/99/53/1058989953.db2.gz XRENZFGLFJYJID-SZVBFZGTSA-N 2 1 306.469 4.438 20 0 DIADMP CCC[N@@H+]([C@H](C)CC)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532122 1058989971 /nfs/dbraw/zinc/98/99/71/1058989971.db2.gz XRENZFGLFJYJID-SZVBFZGTSA-N 2 1 306.469 4.438 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(C)c2)CC[NH2+]1 ZINC001246542655 1058994099 /nfs/dbraw/zinc/99/40/99/1058994099.db2.gz WRIFSFWBDJCMJC-AABGKKOBSA-N 2 1 300.490 4.443 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@@H]([NH3+])[C@H]1C ZINC001246544236 1058994441 /nfs/dbraw/zinc/99/44/41/1058994441.db2.gz PRTQWNMOLHAAKL-CSODHUTKSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@@](C)([NH3+])C1 ZINC001246540170 1058995336 /nfs/dbraw/zinc/99/53/36/1058995336.db2.gz LGYMPQCFYLWNAE-MLGOLLRUSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@](C)([NH3+])C1 ZINC001246540170 1058995360 /nfs/dbraw/zinc/99/53/60/1058995360.db2.gz LGYMPQCFYLWNAE-MLGOLLRUSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@@H]1CC[N@H+](C2CCC(c3ccccc3)CC2)CC[C@H]1C[NH3+] ZINC001246557034 1059000159 /nfs/dbraw/zinc/00/01/59/1059000159.db2.gz JOCNWTZKFKRWRV-OTBHMBEGSA-N 2 1 300.490 4.020 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+]([C@@H](C)CC(C)(C)SCc2ccco2)C1 ZINC001246547650 1059000782 /nfs/dbraw/zinc/00/07/82/1059000782.db2.gz FMYHYRWRTJTBNV-JKSUJKDBSA-N 2 1 324.534 4.001 20 0 DIADMP C[C@@H]1C[N@H+](C2CCC(c3ccccc3)CC2)CCC[C@H]1C[NH3+] ZINC001246565060 1059001838 /nfs/dbraw/zinc/00/18/38/1059001838.db2.gz GZYQDEATDPSIFR-OTBHMBEGSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246561507 1059002215 /nfs/dbraw/zinc/00/22/15/1059002215.db2.gz USHKDJMYFOIRBJ-VQTJNVASSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCCC[C@H](C)C2)CC[NH2+]1 ZINC001246561410 1059003682 /nfs/dbraw/zinc/00/36/82/1059003682.db2.gz SKSXVXSDEOKJQE-FNHZYXHNSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCCC[C@H](C)C2)CC[NH2+]1 ZINC001246561410 1059003702 /nfs/dbraw/zinc/00/37/02/1059003702.db2.gz SKSXVXSDEOKJQE-FNHZYXHNSA-N 2 1 304.453 4.049 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001246568535 1059004909 /nfs/dbraw/zinc/00/49/09/1059004909.db2.gz PCZXKPRBOHSALB-DFQSSKMNSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@H]1C[N@H+](C2CCC(Cc3ccccc3)CC2)CCC[C@@H]1C[NH3+] ZINC001246563426 1059005518 /nfs/dbraw/zinc/00/55/18/1059005518.db2.gz QUPHXSPJKBOBGW-RCKXYERXSA-N 2 1 314.517 4.095 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@@H](C[NH3+])[C@@H]1C ZINC001246565174 1059007062 /nfs/dbraw/zinc/00/70/62/1059007062.db2.gz OUCUGYXWZIXEDT-PMPSAXMXSA-N 2 1 324.534 4.129 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)(F)CC2)CC[NH2+]1 ZINC001246567503 1059007884 /nfs/dbraw/zinc/00/78/84/1059007884.db2.gz KRVCYQVHVZORAJ-YTQUADARSA-N 2 1 322.443 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC[C@@](C)(F)CC2)CC[NH2+]1 ZINC001246567503 1059007905 /nfs/dbraw/zinc/00/79/05/1059007905.db2.gz KRVCYQVHVZORAJ-YTQUADARSA-N 2 1 322.443 4.141 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001246578561 1059008942 /nfs/dbraw/zinc/00/89/42/1059008942.db2.gz SAAKPNLUYPTVPB-VQTJNVASSA-N 2 1 302.506 4.239 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001246581144 1059009770 /nfs/dbraw/zinc/00/97/70/1059009770.db2.gz XYNIRYAMOLRCKW-PMACEKPBSA-N 2 1 302.506 4.095 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CCc2cc(Cl)ccc2C1)[C@@H]1CCC[NH2+]CC1 ZINC001246581823 1059011276 /nfs/dbraw/zinc/01/12/76/1059011276.db2.gz AXIKYMPDXLPYSG-RTBURBONSA-N 2 1 320.908 4.050 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1cccc(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC001246595984 1059019360 /nfs/dbraw/zinc/01/93/60/1059019360.db2.gz UNZYRWOOTAXHJI-YJBOKZPZSA-N 2 1 308.897 4.124 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1ccc(Cl)cc1)[C@H]1CCC[NH2+]CC1 ZINC001246590688 1059019524 /nfs/dbraw/zinc/01/95/24/1059019524.db2.gz HQXIBRLCHGPFNJ-YJBOKZPZSA-N 2 1 308.897 4.124 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246610186 1059025975 /nfs/dbraw/zinc/02/59/75/1059025975.db2.gz QDMZERVCMFTBEC-YLJYHZDGSA-N 2 1 318.480 4.003 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246609270 1059028531 /nfs/dbraw/zinc/02/85/31/1059028531.db2.gz MCKMRSGADHUSGM-PXNSSMCTSA-N 2 1 318.480 4.003 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001246608141 1059030123 /nfs/dbraw/zinc/03/01/23/1059030123.db2.gz SXYSMLALHYCWNE-IEBWSBKVSA-N 2 1 318.530 4.084 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246613427 1059030480 /nfs/dbraw/zinc/03/04/80/1059030480.db2.gz ZHYPYUACDNTXGB-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001246619856 1059031260 /nfs/dbraw/zinc/03/12/60/1059031260.db2.gz JAAPAMDEOFYISC-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2CCC3(CCC3)CC2)CC[NH2+]1 ZINC001246623505 1059031653 /nfs/dbraw/zinc/03/16/53/1059031653.db2.gz UEGQAOBYIVSBEM-MJGOQNOKSA-N 2 1 316.464 4.193 20 0 DIADMP CCCC1CCC([N@H+]2C[C@H](c3ccccc3)C3(C[NH2+]C3)C2)CC1 ZINC001246619067 1059033540 /nfs/dbraw/zinc/03/35/40/1059033540.db2.gz JIZQCKVHKMXDTD-LYBXBRPPSA-N 2 1 312.501 4.034 20 0 DIADMP c1ccc([C@@H]2C[N@@H+](C3CCC4(CCCC4)CC3)CC23C[NH2+]C3)cc1 ZINC001246616680 1059034298 /nfs/dbraw/zinc/03/42/98/1059034298.db2.gz AEGUKNPEKXQFIJ-FQEVSTJZSA-N 2 1 324.512 4.178 20 0 DIADMP CCCCC[C@@H](CC)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625696 1059036582 /nfs/dbraw/zinc/03/65/82/1059036582.db2.gz RZJUREOZOOKECD-RTBURBONSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246629339 1059038790 /nfs/dbraw/zinc/03/87/90/1059038790.db2.gz YWPHCZSXJZHJHJ-CMKODMSKSA-N 2 1 314.517 4.136 20 0 DIADMP CCCCCC[C@H](C)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246623840 1059041034 /nfs/dbraw/zinc/04/10/34/1059041034.db2.gz NTRJOODZROMBQI-HKUYNNGSSA-N 2 1 300.490 4.034 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246634370 1059041274 /nfs/dbraw/zinc/04/12/74/1059041274.db2.gz NASMAGIUNDFHHT-LEWJYISDSA-N 2 1 314.517 4.396 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246636286 1059043011 /nfs/dbraw/zinc/04/30/11/1059043011.db2.gz ULHIMBUZPQVXSO-SFTDATJTSA-N 2 1 314.517 4.396 20 0 DIADMP CCCCCC[C@@H](CC)[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001246638561 1059044237 /nfs/dbraw/zinc/04/42/37/1059044237.db2.gz MOOQKUGUJPSXKH-HZPDHXFCSA-N 2 1 302.453 4.056 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246635518 1059045543 /nfs/dbraw/zinc/04/55/43/1059045543.db2.gz RWGJTUHIYUUUMR-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC2CC1(C[NH3+])C2 ZINC001246643694 1059048807 /nfs/dbraw/zinc/04/88/07/1059048807.db2.gz CGWOTUANVHCZKE-PDDLGQBUSA-N 2 1 320.480 4.020 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246646179 1059051430 /nfs/dbraw/zinc/05/14/30/1059051430.db2.gz OVZYGTZFJDJCDB-BEFAXECRSA-N 2 1 320.908 4.125 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001246656656 1059051883 /nfs/dbraw/zinc/05/18/83/1059051883.db2.gz NYZIZHQJYYETEM-NJDAHSKKSA-N 2 1 312.501 4.177 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001246657681 1059053131 /nfs/dbraw/zinc/05/31/31/1059053131.db2.gz PIIMPOLOUZVEKP-DYESRHJHSA-N 2 1 314.517 4.034 20 0 DIADMP c1ccc(C[C@@H]2C[C@H]([NH+]3CCC4(CCCC4)CC3)CC[NH2+]2)cc1 ZINC001246654280 1059055630 /nfs/dbraw/zinc/05/56/30/1059055630.db2.gz JNXABMNHGVMNMH-WOJBJXKFSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@@H+]3CCCC[C@]34CCC[NH2+]C4)C2)cc1 ZINC001246651515 1059055664 /nfs/dbraw/zinc/05/56/64/1059055664.db2.gz LXRGHEIKRGFHFP-NJDAHSKKSA-N 2 1 312.501 4.321 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246675849 1059058522 /nfs/dbraw/zinc/05/85/22/1059058522.db2.gz YJWKRLPFTVUKQG-PZJWPPBQSA-N 2 1 314.517 4.208 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246682397 1059063225 /nfs/dbraw/zinc/06/32/25/1059063225.db2.gz CFQXLDWYFIZGCU-UXHICEINSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246677120 1059063795 /nfs/dbraw/zinc/06/37/95/1059063795.db2.gz BVLSHEKPGCILNP-BBTUJRGHSA-N 2 1 308.469 4.390 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1C1CCC2(CC[NH2+]CC2)CC1 ZINC001246678592 1059064475 /nfs/dbraw/zinc/06/44/75/1059064475.db2.gz GARFRWAXPFFIJI-FQEVSTJZSA-N 2 1 312.501 4.444 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2C)C[C@H](CC)[NH2+]1 ZINC001246682569 1059065164 /nfs/dbraw/zinc/06/51/64/1059065164.db2.gz WDOBBRCLISVURK-DMUMMCEESA-N 2 1 300.490 4.441 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688364 1059066765 /nfs/dbraw/zinc/06/67/65/1059066765.db2.gz GTMGMQAKTQJMOZ-CJNGLKHVSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688364 1059066783 /nfs/dbraw/zinc/06/67/83/1059066783.db2.gz GTMGMQAKTQJMOZ-CJNGLKHVSA-N 2 1 315.288 4.202 20 0 DIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246690460 1059067311 /nfs/dbraw/zinc/06/73/11/1059067311.db2.gz NNINCIJXRUQNHV-WDNDVIMCSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246690460 1059067328 /nfs/dbraw/zinc/06/73/28/1059067328.db2.gz NNINCIJXRUQNHV-WDNDVIMCSA-N 2 1 313.272 4.098 20 0 DIADMP c1ccc(C2CC[NH+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)cc1 ZINC001246688865 1059067706 /nfs/dbraw/zinc/06/77/06/1059067706.db2.gz ICBZQGQCYJAZNT-VXKWHMMOSA-N 2 1 320.480 4.359 20 0 DIADMP C[N@@H+](Cc1ccccc1Cl)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246769477 1059071735 /nfs/dbraw/zinc/07/17/35/1059071735.db2.gz KPZZFNZFGULYOX-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246775316 1059072148 /nfs/dbraw/zinc/07/21/48/1059072148.db2.gz JFPQMWGUUPWFFU-NJDAHSKKSA-N 2 1 314.517 4.252 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246774068 1059074665 /nfs/dbraw/zinc/07/46/65/1059074665.db2.gz FVYVSTGZVKECPT-VXKWHMMOSA-N 2 1 322.496 4.262 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H](Cc3ccccc3)C2)C[C@@H](CC)[NH2+]1 ZINC001246776772 1059077471 /nfs/dbraw/zinc/07/74/71/1059077471.db2.gz PBJXJCCXALZFOF-VAMGGRTRSA-N 2 1 314.517 4.250 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246779231 1059077978 /nfs/dbraw/zinc/07/79/78/1059077978.db2.gz QKKPNRCXFVWAJV-PZJWPPBQSA-N 2 1 308.469 4.194 20 0 DIADMP C[N@@H+](CCCc1ccccc1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246775717 1059078164 /nfs/dbraw/zinc/07/81/64/1059078164.db2.gz KTVCFXBYSNNWTH-LJQANCHMSA-N 2 1 300.490 4.006 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246776539 1059078558 /nfs/dbraw/zinc/07/85/58/1059078558.db2.gz OBQCPAYPOHZMAV-AABGKKOBSA-N 2 1 314.517 4.108 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(OC)cc2)C[C@H](CC)[NH2+]1 ZINC001246783152 1059081000 /nfs/dbraw/zinc/08/10/00/1059081000.db2.gz WSUSULINNXTGAM-AJYBTWMASA-N 2 1 316.489 4.141 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001246786598 1059084988 /nfs/dbraw/zinc/08/49/88/1059084988.db2.gz MCDJPKZPHXEERM-GBESFXJTSA-N 2 1 318.892 4.399 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783859 1059085109 /nfs/dbraw/zinc/08/51/09/1059085109.db2.gz QILIASOQZSTOOE-YJBOKZPZSA-N 2 1 318.461 4.121 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783859 1059085130 /nfs/dbraw/zinc/08/51/30/1059085130.db2.gz QILIASOQZSTOOE-YJBOKZPZSA-N 2 1 318.461 4.121 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246784679 1059085773 /nfs/dbraw/zinc/08/57/73/1059085773.db2.gz HUUKIUHNCGRWKT-NQKNOSNGSA-N 2 1 316.464 4.275 20 0 DIADMP c1ccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787534 1059087876 /nfs/dbraw/zinc/08/78/76/1059087876.db2.gz QIMHNFIIKHCDPP-HKBOAZHASA-N 2 1 306.453 4.317 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787534 1059087896 /nfs/dbraw/zinc/08/78/96/1059087896.db2.gz QIMHNFIIKHCDPP-HKBOAZHASA-N 2 1 306.453 4.317 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246787353 1059088350 /nfs/dbraw/zinc/08/83/50/1059088350.db2.gz PHLWNOQIEWWJRU-VQIMIIECSA-N 2 1 316.464 4.275 20 0 DIADMP c1ccc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787519 1059088640 /nfs/dbraw/zinc/08/86/40/1059088640.db2.gz QIMHNFIIKHCDPP-ACRUOGEOSA-N 2 1 306.453 4.317 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787519 1059088665 /nfs/dbraw/zinc/08/86/65/1059088665.db2.gz QIMHNFIIKHCDPP-ACRUOGEOSA-N 2 1 306.453 4.317 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788762 1059089847 /nfs/dbraw/zinc/08/98/47/1059089847.db2.gz IZHKNPDLYHUVIF-IEBWSBKVSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788762 1059089871 /nfs/dbraw/zinc/08/98/71/1059089871.db2.gz IZHKNPDLYHUVIF-IEBWSBKVSA-N 2 1 304.453 4.048 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246791006 1059092343 /nfs/dbraw/zinc/09/23/43/1059092343.db2.gz XATKWMMWNXMTRV-MAUKXSAKSA-N 2 1 302.437 4.027 20 0 DIADMP c1ccc2cc(C3CC[NH+]([C@@H]4CCCC[NH2+]C4)CC3)ccc2c1 ZINC001246794461 1059095727 /nfs/dbraw/zinc/09/57/27/1059095727.db2.gz ZUPMBLGNNJLMBE-OAQYLSRUSA-N 2 1 308.469 4.161 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001246795955 1059095888 /nfs/dbraw/zinc/09/58/88/1059095888.db2.gz JQZOHQQGELBZEZ-VQTJNVASSA-N 2 1 300.490 4.034 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1[C@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246793630 1059096388 /nfs/dbraw/zinc/09/63/88/1059096388.db2.gz VAUAGRSWODSCOU-AQNXPRMDSA-N 2 1 300.490 4.004 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246793087 1059098936 /nfs/dbraw/zinc/09/89/36/1059098936.db2.gz CZXHNJUJWBJAJH-RDGPPVDQSA-N 2 1 304.453 4.272 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246799368 1059101731 /nfs/dbraw/zinc/10/17/31/1059101731.db2.gz UARXZNXWFDIAQR-QGZVFWFLSA-N 2 1 306.881 4.227 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246804305 1059102942 /nfs/dbraw/zinc/10/29/42/1059102942.db2.gz FWAXRVKTHMYNIB-URVUXULASA-N 2 1 320.480 4.165 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246801182 1059103251 /nfs/dbraw/zinc/10/32/51/1059103251.db2.gz RYWNWEGPHVZHCC-ACRUOGEOSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246801182 1059103257 /nfs/dbraw/zinc/10/32/57/1059103257.db2.gz RYWNWEGPHVZHCC-ACRUOGEOSA-N 2 1 324.443 4.456 20 0 DIADMP C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246814320 1059104906 /nfs/dbraw/zinc/10/49/06/1059104906.db2.gz PYFQLAPJFIAXKL-SFHVURJKSA-N 2 1 316.565 4.041 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+]([C@H]2CCC[C@@]3(CC[NH2+]C3)C2)C1 ZINC001246809013 1059105349 /nfs/dbraw/zinc/10/53/49/1059105349.db2.gz FYIKHPLZIASQKT-JTDSTZFVSA-N 2 1 318.892 4.052 20 0 DIADMP C[N@@H+](CCc1ccccc1Cl)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246823176 1059111078 /nfs/dbraw/zinc/11/10/78/1059111078.db2.gz NAYFTUZMECTOJU-KRWDZBQOSA-N 2 1 320.908 4.269 20 0 DIADMP C[N@@H+](CCc1ccccc1Cl)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246822364 1059111336 /nfs/dbraw/zinc/11/13/36/1059111336.db2.gz KMLXTRAHZGNWHX-UHFFFAOYSA-N 2 1 320.908 4.127 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCc3cc(Cl)ccc3C2)C[C@@H](CC)[NH2+]1 ZINC001246835649 1059114907 /nfs/dbraw/zinc/11/49/07/1059114907.db2.gz KYTGXORPQMUOLC-IAGOWNOFSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCc3cc(Cl)ccc3C2)C[C@@H](CC)[NH2+]1 ZINC001246835649 1059114916 /nfs/dbraw/zinc/11/49/16/1059114916.db2.gz KYTGXORPQMUOLC-IAGOWNOFSA-N 2 1 306.881 4.007 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CCC[NH2+]CC1 ZINC001246841343 1059118311 /nfs/dbraw/zinc/11/83/11/1059118311.db2.gz BBOQDFJPKDABAH-SFHVURJKSA-N 2 1 310.441 4.053 20 0 DIADMP COc1ccccc1[C@H](C)[N@H+](C)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841575 1059119338 /nfs/dbraw/zinc/11/93/38/1059119338.db2.gz UVCSCBMLSLNPRW-DLBZAZTESA-N 2 1 316.489 4.143 20 0 DIADMP COc1ccccc1[C@H](C)[N@@H+](C)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841575 1059119346 /nfs/dbraw/zinc/11/93/46/1059119346.db2.gz UVCSCBMLSLNPRW-DLBZAZTESA-N 2 1 316.489 4.143 20 0 DIADMP CC[N@H+](Cc1ccc(F)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838430 1059119644 /nfs/dbraw/zinc/11/96/44/1059119644.db2.gz BVVNIHKRNGXUQX-PMACEKPBSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838430 1059119654 /nfs/dbraw/zinc/11/96/54/1059119654.db2.gz BVVNIHKRNGXUQX-PMACEKPBSA-N 2 1 312.432 4.141 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC[NH2+]1 ZINC001246838899 1059120359 /nfs/dbraw/zinc/12/03/59/1059120359.db2.gz KDIGYYMCLXMUHC-YADHBBJMSA-N 2 1 322.496 4.262 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246845070 1059122353 /nfs/dbraw/zinc/12/23/53/1059122353.db2.gz KCEDJMSHZRLEAR-UFYCRDLUSA-N 2 1 314.517 4.423 20 0 DIADMP C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246843203 1059123084 /nfs/dbraw/zinc/12/30/84/1059123084.db2.gz UVBVOSCMERPVBW-LSJNQWAISA-N 2 1 320.908 4.298 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843321 1059123198 /nfs/dbraw/zinc/12/31/98/1059123198.db2.gz JKCBPCUVFRYXLQ-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843321 1059123206 /nfs/dbraw/zinc/12/32/06/1059123206.db2.gz JKCBPCUVFRYXLQ-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)cc1 ZINC001246844493 1059123880 /nfs/dbraw/zinc/12/38/80/1059123880.db2.gz JHESIGMZLVPPNS-VXKWHMMOSA-N 2 1 322.496 4.044 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@@H]3CCC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001246845760 1059123957 /nfs/dbraw/zinc/12/39/57/1059123957.db2.gz NTBKJOLNQQCLDD-VQTJNVASSA-N 2 1 312.501 4.178 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2CCC(C(C)C)CC2)CC[NH2+]1 ZINC001246845516 1059124622 /nfs/dbraw/zinc/12/46/22/1059124622.db2.gz KOEZSURQURJVEG-AZUAARDMSA-N 2 1 318.480 4.295 20 0 DIADMP C[C@H]1CC([N@@H+](CCc2ccccc2)Cc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246844445 1059124782 /nfs/dbraw/zinc/12/47/82/1059124782.db2.gz YWYGWPYLNBHKEQ-OALUTQOASA-N 2 1 322.496 4.260 20 0 DIADMP CC[N@H+](Cc1ccccc1F)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246843258 1059124901 /nfs/dbraw/zinc/12/49/01/1059124901.db2.gz BWRRSQAYFXFSNV-QGZVFWFLSA-N 2 1 304.453 4.103 20 0 DIADMP CC[N@@H+](Cc1ccccc1F)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246843258 1059124922 /nfs/dbraw/zinc/12/49/22/1059124922.db2.gz BWRRSQAYFXFSNV-QGZVFWFLSA-N 2 1 304.453 4.103 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001246843741 1059125037 /nfs/dbraw/zinc/12/50/37/1059125037.db2.gz WALIRTNYZXJHEG-HOTGVXAUSA-N 2 1 324.534 4.001 20 0 DIADMP COc1ccc([C@H](C)[N@H+](C)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246848784 1059126491 /nfs/dbraw/zinc/12/64/91/1059126491.db2.gz FDBXMLQJSPYOAN-LDQXTDLNSA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246848784 1059126497 /nfs/dbraw/zinc/12/64/97/1059126497.db2.gz FDBXMLQJSPYOAN-LDQXTDLNSA-N 2 1 324.468 4.181 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246849893 1059126716 /nfs/dbraw/zinc/12/67/16/1059126716.db2.gz SJJCQLUZCBJSDJ-FHLIZLRMSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H]1CC[NH3+] ZINC001246846612 1059128192 /nfs/dbraw/zinc/12/81/92/1059128192.db2.gz PDWSWCNPWZJMFA-JSGCOSHPSA-N 2 1 315.288 4.128 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246846476 1059129367 /nfs/dbraw/zinc/12/93/67/1059129367.db2.gz ALPNFBJCVCUJOK-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246847710 1059129900 /nfs/dbraw/zinc/12/99/00/1059129900.db2.gz RSYWSAIAWIDVRJ-WBQJQJEBSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246847710 1059129910 /nfs/dbraw/zinc/12/99/10/1059129910.db2.gz RSYWSAIAWIDVRJ-WBQJQJEBSA-N 2 1 316.464 4.049 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246852150 1059133306 /nfs/dbraw/zinc/13/33/06/1059133306.db2.gz NDSVEXRZBOTZMJ-RTBURBONSA-N 2 1 324.468 4.441 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)C1 ZINC001246850744 1059133719 /nfs/dbraw/zinc/13/37/19/1059133719.db2.gz WREUHTMLEIKOQH-SZVBFZGTSA-N 2 1 304.453 4.049 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)C1 ZINC001246850744 1059133727 /nfs/dbraw/zinc/13/37/27/1059133727.db2.gz WREUHTMLEIKOQH-SZVBFZGTSA-N 2 1 304.453 4.049 20 0 DIADMP c1ccc(C2=CC[N@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)cc1 ZINC001246859338 1059136145 /nfs/dbraw/zinc/13/61/45/1059136145.db2.gz NQVIIWIEQYGNJA-YADHBBJMSA-N 2 1 318.464 4.269 20 0 DIADMP c1ccc(C2=CC[N@@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)cc1 ZINC001246859338 1059136155 /nfs/dbraw/zinc/13/61/55/1059136155.db2.gz NQVIIWIEQYGNJA-YADHBBJMSA-N 2 1 318.464 4.269 20 0 DIADMP c1ccc(C[C@H]2C[C@@H]([N@H+]3CCC[C@@H]3c3ccccc3)CC[NH2+]2)cc1 ZINC001246866796 1059136886 /nfs/dbraw/zinc/13/68/86/1059136886.db2.gz FBOGUIHOMKJARI-FDFHNCONSA-N 2 1 320.480 4.187 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2CC3(C2)CCCCC3)CC[NH2+]1 ZINC001246861055 1059137368 /nfs/dbraw/zinc/13/73/68/1059137368.db2.gz PXPKGMZNLGTRSG-PKOBYXMFSA-N 2 1 316.464 4.193 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246863804 1059137500 /nfs/dbraw/zinc/13/75/00/1059137500.db2.gz GIUMMILGSHYJNG-UYAOXDASSA-N 2 1 312.501 4.451 20 0 DIADMP C1C[C@@H](C2CCCCC2)[N@H+](C2CCC3(CC[NH2+]CC3)CC2)C1 ZINC001246866909 1059138666 /nfs/dbraw/zinc/13/86/66/1059138666.db2.gz VBNXXWWLFGIOGK-IBGZPJMESA-N 2 1 304.522 4.344 20 0 DIADMP c1ccc(C[C@@H]2C[C@H]([N@@H+](Cc3ccccc3)C3CC3)CC[NH2+]2)cc1 ZINC001246861084 1059138747 /nfs/dbraw/zinc/13/87/47/1059138747.db2.gz QIDQLRQAIUJOLD-IFMALSPDSA-N 2 1 320.480 4.014 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246865043 1059138768 /nfs/dbraw/zinc/13/87/68/1059138768.db2.gz XPMPEKSSVKISLW-MJGOQNOKSA-N 2 1 314.517 4.338 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCc3ccccc3[C@@H]2CC)CC[NH2+]1 ZINC001246867632 1059140598 /nfs/dbraw/zinc/14/05/98/1059140598.db2.gz PTRFSBNXZRUWSA-GGPKGHCWSA-N 2 1 300.490 4.307 20 0 DIADMP CCCC[C@H]1C[C@H]([N@H+]2Cc3ccccc3C(C)(C)C2)CC[NH2+]1 ZINC001246869016 1059140629 /nfs/dbraw/zinc/14/06/29/1059140629.db2.gz DVLQSJISVYXJEW-ZWKOTPCHSA-N 2 1 300.490 4.091 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246869042 1059140806 /nfs/dbraw/zinc/14/08/06/1059140806.db2.gz QIMHNFIIKHCDPP-PWRODBHTSA-N 2 1 306.453 4.317 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246869042 1059140809 /nfs/dbraw/zinc/14/08/09/1059140809.db2.gz QIMHNFIIKHCDPP-PWRODBHTSA-N 2 1 306.453 4.317 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3[C@@H]2CC)CC[NH2+]1 ZINC001246867648 1059142899 /nfs/dbraw/zinc/14/28/99/1059142899.db2.gz PTRFSBNXZRUWSA-HBFSDRIKSA-N 2 1 300.490 4.307 20 0 DIADMP C1C[C@H](C2CCCCC2)[N@H+](C2CCC3(CCC[NH2+]C3)CC2)C1 ZINC001246867732 1059143327 /nfs/dbraw/zinc/14/33/27/1059143327.db2.gz ZGFRDFKQOABPGW-IOJLRTSASA-N 2 1 304.522 4.344 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCc3ccccc3[C@@H]2CC)C[C@@H](CC)[NH2+]1 ZINC001246868232 1059143770 /nfs/dbraw/zinc/14/37/70/1059143770.db2.gz RIEDDWLDQZMSCK-HLIPFELVSA-N 2 1 300.490 4.305 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCC(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246884075 1059149940 /nfs/dbraw/zinc/14/99/40/1059149940.db2.gz SLJHJWPJQCGICY-NQIIRXRSSA-N 2 1 322.496 4.281 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CCN2)cc1 ZINC001246886573 1059150081 /nfs/dbraw/zinc/15/00/81/1059150081.db2.gz HLZWCSBKVYLNAQ-MOXWOTFGSA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886573 1059150087 /nfs/dbraw/zinc/15/00/87/1059150087.db2.gz HLZWCSBKVYLNAQ-MOXWOTFGSA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886573 1059150095 /nfs/dbraw/zinc/15/00/95/1059150095.db2.gz HLZWCSBKVYLNAQ-MOXWOTFGSA-N 2 1 318.464 4.066 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)C[C@@H](CC)[NH2+]1 ZINC001246884565 1059150167 /nfs/dbraw/zinc/15/01/67/1059150167.db2.gz BLJZKEGRAWTCTQ-SPYBWZPUSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2ccc(F)cc2F)C[C@@H](CC)[NH2+]1 ZINC001246884565 1059150178 /nfs/dbraw/zinc/15/01/78/1059150178.db2.gz BLJZKEGRAWTCTQ-SPYBWZPUSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884567 1059151059 /nfs/dbraw/zinc/15/10/59/1059151059.db2.gz BLJZKEGRAWTCTQ-YYAJDYIMSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884567 1059151076 /nfs/dbraw/zinc/15/10/76/1059151076.db2.gz BLJZKEGRAWTCTQ-YYAJDYIMSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899733 1059158500 /nfs/dbraw/zinc/15/85/00/1059158500.db2.gz FYWITXUYHOGEEH-BASYENTBSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899733 1059158513 /nfs/dbraw/zinc/15/85/13/1059158513.db2.gz FYWITXUYHOGEEH-BASYENTBSA-N 2 1 322.443 4.411 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)C1CCC2(C[NH2+]C2)CC1 ZINC001246898994 1059160779 /nfs/dbraw/zinc/16/07/79/1059160779.db2.gz BTGXABUTTPADDZ-MRXNPFEDSA-N 2 1 308.469 4.365 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246904622 1059162893 /nfs/dbraw/zinc/16/28/93/1059162893.db2.gz HXBBFZZNXZICQC-RTBURBONSA-N 2 1 324.468 4.441 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246901635 1059163000 /nfs/dbraw/zinc/16/30/00/1059163000.db2.gz YRXSZDQTDMQAHA-KZNAEPCWSA-N 2 1 304.453 4.129 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](CC)Cc2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC001246906987 1059167812 /nfs/dbraw/zinc/16/78/12/1059167812.db2.gz SZLFAFVZKBAVBP-JKSUJKDBSA-N 2 1 314.395 4.058 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246910987 1059170761 /nfs/dbraw/zinc/17/07/61/1059170761.db2.gz OSDDWADHKFHWSY-WQUXRXDGSA-N 2 1 300.490 4.337 20 0 DIADMP c1ccc(C[N@@H+](C2CC[NH2+]CC2)C2CCCCCCC2)cc1 ZINC001246912287 1059174331 /nfs/dbraw/zinc/17/43/31/1059174331.db2.gz DWMFFIXJDBQPTH-UHFFFAOYSA-N 2 1 300.490 4.354 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@@H]1C[NH3+] ZINC001246918864 1059175105 /nfs/dbraw/zinc/17/51/05/1059175105.db2.gz XXPSRFBMCHXQLC-FXAWDEMLSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H]1C[NH3+] ZINC001246918864 1059175123 /nfs/dbraw/zinc/17/51/23/1059175123.db2.gz XXPSRFBMCHXQLC-FXAWDEMLSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@H]1CC([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C[C@H](C)C1 ZINC001246912150 1059176610 /nfs/dbraw/zinc/17/66/10/1059176610.db2.gz DMJDENTWDFHKKT-IAGOWNOFSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CCC([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CC1 ZINC001246916417 1059177705 /nfs/dbraw/zinc/17/77/05/1059177705.db2.gz SIKPDPFSGWTTFE-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932437 1059180285 /nfs/dbraw/zinc/18/02/85/1059180285.db2.gz AKKYKMWFULBBIK-MJGOQNOKSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932437 1059180301 /nfs/dbraw/zinc/18/03/01/1059180301.db2.gz AKKYKMWFULBBIK-MJGOQNOKSA-N 2 1 316.464 4.193 20 0 DIADMP CCCCCC1CCC([N@H+]2CC[C@@H]([NH3+])[C@@H](C(F)(F)F)C2)CC1 ZINC001246933820 1059182888 /nfs/dbraw/zinc/18/28/88/1059182888.db2.gz JCNNCELZYMGECG-SSHXOBKSSA-N 2 1 320.443 4.337 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C[C@H]1C ZINC001246936338 1059184283 /nfs/dbraw/zinc/18/42/83/1059184283.db2.gz IZZQHCLQCDLVEG-QINHECLXSA-N 2 1 318.480 4.204 20 0 DIADMP C[C@@H]1CC([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC001246937153 1059185151 /nfs/dbraw/zinc/18/51/51/1059185151.db2.gz ZIQMJYQJTLKQRB-HOTGVXAUSA-N 2 1 318.480 4.204 20 0 DIADMP Fc1cccc(C[N@H+](C2CCC3(CC3)CC2)[C@@H]2CCC[NH2+]C2)c1 ZINC001246939238 1059185794 /nfs/dbraw/zinc/18/57/94/1059185794.db2.gz UHLZUDQHFPRLKF-LJQANCHMSA-N 2 1 316.464 4.103 20 0 DIADMP Fc1cccc(C[N@@H+](C2CCC3(CC3)CC2)[C@@H]2CCC[NH2+]C2)c1 ZINC001246939238 1059185804 /nfs/dbraw/zinc/18/58/04/1059185804.db2.gz UHLZUDQHFPRLKF-LJQANCHMSA-N 2 1 316.464 4.103 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246937862 1059186465 /nfs/dbraw/zinc/18/64/65/1059186465.db2.gz NDZUPLFFUPKWLG-WMZOPIPTSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@@H]([NH3+])[C@H]1C ZINC001246937971 1059186623 /nfs/dbraw/zinc/18/66/23/1059186623.db2.gz KSCXNKAGXSDCGD-XHBSWPGZSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@H]([NH3+])[C@H]1C ZINC001246937971 1059186632 /nfs/dbraw/zinc/18/66/32/1059186632.db2.gz KSCXNKAGXSDCGD-XHBSWPGZSA-N 2 1 315.288 4.126 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246946120 1059188435 /nfs/dbraw/zinc/18/84/35/1059188435.db2.gz FZDWEXXHQOYJOE-QRVBRYPASA-N 2 1 318.892 4.399 20 0 DIADMP [NH3+][C@H]1CC[N@H+](C2CCC3(CCCCC3)CC2)C[C@@H]1C(F)(F)F ZINC001246943225 1059189364 /nfs/dbraw/zinc/18/93/64/1059189364.db2.gz ZSGSBKSRGMXHLV-GJZGRUSLSA-N 2 1 318.427 4.091 20 0 DIADMP CC(C)(C)C[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC001246945638 1059189511 /nfs/dbraw/zinc/18/95/11/1059189511.db2.gz HLKPKAKUMNRGFU-ZFWWWQNUSA-N 2 1 320.443 4.208 20 0 DIADMP CC[C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246945551 1059189665 /nfs/dbraw/zinc/18/96/65/1059189665.db2.gz ZIOHXRVJSXVBRC-JXFKEZNVSA-N 2 1 318.480 4.206 20 0 DIADMP C[C@H]1CC([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C[C@H](C)C1 ZINC001246944749 1059190007 /nfs/dbraw/zinc/19/00/07/1059190007.db2.gz VIJKYGCAJIGFID-HZPDHXFCSA-N 2 1 318.480 4.204 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246946425 1059192749 /nfs/dbraw/zinc/19/27/49/1059192749.db2.gz MJXZVSMHZRKKPK-HXUWFJFHSA-N 2 1 316.533 4.498 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246948004 1059193817 /nfs/dbraw/zinc/19/38/17/1059193817.db2.gz ZIJVJLHDEZHUFR-SFHVURJKSA-N 2 1 320.908 4.473 20 0 DIADMP CCCCCC[C@@H](CC)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246952233 1059195180 /nfs/dbraw/zinc/19/51/80/1059195180.db2.gz JYTQJEIZCKOAMD-LJQANCHMSA-N 2 1 317.521 4.385 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001246951597 1059195535 /nfs/dbraw/zinc/19/55/35/1059195535.db2.gz MPJQAFCMOZJXHR-GOSISDBHSA-N 2 1 306.469 4.267 20 0 DIADMP C[C@H](CC1CC1)[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001246947326 1059195922 /nfs/dbraw/zinc/19/59/22/1059195922.db2.gz VBIBTOVWTBTGSB-CQSZACIVSA-N 2 1 306.881 4.083 20 0 DIADMP CC[C@H]1CC([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246947965 1059196069 /nfs/dbraw/zinc/19/60/69/1059196069.db2.gz OBVIZPPCRGLPKY-YZVOILCLSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@H]1CC([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246947965 1059196083 /nfs/dbraw/zinc/19/60/83/1059196083.db2.gz OBVIZPPCRGLPKY-YZVOILCLSA-N 2 1 322.443 4.411 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246955882 1059198263 /nfs/dbraw/zinc/19/82/63/1059198263.db2.gz UXQPPYGMQJNEBW-INIZCTEOSA-N 2 1 308.897 4.473 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246956249 1059198425 /nfs/dbraw/zinc/19/84/25/1059198425.db2.gz XCJPGZZCWMAJHS-YJBOKZPZSA-N 2 1 320.908 4.473 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956194 1059198573 /nfs/dbraw/zinc/19/85/73/1059198573.db2.gz QRIPJFXTTDHCJL-WMLDXEAASA-N 2 1 322.443 4.098 20 0 DIADMP CCCC[C@@H](CC(C)C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246953174 1059198917 /nfs/dbraw/zinc/19/89/17/1059198917.db2.gz MDEKMRGJKTVYMB-FQEVSTJZSA-N 2 1 317.521 4.241 20 0 DIADMP CC1CCC([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)CC1 ZINC001246954437 1059200210 /nfs/dbraw/zinc/20/02/10/1059200210.db2.gz HHIHSMKLDDVMIB-UHFFFAOYSA-N 2 1 322.443 4.098 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956191 1059201309 /nfs/dbraw/zinc/20/13/09/1059201309.db2.gz QRIPJFXTTDHCJL-RHSMWYFYSA-N 2 1 322.443 4.098 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955960 1059202487 /nfs/dbraw/zinc/20/24/87/1059202487.db2.gz OQFPDDOGJBBANL-KSSFIOAISA-N 2 1 322.443 4.098 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@H](C)C1 ZINC001246961255 1059204261 /nfs/dbraw/zinc/20/42/61/1059204261.db2.gz PLJQZTXICMDUFM-MGPUTAFESA-N 2 1 318.480 4.267 20 0 DIADMP CCCCC[C@H](CCC)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246956614 1059204550 /nfs/dbraw/zinc/20/45/50/1059204550.db2.gz ZFKARLRNSPBZGS-IBGZPJMESA-N 2 1 317.521 4.385 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956832 1059204743 /nfs/dbraw/zinc/20/47/43/1059204743.db2.gz WAYMSGBJTBBSAX-YOEHRIQHSA-N 2 1 322.443 4.098 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001246959203 1059205088 /nfs/dbraw/zinc/20/50/88/1059205088.db2.gz VMFABPWTHMLZQZ-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP CC[C@H]1CC([N@@H+](Cc2ccccc2)C2CCC2)C[C@H](CC)[NH2+]1 ZINC001246959220 1059207650 /nfs/dbraw/zinc/20/76/50/1059207650.db2.gz FRROBWJPQQFZGJ-ROUUACIJSA-N 2 1 300.490 4.350 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246956742 1059208060 /nfs/dbraw/zinc/20/80/60/1059208060.db2.gz UHIJJUNBQDXZIG-KRWDZBQOSA-N 2 1 324.459 4.488 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246956958 1059208973 /nfs/dbraw/zinc/20/89/73/1059208973.db2.gz BKVGGMHNTLGCDC-AZUAARDMSA-N 2 1 300.490 4.352 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CC[NH2+]CC1)C1CCCCCC1 ZINC001246967015 1059209593 /nfs/dbraw/zinc/20/95/93/1059209593.db2.gz ZXBIVOHOHKWMTE-UHFFFAOYSA-N 2 1 318.480 4.411 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@](C)(C[NH3+])C1 ZINC001246965633 1059212870 /nfs/dbraw/zinc/21/28/70/1059212870.db2.gz HLNUOCVKLPYUGO-PGRDOPGGSA-N 2 1 322.496 4.268 20 0 DIADMP CCSC[C@@H](C)[N@@H+](Cc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246974700 1059215312 /nfs/dbraw/zinc/21/53/12/1059215312.db2.gz RFKJXMXTFNQQTP-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001246976227 1059215938 /nfs/dbraw/zinc/21/59/38/1059215938.db2.gz VUIHINPCICEDHR-FPOVZHCZSA-N 2 1 314.517 4.108 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CCC[NH2+]CC1 ZINC001246975377 1059216216 /nfs/dbraw/zinc/21/62/16/1059216216.db2.gz CVUXFSCMFAZGCA-UXHICEINSA-N 2 1 302.506 4.252 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](CCC)C[C@H]1CC[NH2+]C1 ZINC001246972396 1059216757 /nfs/dbraw/zinc/21/67/57/1059216757.db2.gz DRAPOKRGAJPWSK-VQTJNVASSA-N 2 1 302.506 4.109 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246975273 1059217598 /nfs/dbraw/zinc/21/75/98/1059217598.db2.gz BNSDPRXJMGOJIA-MISYRCLQSA-N 2 1 302.506 4.250 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001246971303 1059219988 /nfs/dbraw/zinc/21/99/88/1059219988.db2.gz FMMZRSOTWSGMIV-PMACEKPBSA-N 2 1 314.517 4.252 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246978860 1059222016 /nfs/dbraw/zinc/22/20/16/1059222016.db2.gz NBFOANZQTREMJM-JSXRDJHFSA-N 2 1 314.517 4.393 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246977790 1059222681 /nfs/dbraw/zinc/22/26/81/1059222681.db2.gz RCRCTUCIDJTVRB-CYBMUJFWSA-N 2 1 324.871 4.017 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246978855 1059225519 /nfs/dbraw/zinc/22/55/19/1059225519.db2.gz NBFOANZQTREMJM-HWPVKAJDSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[N@@H+](C[C@@H]1CC[NH2+]C1)C1CCC(Cc2ccccc2)CC1 ZINC001246986749 1059227923 /nfs/dbraw/zinc/22/79/23/1059227923.db2.gz COLDOTIQNPFVMW-NYLDSWQDSA-N 2 1 314.517 4.109 20 0 DIADMP Cc1ccc(C[C@H](C)[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)cc1 ZINC001246999332 1059228392 /nfs/dbraw/zinc/22/83/92/1059228392.db2.gz AYCSJQDUMBWOMO-SFHVURJKSA-N 2 1 320.480 4.021 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001246999296 1059229031 /nfs/dbraw/zinc/22/90/31/1059229031.db2.gz ASXBYEZVECENTR-HKUYNNGSSA-N 2 1 314.517 4.338 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)C[C@@H](CC)[NH2+]1 ZINC001246998171 1059230387 /nfs/dbraw/zinc/23/03/87/1059230387.db2.gz BALAGPVWKNZMPJ-GUDVDZBRSA-N 2 1 318.480 4.142 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001247007682 1059231552 /nfs/dbraw/zinc/23/15/52/1059231552.db2.gz GPYGQXILNDRBRI-HNNXBMFYSA-N 2 1 318.530 4.001 20 0 DIADMP CCCC[C@H](CC)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247007931 1059234123 /nfs/dbraw/zinc/23/41/23/1059234123.db2.gz ZHLIFYCQCBTIGW-SFHVURJKSA-N 2 1 300.490 4.092 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001247001759 1059234361 /nfs/dbraw/zinc/23/43/61/1059234361.db2.gz KZIDPIJCQCPCJL-BHIYHBOVSA-N 2 1 300.490 4.299 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@@H](CC)[NH2+]1 ZINC001247006687 1059235028 /nfs/dbraw/zinc/23/50/28/1059235028.db2.gz XPNJLKGTBGVGOT-ZHALLVOQSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@@H](CC)[NH2+]1 ZINC001247006687 1059235044 /nfs/dbraw/zinc/23/50/44/1059235044.db2.gz XPNJLKGTBGVGOT-ZHALLVOQSA-N 2 1 322.443 4.411 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001783 1059236171 /nfs/dbraw/zinc/23/61/71/1059236171.db2.gz LEYAHJZYZJDYEF-IPMKNSEASA-N 2 1 322.443 4.413 20 0 DIADMP CCCC[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001783 1059236183 /nfs/dbraw/zinc/23/61/83/1059236183.db2.gz LEYAHJZYZJDYEF-IPMKNSEASA-N 2 1 322.443 4.413 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC(C)(C)C1 ZINC001247016349 1059245969 /nfs/dbraw/zinc/24/59/69/1059245969.db2.gz UBYNXCGUWQAMRL-SJLPKXTDSA-N 2 1 312.501 4.296 20 0 DIADMP CC(C)CCC[C@@H](C)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247016344 1059247886 /nfs/dbraw/zinc/24/78/86/1059247886.db2.gz TYQVFEWWHLZRLN-QGZVFWFLSA-N 2 1 300.490 4.296 20 0 DIADMP Cc1ccccc1C[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1ccccc1 ZINC001559506303 1059298940 /nfs/dbraw/zinc/29/89/40/1059298940.db2.gz YEBPVFYNCGXCDT-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1ccccc1 ZINC001559506303 1059298961 /nfs/dbraw/zinc/29/89/61/1059298961.db2.gz YEBPVFYNCGXCDT-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccccc1 ZINC001559506303 1059298981 /nfs/dbraw/zinc/29/89/81/1059298981.db2.gz YEBPVFYNCGXCDT-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccccc1 ZINC001559506303 1059298998 /nfs/dbraw/zinc/29/89/98/1059298998.db2.gz YEBPVFYNCGXCDT-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP C([C@H]1CCC[N@@H+](CC23CCC(CC2)C3)C1)[NH+]1CCCCCC1 ZINC001559524982 1059320967 /nfs/dbraw/zinc/32/09/67/1059320967.db2.gz WVQSZGQAUNWKSC-IOJLRTSASA-N 2 1 304.522 4.155 20 0 DIADMP Clc1ccc(/C=C\C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547491 1059356535 /nfs/dbraw/zinc/35/65/35/1059356535.db2.gz XFRFLVPTIYDFRU-PYTPGESOSA-N 2 1 318.892 4.161 20 0 DIADMP Clc1ccc(/C=C\C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547491 1059356555 /nfs/dbraw/zinc/35/65/55/1059356555.db2.gz XFRFLVPTIYDFRU-PYTPGESOSA-N 2 1 318.892 4.161 20 0 DIADMP Cc1ccc([C@H]2CCCCC[N@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559557572 1059371370 /nfs/dbraw/zinc/37/13/70/1059371370.db2.gz CFQWOSFZSYMDDG-GOSISDBHSA-N 2 1 304.478 4.381 20 0 DIADMP C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001559560586 1059380978 /nfs/dbraw/zinc/38/09/78/1059380978.db2.gz NQSQVLKXXAPLLP-ZWKOTPCHSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@@H](CCSc1ccccc1)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001559568554 1059395295 /nfs/dbraw/zinc/39/52/95/1059395295.db2.gz ZQECWUJTIONOKJ-ROUUACIJSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@@H](CCSc1ccccc1)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC001559568554 1059395316 /nfs/dbraw/zinc/39/53/16/1059395316.db2.gz ZQECWUJTIONOKJ-ROUUACIJSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@@H](CCSc1ccccc1)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC001559568554 1059395338 /nfs/dbraw/zinc/39/53/38/1059395338.db2.gz ZQECWUJTIONOKJ-ROUUACIJSA-N 2 1 320.546 4.364 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)C[C@H]1C ZINC001559584391 1059419137 /nfs/dbraw/zinc/41/91/37/1059419137.db2.gz KVCHGKHHDCPBGA-APWZRJJASA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@H]1C ZINC001559584391 1059419147 /nfs/dbraw/zinc/41/91/47/1059419147.db2.gz KVCHGKHHDCPBGA-APWZRJJASA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@H]1C ZINC001559584391 1059419153 /nfs/dbraw/zinc/41/91/53/1059419153.db2.gz KVCHGKHHDCPBGA-APWZRJJASA-N 2 1 302.506 4.289 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CCC4CCC4)CC[C@H]32)cc1 ZINC001559594554 1059428452 /nfs/dbraw/zinc/42/84/52/1059428452.db2.gz QWSWEJJBQHCTPL-LEWJYISDSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CCC4CCC4)CC[C@H]32)cc1 ZINC001559594554 1059428466 /nfs/dbraw/zinc/42/84/66/1059428466.db2.gz QWSWEJJBQHCTPL-LEWJYISDSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CCC4CCC4)CC[C@H]32)cc1 ZINC001559594554 1059428480 /nfs/dbraw/zinc/42/84/80/1059428480.db2.gz QWSWEJJBQHCTPL-LEWJYISDSA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001559660557 1059488118 /nfs/dbraw/zinc/48/81/18/1059488118.db2.gz XDYBMZRCOJKMFY-GHTZIAJQSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001559660557 1059488129 /nfs/dbraw/zinc/48/81/29/1059488129.db2.gz XDYBMZRCOJKMFY-GHTZIAJQSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001559660557 1059488140 /nfs/dbraw/zinc/48/81/40/1059488140.db2.gz XDYBMZRCOJKMFY-GHTZIAJQSA-N 2 1 312.501 4.259 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C[C@@H]2CC3CCC2CC3)cc1 ZINC001559712126 1059537528 /nfs/dbraw/zinc/53/75/28/1059537528.db2.gz BXWCPXJKSMZSEM-GQOXECLESA-N 2 1 300.490 4.006 20 0 DIADMP CC(C)C[C@@H](C)C[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001559726515 1059558567 /nfs/dbraw/zinc/55/85/67/1059558567.db2.gz SNMOUYZFIISWCY-BNDYYXHWSA-N 2 1 316.533 4.415 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(Cl)c1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737046 1059569273 /nfs/dbraw/zinc/56/92/73/1059569273.db2.gz FRQIOQCTVLKQBL-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(Cl)c1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737046 1059569289 /nfs/dbraw/zinc/56/92/89/1059569289.db2.gz FRQIOQCTVLKQBL-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C1CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737911 1059571675 /nfs/dbraw/zinc/57/16/75/1059571675.db2.gz QIPNTJZMFKXSPG-VQIMIIECSA-N 2 1 312.501 4.307 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](CCCCc2cccc(Cl)c2)CC1 ZINC001559749064 1059583521 /nfs/dbraw/zinc/58/35/21/1059583521.db2.gz DWUOXBHBQLTWEV-GOSISDBHSA-N 2 1 308.897 4.079 20 0 DIADMP CC(C)=CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001559818012 1059651602 /nfs/dbraw/zinc/65/16/02/1059651602.db2.gz BZXOCRYDWQFJQV-QGZVFWFLSA-N 2 1 306.519 4.167 20 0 DIADMP CC(C)=CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001559818012 1059651620 /nfs/dbraw/zinc/65/16/20/1059651620.db2.gz BZXOCRYDWQFJQV-QGZVFWFLSA-N 2 1 306.519 4.167 20 0 DIADMP CC(C)=CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC001559818012 1059651634 /nfs/dbraw/zinc/65/16/34/1059651634.db2.gz BZXOCRYDWQFJQV-QGZVFWFLSA-N 2 1 306.519 4.167 20 0 DIADMP CC(C)=CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C)s2)C1 ZINC001559818012 1059651652 /nfs/dbraw/zinc/65/16/52/1059651652.db2.gz BZXOCRYDWQFJQV-QGZVFWFLSA-N 2 1 306.519 4.167 20 0 DIADMP CCC(CC)C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001559829371 1059662736 /nfs/dbraw/zinc/66/27/36/1059662736.db2.gz RMSPZQMFYWMFSL-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC(CC)C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001559829371 1059662748 /nfs/dbraw/zinc/66/27/48/1059662748.db2.gz RMSPZQMFYWMFSL-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC(CC)C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001559829371 1059662752 /nfs/dbraw/zinc/66/27/52/1059662752.db2.gz RMSPZQMFYWMFSL-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP c1cc(C[N@H+]2CC[C@@H](C3CCC3)C2)cc(C[NH+]2CCCCC2)c1 ZINC001559909658 1059723747 /nfs/dbraw/zinc/72/37/47/1059723747.db2.gz KHYZHLUFMMOXPN-OAQYLSRUSA-N 2 1 312.501 4.295 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)[C@H]1CCCC[C@H]1c1ccccc1 ZINC001559911512 1059728018 /nfs/dbraw/zinc/72/80/18/1059728018.db2.gz LTZDQYMPGDUGKC-PMACEKPBSA-N 2 1 302.506 4.377 20 0 DIADMP CCCC[N@@H+](Cc1cncc(C)c1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001560035763 1059853760 /nfs/dbraw/zinc/85/37/60/1059853760.db2.gz GFLIHPRLUFFJDF-UHFFFAOYSA-N 2 1 317.521 4.301 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001560043365 1059855805 /nfs/dbraw/zinc/85/58/05/1059855805.db2.gz WZODPSHMDBSQCQ-AQNXPRMDSA-N 2 1 300.490 4.006 20 0 DIADMP CC1(C)[C@@H](c2cccc(F)c2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC001560057086 1059865847 /nfs/dbraw/zinc/86/58/47/1059865847.db2.gz FVXHWELEBNSDMR-LJQANCHMSA-N 2 1 318.480 4.270 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cc(C)cc(C)c2)CC1 ZINC001560050385 1059869452 /nfs/dbraw/zinc/86/94/52/1059869452.db2.gz XUZOHCZXJXXNDQ-UHFFFAOYSA-N 2 1 300.490 4.144 20 0 DIADMP CC1(C[NH+]2C[C@]3(C)C[NH+](Cc4ccccc4)C[C@@]3(C)C2)CCC1 ZINC001560071713 1059884849 /nfs/dbraw/zinc/88/48/49/1059884849.db2.gz FGTLPIQYQTYAJY-SFTDATJTSA-N 2 1 312.501 4.021 20 0 DIADMP CC(C)C[N@@H+](CCOC1CCCCCC1)CC1CC[NH+](C)CC1 ZINC001560091036 1059897991 /nfs/dbraw/zinc/89/79/91/1059897991.db2.gz ZHWOGVKDEUUZRW-UHFFFAOYSA-N 2 1 324.553 4.026 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccc(C(F)F)cc1 ZINC001560100793 1059907971 /nfs/dbraw/zinc/90/79/71/1059907971.db2.gz VDIBEIGVLSGTRE-UHFFFAOYSA-N 2 1 310.432 4.322 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001560102184 1059910904 /nfs/dbraw/zinc/91/09/04/1059910904.db2.gz GZFVDMWKPDTOKE-MRXNPFEDSA-N 2 1 317.864 4.113 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001560102184 1059910919 /nfs/dbraw/zinc/91/09/19/1059910919.db2.gz GZFVDMWKPDTOKE-MRXNPFEDSA-N 2 1 317.864 4.113 20 0 DIADMP Cc1[nH]c(C2CC[NH+](C[C@@H]3CCCCC3(C)C)CC2)[nH+]c1C ZINC001560149794 1059946751 /nfs/dbraw/zinc/94/67/51/1059946751.db2.gz WVRWGNIDEHAXLH-KRWDZBQOSA-N 2 1 303.494 4.422 20 0 DIADMP CC(C)C[C@@H](C)C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001560153437 1059950146 /nfs/dbraw/zinc/95/01/46/1059950146.db2.gz FJJBOOAHFCWJSE-NRSPTQNISA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001560153437 1059950163 /nfs/dbraw/zinc/95/01/63/1059950163.db2.gz FJJBOOAHFCWJSE-NRSPTQNISA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001560153437 1059950173 /nfs/dbraw/zinc/95/01/73/1059950173.db2.gz FJJBOOAHFCWJSE-NRSPTQNISA-N 2 1 314.517 4.123 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1[C@H](C)c1ccccc1 ZINC001560162776 1059955251 /nfs/dbraw/zinc/95/52/51/1059955251.db2.gz ALIKTNJMIYUTHG-XLIONFOSSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1[C@H](C)c1ccccc1 ZINC001560162776 1059955270 /nfs/dbraw/zinc/95/52/70/1059955270.db2.gz ALIKTNJMIYUTHG-XLIONFOSSA-N 2 1 311.473 4.240 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(F)c3cc[nH]c32)CC1 ZINC001248818914 1059999833 /nfs/dbraw/zinc/99/98/33/1059999833.db2.gz GIIBPLZANUOGFG-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP CC(C)CCC[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC001560266097 1060037533 /nfs/dbraw/zinc/03/75/33/1060037533.db2.gz PJRFSMKUOLMRIA-SFHVURJKSA-N 2 1 302.506 4.444 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC001560269924 1060040622 /nfs/dbraw/zinc/04/06/22/1060040622.db2.gz YKBYRDLFDMIUJK-HDICACEKSA-N 2 1 314.517 4.412 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001560269726 1060042749 /nfs/dbraw/zinc/04/27/49/1060042749.db2.gz OJBHSYYENTUYLU-KDURUIRLSA-N 2 1 316.533 4.343 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C2CCC(C3CCCCC3)CC2)C1 ZINC001560291109 1060071355 /nfs/dbraw/zinc/07/13/55/1060071355.db2.gz DCURXZXKHOPSKS-KKXNLOMOSA-N 2 1 306.538 4.447 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+]C[C@@H](CC)c1ccccc1 ZINC001560320747 1060107856 /nfs/dbraw/zinc/10/78/56/1060107856.db2.gz NAYIDYXDJUFQHJ-QUCCMNQESA-N 2 1 302.506 4.424 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+]C[C@@H](CC)c1ccccc1 ZINC001560320747 1060107864 /nfs/dbraw/zinc/10/78/64/1060107864.db2.gz NAYIDYXDJUFQHJ-QUCCMNQESA-N 2 1 302.506 4.424 20 0 DIADMP CC(C)(C)CCC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001560346363 1060132803 /nfs/dbraw/zinc/13/28/03/1060132803.db2.gz SBQYMGQEIIMNFP-UHFFFAOYSA-N 2 1 320.496 4.249 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c(Cl)c1 ZINC001560406815 1060189555 /nfs/dbraw/zinc/18/95/55/1060189555.db2.gz RUXOOPPIPLWNGV-MRXNPFEDSA-N 2 1 308.897 4.106 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c(Cl)c1 ZINC001560406815 1060189566 /nfs/dbraw/zinc/18/95/66/1060189566.db2.gz RUXOOPPIPLWNGV-MRXNPFEDSA-N 2 1 308.897 4.106 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc3oc4ccccc4c3c2)C1 ZINC001560500629 1060295865 /nfs/dbraw/zinc/29/58/65/1060295865.db2.gz WTOBZKRFQPTFEW-MRXNPFEDSA-N 2 1 322.452 4.408 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC[C@H]2C=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001560576911 1060392453 /nfs/dbraw/zinc/39/24/53/1060392453.db2.gz UDOWUAJMFBPSAC-SVFBPWRDSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC[C@H]2C=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001560576911 1060392476 /nfs/dbraw/zinc/39/24/76/1060392476.db2.gz UDOWUAJMFBPSAC-SVFBPWRDSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560610178 1060424925 /nfs/dbraw/zinc/42/49/25/1060424925.db2.gz MCXNJTYHFPQNFM-SJLPKXTDSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560610178 1060424935 /nfs/dbraw/zinc/42/49/35/1060424935.db2.gz MCXNJTYHFPQNFM-SJLPKXTDSA-N 2 1 314.517 4.454 20 0 DIADMP Cc1occc1C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001560629627 1060441753 /nfs/dbraw/zinc/44/17/53/1060441753.db2.gz XXKGPUIDSQQHRK-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1occc1C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001560629627 1060441758 /nfs/dbraw/zinc/44/17/58/1060441758.db2.gz XXKGPUIDSQQHRK-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1occc1C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001560629627 1060441761 /nfs/dbraw/zinc/44/17/61/1060441761.db2.gz XXKGPUIDSQQHRK-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1occc1C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001560629627 1060441767 /nfs/dbraw/zinc/44/17/67/1060441767.db2.gz XXKGPUIDSQQHRK-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632819 1060444044 /nfs/dbraw/zinc/44/40/44/1060444044.db2.gz ZTBVUOFTOPNSBN-HCZHMGAMSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632819 1060444049 /nfs/dbraw/zinc/44/40/49/1060444049.db2.gz ZTBVUOFTOPNSBN-HCZHMGAMSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632820 1060444423 /nfs/dbraw/zinc/44/44/23/1060444423.db2.gz ZTBVUOFTOPNSBN-PXDRNWIDSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632820 1060444436 /nfs/dbraw/zinc/44/44/36/1060444436.db2.gz ZTBVUOFTOPNSBN-PXDRNWIDSA-N 2 1 312.501 4.043 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC001560640479 1060455867 /nfs/dbraw/zinc/45/58/67/1060455867.db2.gz RCPLMDNTDTXPCE-BRAJZSMUSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC001560640479 1060455871 /nfs/dbraw/zinc/45/58/71/1060455871.db2.gz RCPLMDNTDTXPCE-BRAJZSMUSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC001560640479 1060455877 /nfs/dbraw/zinc/45/58/77/1060455877.db2.gz RCPLMDNTDTXPCE-BRAJZSMUSA-N 2 1 318.549 4.398 20 0 DIADMP CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560644095 1060464279 /nfs/dbraw/zinc/46/42/79/1060464279.db2.gz HTCKFMRCHZILTO-ANULTFPQSA-N 2 1 312.501 4.055 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](CC1CC[NH+](C)CC1)C1CC1 ZINC001560680107 1060524717 /nfs/dbraw/zinc/52/47/17/1060524717.db2.gz LWJJJTDTLYUNHA-AWEZNQCLSA-N 2 1 306.881 4.207 20 0 DIADMP C[N@@H+](CCC1CCCCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001560696854 1060546473 /nfs/dbraw/zinc/54/64/73/1060546473.db2.gz FHNLDUSMXYFAOE-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCC1CCCCC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001560696854 1060546491 /nfs/dbraw/zinc/54/64/91/1060546491.db2.gz FHNLDUSMXYFAOE-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCC1CCCCC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001560696854 1060546513 /nfs/dbraw/zinc/54/65/13/1060546513.db2.gz FHNLDUSMXYFAOE-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)C1(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700937 1060555795 /nfs/dbraw/zinc/55/57/95/1060555795.db2.gz VNYQSPKSDLKLEX-UYAOXDASSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700937 1060555813 /nfs/dbraw/zinc/55/58/13/1060555813.db2.gz VNYQSPKSDLKLEX-UYAOXDASSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700937 1060555832 /nfs/dbraw/zinc/55/58/32/1060555832.db2.gz VNYQSPKSDLKLEX-UYAOXDASSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700937 1060555845 /nfs/dbraw/zinc/55/58/45/1060555845.db2.gz VNYQSPKSDLKLEX-UYAOXDASSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001560703747 1060562214 /nfs/dbraw/zinc/56/22/14/1060562214.db2.gz LNRJGZODAFXROH-ZIBCJSCZSA-N 2 1 314.517 4.311 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@H]1Cc1ccc(Cl)cc1 ZINC001560803611 1060663441 /nfs/dbraw/zinc/66/34/41/1060663441.db2.gz BBVUXKAHZUTXLL-AYBZRNKSSA-N 2 1 322.924 4.371 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(C3CC3)cc2)cc1 ZINC001560811063 1060669414 /nfs/dbraw/zinc/66/94/14/1060669414.db2.gz WUQADSNFBMENBV-UHFFFAOYSA-N 2 1 308.469 4.258 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H](CC)Cc1ccc(Cl)cc1 ZINC001560861535 1060718613 /nfs/dbraw/zinc/71/86/13/1060718613.db2.gz QGQPCUNQOVYFHF-QAPCUYQASA-N 2 1 310.913 4.371 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H](CC)Cc1ccc(Cl)cc1 ZINC001560861535 1060718628 /nfs/dbraw/zinc/71/86/28/1060718628.db2.gz QGQPCUNQOVYFHF-QAPCUYQASA-N 2 1 310.913 4.371 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001560870972 1060732321 /nfs/dbraw/zinc/73/23/21/1060732321.db2.gz VATCJBREMJCXQM-MISYRCLQSA-N 2 1 302.506 4.421 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001560870972 1060732322 /nfs/dbraw/zinc/73/23/22/1060732322.db2.gz VATCJBREMJCXQM-MISYRCLQSA-N 2 1 302.506 4.421 20 0 DIADMP Cc1ccc2oc(C[NH2+]C3CC[NH+](CCC(C)C)CC3)cc2c1 ZINC001560933664 1060796527 /nfs/dbraw/zinc/79/65/27/1060796527.db2.gz WWWZOOBEIAUAFO-UHFFFAOYSA-N 2 1 314.473 4.341 20 0 DIADMP c1ccc(C2CC([NH2+]C[C@H]3CC[N@@H+]3C3CCCCCC3)C2)cc1 ZINC001560973587 1060838354 /nfs/dbraw/zinc/83/83/54/1060838354.db2.gz YQOIFMAJJDQLCJ-GZNCHQMQSA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc(C2CC([NH2+]C[C@H]3CC[N@H+]3C3CCCCCC3)C2)cc1 ZINC001560973587 1060838367 /nfs/dbraw/zinc/83/83/67/1060838367.db2.gz YQOIFMAJJDQLCJ-GZNCHQMQSA-N 2 1 312.501 4.319 20 0 DIADMP C[C@H]([NH2+]CC1CCC=CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001561017717 1060875152 /nfs/dbraw/zinc/87/51/52/1060875152.db2.gz FUTOZKINHHOLMJ-RXVVDRJESA-N 2 1 312.501 4.233 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@@H]1CCCc2ccc(F)cc21 ZINC001473191005 1060942613 /nfs/dbraw/zinc/94/26/13/1060942613.db2.gz CYWKTMRBVXNBPW-IEBWSBKVSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@@H]1CCCc2ccc(F)cc21 ZINC001473191005 1060942635 /nfs/dbraw/zinc/94/26/35/1060942635.db2.gz CYWKTMRBVXNBPW-IEBWSBKVSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@@H]1CCCc2ccc(F)cc21 ZINC001473191005 1060942659 /nfs/dbraw/zinc/94/26/59/1060942659.db2.gz CYWKTMRBVXNBPW-IEBWSBKVSA-N 2 1 304.453 4.009 20 0 DIADMP CC(C)C[C@H](C)[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203038 1060963710 /nfs/dbraw/zinc/96/37/10/1060963710.db2.gz GMRDUMWJNZZQMU-FPOVZHCZSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203038 1060963737 /nfs/dbraw/zinc/96/37/37/1060963737.db2.gz GMRDUMWJNZZQMU-FPOVZHCZSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203038 1060963766 /nfs/dbraw/zinc/96/37/66/1060963766.db2.gz GMRDUMWJNZZQMU-FPOVZHCZSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203038 1060963792 /nfs/dbraw/zinc/96/37/92/1060963792.db2.gz GMRDUMWJNZZQMU-FPOVZHCZSA-N 2 1 314.517 4.409 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC001462145356 1060969410 /nfs/dbraw/zinc/96/94/10/1060969410.db2.gz FBFADZGBUUWMMX-HAGHYFMRSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC001462145356 1060969431 /nfs/dbraw/zinc/96/94/31/1060969431.db2.gz FBFADZGBUUWMMX-HAGHYFMRSA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@H](C)[C@H](C)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219588 1060995474 /nfs/dbraw/zinc/99/54/74/1060995474.db2.gz KCAMCCIHLRWGNR-QIJZPMMNSA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219588 1060995495 /nfs/dbraw/zinc/99/54/95/1060995495.db2.gz KCAMCCIHLRWGNR-QIJZPMMNSA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219588 1060995519 /nfs/dbraw/zinc/99/55/19/1060995519.db2.gz KCAMCCIHLRWGNR-QIJZPMMNSA-N 2 1 314.517 4.408 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC001462189495 1061011569 /nfs/dbraw/zinc/01/15/69/1061011569.db2.gz IUXKXKSCGUZCHX-QGPMSJSTSA-N 2 1 308.897 4.296 20 0 DIADMP Cc1ccc([C@@H](C)C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)cc1 ZINC001462192200 1061014303 /nfs/dbraw/zinc/01/43/03/1061014303.db2.gz OGRQPDLBEDDEKQ-SFHVURJKSA-N 2 1 324.468 4.345 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462300103 1061089849 /nfs/dbraw/zinc/08/98/49/1061089849.db2.gz OIMSQWDAYHTORF-HOJAQTOUSA-N 2 1 302.506 4.108 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462300103 1061089866 /nfs/dbraw/zinc/08/98/66/1061089866.db2.gz OIMSQWDAYHTORF-HOJAQTOUSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462306534 1061093395 /nfs/dbraw/zinc/09/33/95/1061093395.db2.gz PIACNGRPOBCMED-SXLOBPIMSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462306534 1061093409 /nfs/dbraw/zinc/09/34/09/1061093409.db2.gz PIACNGRPOBCMED-SXLOBPIMSA-N 2 1 302.506 4.108 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1)C1CC1 ZINC001462311131 1061097958 /nfs/dbraw/zinc/09/79/58/1061097958.db2.gz QJMOFHIZHDRPEW-OALUTQOASA-N 2 1 320.908 4.440 20 0 DIADMP CC(C)CCCCNc1ccc(N2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC001462534360 1061244099 /nfs/dbraw/zinc/24/40/99/1061244099.db2.gz FUJSUAGDCIFLHD-FQEVSTJZSA-N 2 1 315.505 4.209 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001462627424 1061307359 /nfs/dbraw/zinc/30/73/59/1061307359.db2.gz JSQBUQDJSNOJJL-ICSRJNTNSA-N 2 1 312.501 4.380 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001462627424 1061307372 /nfs/dbraw/zinc/30/73/72/1061307372.db2.gz JSQBUQDJSNOJJL-ICSRJNTNSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@H](CC1CCCCC1)C[NH+]1C[C@@]23C[N@H+](C)C[C@]2(C1)CCCC3 ZINC001462673099 1061331010 /nfs/dbraw/zinc/33/10/10/1061331010.db2.gz SYFXZVFYDUAHBX-NRSPTQNISA-N 2 1 318.549 4.401 20 0 DIADMP C[C@H](CC1CCCCC1)C[NH+]1C[C@@]23C[N@@H+](C)C[C@]2(C1)CCCC3 ZINC001462673099 1061331024 /nfs/dbraw/zinc/33/10/24/1061331024.db2.gz SYFXZVFYDUAHBX-NRSPTQNISA-N 2 1 318.549 4.401 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2)CC1 ZINC001473717681 1061367540 /nfs/dbraw/zinc/36/75/40/1061367540.db2.gz ZIQYQXWNQRSXPO-IBGZPJMESA-N 2 1 320.908 4.426 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2Cc2ccc(Cl)cc2)CC1 ZINC001473717681 1061367568 /nfs/dbraw/zinc/36/75/68/1061367568.db2.gz ZIQYQXWNQRSXPO-IBGZPJMESA-N 2 1 320.908 4.426 20 0 DIADMP CC1(C)[C@@H](c2ccccc2F)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC001473726953 1061374227 /nfs/dbraw/zinc/37/42/27/1061374227.db2.gz SSLUFXLHONONLP-GOSISDBHSA-N 2 1 318.480 4.270 20 0 DIADMP CC1(C)[C@H](c2ccccc2F)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC001473726954 1061375375 /nfs/dbraw/zinc/37/53/75/1061375375.db2.gz SSLUFXLHONONLP-SFHVURJKSA-N 2 1 318.480 4.270 20 0 DIADMP C[C@H](c1cccc(Cl)c1)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001473900856 1061452509 /nfs/dbraw/zinc/45/25/09/1061452509.db2.gz HAOHKHHXCUPCDK-LZQZEXGQSA-N 2 1 318.892 4.209 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2scnc2c1 ZINC001473937275 1061482649 /nfs/dbraw/zinc/48/26/49/1061482649.db2.gz OWSVFBAYBTUHES-OAHLLOKOSA-N 2 1 317.502 4.041 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccccc1C1CC1 ZINC001473937467 1061482734 /nfs/dbraw/zinc/48/27/34/1061482734.db2.gz VIOBLEWRYATQQD-QGZVFWFLSA-N 2 1 300.490 4.308 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c(Cl)c1 ZINC001473937116 1061483026 /nfs/dbraw/zinc/48/30/26/1061483026.db2.gz LVANMAROHGWAFT-INIZCTEOSA-N 2 1 308.897 4.250 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(Cl)ccc2F)C1 ZINC001473937090 1061483141 /nfs/dbraw/zinc/48/31/41/1061483141.db2.gz KVRUGJXYJGHJAY-AWEZNQCLSA-N 2 1 312.860 4.081 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001473964616 1061507181 /nfs/dbraw/zinc/50/71/81/1061507181.db2.gz GVZDCWWEJOPUKQ-KRWDZBQOSA-N 2 1 312.501 4.263 20 0 DIADMP Cc1cccc(C2(C[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)CCCC2)c1 ZINC001473970942 1061514691 /nfs/dbraw/zinc/51/46/91/1061514691.db2.gz QAYMJCMKWKXZAB-IBGZPJMESA-N 2 1 314.517 4.269 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2C2CC2)c1 ZINC001473988208 1061531655 /nfs/dbraw/zinc/53/16/55/1061531655.db2.gz FYUYWDXEVBFWPK-UHFFFAOYSA-N 2 1 308.469 4.306 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001473987774 1061531701 /nfs/dbraw/zinc/53/17/01/1061531701.db2.gz NDYVIMPFWUBCHP-SXLOBPIMSA-N 2 1 302.506 4.423 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)CCCC3)c1 ZINC001473988870 1061532324 /nfs/dbraw/zinc/53/23/24/1061532324.db2.gz VNQLGZLWOZPEEM-UHFFFAOYSA-N 2 1 322.496 4.307 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)c1 ZINC001474015640 1061557752 /nfs/dbraw/zinc/55/77/52/1061557752.db2.gz DFYFBKICDKPOIN-FUHIMQAGSA-N 2 1 302.506 4.441 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]CC2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC001474072893 1061618089 /nfs/dbraw/zinc/61/80/89/1061618089.db2.gz AHDBFZXXLPKNMT-NQIIRXRSSA-N 2 1 314.517 4.457 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2(Cc3cccc(Cl)c3)CC2)CC1(C)C ZINC001474173955 1061719016 /nfs/dbraw/zinc/71/90/16/1061719016.db2.gz GCGBGINBQIVJCY-KRWDZBQOSA-N 2 1 320.908 4.125 20 0 DIADMP CC(C)C[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC001474223099 1061783143 /nfs/dbraw/zinc/78/31/43/1061783143.db2.gz BTYJEGDMYNUHGS-XUVXKRRUSA-N 2 1 306.538 4.303 20 0 DIADMP CC(C)C[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC001474223097 1061784210 /nfs/dbraw/zinc/78/42/10/1061784210.db2.gz BTYJEGDMYNUHGS-SLFFLAALSA-N 2 1 306.538 4.303 20 0 DIADMP Cc1cc(C)cc(-c2ccc(C[NH2+]CC[C@@H](C)[NH+](C)C)cc2)c1 ZINC001474223465 1061784597 /nfs/dbraw/zinc/78/45/97/1061784597.db2.gz JKKSOPPHFWBWBQ-GOSISDBHSA-N 2 1 310.485 4.400 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC001253094563 1061797548 /nfs/dbraw/zinc/79/75/48/1061797548.db2.gz FFYSAOGFGTVYCW-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270088 1061839244 /nfs/dbraw/zinc/83/92/44/1061839244.db2.gz SGCIAVSTXMXBGT-IEBWSBKVSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270088 1061839268 /nfs/dbraw/zinc/83/92/68/1061839268.db2.gz SGCIAVSTXMXBGT-IEBWSBKVSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H](C[NH2+][C@H](CC[NH+](C)C)c1cccnc1)CC1CCCCC1 ZINC001474275419 1061840463 /nfs/dbraw/zinc/84/04/63/1061840463.db2.gz RKDCJPYQXIZPDD-FXAWDEMLSA-N 2 1 317.521 4.271 20 0 DIADMP C[C@H](C[NH2+][C@@H](CC[NH+](C)C)c1cccnc1)CC1CCCCC1 ZINC001474275459 1061841031 /nfs/dbraw/zinc/84/10/31/1061841031.db2.gz RKDCJPYQXIZPDD-PXNSSMCTSA-N 2 1 317.521 4.271 20 0 DIADMP C[C@@H](C[NH2+][C@H](CC[NH+](C)C)c1cccnc1)CC1CCCCC1 ZINC001474275461 1061842577 /nfs/dbraw/zinc/84/25/77/1061842577.db2.gz RKDCJPYQXIZPDD-YLJYHZDGSA-N 2 1 317.521 4.271 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001474294755 1061863881 /nfs/dbraw/zinc/86/38/81/1061863881.db2.gz TUIVMICQMKRBAB-YZGWKJHDSA-N 2 1 310.485 4.128 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001474294755 1061863900 /nfs/dbraw/zinc/86/39/00/1061863900.db2.gz TUIVMICQMKRBAB-YZGWKJHDSA-N 2 1 310.485 4.128 20 0 DIADMP Cc1ccccc1C[N@H+](Cc1ccccc1)CC1CC[NH+](C)CC1 ZINC001474337404 1061934897 /nfs/dbraw/zinc/93/48/97/1061934897.db2.gz YSKUPBJHJULRIV-UHFFFAOYSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)CC1 ZINC001474362186 1061987139 /nfs/dbraw/zinc/98/71/39/1061987139.db2.gz LQTYTHKACCDYDM-NRFANRHFSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCC[C@@H](CCCc3ccccc3)C2)CC1 ZINC001474372819 1062016904 /nfs/dbraw/zinc/01/69/04/1062016904.db2.gz PWHRSDPHQTTXAE-HXUWFJFHSA-N 2 1 314.517 4.063 20 0 DIADMP CC(C)(C)C[N@H+](C1CCC(F)(F)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001254214313 1062051044 /nfs/dbraw/zinc/05/10/44/1062051044.db2.gz JWGGFAKGUDKURA-HDJSIYSDSA-N 2 1 302.453 4.182 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCc2ccccc2CC)CC1 ZINC001459317366 1062084122 /nfs/dbraw/zinc/08/41/22/1062084122.db2.gz IOAOMXXFCCYOND-UHFFFAOYSA-N 2 1 316.533 4.235 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)C2CCC3(CC3)CC2)CC1 ZINC001254438272 1062103745 /nfs/dbraw/zinc/10/37/45/1062103745.db2.gz UKZWQBJVYQYRQQ-IYARVYRRSA-N 2 1 304.522 4.471 20 0 DIADMP CC[C@H](C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC001474436105 1062112269 /nfs/dbraw/zinc/11/22/69/1062112269.db2.gz WCCKPJKMGVDPNZ-QWFCFKBJSA-N 2 1 314.517 4.423 20 0 DIADMP CC[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC001474436103 1062112409 /nfs/dbraw/zinc/11/24/09/1062112409.db2.gz WCCKPJKMGVDPNZ-NLWGTHIKSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442456 1062120932 /nfs/dbraw/zinc/12/09/32/1062120932.db2.gz NDCBSTVXBWJBCG-GZBFAFLISA-N 2 1 310.532 4.090 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCC[C@@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442456 1062120938 /nfs/dbraw/zinc/12/09/38/1062120938.db2.gz NDCBSTVXBWJBCG-GZBFAFLISA-N 2 1 310.532 4.090 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001474451800 1062129762 /nfs/dbraw/zinc/12/97/62/1062129762.db2.gz LDVAUYMZTZOOSJ-UYAOXDASSA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001474451800 1062129770 /nfs/dbraw/zinc/12/97/70/1062129770.db2.gz LDVAUYMZTZOOSJ-UYAOXDASSA-N 2 1 312.501 4.380 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001254494173 1062137589 /nfs/dbraw/zinc/13/75/89/1062137589.db2.gz KACZLDJZVJLYIP-FQEVSTJZSA-N 2 1 302.506 4.062 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001254497520 1062137866 /nfs/dbraw/zinc/13/78/66/1062137866.db2.gz DBKICWBMHBWBON-NRFANRHFSA-N 2 1 314.517 4.347 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+](C)C1CC[NH+](CC)CC1 ZINC001254494104 1062137945 /nfs/dbraw/zinc/13/79/45/1062137945.db2.gz IRGHIAQVGOIBMO-LJQANCHMSA-N 2 1 302.506 4.204 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](C)C1CC[NH+](CC)CC1 ZINC001254494104 1062137955 /nfs/dbraw/zinc/13/79/55/1062137955.db2.gz IRGHIAQVGOIBMO-LJQANCHMSA-N 2 1 302.506 4.204 20 0 DIADMP C[C@@H](N[C@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499334 1062141918 /nfs/dbraw/zinc/14/19/18/1062141918.db2.gz CYWXJPASGBQHIK-YPMHNXCESA-N 2 1 301.261 4.128 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499334 1062141924 /nfs/dbraw/zinc/14/19/24/1062141924.db2.gz CYWXJPASGBQHIK-YPMHNXCESA-N 2 1 301.261 4.128 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499334 1062141930 /nfs/dbraw/zinc/14/19/30/1062141930.db2.gz CYWXJPASGBQHIK-YPMHNXCESA-N 2 1 301.261 4.128 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001254498949 1062141961 /nfs/dbraw/zinc/14/19/61/1062141961.db2.gz USEPHCHYSPLXCE-FQEVSTJZSA-N 2 1 314.517 4.206 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC1 ZINC001254498376 1062142029 /nfs/dbraw/zinc/14/20/29/1062142029.db2.gz YFTDXPAFUCJCPI-LEWJYISDSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC1 ZINC001254498379 1062142112 /nfs/dbraw/zinc/14/21/12/1062142112.db2.gz YFTDXPAFUCJCPI-SFTDATJTSA-N 2 1 308.469 4.044 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH+]1CCC([N@@H+](C)CC)CC1 ZINC001254497975 1062143074 /nfs/dbraw/zinc/14/30/74/1062143074.db2.gz GHEWLJSSZSZWHK-HXUWFJFHSA-N 2 1 302.506 4.204 20 0 DIADMP C[C@H](N[C@@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499333 1062143226 /nfs/dbraw/zinc/14/32/26/1062143226.db2.gz CYWXJPASGBQHIK-WCQYABFASA-N 2 1 301.261 4.128 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499333 1062143243 /nfs/dbraw/zinc/14/32/43/1062143243.db2.gz CYWXJPASGBQHIK-WCQYABFASA-N 2 1 301.261 4.128 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499333 1062143257 /nfs/dbraw/zinc/14/32/57/1062143257.db2.gz CYWXJPASGBQHIK-WCQYABFASA-N 2 1 301.261 4.128 20 0 DIADMP CC(C)CC1([NH2+][C@H]2CCC[N@@H+](C)CC2)CCC(F)(F)CC1 ZINC001254510886 1062148656 /nfs/dbraw/zinc/14/86/56/1062148656.db2.gz QYORQLODZPYVLB-HNNXBMFYSA-N 2 1 302.453 4.055 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC1 ZINC001254507454 1062150160 /nfs/dbraw/zinc/15/01/60/1062150160.db2.gz CELUBNWCUGPNEY-VQIMIIECSA-N 2 1 304.453 4.131 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254515863 1062157144 /nfs/dbraw/zinc/15/71/44/1062157144.db2.gz FLTKPQJHVLDKMN-HXUWFJFHSA-N 2 1 308.469 4.192 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@@H]1CCC[N@H+](C)CC1 ZINC001254515863 1062157153 /nfs/dbraw/zinc/15/71/53/1062157153.db2.gz FLTKPQJHVLDKMN-HXUWFJFHSA-N 2 1 308.469 4.192 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@@H]1CCC[N@@H+](C)CC1 ZINC001254515863 1062157163 /nfs/dbraw/zinc/15/71/63/1062157163.db2.gz FLTKPQJHVLDKMN-HXUWFJFHSA-N 2 1 308.469 4.192 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC001254527432 1062160026 /nfs/dbraw/zinc/16/00/26/1062160026.db2.gz YHYJHHHAIIXWLQ-NRFANRHFSA-N 2 1 308.469 4.173 20 0 DIADMP CCCSC[C@H](C)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001474483875 1062164284 /nfs/dbraw/zinc/16/42/84/1062164284.db2.gz NGOPRGWPIHBGFZ-PKOBYXMFSA-N 2 1 320.546 4.020 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1cccc(CC2CCC2)c1 ZINC001474501319 1062180517 /nfs/dbraw/zinc/18/05/17/1062180517.db2.gz VUSCZYMOZVIQPC-UHFFFAOYSA-N 2 1 314.517 4.337 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1cc2ccc(C)cc2[nH]1 ZINC001474502178 1062183644 /nfs/dbraw/zinc/18/36/44/1062183644.db2.gz VKNFTUYLGLHHAN-UHFFFAOYSA-N 2 1 301.478 4.030 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1cc2ccc(C)cc2[nH]1 ZINC001474502178 1062183662 /nfs/dbraw/zinc/18/36/62/1062183662.db2.gz VKNFTUYLGLHHAN-UHFFFAOYSA-N 2 1 301.478 4.030 20 0 DIADMP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506046 1062187886 /nfs/dbraw/zinc/18/78/86/1062187886.db2.gz ZPBRPNKUARFRNG-SFTDATJTSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506046 1062187901 /nfs/dbraw/zinc/18/79/01/1062187901.db2.gz ZPBRPNKUARFRNG-SFTDATJTSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506046 1062187910 /nfs/dbraw/zinc/18/79/10/1062187910.db2.gz ZPBRPNKUARFRNG-SFTDATJTSA-N 2 1 312.501 4.260 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCC[NH+]1C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001459557232 1062209437 /nfs/dbraw/zinc/20/94/37/1062209437.db2.gz GBSHCMCSZGUPFB-VQTJNVASSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@@H+]1C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001459557232 1062209445 /nfs/dbraw/zinc/20/94/45/1062209445.db2.gz GBSHCMCSZGUPFB-VQTJNVASSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@H+]1C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001459557232 1062209458 /nfs/dbraw/zinc/20/94/58/1062209458.db2.gz GBSHCMCSZGUPFB-VQTJNVASSA-N 2 1 320.496 4.199 20 0 DIADMP Cc1cccc([C@@H]2CCCC[NH+]2CC[C@@H]2CCC[N@@H+]2C)c1C ZINC001459565681 1062214187 /nfs/dbraw/zinc/21/41/87/1062214187.db2.gz RYNORGDGACTJSQ-ICSRJNTNSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@@H]2CCCC[N@H+]2CC[C@@H]2CCC[NH+]2C)c1C ZINC001459565681 1062214209 /nfs/dbraw/zinc/21/42/09/1062214209.db2.gz RYNORGDGACTJSQ-ICSRJNTNSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@@H]2CCCC[N@@H+]2CC[C@@H]2CCC[NH+]2C)c1C ZINC001459565681 1062214233 /nfs/dbraw/zinc/21/42/33/1062214233.db2.gz RYNORGDGACTJSQ-ICSRJNTNSA-N 2 1 300.490 4.315 20 0 DIADMP CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2CCC[NH+](CC)CC)o1 ZINC001459567015 1062217357 /nfs/dbraw/zinc/21/73/57/1062217357.db2.gz AODWFLPFMQQHNJ-SJLPKXTDSA-N 2 1 306.494 4.347 20 0 DIADMP CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CCC[NH+](CC)CC)o1 ZINC001459567015 1062217373 /nfs/dbraw/zinc/21/73/73/1062217373.db2.gz AODWFLPFMQQHNJ-SJLPKXTDSA-N 2 1 306.494 4.347 20 0 DIADMP C[C@H]1CC(CC[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)C[C@H](C)C1 ZINC001459625540 1062260844 /nfs/dbraw/zinc/26/08/44/1062260844.db2.gz TVWVEUZDBHMPHB-HLIPFELVSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1CC(CC[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)C[C@H](C)C1 ZINC001459625540 1062260865 /nfs/dbraw/zinc/26/08/65/1062260865.db2.gz TVWVEUZDBHMPHB-HLIPFELVSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1CC(CC[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)C[C@H](C)C1 ZINC001459625540 1062260891 /nfs/dbraw/zinc/26/08/91/1062260891.db2.gz TVWVEUZDBHMPHB-HLIPFELVSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1CC(CC[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)C[C@H](C)C1 ZINC001459625549 1062261507 /nfs/dbraw/zinc/26/15/07/1062261507.db2.gz TVWVEUZDBHMPHB-MBOZVWFJSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1CC(CC[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)C[C@H](C)C1 ZINC001459625549 1062261529 /nfs/dbraw/zinc/26/15/29/1062261529.db2.gz TVWVEUZDBHMPHB-MBOZVWFJSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1CC(CC[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)C[C@H](C)C1 ZINC001459625549 1062261552 /nfs/dbraw/zinc/26/15/52/1062261552.db2.gz TVWVEUZDBHMPHB-MBOZVWFJSA-N 2 1 306.538 4.113 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@@H]3C[C@@H]4CCC[C@H]34)C2)cc1 ZINC001474565021 1062268165 /nfs/dbraw/zinc/26/81/65/1062268165.db2.gz PHTJEFQBNCLJPU-IVAOSVALSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@H]([NH3+])c1cn([C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001255109308 1062319491 /nfs/dbraw/zinc/31/94/91/1062319491.db2.gz QMPLAOITDBNEKD-FUHWJXTLSA-N 2 1 319.452 4.108 20 0 DIADMP C[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129899 1062320211 /nfs/dbraw/zinc/32/02/11/1062320211.db2.gz NCWAYSYTEHBHBI-MVJPYGJCSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129899 1062320234 /nfs/dbraw/zinc/32/02/34/1062320234.db2.gz NCWAYSYTEHBHBI-MVJPYGJCSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129899 1062320250 /nfs/dbraw/zinc/32/02/50/1062320250.db2.gz NCWAYSYTEHBHBI-MVJPYGJCSA-N 2 1 310.441 4.126 20 0 DIADMP F[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255122215 1062321484 /nfs/dbraw/zinc/32/14/84/1062321484.db2.gz MWYMWCVOXLVURE-YCKXBTPASA-N 2 1 316.464 4.052 20 0 DIADMP F[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255135939 1062325966 /nfs/dbraw/zinc/32/59/66/1062325966.db2.gz GJDTXFAFEDUFJQ-ZRNYENFQSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255135939 1062325987 /nfs/dbraw/zinc/32/59/87/1062325987.db2.gz GJDTXFAFEDUFJQ-ZRNYENFQSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255135939 1062326010 /nfs/dbraw/zinc/32/60/10/1062326010.db2.gz GJDTXFAFEDUFJQ-ZRNYENFQSA-N 2 1 316.464 4.006 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2CCCC24CCC4)C3)cc1 ZINC001255134828 1062326135 /nfs/dbraw/zinc/32/61/35/1062326135.db2.gz CZFOBHGPUCRIBJ-PLACYPQZSA-N 2 1 324.512 4.494 20 0 DIADMP CCC1CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255137017 1062329152 /nfs/dbraw/zinc/32/91/52/1062329152.db2.gz ORZRFMZIXQVPQS-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[N@@H+](C1CCCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255137539 1062331182 /nfs/dbraw/zinc/33/11/82/1062331182.db2.gz UCZPVXNSBLPMLQ-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255137539 1062331209 /nfs/dbraw/zinc/33/12/09/1062331209.db2.gz UCZPVXNSBLPMLQ-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCCC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255137539 1062331233 /nfs/dbraw/zinc/33/12/33/1062331233.db2.gz UCZPVXNSBLPMLQ-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2C[C@@H]4CCCC[C@@H]4C2)C3)cc1 ZINC001255135345 1062332428 /nfs/dbraw/zinc/33/24/28/1062332428.db2.gz AEULEPCFIPSFTJ-YUBLJMCLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+]2C[C@@H]4CCCC[C@@H]4C2)C3)cc1 ZINC001255135345 1062332451 /nfs/dbraw/zinc/33/24/51/1062332451.db2.gz AEULEPCFIPSFTJ-YUBLJMCLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+]2C[C@@H]4CCCC[C@@H]4C2)C3)cc1 ZINC001255135345 1062332473 /nfs/dbraw/zinc/33/24/73/1062332473.db2.gz AEULEPCFIPSFTJ-YUBLJMCLSA-N 2 1 324.512 4.304 20 0 DIADMP C[C@@H]1C[C@@H](C)C[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146431 1062333135 /nfs/dbraw/zinc/33/31/35/1062333135.db2.gz GPFKHWBXLKYUEM-LPOYBJAFSA-N 2 1 312.501 4.160 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255146058 1062334749 /nfs/dbraw/zinc/33/47/49/1062334749.db2.gz BRKKPKJLIRUSAT-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255146058 1062334769 /nfs/dbraw/zinc/33/47/69/1062334769.db2.gz BRKKPKJLIRUSAT-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146058 1062334790 /nfs/dbraw/zinc/33/47/90/1062334790.db2.gz BRKKPKJLIRUSAT-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001255142573 1062335977 /nfs/dbraw/zinc/33/59/77/1062335977.db2.gz DTORGCPJPWDLDQ-ZHLPAPNQSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001255142573 1062335998 /nfs/dbraw/zinc/33/59/98/1062335998.db2.gz DTORGCPJPWDLDQ-ZHLPAPNQSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+]2CC4CCC2CC4)C3)cc1 ZINC001255142573 1062336018 /nfs/dbraw/zinc/33/60/18/1062336018.db2.gz DTORGCPJPWDLDQ-ZHLPAPNQSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+]2CC4CCC2CC4)C3)cc1 ZINC001255142573 1062336040 /nfs/dbraw/zinc/33/60/40/1062336040.db2.gz DTORGCPJPWDLDQ-ZHLPAPNQSA-N 2 1 310.485 4.056 20 0 DIADMP CC(C)[C@H]1CCC[N@@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145332 1062336777 /nfs/dbraw/zinc/33/67/77/1062336777.db2.gz AXDTXEZYJOFRPM-PLACYPQZSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145332 1062336799 /nfs/dbraw/zinc/33/67/99/1062336799.db2.gz AXDTXEZYJOFRPM-PLACYPQZSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145332 1062336822 /nfs/dbraw/zinc/33/68/22/1062336822.db2.gz AXDTXEZYJOFRPM-PLACYPQZSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145332 1062336842 /nfs/dbraw/zinc/33/68/42/1062336842.db2.gz AXDTXEZYJOFRPM-PLACYPQZSA-N 2 1 312.501 4.302 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@H]4CCC[C@H]42)C3)cc1 ZINC001255143297 1062337323 /nfs/dbraw/zinc/33/73/23/1062337323.db2.gz JRNUMWFLILLAMT-LXHROKJGSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@H]4CCC[C@H]42)C3)cc1 ZINC001255143297 1062337346 /nfs/dbraw/zinc/33/73/46/1062337346.db2.gz JRNUMWFLILLAMT-LXHROKJGSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCC[C@H]4CCC[C@H]42)C3)cc1 ZINC001255143297 1062337367 /nfs/dbraw/zinc/33/73/67/1062337367.db2.gz JRNUMWFLILLAMT-LXHROKJGSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCC[C@H]4CCC[C@H]42)C3)cc1 ZINC001255143297 1062337390 /nfs/dbraw/zinc/33/73/90/1062337390.db2.gz JRNUMWFLILLAMT-LXHROKJGSA-N 2 1 324.512 4.447 20 0 DIADMP CC(C)[N@H+](CC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145692 1062337458 /nfs/dbraw/zinc/33/74/58/1062337458.db2.gz SFDGCTJVICFKPH-WKCHPHFGSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145692 1062337475 /nfs/dbraw/zinc/33/74/75/1062337475.db2.gz SFDGCTJVICFKPH-WKCHPHFGSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145692 1062337491 /nfs/dbraw/zinc/33/74/91/1062337491.db2.gz SFDGCTJVICFKPH-WKCHPHFGSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145692 1062337508 /nfs/dbraw/zinc/33/75/08/1062337508.db2.gz SFDGCTJVICFKPH-WKCHPHFGSA-N 2 1 312.501 4.302 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146326 1062339647 /nfs/dbraw/zinc/33/96/47/1062339647.db2.gz FRJWUJQDIUQWSO-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146326 1062339670 /nfs/dbraw/zinc/33/96/70/1062339670.db2.gz FRJWUJQDIUQWSO-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146326 1062339693 /nfs/dbraw/zinc/33/96/93/1062339693.db2.gz FRJWUJQDIUQWSO-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146326 1062339721 /nfs/dbraw/zinc/33/97/21/1062339721.db2.gz FRJWUJQDIUQWSO-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP CCC(CC)[N@@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146386 1062340339 /nfs/dbraw/zinc/34/03/39/1062340339.db2.gz FYJQYFZGAJHTET-PMOLBWCYSA-N 2 1 300.490 4.302 20 0 DIADMP CCC(CC)[NH+](C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146386 1062340367 /nfs/dbraw/zinc/34/03/67/1062340367.db2.gz FYJQYFZGAJHTET-PMOLBWCYSA-N 2 1 300.490 4.302 20 0 DIADMP CCC(CC)[NH+](C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146386 1062340388 /nfs/dbraw/zinc/34/03/88/1062340388.db2.gz FYJQYFZGAJHTET-PMOLBWCYSA-N 2 1 300.490 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CC4CCC(CC4)C2)C3)cc1 ZINC001255147094 1062342676 /nfs/dbraw/zinc/34/26/76/1062342676.db2.gz LTTNFLBXWONGCE-UMOULQGESA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+](CC2CC2)C2CC2)C3)cc1 ZINC001255151089 1062343872 /nfs/dbraw/zinc/34/38/72/1062343872.db2.gz SGRAZKYDBOVFGP-WKCHPHFGSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+](CC2CC2)C2CC2)C3)cc1 ZINC001255151089 1062343901 /nfs/dbraw/zinc/34/39/01/1062343901.db2.gz SGRAZKYDBOVFGP-WKCHPHFGSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001255151089 1062343927 /nfs/dbraw/zinc/34/39/27/1062343927.db2.gz SGRAZKYDBOVFGP-WKCHPHFGSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001255151089 1062343953 /nfs/dbraw/zinc/34/39/53/1062343953.db2.gz SGRAZKYDBOVFGP-WKCHPHFGSA-N 2 1 310.485 4.056 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001474644814 1062372065 /nfs/dbraw/zinc/37/20/65/1062372065.db2.gz CAHVDHJYFCKHGK-SFTDATJTSA-N 2 1 314.517 4.109 20 0 DIADMP CCCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255310592 1062390908 /nfs/dbraw/zinc/39/09/08/1062390908.db2.gz ZGBZIHWIUMIMBD-FFGOWVMKSA-N 2 1 300.490 4.350 20 0 DIADMP CCCC[C@H](C)[NH2+][C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1[NH3+] ZINC001255315109 1062392281 /nfs/dbraw/zinc/39/22/81/1062392281.db2.gz CPMCKGQUBDTMMH-VMHNJKNPSA-N 2 1 320.480 4.142 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001474670576 1062403139 /nfs/dbraw/zinc/40/31/39/1062403139.db2.gz HLUUJHAAYUNQLR-GHTZIAJQSA-N 2 1 314.517 4.394 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001474670576 1062403150 /nfs/dbraw/zinc/40/31/50/1062403150.db2.gz HLUUJHAAYUNQLR-GHTZIAJQSA-N 2 1 314.517 4.394 20 0 DIADMP CCCC[C@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001255333079 1062406192 /nfs/dbraw/zinc/40/61/92/1062406192.db2.gz UKMNQBAIOXYMEG-KRWDZBQOSA-N 2 1 300.490 4.088 20 0 DIADMP CCCC[C@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001255333079 1062406203 /nfs/dbraw/zinc/40/62/03/1062406203.db2.gz UKMNQBAIOXYMEG-KRWDZBQOSA-N 2 1 300.490 4.088 20 0 DIADMP CCCC[C@H](C)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001255329032 1062406958 /nfs/dbraw/zinc/40/69/58/1062406958.db2.gz HCTQNIIJOAODSP-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001255329032 1062406972 /nfs/dbraw/zinc/40/69/72/1062406972.db2.gz HCTQNIIJOAODSP-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001255329032 1062406987 /nfs/dbraw/zinc/40/69/87/1062406987.db2.gz HCTQNIIJOAODSP-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c(C)c1 ZINC001255383416 1062421881 /nfs/dbraw/zinc/42/18/81/1062421881.db2.gz JBTXTCSETUPQHK-JOCHJYFZSA-N 2 1 322.496 4.448 20 0 DIADMP Cc1ccc(C)c(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255381962 1062424070 /nfs/dbraw/zinc/42/40/70/1062424070.db2.gz ADUQGZYLRCMKSC-JOCHJYFZSA-N 2 1 322.496 4.448 20 0 DIADMP Cc1ccsc1C[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255382189 1062425254 /nfs/dbraw/zinc/42/52/54/1062425254.db2.gz SSKDJEJITGXNEO-SFHVURJKSA-N 2 1 314.498 4.201 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255388805 1062426971 /nfs/dbraw/zinc/42/69/71/1062426971.db2.gz IBJOWMPGCBDDNO-DFQSSKMNSA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386201 1062428492 /nfs/dbraw/zinc/42/84/92/1062428492.db2.gz KYSUKBNKCKLCRT-AZUAARDMSA-N 2 1 302.506 4.455 20 0 DIADMP CC(C)C([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)C(C)C ZINC001255390513 1062429478 /nfs/dbraw/zinc/42/94/78/1062429478.db2.gz CDRYOKLBZCMMHS-LJQANCHMSA-N 2 1 302.506 4.311 20 0 DIADMP Cc1cccc(C[N@H+](C)[C@@H]2CCC[NH+](Cc3ccccc3)CC2)c1 ZINC001255397819 1062432713 /nfs/dbraw/zinc/43/27/13/1062432713.db2.gz HMRVSQCWIQYNCJ-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1cccc(C[NH+](C)[C@@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255397819 1062432726 /nfs/dbraw/zinc/43/27/26/1062432726.db2.gz HMRVSQCWIQYNCJ-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1cccc(C[NH+](C)[C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255397819 1062432737 /nfs/dbraw/zinc/43/27/37/1062432737.db2.gz HMRVSQCWIQYNCJ-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP FC1(F)CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255397890 1062433531 /nfs/dbraw/zinc/43/35/31/1062433531.db2.gz IDHPDUKENWYKRA-SFHVURJKSA-N 2 1 322.443 4.162 20 0 DIADMP FC1(F)CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255397890 1062433535 /nfs/dbraw/zinc/43/35/35/1062433535.db2.gz IDHPDUKENWYKRA-SFHVURJKSA-N 2 1 322.443 4.162 20 0 DIADMP FC1(F)CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255397890 1062433542 /nfs/dbraw/zinc/43/35/42/1062433542.db2.gz IDHPDUKENWYKRA-SFHVURJKSA-N 2 1 322.443 4.162 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC4(C3)CCCCC4)CC2)cc1 ZINC001255408308 1062438779 /nfs/dbraw/zinc/43/87/79/1062438779.db2.gz KCWPJRVCOYZBLV-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407260 1062441454 /nfs/dbraw/zinc/44/14/54/1062441454.db2.gz YAVQOTCUWUDTRY-PMACEKPBSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255407260 1062441466 /nfs/dbraw/zinc/44/14/66/1062441466.db2.gz YAVQOTCUWUDTRY-PMACEKPBSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255407260 1062441478 /nfs/dbraw/zinc/44/14/78/1062441478.db2.gz YAVQOTCUWUDTRY-PMACEKPBSA-N 2 1 300.490 4.306 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255405053 1062441578 /nfs/dbraw/zinc/44/15/78/1062441578.db2.gz VSOKGNXIWYJGPM-GOSISDBHSA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255405053 1062441585 /nfs/dbraw/zinc/44/15/85/1062441585.db2.gz VSOKGNXIWYJGPM-GOSISDBHSA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255405053 1062441594 /nfs/dbraw/zinc/44/15/94/1062441594.db2.gz VSOKGNXIWYJGPM-GOSISDBHSA-N 2 1 314.498 4.235 20 0 DIADMP C[C@H]1CCCCC[N@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255402658 1062442592 /nfs/dbraw/zinc/44/25/92/1062442592.db2.gz LEGNVBHUQAOBOP-ICSRJNTNSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255402658 1062442601 /nfs/dbraw/zinc/44/26/01/1062442601.db2.gz LEGNVBHUQAOBOP-ICSRJNTNSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255402658 1062442615 /nfs/dbraw/zinc/44/26/15/1062442615.db2.gz LEGNVBHUQAOBOP-ICSRJNTNSA-N 2 1 300.490 4.306 20 0 DIADMP CC(C)C1CC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255408145 1062443060 /nfs/dbraw/zinc/44/30/60/1062443060.db2.gz IRAHGNSQQGCUAE-NRFANRHFSA-N 2 1 314.517 4.409 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255409931 1062446167 /nfs/dbraw/zinc/44/61/67/1062446167.db2.gz NNIPMANREZKEGL-HXUWFJFHSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](CC(C)C)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255409931 1062446177 /nfs/dbraw/zinc/44/61/77/1062446177.db2.gz NNIPMANREZKEGL-HXUWFJFHSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](CC(C)C)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255409931 1062446186 /nfs/dbraw/zinc/44/61/86/1062446186.db2.gz NNIPMANREZKEGL-HXUWFJFHSA-N 2 1 302.506 4.409 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC4(CCC4)C3)CC2)cc1 ZINC001255410261 1062446338 /nfs/dbraw/zinc/44/63/38/1062446338.db2.gz SIZSINHOYKBIGG-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@@H+]3CCCC4(CCC4)C3)CC2)cc1 ZINC001255410261 1062446344 /nfs/dbraw/zinc/44/63/44/1062446344.db2.gz SIZSINHOYKBIGG-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@H+]3CCCC4(CCC4)C3)CC2)cc1 ZINC001255410261 1062446350 /nfs/dbraw/zinc/44/63/50/1062446350.db2.gz SIZSINHOYKBIGG-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP Cc1cccnc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC001474747386 1062463072 /nfs/dbraw/zinc/46/30/72/1062463072.db2.gz BQMQKTDZVOKMOT-HHXXYDBFSA-N 2 1 315.505 4.084 20 0 DIADMP [NH3+]CCC[N@@H+](C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC001255506878 1062465082 /nfs/dbraw/zinc/46/50/82/1062465082.db2.gz INGNOBOFEYGCFW-UHFFFAOYSA-N 2 1 306.416 4.091 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)[C@@H]2CCc3c2cccc3F)cc1 ZINC001459878861 1062466370 /nfs/dbraw/zinc/46/63/70/1062466370.db2.gz SIODHDJUVGDHKU-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)C2CCC(C(F)(F)F)CC2)CC1 ZINC001255511164 1062466805 /nfs/dbraw/zinc/46/68/05/1062466805.db2.gz VLFWTQBHPSYVFN-DHAXNPMCSA-N 2 1 318.427 4.089 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1Cl ZINC001255670131 1062509904 /nfs/dbraw/zinc/50/99/04/1062509904.db2.gz PHVUBAFBWNQMJY-LNRIEFBSSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ccc1Cl ZINC001255670131 1062509925 /nfs/dbraw/zinc/50/99/25/1062509925.db2.gz PHVUBAFBWNQMJY-LNRIEFBSSA-N 2 1 306.881 4.314 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001255670717 1062510416 /nfs/dbraw/zinc/51/04/16/1062510416.db2.gz YUDQZSSMPFKWRF-IHBAFOEMSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001255670717 1062510441 /nfs/dbraw/zinc/51/04/41/1062510441.db2.gz YUDQZSSMPFKWRF-IHBAFOEMSA-N 2 1 304.453 4.128 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C)c1C ZINC001255676441 1062511456 /nfs/dbraw/zinc/51/14/56/1062511456.db2.gz MTWQFCQNIOTTTG-AQDPXUSMSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1C ZINC001255676441 1062511476 /nfs/dbraw/zinc/51/14/76/1062511476.db2.gz MTWQFCQNIOTTTG-AQDPXUSMSA-N 2 1 300.490 4.359 20 0 DIADMP Cc1cc(Cl)ccc1[C@@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255671359 1062512571 /nfs/dbraw/zinc/51/25/71/1062512571.db2.gz KTIYZENOISBWBO-HZTRTUMWSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1cc(Cl)ccc1[C@@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255671359 1062512595 /nfs/dbraw/zinc/51/25/95/1062512595.db2.gz KTIYZENOISBWBO-HZTRTUMWSA-N 2 1 306.881 4.314 20 0 DIADMP CC[N@H+](Cc1ccc(Cl)cc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255681094 1062515039 /nfs/dbraw/zinc/51/50/39/1062515039.db2.gz LQRMDNUAKBKHAE-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255681094 1062515060 /nfs/dbraw/zinc/51/50/60/1062515060.db2.gz LQRMDNUAKBKHAE-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1ccc(Cl)cc1)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255681094 1062515084 /nfs/dbraw/zinc/51/50/84/1062515084.db2.gz LQRMDNUAKBKHAE-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1ccc(Cl)cc1)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255681094 1062515101 /nfs/dbraw/zinc/51/51/01/1062515101.db2.gz LQRMDNUAKBKHAE-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP CC[N@H+](Cc1cccc(Cl)c1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255682855 1062515411 /nfs/dbraw/zinc/51/54/11/1062515411.db2.gz MOTHFSNSQQCFLG-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255682855 1062515430 /nfs/dbraw/zinc/51/54/30/1062515430.db2.gz MOTHFSNSQQCFLG-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1cccc(Cl)c1)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255682855 1062515451 /nfs/dbraw/zinc/51/54/51/1062515451.db2.gz MOTHFSNSQQCFLG-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1cccc(Cl)c1)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255682855 1062515473 /nfs/dbraw/zinc/51/54/73/1062515473.db2.gz MOTHFSNSQQCFLG-JWTNVVGKSA-N 2 1 306.881 4.177 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[NH+]2C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001255683763 1062515786 /nfs/dbraw/zinc/51/57/86/1062515786.db2.gz UPOBFHDZRZAJQJ-JKWVGCSGSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[NH+]2C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001255683763 1062515797 /nfs/dbraw/zinc/51/57/97/1062515797.db2.gz UPOBFHDZRZAJQJ-JKWVGCSGSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2C2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001255683763 1062515815 /nfs/dbraw/zinc/51/58/15/1062515815.db2.gz UPOBFHDZRZAJQJ-JKWVGCSGSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2C2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001255683763 1062515833 /nfs/dbraw/zinc/51/58/33/1062515833.db2.gz UPOBFHDZRZAJQJ-JKWVGCSGSA-N 2 1 312.501 4.456 20 0 DIADMP FC(F)(F)[C@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001255696736 1062523985 /nfs/dbraw/zinc/52/39/85/1062523985.db2.gz HUXKJJCVSZVIBI-RRFJBIMHSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001255696736 1062524008 /nfs/dbraw/zinc/52/40/08/1062524008.db2.gz HUXKJJCVSZVIBI-RRFJBIMHSA-N 2 1 318.427 4.104 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255701212 1062526820 /nfs/dbraw/zinc/52/68/20/1062526820.db2.gz SJKXSHMKAMPQSI-DARAHFNDSA-N 2 1 318.427 4.232 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255702083 1062528377 /nfs/dbraw/zinc/52/83/77/1062528377.db2.gz XEZLCHRFMMDGQC-FPCVCCKLSA-N 2 1 318.427 4.089 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCC2CCCCCC2)[C@@H](C)C1 ZINC001459989650 1062550265 /nfs/dbraw/zinc/55/02/65/1062550265.db2.gz WFINOYKCQPLSCH-ICSRJNTNSA-N 2 1 324.553 4.074 20 0 DIADMP CCCC[N@@H+](C)CCC[NH2+][C@H](C)CSc1ccc(F)cc1 ZINC001255731374 1062554071 /nfs/dbraw/zinc/55/40/71/1062554071.db2.gz KSOMMZVLDKUBAE-OAHLLOKOSA-N 2 1 312.498 4.018 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)CSc2ccc(F)cc2)[C@@H](C)C1 ZINC001255737448 1062559237 /nfs/dbraw/zinc/55/92/37/1062559237.db2.gz ICQVTYMHUZDDGX-DAYGRLMNSA-N 2 1 324.509 4.015 20 0 DIADMP C[C@H](CSc1ccc(F)cc1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001255737560 1062560664 /nfs/dbraw/zinc/56/06/64/1062560664.db2.gz IULVZWQRDRNHMK-HZPDHXFCSA-N 2 1 324.509 4.147 20 0 DIADMP Cc1ccc(C[C@H](C)[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001255793632 1062607696 /nfs/dbraw/zinc/60/76/96/1062607696.db2.gz NSMOFWHAGZLMDA-FPOVZHCZSA-N 2 1 314.517 4.266 20 0 DIADMP C[N@H+]1CCC[C@H]1CCN1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100889 1062637064 /nfs/dbraw/zinc/63/70/64/1062637064.db2.gz XTFCYUHENVAQAW-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100889 1062637076 /nfs/dbraw/zinc/63/70/76/1062637076.db2.gz XTFCYUHENVAQAW-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100889 1062637085 /nfs/dbraw/zinc/63/70/85/1062637085.db2.gz XTFCYUHENVAQAW-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100889 1062637099 /nfs/dbraw/zinc/63/70/99/1062637099.db2.gz XTFCYUHENVAQAW-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100889 1062637109 /nfs/dbraw/zinc/63/71/09/1062637109.db2.gz XTFCYUHENVAQAW-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001255872368 1062647451 /nfs/dbraw/zinc/64/74/51/1062647451.db2.gz IIQJPGWVBFTBGY-PXNSSMCTSA-N 2 1 318.480 4.097 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(F)cc1C(F)(F)F ZINC001255943645 1062665334 /nfs/dbraw/zinc/66/53/34/1062665334.db2.gz PIQPPMOODVKZNO-LBPRGKRZSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](CC1CC1)c1ccccc1F ZINC001255952651 1062668736 /nfs/dbraw/zinc/66/87/36/1062668736.db2.gz GGNPNTBBGXCYHX-DNVCBOLYSA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC001255948963 1062669626 /nfs/dbraw/zinc/66/96/26/1062669626.db2.gz SKLVCZKUCDXTIJ-KBPBESRZSA-N 2 1 316.411 4.476 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001255967839 1062674472 /nfs/dbraw/zinc/67/44/72/1062674472.db2.gz TZMHKIUKGWELTB-NVXWUHKLSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001255963702 1062674948 /nfs/dbraw/zinc/67/49/48/1062674948.db2.gz JQOZVOHWMCPUDH-JKSUJKDBSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001255963702 1062674962 /nfs/dbraw/zinc/67/49/62/1062674962.db2.gz JQOZVOHWMCPUDH-JKSUJKDBSA-N 2 1 308.897 4.250 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)C1 ZINC001256106891 1062703025 /nfs/dbraw/zinc/70/30/25/1062703025.db2.gz LUEKXFJCVWUAQA-YZGWKJHDSA-N 2 1 300.490 4.034 20 0 DIADMP c1[nH+]cn([C@H]2CCC[C@H](c3ccccc3)C2)c1C1CC[NH2+]CC1 ZINC001256121267 1062719278 /nfs/dbraw/zinc/71/92/78/1062719278.db2.gz OMMMRUPQWUMHST-OALUTQOASA-N 2 1 309.457 4.249 20 0 DIADMP C[NH+]1CCC([NH2+]CCc2ccc(/C=C/c3ccccc3)cc2)CC1 ZINC001256202273 1062745092 /nfs/dbraw/zinc/74/50/92/1062745092.db2.gz UCKHZFNKUJLBMD-BQYQJAHWSA-N 2 1 320.480 4.083 20 0 DIADMP C[NH+]1CCC([NH+]2CCC(c3ccc4ccccc4c3)CC2)CC1 ZINC001256207165 1062748265 /nfs/dbraw/zinc/74/82/65/1062748265.db2.gz APBQLGHZAOVXIS-UHFFFAOYSA-N 2 1 308.469 4.113 20 0 DIADMP CCOC1CCC([N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001256448123 1062827995 /nfs/dbraw/zinc/82/79/95/1062827995.db2.gz TXGMQCXKSPENOV-UHFFFAOYSA-N 2 1 322.537 4.063 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(F)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256524413 1062849248 /nfs/dbraw/zinc/84/92/48/1062849248.db2.gz UILHUWPADYFNGI-PKOBYXMFSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(F)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256524413 1062849274 /nfs/dbraw/zinc/84/92/74/1062849274.db2.gz UILHUWPADYFNGI-PKOBYXMFSA-N 2 1 318.480 4.302 20 0 DIADMP Cc1cccc2c1C[NH+]([C@H]1CC[N@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536791 1062855881 /nfs/dbraw/zinc/85/58/81/1062855881.db2.gz FWKVWUZLUCQKRO-RXVVDRJESA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[NH+]([C@H]1CC[N@@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536791 1062855903 /nfs/dbraw/zinc/85/59/03/1062855903.db2.gz FWKVWUZLUCQKRO-RXVVDRJESA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@H]1CC[NH+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536791 1062855930 /nfs/dbraw/zinc/85/59/30/1062855930.db2.gz FWKVWUZLUCQKRO-RXVVDRJESA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@H]1CC[NH+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536791 1062855954 /nfs/dbraw/zinc/85/59/54/1062855954.db2.gz FWKVWUZLUCQKRO-RXVVDRJESA-N 2 1 320.480 4.364 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256535848 1062857031 /nfs/dbraw/zinc/85/70/31/1062857031.db2.gz DWKYBXHZHOQGAT-PGRDOPGGSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535848 1062857057 /nfs/dbraw/zinc/85/70/57/1062857057.db2.gz DWKYBXHZHOQGAT-PGRDOPGGSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535848 1062857077 /nfs/dbraw/zinc/85/70/77/1062857077.db2.gz DWKYBXHZHOQGAT-PGRDOPGGSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535848 1062857102 /nfs/dbraw/zinc/85/71/02/1062857102.db2.gz DWKYBXHZHOQGAT-PGRDOPGGSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256535850 1062858001 /nfs/dbraw/zinc/85/80/01/1062858001.db2.gz DWKYBXHZHOQGAT-XMSQKQJNSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535850 1062858020 /nfs/dbraw/zinc/85/80/20/1062858020.db2.gz DWKYBXHZHOQGAT-XMSQKQJNSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535850 1062858045 /nfs/dbraw/zinc/85/80/45/1062858045.db2.gz DWKYBXHZHOQGAT-XMSQKQJNSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535850 1062858061 /nfs/dbraw/zinc/85/80/61/1062858061.db2.gz DWKYBXHZHOQGAT-XMSQKQJNSA-N 2 1 320.480 4.098 20 0 DIADMP CCC[N@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256537813 1062859329 /nfs/dbraw/zinc/85/93/29/1062859329.db2.gz OTVCENOWPGIFTL-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256537813 1062859351 /nfs/dbraw/zinc/85/93/51/1062859351.db2.gz OTVCENOWPGIFTL-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256537813 1062859377 /nfs/dbraw/zinc/85/93/77/1062859377.db2.gz OTVCENOWPGIFTL-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256537813 1062859394 /nfs/dbraw/zinc/85/93/94/1062859394.db2.gz OTVCENOWPGIFTL-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256537870 1062859475 /nfs/dbraw/zinc/85/94/75/1062859475.db2.gz QPFYNKISZXUECQ-FXAWDEMLSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256537870 1062859492 /nfs/dbraw/zinc/85/94/92/1062859492.db2.gz QPFYNKISZXUECQ-FXAWDEMLSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC3(CCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256542946 1062860067 /nfs/dbraw/zinc/86/00/67/1062860067.db2.gz RHMHJROQOYYMQB-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(F)(F)[C@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256541167 1062860319 /nfs/dbraw/zinc/86/03/19/1062860319.db2.gz LEQYZYFHBWFZHQ-JFIYKMOQSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(F)(F)[C@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256541167 1062860330 /nfs/dbraw/zinc/86/03/30/1062860330.db2.gz LEQYZYFHBWFZHQ-JFIYKMOQSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC(F)(F)[C@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541167 1062860352 /nfs/dbraw/zinc/86/03/52/1062860352.db2.gz LEQYZYFHBWFZHQ-JFIYKMOQSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC(F)(F)[C@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541167 1062860377 /nfs/dbraw/zinc/86/03/77/1062860377.db2.gz LEQYZYFHBWFZHQ-JFIYKMOQSA-N 2 1 322.443 4.017 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256554137 1062873097 /nfs/dbraw/zinc/87/30/97/1062873097.db2.gz NTXSPXCRYBWPAC-RLLQIKCJSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256554137 1062873117 /nfs/dbraw/zinc/87/31/17/1062873117.db2.gz NTXSPXCRYBWPAC-RLLQIKCJSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256554137 1062873136 /nfs/dbraw/zinc/87/31/36/1062873136.db2.gz NTXSPXCRYBWPAC-RLLQIKCJSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256554137 1062873154 /nfs/dbraw/zinc/87/31/54/1062873154.db2.gz NTXSPXCRYBWPAC-RLLQIKCJSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552393 1062873831 /nfs/dbraw/zinc/87/38/31/1062873831.db2.gz BWRGMXXNPFBFTL-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552393 1062873858 /nfs/dbraw/zinc/87/38/58/1062873858.db2.gz BWRGMXXNPFBFTL-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552393 1062873879 /nfs/dbraw/zinc/87/38/79/1062873879.db2.gz BWRGMXXNPFBFTL-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552393 1062873911 /nfs/dbraw/zinc/87/39/11/1062873911.db2.gz BWRGMXXNPFBFTL-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256552570 1062877050 /nfs/dbraw/zinc/87/70/50/1062877050.db2.gz COVOKMUQVSQGFB-CRAIPNDOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256552570 1062877065 /nfs/dbraw/zinc/87/70/65/1062877065.db2.gz COVOKMUQVSQGFB-CRAIPNDOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CC3(C2)CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256553994 1062878100 /nfs/dbraw/zinc/87/81/00/1062878100.db2.gz MYZHTRJUKJNYGK-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CC3(C2)CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256553994 1062878125 /nfs/dbraw/zinc/87/81/25/1062878125.db2.gz MYZHTRJUKJNYGK-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556316 1062881292 /nfs/dbraw/zinc/88/12/92/1062881292.db2.gz YSTUBSQZZKETHA-HLNWXESRSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556316 1062881314 /nfs/dbraw/zinc/88/13/14/1062881314.db2.gz YSTUBSQZZKETHA-HLNWXESRSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556316 1062881331 /nfs/dbraw/zinc/88/13/31/1062881331.db2.gz YSTUBSQZZKETHA-HLNWXESRSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556316 1062881349 /nfs/dbraw/zinc/88/13/49/1062881349.db2.gz YSTUBSQZZKETHA-HLNWXESRSA-N 2 1 300.490 4.017 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256559842 1062881811 /nfs/dbraw/zinc/88/18/11/1062881811.db2.gz NTXSPXCRYBWPAC-HOJAQTOUSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256559842 1062881823 /nfs/dbraw/zinc/88/18/23/1062881823.db2.gz NTXSPXCRYBWPAC-HOJAQTOUSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256559842 1062881831 /nfs/dbraw/zinc/88/18/31/1062881831.db2.gz NTXSPXCRYBWPAC-HOJAQTOUSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256559842 1062881850 /nfs/dbraw/zinc/88/18/50/1062881850.db2.gz NTXSPXCRYBWPAC-HOJAQTOUSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556314 1062884572 /nfs/dbraw/zinc/88/45/72/1062884572.db2.gz YSTUBSQZZKETHA-DMUMMCEESA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556314 1062884591 /nfs/dbraw/zinc/88/45/91/1062884591.db2.gz YSTUBSQZZKETHA-DMUMMCEESA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556314 1062884614 /nfs/dbraw/zinc/88/46/14/1062884614.db2.gz YSTUBSQZZKETHA-DMUMMCEESA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256556314 1062884638 /nfs/dbraw/zinc/88/46/38/1062884638.db2.gz YSTUBSQZZKETHA-DMUMMCEESA-N 2 1 300.490 4.017 20 0 DIADMP CCC[N@H+](CC(C)C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256556768 1062886100 /nfs/dbraw/zinc/88/61/00/1062886100.db2.gz GOGRIMFGWIJFDF-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256556768 1062886118 /nfs/dbraw/zinc/88/61/18/1062886118.db2.gz GOGRIMFGWIJFDF-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CCC[NH+](CC(C)C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256556768 1062886133 /nfs/dbraw/zinc/88/61/33/1062886133.db2.gz GOGRIMFGWIJFDF-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CCC[NH+](CC(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256556768 1062886152 /nfs/dbraw/zinc/88/61/52/1062886152.db2.gz GOGRIMFGWIJFDF-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCCc3c(F)cc(F)cc32)CC1 ZINC001256567563 1062891313 /nfs/dbraw/zinc/89/13/13/1062891313.db2.gz WEDDNMPHMAJGBA-SFHVURJKSA-N 2 1 322.443 4.195 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH+]2CCC(c3ccccc3F)CC2)CC1 ZINC001256571822 1062893385 /nfs/dbraw/zinc/89/33/85/1062893385.db2.gz LCUGLAQXFZKWSE-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2C2CC[NH+](C(C)(C)C)CC2)c1 ZINC001256568913 1062893682 /nfs/dbraw/zinc/89/36/82/1062893682.db2.gz KPXWHYYOXDZLJG-IBGZPJMESA-N 2 1 300.490 4.395 20 0 DIADMP COc1cccc([C@@H]2CCC[N@H+]2C2CC[NH+](C(C)(C)C)CC2)c1 ZINC001256575331 1062897890 /nfs/dbraw/zinc/89/78/90/1062897890.db2.gz LUKBEPAMFDZTSY-IBGZPJMESA-N 2 1 316.489 4.095 20 0 DIADMP CC[C@H]1c2ccccc2CC[N@H+]1C1CC[NH+](C(C)(C)C)CC1 ZINC001256575528 1062899620 /nfs/dbraw/zinc/89/96/20/1062899620.db2.gz POWWPFAAIFZHKK-IBGZPJMESA-N 2 1 300.490 4.259 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)[C@@H]1C=CCCCCC1 ZINC001460565334 1062913286 /nfs/dbraw/zinc/91/32/86/1062913286.db2.gz DYVYLXJMROJEHB-HXUWFJFHSA-N 2 1 300.490 4.459 20 0 DIADMP C[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC001256604827 1062916039 /nfs/dbraw/zinc/91/60/39/1062916039.db2.gz WZSCQUBPWSXCOD-ZWKOTPCHSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC001256604827 1062916063 /nfs/dbraw/zinc/91/60/63/1062916063.db2.gz WZSCQUBPWSXCOD-ZWKOTPCHSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001256617618 1062917334 /nfs/dbraw/zinc/91/73/34/1062917334.db2.gz USCKXQJOSUXHQT-IHBAFOEMSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001256617618 1062917368 /nfs/dbraw/zinc/91/73/68/1062917368.db2.gz USCKXQJOSUXHQT-IHBAFOEMSA-N 2 1 304.453 4.128 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1ccc(F)cc1)C1CCCCC1 ZINC001460627057 1062947206 /nfs/dbraw/zinc/94/72/06/1062947206.db2.gz NPNHBNUCKMQNJJ-LJQANCHMSA-N 2 1 315.436 4.013 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC001460710756 1063004019 /nfs/dbraw/zinc/00/40/19/1063004019.db2.gz RQFKXQVTHSUHMC-SFHVURJKSA-N 2 1 322.537 4.065 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@H+]2C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC001256861265 1063020122 /nfs/dbraw/zinc/02/01/22/1063020122.db2.gz VAKIOBHBHNMHRD-NRFANRHFSA-N 2 1 321.468 4.196 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855506 1063020442 /nfs/dbraw/zinc/02/04/42/1063020442.db2.gz NCBMZMBZDAQKIB-UHFFFAOYSA-N 2 1 323.484 4.209 20 0 DIADMP CCC1CCC([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC1 ZINC001256869455 1063023899 /nfs/dbraw/zinc/02/38/99/1063023899.db2.gz JLZQTEZWARAFAG-UHFFFAOYSA-N 2 1 304.453 4.044 20 0 DIADMP Fc1c(Cl)cccc1CC[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256904023 1063036173 /nfs/dbraw/zinc/03/61/73/1063036173.db2.gz BITKCUPMIWODOB-HNNXBMFYSA-N 2 1 324.871 4.018 20 0 DIADMP Fc1c(Cl)cccc1CC[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256904023 1063036193 /nfs/dbraw/zinc/03/61/93/1063036193.db2.gz BITKCUPMIWODOB-HNNXBMFYSA-N 2 1 324.871 4.018 20 0 DIADMP c1ccc(CC2(C[NH2+][C@H]3CCC[N@@H+](C4CCCC4)C3)CC2)cc1 ZINC001256906687 1063039693 /nfs/dbraw/zinc/03/96/93/1063039693.db2.gz UFIUFNIIKDYSEQ-IBGZPJMESA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc(CC2(C[NH2+][C@H]3CCC[N@H+](C4CCCC4)C3)CC2)cc1 ZINC001256906687 1063039716 /nfs/dbraw/zinc/03/97/16/1063039716.db2.gz UFIUFNIIKDYSEQ-IBGZPJMESA-N 2 1 312.501 4.006 20 0 DIADMP FC(F)(F)[C@H]1CC[C@H]([NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)CC1 ZINC001256910908 1063048076 /nfs/dbraw/zinc/04/80/76/1063048076.db2.gz FRCCHYIWCNCSBQ-KKUMJFAQSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@H]1CC[C@H]([NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)CC1 ZINC001256910908 1063048098 /nfs/dbraw/zinc/04/80/98/1063048098.db2.gz FRCCHYIWCNCSBQ-KKUMJFAQSA-N 2 1 318.427 4.104 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@H](C)O1 ZINC001257079683 1063105139 /nfs/dbraw/zinc/10/51/39/1063105139.db2.gz GMDFXYLXSPIGTB-WKYWSUOGSA-N 2 1 322.537 4.095 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](c2ccccc2F)C2CCC2)CC1 ZINC001257207936 1063136884 /nfs/dbraw/zinc/13/68/84/1063136884.db2.gz ASVPCTKRSFLMAR-LJQANCHMSA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](c2ccccc2F)C2CCC2)CC1 ZINC001257207932 1063137903 /nfs/dbraw/zinc/13/79/03/1063137903.db2.gz ASVPCTKRSFLMAR-IBGZPJMESA-N 2 1 304.453 4.129 20 0 DIADMP COc1cccc([C@@H]2CCCC[N@@H+]2C2CC[NH+](C(C)C)CC2)c1 ZINC001257217515 1063142365 /nfs/dbraw/zinc/14/23/65/1063142365.db2.gz NXUXITWCVMYSNO-FQEVSTJZSA-N 2 1 316.489 4.095 20 0 DIADMP COc1cccc([C@@H]2CCCC[N@H+]2C2CC[NH+](C(C)C)CC2)c1 ZINC001257217515 1063142378 /nfs/dbraw/zinc/14/23/78/1063142378.db2.gz NXUXITWCVMYSNO-FQEVSTJZSA-N 2 1 316.489 4.095 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC1 ZINC001257221734 1063147164 /nfs/dbraw/zinc/14/71/64/1063147164.db2.gz FNIWXKAKILUAKL-HNNXBMFYSA-N 2 1 320.908 4.174 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC1 ZINC001257221734 1063147177 /nfs/dbraw/zinc/14/71/77/1063147177.db2.gz FNIWXKAKILUAKL-HNNXBMFYSA-N 2 1 320.908 4.174 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257253510 1063159473 /nfs/dbraw/zinc/15/94/73/1063159473.db2.gz PKUDGURKLXCWAH-FHWLQOOXSA-N 2 1 306.469 4.476 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257253409 1063159736 /nfs/dbraw/zinc/15/97/36/1063159736.db2.gz NYGDGUHQQZFMKK-GUDVDZBRSA-N 2 1 306.469 4.476 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCCc2ccccc2C1)C1CCCCC1 ZINC001460988472 1063169705 /nfs/dbraw/zinc/16/97/05/1063169705.db2.gz IPLYSTGEMHUDMN-FQEVSTJZSA-N 2 1 314.517 4.178 20 0 DIADMP CCC[C@H](CC)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001257271803 1063173433 /nfs/dbraw/zinc/17/34/33/1063173433.db2.gz TVFTWNWFHRSRJZ-AABGKKOBSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc2c(c1)CC[N@@H+](CCC[NH2+]C1CCC3(CCC3)CC1)C2 ZINC001461035586 1063206063 /nfs/dbraw/zinc/20/60/63/1063206063.db2.gz ASXSWAZUHSCHCE-UHFFFAOYSA-N 2 1 312.501 4.137 20 0 DIADMP c1ccc2c(c1)CC[N@H+](CCC[NH2+]C1CCC3(CCC3)CC1)C2 ZINC001461035586 1063206077 /nfs/dbraw/zinc/20/60/77/1063206077.db2.gz ASXSWAZUHSCHCE-UHFFFAOYSA-N 2 1 312.501 4.137 20 0 DIADMP CC1(C)CCC(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001461039552 1063209171 /nfs/dbraw/zinc/20/91/71/1063209171.db2.gz ORVLWLPAVSQBTM-UHFFFAOYSA-N 2 1 314.517 4.241 20 0 DIADMP CC1(C)CCC(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001461039552 1063209190 /nfs/dbraw/zinc/20/91/90/1063209190.db2.gz ORVLWLPAVSQBTM-UHFFFAOYSA-N 2 1 314.517 4.241 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001461045187 1063212168 /nfs/dbraw/zinc/21/21/68/1063212168.db2.gz QJCZIUYFGMPXRZ-HLIPFELVSA-N 2 1 300.490 4.197 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001461047389 1063214050 /nfs/dbraw/zinc/21/40/50/1063214050.db2.gz WIMUMPAYJOTFAX-IYBDPMFKSA-N 2 1 320.521 4.343 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001461047389 1063214065 /nfs/dbraw/zinc/21/40/65/1063214065.db2.gz WIMUMPAYJOTFAX-IYBDPMFKSA-N 2 1 320.521 4.343 20 0 DIADMP CCCC(CCC)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001257340567 1063219774 /nfs/dbraw/zinc/21/97/74/1063219774.db2.gz KJRCAMFXGZAALT-UHFFFAOYSA-N 2 1 314.517 4.478 20 0 DIADMP CCCC(CCC)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001257340567 1063219793 /nfs/dbraw/zinc/21/97/93/1063219793.db2.gz KJRCAMFXGZAALT-UHFFFAOYSA-N 2 1 314.517 4.478 20 0 DIADMP CCCCCC[C@H](C)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001257371535 1063239210 /nfs/dbraw/zinc/23/92/10/1063239210.db2.gz HZJVTJKMJRKDDU-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCC[C@H](C)CC2)cc1F ZINC001461097036 1063252105 /nfs/dbraw/zinc/25/21/05/1063252105.db2.gz ADKFSPFNSPRHCM-YOEHRIQHSA-N 2 1 315.436 4.378 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257416844 1063264816 /nfs/dbraw/zinc/26/48/16/1063264816.db2.gz SJPPNLIESYIFHU-GUDVDZBRSA-N 2 1 303.494 4.122 20 0 DIADMP CC[C@@H](C)[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001257445717 1063281264 /nfs/dbraw/zinc/28/12/64/1063281264.db2.gz CXZPHXGBRPCCEL-GOSISDBHSA-N 2 1 300.490 4.163 20 0 DIADMP c1csc(C[N@H+]2CCC3(C2)CC[NH+](C2CCCCC2)CC3)c1 ZINC001257458103 1063284333 /nfs/dbraw/zinc/28/43/33/1063284333.db2.gz QEZMZXALHASTHM-UHFFFAOYSA-N 2 1 318.530 4.369 20 0 DIADMP CCC[C@H](C)CC[C@@H](C)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001257480294 1063300158 /nfs/dbraw/zinc/30/01/58/1063300158.db2.gz CZGZCGKCVCQPAV-NLWGTHIKSA-N 2 1 324.553 4.167 20 0 DIADMP CCC[C@@H](C)CC[C@@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001257481332 1063303592 /nfs/dbraw/zinc/30/35/92/1063303592.db2.gz JXBHBONQGFZTQL-QZTJIDSGSA-N 2 1 324.553 4.167 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257505193 1063314324 /nfs/dbraw/zinc/31/43/24/1063314324.db2.gz ALUQAJCNJKOWFP-WDSOQIARSA-N 2 1 303.494 4.122 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)[C@@H]1c1cccs1 ZINC001461229092 1063349626 /nfs/dbraw/zinc/34/96/26/1063349626.db2.gz GGNABBKXVDPJRL-OYNZLANYSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)[C@@H]1c1cccs1 ZINC001461229092 1063349640 /nfs/dbraw/zinc/34/96/40/1063349640.db2.gz GGNABBKXVDPJRL-OYNZLANYSA-N 2 1 318.530 4.299 20 0 DIADMP CC(C)C[C@@H]1CCC[C@H]([NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)C1 ZINC001461234703 1063354513 /nfs/dbraw/zinc/35/45/13/1063354513.db2.gz UFBAQFZIXJFKGK-YRPNKDGESA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)OC1CCC([N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)CC1 ZINC001257883005 1063422279 /nfs/dbraw/zinc/42/22/79/1063422279.db2.gz KXPRHNHMSLXKST-FUFFSDJGSA-N 2 1 322.537 4.061 20 0 DIADMP CC(C)OC1CCC([NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)CC1 ZINC001257883005 1063422287 /nfs/dbraw/zinc/42/22/87/1063422287.db2.gz KXPRHNHMSLXKST-FUFFSDJGSA-N 2 1 322.537 4.061 20 0 DIADMP CC(C)OC1CCC([NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)CC1 ZINC001257883005 1063422298 /nfs/dbraw/zinc/42/22/98/1063422298.db2.gz KXPRHNHMSLXKST-FUFFSDJGSA-N 2 1 322.537 4.061 20 0 DIADMP CCC[N@@H+](CCC[NH+]1CCCCC1)[C@H](C)c1ccccc1OC ZINC001473126017 1063430866 /nfs/dbraw/zinc/43/08/66/1063430866.db2.gz AMEYCBUGXBWMQR-GOSISDBHSA-N 2 1 318.505 4.344 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@H](Cc3ccccc3)C2)CC1 ZINC001258014018 1063462227 /nfs/dbraw/zinc/46/22/27/1063462227.db2.gz CMJDRSHHIIOKLZ-HXUWFJFHSA-N 2 1 314.517 4.062 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](C)C23CC4CC(CC(C4)C2)C3)CC1 ZINC001258013992 1063464375 /nfs/dbraw/zinc/46/43/75/1063464375.db2.gz BNQJWJDWXFSQFN-UHFFFAOYSA-N 2 1 304.522 4.007 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)C1CC[NH+](CC(C)C)CC1 ZINC001258017932 1063466792 /nfs/dbraw/zinc/46/67/92/1063466792.db2.gz IAIUXDWZGFMYCU-UHFFFAOYSA-N 2 1 302.506 4.246 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@H](C)C[C@@H](C)CC(C)C)CC1 ZINC001258055789 1063487998 /nfs/dbraw/zinc/48/79/98/1063487998.db2.gz MUICWHSLSUGEID-FUHWJXTLSA-N 2 1 317.521 4.409 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)CC1 ZINC001461427258 1063493449 /nfs/dbraw/zinc/49/34/49/1063493449.db2.gz AVEXHICOUNZYNW-LMDPOFIKSA-N 2 1 324.553 4.072 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]CCC[N@H+]2CCCO[C@H](C)C2)CC1 ZINC001461427258 1063493454 /nfs/dbraw/zinc/49/34/54/1063493454.db2.gz AVEXHICOUNZYNW-LMDPOFIKSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1ccc([C@H]2CCC[C@H]2[N@@H+](C)CCC[NH+]2CCCCC2)cc1 ZINC001473186908 1063498020 /nfs/dbraw/zinc/49/80/20/1063498020.db2.gz NLYBVJJROCUDDT-NHCUHLMSSA-N 2 1 314.517 4.439 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001258074015 1063500697 /nfs/dbraw/zinc/50/06/97/1063500697.db2.gz HJRJYUHWMGPYKF-ZWKOTPCHSA-N 2 1 324.553 4.022 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461440696 1063508134 /nfs/dbraw/zinc/50/81/34/1063508134.db2.gz LUCLEWHWVZLWRT-SFHVURJKSA-N 2 1 300.490 4.209 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461440696 1063508149 /nfs/dbraw/zinc/50/81/49/1063508149.db2.gz LUCLEWHWVZLWRT-SFHVURJKSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1cc(C)cc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC001258131454 1063528731 /nfs/dbraw/zinc/52/87/31/1063528731.db2.gz KBFLPICGBMXQHD-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP CC(C)C[NH+](CC(C)C)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258140693 1063532482 /nfs/dbraw/zinc/53/24/82/1063532482.db2.gz CTTJVUSXWMTDMV-UHFFFAOYSA-N 2 1 316.533 4.308 20 0 DIADMP C[C@@H]1CC([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C[C@@H](C)C1 ZINC001258158326 1063534677 /nfs/dbraw/zinc/53/46/77/1063534677.db2.gz CFMCIAMQWNUVDN-IRXDYDNUSA-N 2 1 304.522 4.152 20 0 DIADMP c1csc(C[NH+]2C[C@H]3C[NH+](C4CCCCCCC4)C[C@@H]3C2)c1 ZINC001258237413 1063576684 /nfs/dbraw/zinc/57/66/84/1063576684.db2.gz JTAZFUQBSAOVJA-IRXDYDNUSA-N 2 1 318.530 4.225 20 0 DIADMP C[C@H](C[NH+]1CCCC1)[NH2+][C@H](C)CC(C)(C)SCc1ccco1 ZINC001258295844 1063592301 /nfs/dbraw/zinc/59/23/01/1063592301.db2.gz QYIZBRBZBBDKEI-HZPDHXFCSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+][C@H]1CCC[N@@H+](C)CC1 ZINC001258296406 1063592559 /nfs/dbraw/zinc/59/25/59/1063592559.db2.gz WPKHSFKBOXIMQS-HOTGVXAUSA-N 2 1 324.534 4.144 20 0 DIADMP CC[C@@H](C)CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622298 1063619024 /nfs/dbraw/zinc/61/90/24/1063619024.db2.gz OGCRXHGIPQDYAA-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H](C)CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622298 1063619032 /nfs/dbraw/zinc/61/90/32/1063619032.db2.gz OGCRXHGIPQDYAA-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H](C)CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622291 1063619281 /nfs/dbraw/zinc/61/92/81/1063619281.db2.gz OGCRXHGIPQDYAA-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H](C)CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622291 1063619291 /nfs/dbraw/zinc/61/92/91/1063619291.db2.gz OGCRXHGIPQDYAA-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H](C)CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622300 1063619619 /nfs/dbraw/zinc/61/96/19/1063619619.db2.gz OGCRXHGIPQDYAA-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H](C)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622300 1063619623 /nfs/dbraw/zinc/61/96/23/1063619623.db2.gz OGCRXHGIPQDYAA-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CCCCC(CCCC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258383471 1063628526 /nfs/dbraw/zinc/62/85/26/1063628526.db2.gz RGRWOIPGYDYCPK-UAPYVXQJSA-N 2 1 324.553 4.486 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cccc(Oc3ccccc3)c2)C1 ZINC001461642493 1063630932 /nfs/dbraw/zinc/63/09/32/1063630932.db2.gz PXMLWGSJJBAVAM-LJQANCHMSA-N 2 1 324.468 4.300 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461666199 1063647774 /nfs/dbraw/zinc/64/77/74/1063647774.db2.gz WPLIPMREORZNOX-QGZVFWFLSA-N 2 1 320.908 4.168 20 0 DIADMP C[C@@H](CC1CC1)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001258453630 1063661269 /nfs/dbraw/zinc/66/12/69/1063661269.db2.gz BVLFRFOZFWFYRR-SPIRWFSGSA-N 2 1 312.501 4.303 20 0 DIADMP C[C@@H](CC1CC1)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258453070 1063661749 /nfs/dbraw/zinc/66/17/49/1063661749.db2.gz IFKHXLNBGOOGQY-WBAXXEDZSA-N 2 1 304.453 4.086 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+]([C@H](C)CC3CC3)C[C@@H]21 ZINC001258463545 1063666214 /nfs/dbraw/zinc/66/62/14/1063666214.db2.gz OWAJOGVUXJUBLB-DVMWJLJYSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+]([C@H](C)CC3CC3)C[C@@H]21 ZINC001258463545 1063666219 /nfs/dbraw/zinc/66/62/19/1063666219.db2.gz OWAJOGVUXJUBLB-DVMWJLJYSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+]([C@H](C)CC3CC3)C[C@@H]21 ZINC001258463545 1063666232 /nfs/dbraw/zinc/66/62/32/1063666232.db2.gz OWAJOGVUXJUBLB-DVMWJLJYSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@H](CC1CC1)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001258471268 1063669191 /nfs/dbraw/zinc/66/91/91/1063669191.db2.gz XNZRTBTUFYXCAX-NQIIRXRSSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258471268 1063669203 /nfs/dbraw/zinc/66/92/03/1063669203.db2.gz XNZRTBTUFYXCAX-NQIIRXRSSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258471268 1063669208 /nfs/dbraw/zinc/66/92/08/1063669208.db2.gz XNZRTBTUFYXCAX-NQIIRXRSSA-N 2 1 312.501 4.163 20 0 DIADMP C1=C[C@@H](CCC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC001461726181 1063679264 /nfs/dbraw/zinc/67/92/64/1063679264.db2.gz BGABPIDNNFWCGS-LJQANCHMSA-N 2 1 312.501 4.030 20 0 DIADMP CCCC1CCC([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC1 ZINC001258530550 1063684584 /nfs/dbraw/zinc/68/45/84/1063684584.db2.gz OLMULIJFJFDARI-UHFFFAOYSA-N 2 1 318.480 4.434 20 0 DIADMP CCCC1CCC([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC1 ZINC001258529945 1063684703 /nfs/dbraw/zinc/68/47/03/1063684703.db2.gz GGEDTKOAXZGUFU-UHFFFAOYSA-N 2 1 318.480 4.434 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC(C)(C)C1 ZINC001258607905 1063708570 /nfs/dbraw/zinc/70/85/70/1063708570.db2.gz UJIRQFPROGTXPC-MOPGFXCFSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001258659948 1063730565 /nfs/dbraw/zinc/73/05/65/1063730565.db2.gz WMXULEGIKJIYNP-OAQYLSRUSA-N 2 1 316.533 4.450 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001258701711 1063759270 /nfs/dbraw/zinc/75/92/70/1063759270.db2.gz MPEMDEGCCSUGCQ-VQTJNVASSA-N 2 1 302.506 4.109 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001258701710 1063759917 /nfs/dbraw/zinc/75/99/17/1063759917.db2.gz MPEMDEGCCSUGCQ-UXHICEINSA-N 2 1 302.506 4.109 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2cccc(Cl)c2)C1 ZINC001258741189 1063790858 /nfs/dbraw/zinc/79/08/58/1063790858.db2.gz GULPHXUCDTYAGH-YOEHRIQHSA-N 2 1 308.897 4.124 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@@H](C)Cc2cccc(Cl)c2)C1 ZINC001258741189 1063790867 /nfs/dbraw/zinc/79/08/67/1063790867.db2.gz GULPHXUCDTYAGH-YOEHRIQHSA-N 2 1 308.897 4.124 20 0 DIADMP Cc1ccccc1C1CC([N@@H+](CC2CC[NH+](C)CC2)C2CC2)C1 ZINC001461921509 1063803461 /nfs/dbraw/zinc/80/34/61/1063803461.db2.gz PIXYPPKLPNHOQD-UHFFFAOYSA-N 2 1 312.501 4.047 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001461921456 1063806092 /nfs/dbraw/zinc/80/60/92/1063806092.db2.gz OTHUZALDSIHHEE-WMZOPIPTSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001461921456 1063806106 /nfs/dbraw/zinc/80/61/06/1063806106.db2.gz OTHUZALDSIHHEE-WMZOPIPTSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC001461921456 1063806116 /nfs/dbraw/zinc/80/61/16/1063806116.db2.gz OTHUZALDSIHHEE-WMZOPIPTSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC001461921456 1063806125 /nfs/dbraw/zinc/80/61/25/1063806125.db2.gz OTHUZALDSIHHEE-WMZOPIPTSA-N 2 1 311.473 4.102 20 0 DIADMP CCCC[C@@H](CCC)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258762534 1063807575 /nfs/dbraw/zinc/80/75/75/1063807575.db2.gz YHBDCVYBULPPLQ-QZTJIDSGSA-N 2 1 324.553 4.357 20 0 DIADMP CCCC[C@H](CCC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258764696 1063810798 /nfs/dbraw/zinc/81/07/98/1063810798.db2.gz YPFIXPNCDPWTIW-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](c2ccccc2F)C2CCC2)CC1 ZINC001258768771 1063812387 /nfs/dbraw/zinc/81/23/87/1063812387.db2.gz WGERMIZFGQHOQN-IBGZPJMESA-N 2 1 304.453 4.131 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](CC(C)C)c2ccccc2F)CC1 ZINC001258768258 1063813055 /nfs/dbraw/zinc/81/30/55/1063813055.db2.gz GFOBIJSDCQWMOD-IBGZPJMESA-N 2 1 306.469 4.377 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001258775158 1063816034 /nfs/dbraw/zinc/81/60/34/1063816034.db2.gz CECNZEXLXGAUSF-MRXNPFEDSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001258775158 1063816048 /nfs/dbraw/zinc/81/60/48/1063816048.db2.gz CECNZEXLXGAUSF-MRXNPFEDSA-N 2 1 306.881 4.004 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258785123 1063821560 /nfs/dbraw/zinc/82/15/60/1063821560.db2.gz DTZVLPROYSFBIM-SJORKVTESA-N 2 1 318.505 4.160 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258799771 1063834644 /nfs/dbraw/zinc/83/46/44/1063834644.db2.gz IDDDPEXLZKZXSS-NVXWUHKLSA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@H](C[C@@H](C)CC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258799432 1063834679 /nfs/dbraw/zinc/83/46/79/1063834679.db2.gz FDJYVLDBEBIBDZ-DOTOQJQBSA-N 2 1 303.494 4.163 20 0 DIADMP Cc1ccc[nH+]c1N(C1CC[NH2+]CC1)C1CCC(C(C)C)CC1 ZINC001258806246 1063837867 /nfs/dbraw/zinc/83/78/67/1063837867.db2.gz NXZSSSNOJWYPPN-UHFFFAOYSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001258808951 1063838875 /nfs/dbraw/zinc/83/88/75/1063838875.db2.gz SSQNDJQVROLEAC-OSTWSGHESA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813191 1063842306 /nfs/dbraw/zinc/84/23/06/1063842306.db2.gz PMFHFHMSEQFIQI-KNTRFNDTSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813281 1063843577 /nfs/dbraw/zinc/84/35/77/1063843577.db2.gz JRENUTPMHGXWRW-OWYHZJEWSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258825453 1063850427 /nfs/dbraw/zinc/85/04/27/1063850427.db2.gz CUXKEZDWYUWFQL-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825453 1063850439 /nfs/dbraw/zinc/85/04/39/1063850439.db2.gz CUXKEZDWYUWFQL-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825453 1063850449 /nfs/dbraw/zinc/85/04/49/1063850449.db2.gz CUXKEZDWYUWFQL-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1CCF ZINC000556857295 1063902641 /nfs/dbraw/zinc/90/26/41/1063902641.db2.gz RMPRZGTWDQBWAE-VQIMIIECSA-N 2 1 306.469 4.145 20 0 DIADMP Cc1ccc(CC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001462079491 1063919369 /nfs/dbraw/zinc/91/93/69/1063919369.db2.gz JKCFAMXTCNIPBM-UYAOXDASSA-N 2 1 314.517 4.089 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[C@@H](C)C1 ZINC000379632759 1063985107 /nfs/dbraw/zinc/98/51/07/1063985107.db2.gz SSGNZPKEECAQPT-QBVCYTKMSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)[C@@H](C)C1 ZINC000379632759 1063985112 /nfs/dbraw/zinc/98/51/12/1063985112.db2.gz SSGNZPKEECAQPT-QBVCYTKMSA-N 2 1 314.517 4.454 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379628058 1063985197 /nfs/dbraw/zinc/98/51/97/1063985197.db2.gz IOFGYHZQIVKXKW-FPOVZHCZSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c(C)c1 ZINC000379637580 1063985634 /nfs/dbraw/zinc/98/56/34/1063985634.db2.gz SMXOWCWZQJJGMJ-KNQAVFIVSA-N 2 1 322.496 4.446 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379638979 1063985803 /nfs/dbraw/zinc/98/58/03/1063985803.db2.gz VFCXYQNJNHMBOK-AVRDEDQJSA-N 2 1 322.496 4.392 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379638979 1063985810 /nfs/dbraw/zinc/98/58/10/1063985810.db2.gz VFCXYQNJNHMBOK-AVRDEDQJSA-N 2 1 322.496 4.392 20 0 DIADMP C[C@H](CC[NH2+]CC1CCCCCC1)[N@@H+](C)Cc1ccccc1 ZINC000379654522 1063986855 /nfs/dbraw/zinc/98/68/55/1063986855.db2.gz ISBIRIDHPXYVNP-GOSISDBHSA-N 2 1 302.506 4.457 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658815 1063987957 /nfs/dbraw/zinc/98/79/57/1063987957.db2.gz XLIPMQFQJNZBOI-AOIWGVFYSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658815 1063987971 /nfs/dbraw/zinc/98/79/71/1063987971.db2.gz XLIPMQFQJNZBOI-AOIWGVFYSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)C(C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000380916462 1063989533 /nfs/dbraw/zinc/98/95/33/1063989533.db2.gz SPYRTZQEBYINGH-LJQANCHMSA-N 2 1 302.506 4.026 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000381025451 1063990554 /nfs/dbraw/zinc/99/05/54/1063990554.db2.gz XVOOBYVOOULOAO-UKAVVXHISA-N 2 1 314.517 4.313 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382073442 1063996715 /nfs/dbraw/zinc/99/67/15/1063996715.db2.gz SWSHGJQDTHRKOC-BJLQDIEVSA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCC1 ZINC000385517772 1064020042 /nfs/dbraw/zinc/02/00/42/1064020042.db2.gz SGZBERNOBYEGJN-UHFFFAOYSA-N 2 1 300.490 4.067 20 0 DIADMP CCCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390717782 1064167298 /nfs/dbraw/zinc/16/72/98/1064167298.db2.gz YOMRJMYMLWCROF-HKUYNNGSSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390717782 1064167304 /nfs/dbraw/zinc/16/73/04/1064167304.db2.gz YOMRJMYMLWCROF-HKUYNNGSSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390772160 1064169064 /nfs/dbraw/zinc/16/90/64/1064169064.db2.gz KGEAWOAINWKFHL-HLAWJBBLSA-N 2 1 314.517 4.315 20 0 DIADMP CC(C)CC(C)(C)C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000391120467 1064179931 /nfs/dbraw/zinc/17/99/31/1064179931.db2.gz AZNNYNLLXUTJCY-UHFFFAOYSA-N 2 1 302.506 4.313 20 0 DIADMP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(c1ccccc1)c1ccccc1 ZINC001279627747 1064361517 /nfs/dbraw/zinc/36/15/17/1064361517.db2.gz VVOKIRFPVWJKME-SEJPIABJSA-N 2 1 320.480 4.033 20 0 DIADMP C[N@H+]1CCC[C@@]2(CCC[NH+](Cc3ccc4cccccc3-4)C2)C1 ZINC001279694411 1064363625 /nfs/dbraw/zinc/36/36/25/1064363625.db2.gz YEDJNYMMBSIAHJ-OAQYLSRUSA-N 2 1 308.469 4.099 20 0 DIADMP C[NH+]1CCC[C@@]2(CCC[N@H+](Cc3ccc4cccccc3-4)C2)C1 ZINC001279694411 1064363641 /nfs/dbraw/zinc/36/36/41/1064363641.db2.gz YEDJNYMMBSIAHJ-OAQYLSRUSA-N 2 1 308.469 4.099 20 0 DIADMP Cc1cc[nH+]c(N2CCC[C@]3(CCC[N@@H+](C4CCCC4)C3)C2)c1 ZINC001280090000 1064380088 /nfs/dbraw/zinc/38/00/88/1064380088.db2.gz JYMBLKRDLLYUAY-FQEVSTJZSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cc[nH+]c(N2CCC[C@]3(CCC[N@H+](C4CCCC4)C3)C2)c1 ZINC001280090000 1064380108 /nfs/dbraw/zinc/38/01/08/1064380108.db2.gz JYMBLKRDLLYUAY-FQEVSTJZSA-N 2 1 313.489 4.015 20 0 DIADMP CC(C)Oc1cccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000817888769 1064412780 /nfs/dbraw/zinc/41/27/80/1064412780.db2.gz OGIGEHOOVYWFSO-PZJWPPBQSA-N 2 1 324.468 4.057 20 0 DIADMP C[N@H+](CCC[NH+]1CCCCC1)Cc1csc2ccccc12 ZINC001307415127 1065378044 /nfs/dbraw/zinc/37/80/44/1065378044.db2.gz ZJEGCNPSJJKKMY-UHFFFAOYSA-N 2 1 302.487 4.209 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCCC1)Cc1csc2ccccc12 ZINC001307415127 1065378053 /nfs/dbraw/zinc/37/80/53/1065378053.db2.gz ZJEGCNPSJJKKMY-UHFFFAOYSA-N 2 1 302.487 4.209 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CC[C@@H]2CCc3ccccc32)CC1 ZINC001307455513 1065410250 /nfs/dbraw/zinc/41/02/50/1065410250.db2.gz PUONJSINPGNGBX-FQEVSTJZSA-N 2 1 314.517 4.159 20 0 DIADMP CC(C)[N@@H+]1CCCC[C@H]1C[NH2+]C(C)(C)CCc1ccccc1 ZINC001307456300 1065410504 /nfs/dbraw/zinc/41/05/04/1065410504.db2.gz PZGDWEFCRKDKET-IBGZPJMESA-N 2 1 302.506 4.250 20 0 DIADMP CC(C)[N@H+]1CCCC[C@H]1C[NH2+]C(C)(C)CCc1ccccc1 ZINC001307456300 1065410515 /nfs/dbraw/zinc/41/05/15/1065410515.db2.gz PZGDWEFCRKDKET-IBGZPJMESA-N 2 1 302.506 4.250 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477725 1065422780 /nfs/dbraw/zinc/42/27/80/1065422780.db2.gz NJFAUHLMXASUTG-CUDHKJQZSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477725 1065422790 /nfs/dbraw/zinc/42/27/90/1065422790.db2.gz NJFAUHLMXASUTG-CUDHKJQZSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477725 1065422795 /nfs/dbraw/zinc/42/27/95/1065422795.db2.gz NJFAUHLMXASUTG-CUDHKJQZSA-N 2 1 304.522 4.009 20 0 DIADMP c1cc(C2CCCC2)ccc1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC001307484102 1065430615 /nfs/dbraw/zinc/43/06/15/1065430615.db2.gz ZGVDGDKFLPPZTE-LJQANCHMSA-N 2 1 312.501 4.262 20 0 DIADMP C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001307492532 1065436497 /nfs/dbraw/zinc/43/64/97/1065436497.db2.gz MABDBRIEZHKATH-ZWKOTPCHSA-N 2 1 300.490 4.293 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001307509313 1065450946 /nfs/dbraw/zinc/45/09/46/1065450946.db2.gz GLCGLFKVVUGOMW-UHFFFAOYSA-N 2 1 300.490 4.293 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)C[C@H]2CCC3(CCCCCC3)O2)CC1 ZINC001307514299 1065453928 /nfs/dbraw/zinc/45/39/28/1065453928.db2.gz BFYLVXNKBVXOLO-LJQANCHMSA-N 2 1 322.537 4.065 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(CC(C)C)cc2)CC1 ZINC001307515641 1065455459 /nfs/dbraw/zinc/45/54/59/1065455459.db2.gz RSKVDTNSNMIHTR-UHFFFAOYSA-N 2 1 302.506 4.191 20 0 DIADMP Cc1ccc(C)c([C@@H]2CCC[N@H+]2CCC[NH+]2CCCCC2)c1 ZINC001307581658 1065495956 /nfs/dbraw/zinc/49/59/56/1065495956.db2.gz BKALMJGPYKJQNS-FQEVSTJZSA-N 2 1 300.490 4.316 20 0 DIADMP Fc1ccc(C2([NH2+]CCC[NH+]3CCCCC3)CCCC2)c(F)c1 ZINC001307613167 1065516309 /nfs/dbraw/zinc/51/63/09/1065516309.db2.gz PHLOZISHOIIFDR-UHFFFAOYSA-N 2 1 322.443 4.200 20 0 DIADMP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670207 1065553876 /nfs/dbraw/zinc/55/38/76/1065553876.db2.gz QKMJEUAGTWHYLI-RDJZCZTQSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670207 1065553890 /nfs/dbraw/zinc/55/38/90/1065553890.db2.gz QKMJEUAGTWHYLI-RDJZCZTQSA-N 2 1 320.908 4.391 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC001307680619 1065558027 /nfs/dbraw/zinc/55/80/27/1065558027.db2.gz JCVNPUNUPMDYJZ-IBGZPJMESA-N 2 1 310.485 4.318 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2C[C@H]2CCCC[C@@H]2C)CC1 ZINC001308001742 1065719622 /nfs/dbraw/zinc/71/96/22/1065719622.db2.gz HCWHZUOJADDBPY-ZCNNSNEGSA-N 2 1 306.538 4.399 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC[C@@H](c2ccc(Cl)cc2)C1(C)C ZINC001308098781 1065762981 /nfs/dbraw/zinc/76/29/81/1065762981.db2.gz RNPDGXGMCUJVAL-MSOLQXFVSA-N 2 1 320.908 4.392 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182566 1065793471 /nfs/dbraw/zinc/79/34/71/1065793471.db2.gz ZPHUCELUIOLSPJ-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182566 1065793484 /nfs/dbraw/zinc/79/34/84/1065793484.db2.gz ZPHUCELUIOLSPJ-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC001308199278 1065807143 /nfs/dbraw/zinc/80/71/43/1065807143.db2.gz JEJVUWRYSYQMEL-FUHIMQAGSA-N 2 1 300.490 4.339 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]CC(C)(C)C)cc2)C1 ZINC001308203919 1065811859 /nfs/dbraw/zinc/81/18/59/1065811859.db2.gz JQRLJNCIGGDWGY-CALCHBBNSA-N 2 1 302.506 4.300 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001308206382 1065815163 /nfs/dbraw/zinc/81/51/63/1065815163.db2.gz XFHNKMOQCVWCFD-RMFSNUHRSA-N 2 1 312.501 4.128 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC(C)(C)C[C@H]2C)CC1 ZINC001308205697 1065815959 /nfs/dbraw/zinc/81/59/59/1065815959.db2.gz AXEMPJSBDXXSQS-YLJYHZDGSA-N 2 1 314.517 4.374 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CC[N@H+](C)C1CCCCC1 ZINC001308229231 1065837342 /nfs/dbraw/zinc/83/73/42/1065837342.db2.gz XKASGIXZVNIKFC-SFHVURJKSA-N 2 1 302.506 4.109 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CC[N@@H+](C)C1CCCCC1 ZINC001308229231 1065837354 /nfs/dbraw/zinc/83/73/54/1065837354.db2.gz XKASGIXZVNIKFC-SFHVURJKSA-N 2 1 302.506 4.109 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC001308255015 1065859182 /nfs/dbraw/zinc/85/91/82/1065859182.db2.gz WPFAJOMBFPITOL-RBUKOAKNSA-N 2 1 322.537 4.113 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC001308255015 1065859194 /nfs/dbraw/zinc/85/91/94/1065859194.db2.gz WPFAJOMBFPITOL-RBUKOAKNSA-N 2 1 322.537 4.113 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc1 ZINC001308283012 1065880963 /nfs/dbraw/zinc/88/09/63/1065880963.db2.gz QVXCVPLRIFOERQ-HKUYNNGSSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc1 ZINC001308283012 1065880979 /nfs/dbraw/zinc/88/09/79/1065880979.db2.gz QVXCVPLRIFOERQ-HKUYNNGSSA-N 2 1 314.498 4.229 20 0 DIADMP C(C1CCCC1)[N@@H+]1CC[C@@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001308293865 1065890268 /nfs/dbraw/zinc/89/02/68/1065890268.db2.gz XGTSICWUSHDMSS-SOAGJPPSSA-N 2 1 304.522 4.199 20 0 DIADMP C(C1CCCC1)[N@H+]1CC[C@@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001308293865 1065890278 /nfs/dbraw/zinc/89/02/78/1065890278.db2.gz XGTSICWUSHDMSS-SOAGJPPSSA-N 2 1 304.522 4.199 20 0 DIADMP CC(C)c1[nH+]c(CNc2ccc3c(c2)C[N@H+](C)C3)c2ccccn21 ZINC001308319927 1065910923 /nfs/dbraw/zinc/91/09/23/1065910923.db2.gz FNGPMYVFDDQBAF-UHFFFAOYSA-N 2 1 320.440 4.015 20 0 DIADMP CC(C)c1ccc(C[C@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001308333280 1065919316 /nfs/dbraw/zinc/91/93/16/1065919316.db2.gz MHCHKDLYTYHCSU-LPHOPBHVSA-N 2 1 302.506 4.203 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001308338633 1065923655 /nfs/dbraw/zinc/92/36/55/1065923655.db2.gz BFMRQZKQAWJQCV-KRWDZBQOSA-N 2 1 300.490 4.022 20 0 DIADMP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC001308368373 1065945697 /nfs/dbraw/zinc/94/56/97/1065945697.db2.gz SJMRHAMTWKILFK-DOTOQJQBSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1scc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC001308367306 1065945807 /nfs/dbraw/zinc/94/58/07/1065945807.db2.gz DVSPLPMBMHZURO-GDBMZVCRSA-N 2 1 306.519 4.108 20 0 DIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cc(F)cc(F)c1 ZINC001308378051 1065951519 /nfs/dbraw/zinc/95/15/19/1065951519.db2.gz RDQMGSQEMMWHHE-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001308547963 1066062633 /nfs/dbraw/zinc/06/26/33/1066062633.db2.gz JLOVFKAJWPWVIL-TZMRYXNNSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559479 1066069527 /nfs/dbraw/zinc/06/95/27/1066069527.db2.gz CRKOZJIJYCRVND-AQKVLALTSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559479 1066069535 /nfs/dbraw/zinc/06/95/35/1066069535.db2.gz CRKOZJIJYCRVND-AQKVLALTSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559479 1066069544 /nfs/dbraw/zinc/06/95/44/1066069544.db2.gz CRKOZJIJYCRVND-AQKVLALTSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559479 1066069554 /nfs/dbraw/zinc/06/95/54/1066069554.db2.gz CRKOZJIJYCRVND-AQKVLALTSA-N 2 1 314.517 4.289 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC001308564042 1066072325 /nfs/dbraw/zinc/07/23/25/1066072325.db2.gz GUJMQLGQQWNXKC-FQEVSTJZSA-N 2 1 314.517 4.160 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2CCCc2ccccc2)CC1 ZINC001308562775 1066073468 /nfs/dbraw/zinc/07/34/68/1066073468.db2.gz PRUNFOQYVJSNGT-OAQYLSRUSA-N 2 1 314.517 4.206 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(CC3CCC3)c2)[C@H](C)C1 ZINC001308567731 1066079470 /nfs/dbraw/zinc/07/94/70/1066079470.db2.gz KLEJUFXXJDBNER-UTKZUKDTSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(CC3CCC3)c2)[C@H](C)C1 ZINC001308567731 1066079481 /nfs/dbraw/zinc/07/94/81/1066079481.db2.gz KLEJUFXXJDBNER-UTKZUKDTSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(CC3CCC3)c2)[C@H](C)C1 ZINC001308567731 1066079493 /nfs/dbraw/zinc/07/94/93/1066079493.db2.gz KLEJUFXXJDBNER-UTKZUKDTSA-N 2 1 314.517 4.191 20 0 DIADMP C[N@H+](Cc1cccc(C2CCCC2)c1)C[C@H]1CCC[NH+](C)C1 ZINC001308586238 1066101230 /nfs/dbraw/zinc/10/12/30/1066101230.db2.gz XKGBDNGCWNMXFV-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+](Cc1cccc(C2CCCC2)c1)C[C@H]1CCC[N@H+](C)C1 ZINC001308586238 1066101237 /nfs/dbraw/zinc/10/12/37/1066101237.db2.gz XKGBDNGCWNMXFV-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+](Cc1cccc(C2CCCC2)c1)C[C@H]1CCC[N@@H+](C)C1 ZINC001308586238 1066101246 /nfs/dbraw/zinc/10/12/46/1066101246.db2.gz XKGBDNGCWNMXFV-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001308589571 1066103239 /nfs/dbraw/zinc/10/32/39/1066103239.db2.gz HBCCEMCRJPGIPU-HBMCJLEFSA-N 2 1 318.549 4.423 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C/C=C/c2cc(C)c(C)cc2C)C1 ZINC001308594757 1066106633 /nfs/dbraw/zinc/10/66/33/1066106633.db2.gz QXTLKLFMVYTXIR-IBDYFIJFSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C/C=C/c2cc(C)c(C)cc2C)C1 ZINC001308594757 1066106638 /nfs/dbraw/zinc/10/66/38/1066106638.db2.gz QXTLKLFMVYTXIR-IBDYFIJFSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C/C=C\c2cc(C)c(C)cc2C)C1 ZINC001308594761 1066107085 /nfs/dbraw/zinc/10/70/85/1066107085.db2.gz QXTLKLFMVYTXIR-ZTBDEIDFSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C/C=C\c2cc(C)c(C)cc2C)C1 ZINC001308594761 1066107087 /nfs/dbraw/zinc/10/70/87/1066107087.db2.gz QXTLKLFMVYTXIR-ZTBDEIDFSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C/C=C/c2cc(C)c(C)cc2C)C1 ZINC001308594758 1066107480 /nfs/dbraw/zinc/10/74/80/1066107480.db2.gz QXTLKLFMVYTXIR-NDDJGDGRSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C/C=C/c2cc(C)c(C)cc2C)C1 ZINC001308594758 1066107484 /nfs/dbraw/zinc/10/74/84/1066107484.db2.gz QXTLKLFMVYTXIR-NDDJGDGRSA-N 2 1 314.517 4.289 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(F)cccc2CC)CC1 ZINC001308604921 1066113475 /nfs/dbraw/zinc/11/34/75/1066113475.db2.gz BXDZQDLXZCZXSH-UHFFFAOYSA-N 2 1 320.496 4.332 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1(C)CCCC1 ZINC001308628521 1066124492 /nfs/dbraw/zinc/12/44/92/1066124492.db2.gz APCYXDQJJQFBQB-IBGZPJMESA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(C)CCCC1 ZINC001308628521 1066124499 /nfs/dbraw/zinc/12/44/99/1066124499.db2.gz APCYXDQJJQFBQB-IBGZPJMESA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)C1CCC1 ZINC001308634047 1066129057 /nfs/dbraw/zinc/12/90/57/1066129057.db2.gz DGOASYGZTKDGFJ-LLUDDFSJSA-N 2 1 312.501 4.065 20 0 DIADMP c1ccc([C@@H]2C[C@@H]2C[NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001308720959 1066198713 /nfs/dbraw/zinc/19/87/13/1066198713.db2.gz AGOMLVGBWCPNFO-GIVPXCGWSA-N 2 1 312.501 4.177 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)CCc1cc(Cl)cc(Cl)c1 ZINC001308745513 1066219187 /nfs/dbraw/zinc/21/91/87/1066219187.db2.gz YYDGYKHVGKCZOM-UHFFFAOYSA-N 2 1 317.304 4.200 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001308751540 1066225855 /nfs/dbraw/zinc/22/58/55/1066225855.db2.gz UEFVQYFKIKWPSO-KGLIPLIRSA-N 2 1 314.926 4.187 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001308751540 1066225871 /nfs/dbraw/zinc/22/58/71/1066225871.db2.gz UEFVQYFKIKWPSO-KGLIPLIRSA-N 2 1 314.926 4.187 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2C)CC1 ZINC001308817537 1066292771 /nfs/dbraw/zinc/29/27/71/1066292771.db2.gz FVLQNOMSPWEOEB-LJQANCHMSA-N 2 1 304.453 4.003 20 0 DIADMP Cc1ccc(Oc2ccccc2CC[NH2+]C2CC[NH+](C)CC2)cc1 ZINC001308818165 1066293687 /nfs/dbraw/zinc/29/36/87/1066293687.db2.gz SKTVYJBGCCTMEC-UHFFFAOYSA-N 2 1 324.468 4.014 20 0 DIADMP c1cc(C[N@@H+]2CCC[C@H](C3CCCCC3)C2)n(-c2cc[nH+]cc2)n1 ZINC001308878329 1066357962 /nfs/dbraw/zinc/35/79/62/1066357962.db2.gz ISATXIZHJSGSGP-SFHVURJKSA-N 2 1 324.472 4.060 20 0 DIADMP c1cc(C[N@H+]2CCC[C@H](C3CCCCC3)C2)n(-c2cc[nH+]cc2)n1 ZINC001308878329 1066357978 /nfs/dbraw/zinc/35/79/78/1066357978.db2.gz ISATXIZHJSGSGP-SFHVURJKSA-N 2 1 324.472 4.060 20 0 DIADMP C[C@H](C[N@@H+]1CCCC[C@@H]1[C@@H](C)C[NH+](C)C)c1cc(F)cc(F)c1 ZINC001308882875 1066364310 /nfs/dbraw/zinc/36/43/10/1066364310.db2.gz SGRJSRMUBUEBSD-ZRGWGRIASA-N 2 1 324.459 4.121 20 0 DIADMP CCc1cccc(F)c1C[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001308915347 1066394655 /nfs/dbraw/zinc/39/46/55/1066394655.db2.gz VZOIMMUQNUALCP-UHFFFAOYSA-N 2 1 306.469 4.086 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCC[C@H]3C3CCCCC3)[C@H]2C1 ZINC001308985100 1066432815 /nfs/dbraw/zinc/43/28/15/1066432815.db2.gz SDBJXUGGPFZARB-FSGKZVOOSA-N 2 1 304.522 4.055 20 0 DIADMP C[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccnc1Cl ZINC000272635162 130048891 /nfs/dbraw/zinc/04/88/91/130048891.db2.gz BOBPLZXAOYYMED-SOUVJXGZSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cn1 ZINC000274801378 130264145 /nfs/dbraw/zinc/26/41/45/130264145.db2.gz VINKCKYUBLUOJB-SOUVJXGZSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(Cl)cn1 ZINC000274801378 130264149 /nfs/dbraw/zinc/26/41/49/130264149.db2.gz VINKCKYUBLUOJB-SOUVJXGZSA-N 2 1 321.896 4.039 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)c1 ZINC000274823426 130265396 /nfs/dbraw/zinc/26/53/96/130265396.db2.gz BWASKJCPGIJFJP-CQSZACIVSA-N 2 1 317.864 4.038 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000275648498 130354872 /nfs/dbraw/zinc/35/48/72/130354872.db2.gz UFMZYAAAFYGALF-NEPJUHHUSA-N 2 1 324.255 4.103 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1Cl ZINC000284550911 131091562 /nfs/dbraw/zinc/09/15/62/131091562.db2.gz XXLYVTVNOQATRH-CQSZACIVSA-N 2 1 322.880 4.040 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]Cc3ccccc3)cc2)C1 ZINC000518266902 332003233 /nfs/dbraw/zinc/00/32/33/332003233.db2.gz LSAPPAJGVJVOIQ-KDURUIRLSA-N 2 1 322.496 4.454 20 0 DIADMP Cc1sccc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000559273243 332012042 /nfs/dbraw/zinc/01/20/42/332012042.db2.gz KVTLCIRRUPWJOF-NVXWUHKLSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1sccc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000559273243 332012044 /nfs/dbraw/zinc/01/20/44/332012044.db2.gz KVTLCIRRUPWJOF-NVXWUHKLSA-N 2 1 320.527 4.291 20 0 DIADMP Fc1ccccc1[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000091268668 332102691 /nfs/dbraw/zinc/10/26/91/332102691.db2.gz PYEPIWJERVWMDE-HXUWFJFHSA-N 2 1 316.464 4.273 20 0 DIADMP Cc1ccsc1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093336857 332137560 /nfs/dbraw/zinc/13/75/60/332137560.db2.gz UQGNTXUXVPPHKP-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccsc1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000093336857 332137561 /nfs/dbraw/zinc/13/75/61/332137561.db2.gz UQGNTXUXVPPHKP-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccsc1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000093336857 332137563 /nfs/dbraw/zinc/13/75/63/332137563.db2.gz UQGNTXUXVPPHKP-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000536476850 332250809 /nfs/dbraw/zinc/25/08/09/332250809.db2.gz WFIUDOJWXYGFNZ-PMACEKPBSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000536476850 332250811 /nfs/dbraw/zinc/25/08/11/332250811.db2.gz WFIUDOJWXYGFNZ-PMACEKPBSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(F)cc1)C(C)(C)C ZINC000536476439 332250853 /nfs/dbraw/zinc/25/08/53/332250853.db2.gz QGQYZLMLYXKNSH-QGZVFWFLSA-N 2 1 303.425 4.098 20 0 DIADMP CN1CC[C@H]([NH2+]Cc2ccccc2Cl)C[C@@H]1c1ccccc1 ZINC000559722577 332277836 /nfs/dbraw/zinc/27/78/36/332277836.db2.gz XXKPDWAMMVNKAC-PKOBYXMFSA-N 2 1 314.860 4.265 20 0 DIADMP C[C@@H](C1CC1)[NH+](C)Cc1ccccc1C[N@H+](C)[C@@H](C)C1CC1 ZINC000559869108 332287232 /nfs/dbraw/zinc/28/72/32/332287232.db2.gz SWMAMUPYJQYPDH-HOTGVXAUSA-N 2 1 300.490 4.147 20 0 DIADMP C[C@H](C1CC1)[NH+](C)Cc1ccccc1C[N@H+](C)[C@@H](C)C1CC1 ZINC000559869110 332287272 /nfs/dbraw/zinc/28/72/72/332287272.db2.gz SWMAMUPYJQYPDH-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP C[C@H](C1CC1)[N@@H+](C)Cc1ccccc1C[NH+](C)[C@@H](C)C1CC1 ZINC000559869110 332287273 /nfs/dbraw/zinc/28/72/73/332287273.db2.gz SWMAMUPYJQYPDH-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP C[C@H](C1CC1)[N@H+](C)Cc1ccccc1C[NH+](C)[C@@H](C)C1CC1 ZINC000559869110 332287274 /nfs/dbraw/zinc/28/72/74/332287274.db2.gz SWMAMUPYJQYPDH-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000560251967 332323675 /nfs/dbraw/zinc/32/36/75/332323675.db2.gz NELGXSKCYRNDED-DLBZAZTESA-N 2 1 316.489 4.000 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000583388826 332381043 /nfs/dbraw/zinc/38/10/43/332381043.db2.gz FBZAYHLOKWKWKC-SFHVURJKSA-N 2 1 317.452 4.259 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)s2)CC1 ZINC000428885566 332448862 /nfs/dbraw/zinc/44/88/62/332448862.db2.gz GQJFDOJLIYCJHX-UHFFFAOYSA-N 2 1 320.424 4.121 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000525696307 332620198 /nfs/dbraw/zinc/62/01/98/332620198.db2.gz WNEWYTQOMIDRQU-UHFFFAOYSA-N 2 1 312.457 4.254 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245606 333040291 /nfs/dbraw/zinc/04/02/91/333040291.db2.gz WKTMGCYSUDKIMQ-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245606 333040292 /nfs/dbraw/zinc/04/02/92/333040292.db2.gz WKTMGCYSUDKIMQ-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245606 333040293 /nfs/dbraw/zinc/04/02/93/333040293.db2.gz WKTMGCYSUDKIMQ-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245606 333040294 /nfs/dbraw/zinc/04/02/94/333040294.db2.gz WKTMGCYSUDKIMQ-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526055578 333051779 /nfs/dbraw/zinc/05/17/79/333051779.db2.gz HIDDYIOIVGRRQI-RTRPANQVSA-N 2 1 306.881 4.017 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526055578 333051781 /nfs/dbraw/zinc/05/17/81/333051781.db2.gz HIDDYIOIVGRRQI-RTRPANQVSA-N 2 1 306.881 4.017 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000378902530 333061820 /nfs/dbraw/zinc/06/18/20/333061820.db2.gz XPWMONWWBJSRPU-AQNXPRMDSA-N 2 1 300.490 4.380 20 0 DIADMP c1ccc(C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000378922298 333064881 /nfs/dbraw/zinc/06/48/81/333064881.db2.gz QBBLDKPBXWYPMK-VSKRKVRLSA-N 2 1 320.480 4.187 20 0 DIADMP Cc1cccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000378933445 333066026 /nfs/dbraw/zinc/06/60/26/333066026.db2.gz ZWQWLPPKXIAQDQ-IBGZPJMESA-N 2 1 322.496 4.353 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)C1 ZINC000462676955 333072508 /nfs/dbraw/zinc/07/25/08/333072508.db2.gz ORFXGDZJLUWPKO-MBOZVWFJSA-N 2 1 300.490 4.339 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000323404384 333121712 /nfs/dbraw/zinc/12/17/12/333121712.db2.gz BPDCMZKIOAUYEU-INIZCTEOSA-N 2 1 305.425 4.209 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1nccc2ccccc21)C(C)C ZINC000582032502 333175322 /nfs/dbraw/zinc/17/53/22/333175322.db2.gz LIZIILMTRCJWFZ-QGZVFWFLSA-N 2 1 313.489 4.394 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)c1cnc2ccsc2c1)[NH+]1CCCCC1 ZINC000184512976 333197667 /nfs/dbraw/zinc/19/76/67/333197667.db2.gz PSOFOOBKTGYASK-GJZGRUSLSA-N 2 1 317.502 4.211 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccnc1 ZINC000185634213 333211094 /nfs/dbraw/zinc/21/10/94/333211094.db2.gz YPVCHPCDPPJRFB-HXUWFJFHSA-N 2 1 315.505 4.310 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+][C@@H](c3ccccc3)C3CC3)C2)cc1 ZINC000310101977 333219252 /nfs/dbraw/zinc/21/92/52/333219252.db2.gz YDNOYVGEEWFNBN-UGKGYDQZSA-N 2 1 320.480 4.249 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCc2occc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310166067 333221459 /nfs/dbraw/zinc/22/14/59/333221459.db2.gz SFHCPDBUJUPSHQ-ILZDJORESA-N 2 1 324.468 4.157 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497518136 333258824 /nfs/dbraw/zinc/25/88/24/333258824.db2.gz KTIHRCOYVSPXGD-OXJNMPFZSA-N 2 1 316.464 4.083 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCC3)[C@H]1c1cccs1 ZINC000502465324 333298034 /nfs/dbraw/zinc/29/80/34/333298034.db2.gz VBICHGKDLHZANO-OIISXLGYSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCC3)[C@H]1c1cccs1 ZINC000502465324 333298036 /nfs/dbraw/zinc/29/80/36/333298036.db2.gz VBICHGKDLHZANO-OIISXLGYSA-N 2 1 304.503 4.053 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525787122 333313466 /nfs/dbraw/zinc/31/34/66/333313466.db2.gz OJVACZQPIQVZBV-QZTJIDSGSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525787123 333313498 /nfs/dbraw/zinc/31/34/98/333313498.db2.gz OJVACZQPIQVZBV-ROUUACIJSA-N 2 1 308.469 4.319 20 0 DIADMP Cc1ccccc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744237 333322848 /nfs/dbraw/zinc/32/28/48/333322848.db2.gz OPZOMDAFODOUSB-ICSRJNTNSA-N 2 1 308.469 4.168 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000221916561 333379660 /nfs/dbraw/zinc/37/96/60/333379660.db2.gz CUFXLWKFEBEPQF-OAHLLOKOSA-N 2 1 312.910 4.197 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000221916561 333379661 /nfs/dbraw/zinc/37/96/61/333379661.db2.gz CUFXLWKFEBEPQF-OAHLLOKOSA-N 2 1 312.910 4.197 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000221918532 333379887 /nfs/dbraw/zinc/37/98/87/333379887.db2.gz FELGBRVTMAPJAQ-ZDUSSCGKSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000221918532 333379888 /nfs/dbraw/zinc/37/98/88/333379888.db2.gz FELGBRVTMAPJAQ-ZDUSSCGKSA-N 2 1 302.384 4.086 20 0 DIADMP Cc1cc[nH+]c(N[C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390851798 333399538 /nfs/dbraw/zinc/39/95/38/333399538.db2.gz HERVFEUUJJNJIR-SFHVURJKSA-N 2 1 309.457 4.103 20 0 DIADMP Cc1cc[nH+]c(N[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1 ZINC000390851798 333399540 /nfs/dbraw/zinc/39/95/40/333399540.db2.gz HERVFEUUJJNJIR-SFHVURJKSA-N 2 1 309.457 4.103 20 0 DIADMP Cc1cccc(N[C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)[nH+]1 ZINC000390853723 333399929 /nfs/dbraw/zinc/39/99/29/333399929.db2.gz HSOHKFKEVLWRFL-GOSISDBHSA-N 2 1 309.457 4.103 20 0 DIADMP Cc1cccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)[nH+]1 ZINC000390853723 333399931 /nfs/dbraw/zinc/39/99/31/333399931.db2.gz HSOHKFKEVLWRFL-GOSISDBHSA-N 2 1 309.457 4.103 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[NH2+]CCC[NH+]1CCCCC1 ZINC000319763355 333403486 /nfs/dbraw/zinc/40/34/86/333403486.db2.gz CYPVREXUFACNKV-UHFFFAOYSA-N 2 1 306.453 4.222 20 0 DIADMP C[C@H](C[NH2+]C1c2ccccc2-c2ccccc21)C[NH+]1CCCC1 ZINC000320786020 335141534 /nfs/dbraw/zinc/14/15/34/335141534.db2.gz WBFWDXOSDYPQJR-MRXNPFEDSA-N 2 1 306.453 4.078 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000391364617 333458171 /nfs/dbraw/zinc/45/81/71/333458171.db2.gz METCCEOOONCXTI-NQIIRXRSSA-N 2 1 314.517 4.252 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000338010244 333467835 /nfs/dbraw/zinc/46/78/35/333467835.db2.gz KHVXQFJOUALREA-SECBINFHSA-N 2 1 318.273 4.301 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000531711522 333549178 /nfs/dbraw/zinc/54/91/78/333549178.db2.gz NCAPMKOXEAAYPM-QKLQHJQFSA-N 2 1 300.490 4.380 20 0 DIADMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2ccsc2)c2ccc(Cl)cc2)C1 ZINC000563424254 333603419 /nfs/dbraw/zinc/60/34/19/333603419.db2.gz KDSZUGNUHBWEAG-IXDOHACOSA-N 2 1 320.889 4.350 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000343450420 335165577 /nfs/dbraw/zinc/16/55/77/335165577.db2.gz PWHSWESLCILLLL-SFHVURJKSA-N 2 1 317.864 4.137 20 0 DIADMP Cc1nc([C@H](C)NCc2cccc(C[N@H+](C)C(C)C)c2)cs1 ZINC000269436597 334001387 /nfs/dbraw/zinc/00/13/87/334001387.db2.gz RDMNYCCHKIGVHT-AWEZNQCLSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cs1 ZINC000269436597 334001388 /nfs/dbraw/zinc/00/13/88/334001388.db2.gz RDMNYCCHKIGVHT-AWEZNQCLSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cs1 ZINC000269436597 334001389 /nfs/dbraw/zinc/00/13/89/334001389.db2.gz RDMNYCCHKIGVHT-AWEZNQCLSA-N 2 1 317.502 4.143 20 0 DIADMP Clc1cccc([C@@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000415081893 334272914 /nfs/dbraw/zinc/27/29/14/334272914.db2.gz CQBQBWIFNIJWNP-OALUTQOASA-N 2 1 314.860 4.161 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc(F)c(Cl)cc1Cl ZINC000415097305 334280983 /nfs/dbraw/zinc/28/09/83/334280983.db2.gz CRBVSKDEXZRETL-GARJFASQSA-N 2 1 319.251 4.171 20 0 DIADMP Cc1ccccc1C1(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC000415098514 334281243 /nfs/dbraw/zinc/28/12/43/334281243.db2.gz FJXOKUXBPQZIIU-TZIWHRDSSA-N 2 1 320.480 4.110 20 0 DIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837773 334291389 /nfs/dbraw/zinc/29/13/89/334291389.db2.gz OALNBFBNDCMGOL-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837773 334291390 /nfs/dbraw/zinc/29/13/90/334291390.db2.gz OALNBFBNDCMGOL-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837773 334291391 /nfs/dbraw/zinc/29/13/91/334291391.db2.gz OALNBFBNDCMGOL-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC000302837773 334291392 /nfs/dbraw/zinc/29/13/92/334291392.db2.gz OALNBFBNDCMGOL-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC)c(Cl)c2)CC1 ZINC000531961977 334312505 /nfs/dbraw/zinc/31/25/05/334312505.db2.gz DTBZLADZROWMKR-CQSZACIVSA-N 2 1 324.896 4.264 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCc3ccccc32)CC1 ZINC000531967590 334326398 /nfs/dbraw/zinc/32/63/98/334326398.db2.gz GTLUSFQTDBFSRC-VGSWGCGISA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000534757358 334336902 /nfs/dbraw/zinc/33/69/02/334336902.db2.gz XWQLSJYKFZPFMY-YLJYHZDGSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000534757358 334336903 /nfs/dbraw/zinc/33/69/03/334336903.db2.gz XWQLSJYKFZPFMY-YLJYHZDGSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000534757358 334336904 /nfs/dbraw/zinc/33/69/04/334336904.db2.gz XWQLSJYKFZPFMY-YLJYHZDGSA-N 2 1 311.473 4.179 20 0 DIADMP COc1ccc([C@@H](CCC(C)C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972457 334336915 /nfs/dbraw/zinc/33/69/15/334336915.db2.gz YYSCOLBQWBYDOV-YLJYHZDGSA-N 2 1 318.505 4.104 20 0 DIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(Cl)c2F)CC1 ZINC000535083039 334366625 /nfs/dbraw/zinc/36/66/25/334366625.db2.gz ISJKVJTXGXHOSI-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(Cl)c2F)CC1 ZINC000535083039 334366627 /nfs/dbraw/zinc/36/66/27/334366627.db2.gz ISJKVJTXGXHOSI-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000535228774 334381014 /nfs/dbraw/zinc/38/10/14/334381014.db2.gz DUEBKOSPBIHNNS-BMGDILEWSA-N 2 1 304.503 4.076 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000535228774 334381016 /nfs/dbraw/zinc/38/10/16/334381016.db2.gz DUEBKOSPBIHNNS-BMGDILEWSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000342864390 334584606 /nfs/dbraw/zinc/58/46/06/334584606.db2.gz NCHPMXAWZHECEZ-UHFFFAOYSA-N 2 1 324.255 4.167 20 0 DIADMP CC[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000344302012 335238417 /nfs/dbraw/zinc/23/84/17/335238417.db2.gz SFHZNWYAXGJGIW-OAQYLSRUSA-N 2 1 324.468 4.151 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2cccc(F)c2)cc1 ZINC000346224235 335386037 /nfs/dbraw/zinc/38/60/37/335386037.db2.gz WKDFWEFKVSHGJB-HNNXBMFYSA-N 2 1 323.415 4.213 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1C(C)(C)C ZINC000535839401 335792547 /nfs/dbraw/zinc/79/25/47/335792547.db2.gz YXUXOSRTIILABW-OAHLLOKOSA-N 2 1 300.490 4.262 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C3(C4CCC4)CCC3)CC23CC3)cc1 ZINC000583630550 336007488 /nfs/dbraw/zinc/00/74/88/336007488.db2.gz HLZDJOOYKIRWEW-HXUWFJFHSA-N 2 1 324.512 4.496 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C3(C4CCC4)CCC3)CC23CC3)cc1 ZINC000583630550 336007490 /nfs/dbraw/zinc/00/74/90/336007490.db2.gz HLZDJOOYKIRWEW-HXUWFJFHSA-N 2 1 324.512 4.496 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1)c1cccc(O)c1 ZINC000192035273 336016887 /nfs/dbraw/zinc/01/68/87/336016887.db2.gz YTSOPTORALKPIU-FRQCXROJSA-N 2 1 316.489 4.086 20 0 DIADMP Cc1sccc1C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000351568543 336045286 /nfs/dbraw/zinc/04/52/86/336045286.db2.gz ODUFLHFVTMFHMJ-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1sccc1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000351568543 336045288 /nfs/dbraw/zinc/04/52/88/336045288.db2.gz ODUFLHFVTMFHMJ-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1sccc1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000351568543 336045290 /nfs/dbraw/zinc/04/52/90/336045290.db2.gz ODUFLHFVTMFHMJ-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1sccc1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000351568543 336045291 /nfs/dbraw/zinc/04/52/91/336045291.db2.gz ODUFLHFVTMFHMJ-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CCCCc2ccccc2)CC1 ZINC000352356159 336213921 /nfs/dbraw/zinc/21/39/21/336213921.db2.gz GRDLXHWUXNNRHO-UHFFFAOYSA-N 2 1 324.468 4.256 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2cccs2)cc1 ZINC000532507084 336252679 /nfs/dbraw/zinc/25/26/79/336252679.db2.gz VOCFLXXDELDTBX-HOTGVXAUSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cc1 ZINC000532505379 336252707 /nfs/dbraw/zinc/25/27/07/336252707.db2.gz IDQXNACWUYELNY-QZTJIDSGSA-N 2 1 324.468 4.471 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cc1 ZINC000532505380 336252720 /nfs/dbraw/zinc/25/27/20/336252720.db2.gz IDQXNACWUYELNY-ROUUACIJSA-N 2 1 324.468 4.471 20 0 DIADMP CCC(CC)(C[NH2+][C@@H]1C[C@H](C)[N@@H+](C)C[C@@H]1C)c1ccccc1 ZINC000532532233 336253978 /nfs/dbraw/zinc/25/39/78/336253978.db2.gz TZUIVFIDUKXLHK-JENIJYKNSA-N 2 1 302.506 4.063 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526974263 336277054 /nfs/dbraw/zinc/27/70/54/336277054.db2.gz QBEGAUCTQZMIFG-GASCZTMLSA-N 2 1 310.432 4.082 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526974393 336277135 /nfs/dbraw/zinc/27/71/35/336277135.db2.gz KIEOISRRUBUKBN-HNNXBMFYSA-N 2 1 310.432 4.226 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)C(c2ccccc2)c2ccccc2)CC1 ZINC000325114304 336279304 /nfs/dbraw/zinc/27/93/04/336279304.db2.gz KJYBVWTYHBVDOM-SFHVURJKSA-N 2 1 322.496 4.281 20 0 DIADMP C[C@H](CC[NH2+]Cc1cscc1C(F)(F)F)[NH+]1CCCCC1 ZINC000352862128 336282406 /nfs/dbraw/zinc/28/24/06/336282406.db2.gz MCHXFRDJHRKGBA-GFCCVEGCSA-N 2 1 320.424 4.121 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000325313895 336283430 /nfs/dbraw/zinc/28/34/30/336283430.db2.gz ZWQWLPPKXIAQDQ-LJQANCHMSA-N 2 1 322.496 4.353 20 0 DIADMP Clc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000192917855 336284406 /nfs/dbraw/zinc/28/44/06/336284406.db2.gz PGRAGIKLYSKGTL-HNNXBMFYSA-N 2 1 320.889 4.013 20 0 DIADMP Clc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000192917855 336284407 /nfs/dbraw/zinc/28/44/07/336284407.db2.gz PGRAGIKLYSKGTL-HNNXBMFYSA-N 2 1 320.889 4.013 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]c3cc(Cl)ccc32)C1 ZINC000301463034 336308354 /nfs/dbraw/zinc/30/83/54/336308354.db2.gz JYDFCPGJQOKCDQ-AWEZNQCLSA-N 2 1 317.864 4.056 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CCN(c2cc[nH+]c3cc(Cl)ccc32)C1 ZINC000301463034 336308355 /nfs/dbraw/zinc/30/83/55/336308355.db2.gz JYDFCPGJQOKCDQ-AWEZNQCLSA-N 2 1 317.864 4.056 20 0 DIADMP Clc1c[nH+]ccc1NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000301497651 336310477 /nfs/dbraw/zinc/31/04/77/336310477.db2.gz CYGQEXNMDZISSC-ZDUSSCGKSA-N 2 1 321.877 4.121 20 0 DIADMP Clc1c[nH+]ccc1NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301497651 336310478 /nfs/dbraw/zinc/31/04/78/336310478.db2.gz CYGQEXNMDZISSC-ZDUSSCGKSA-N 2 1 321.877 4.121 20 0 DIADMP CC[NH+](CC)Cc1ccccc1CNc1cc[nH+]cc1Cl ZINC000301570566 336315615 /nfs/dbraw/zinc/31/56/15/336315615.db2.gz KSRWFKMGQQHKFJ-UHFFFAOYSA-N 2 1 303.837 4.189 20 0 DIADMP Clc1c[nH+]ccc1NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000301602336 336317761 /nfs/dbraw/zinc/31/77/61/336317761.db2.gz WFMGZCALFGFNQX-CQSZACIVSA-N 2 1 307.850 4.046 20 0 DIADMP CC[NH+](CC)Cc1cccc(CNc2[nH]c3ccccc3[nH+]2)c1 ZINC000301900054 336337204 /nfs/dbraw/zinc/33/72/04/336337204.db2.gz YSZHUSZRVULPCV-UHFFFAOYSA-N 2 1 308.429 4.017 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCC[C@@H]2CCF)CC1 ZINC000514104867 336352612 /nfs/dbraw/zinc/35/26/12/336352612.db2.gz NCAHQNIEHZJKRS-XLIONFOSSA-N 2 1 318.480 4.077 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000514106297 336360962 /nfs/dbraw/zinc/36/09/62/336360962.db2.gz XJGACCFOJGZWCA-INIZCTEOSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000152443422 336384509 /nfs/dbraw/zinc/38/45/09/336384509.db2.gz JMGQLVPDFBGHPR-HZPDHXFCSA-N 2 1 318.530 4.322 20 0 DIADMP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610540 336386178 /nfs/dbraw/zinc/38/61/78/336386178.db2.gz ZRXPORAFUSPHFY-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610540 336386179 /nfs/dbraw/zinc/38/61/79/336386179.db2.gz ZRXPORAFUSPHFY-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610540 336386180 /nfs/dbraw/zinc/38/61/80/336386180.db2.gz ZRXPORAFUSPHFY-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610540 336386181 /nfs/dbraw/zinc/38/61/81/336386181.db2.gz ZRXPORAFUSPHFY-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP Fc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000563957689 336388369 /nfs/dbraw/zinc/38/83/69/336388369.db2.gz QTFFAIGAJRYKEW-HXUWFJFHSA-N 2 1 324.443 4.113 20 0 DIADMP Fc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000563957689 336388370 /nfs/dbraw/zinc/38/83/70/336388370.db2.gz QTFFAIGAJRYKEW-HXUWFJFHSA-N 2 1 324.443 4.113 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472527 336389297 /nfs/dbraw/zinc/38/92/97/336389297.db2.gz BGPNMCSGHUBEIC-HZPDHXFCSA-N 2 1 310.441 4.082 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472527 336389298 /nfs/dbraw/zinc/38/92/98/336389298.db2.gz BGPNMCSGHUBEIC-HZPDHXFCSA-N 2 1 310.441 4.082 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H]2CC(C)(C)Cc3occc32)CC1 ZINC000358016666 336606223 /nfs/dbraw/zinc/60/62/23/336606223.db2.gz GXUAFUADUDGIIY-QGZVFWFLSA-N 2 1 304.478 4.003 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3occc32)CC1 ZINC000359101090 336657866 /nfs/dbraw/zinc/65/78/66/336657866.db2.gz CQYTYCFLTYKVJS-ATZDWAIDSA-N 2 1 316.489 4.290 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCOc3ccc(Cl)cc32)C1 ZINC000361968185 336780397 /nfs/dbraw/zinc/78/03/97/336780397.db2.gz ZFKRFVQHFIMTAW-UXLLHSPISA-N 2 1 322.880 4.016 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCOc3c(Cl)cccc32)C1 ZINC000361971899 336780609 /nfs/dbraw/zinc/78/06/09/336780609.db2.gz OASVNTNAMXYEEF-CPUCHLNUSA-N 2 1 322.880 4.016 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000361973929 336780731 /nfs/dbraw/zinc/78/07/31/336780731.db2.gz ZOTMTXKJWDBXEG-LZWOXQAQSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000377101809 337046871 /nfs/dbraw/zinc/04/68/71/337046871.db2.gz HGNSHAJHWJSMSZ-BYCMXARLSA-N 2 1 324.921 4.110 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024175 337226469 /nfs/dbraw/zinc/22/64/69/337226469.db2.gz MBZMHSZMGZOVOL-OALUTQOASA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024175 337226470 /nfs/dbraw/zinc/22/64/70/337226470.db2.gz MBZMHSZMGZOVOL-OALUTQOASA-N 2 1 310.485 4.106 20 0 DIADMP CC1(C)CCC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000321378036 337260126 /nfs/dbraw/zinc/26/01/26/337260126.db2.gz GSQOAQVPPCHLQB-UHFFFAOYSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cc2ccccc2s1 ZINC000525952586 337309075 /nfs/dbraw/zinc/30/90/75/337309075.db2.gz YXBJCKZQDATNMC-GDBMZVCRSA-N 2 1 302.487 4.426 20 0 DIADMP CCC[N@H+](Cc1cnc(C2CCCCC2)s1)C1CC[NH2+]CC1 ZINC000584469675 337344941 /nfs/dbraw/zinc/34/49/41/337344941.db2.gz QSMATWPQXURUKZ-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP CCC[N@@H+](Cc1cnc(C2CCCCC2)s1)C1CC[NH2+]CC1 ZINC000584469675 337344942 /nfs/dbraw/zinc/34/49/42/337344942.db2.gz QSMATWPQXURUKZ-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)c1C ZINC000422734058 337684581 /nfs/dbraw/zinc/68/45/81/337684581.db2.gz CCAUROIRNSCWQF-UXHICEINSA-N 2 1 319.452 4.328 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]C[C@@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC000422807742 337687431 /nfs/dbraw/zinc/68/74/31/337687431.db2.gz PIEFSBONJMFWCY-VWPQPMDRSA-N 2 1 320.480 4.189 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)Cc1cccc(Cl)c1)c1c[nH+]ccc1N ZINC000422877820 337689787 /nfs/dbraw/zinc/68/97/87/337689787.db2.gz RVMAFMYSQXFBTO-ZDUSSCGKSA-N 2 1 317.864 4.067 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc2cc(Cl)ccc2o1 ZINC000422914720 337691136 /nfs/dbraw/zinc/69/11/36/337691136.db2.gz VRAXRNZQHAJUCN-ZEIJEMSESA-N 2 1 304.821 4.020 20 0 DIADMP c1ccc([C@H]([NH2+]C2CC[NH2+]CC2)c2ccc3ccccc3c2)cc1 ZINC000422913696 337691164 /nfs/dbraw/zinc/69/11/64/337691164.db2.gz ZFAJMNXYQLPNLB-QFIPXVFZSA-N 2 1 316.448 4.271 20 0 DIADMP Cc1cccc(C)c1[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000423040369 337696600 /nfs/dbraw/zinc/69/66/00/337696600.db2.gz UANVYENSFTWFCR-IHPCNDPISA-N 2 1 308.469 4.447 20 0 DIADMP CCCOc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)c(C)c1 ZINC000423071813 337698360 /nfs/dbraw/zinc/69/83/60/337698360.db2.gz OXXINEOTVFSAPU-VQTJNVASSA-N 2 1 310.441 4.018 20 0 DIADMP FC1(F)CCCC[C@H](C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC000423136220 337701174 /nfs/dbraw/zinc/70/11/74/337701174.db2.gz UXFDKKFUKRAKPR-RYQLBKOJSA-N 2 1 322.443 4.285 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)c2ccccc21 ZINC000423167860 337702248 /nfs/dbraw/zinc/70/22/48/337702248.db2.gz FWDGRIVKIXAHST-YYQUZTFQSA-N 2 1 316.807 4.069 20 0 DIADMP c1ccc([C@@H](CC2CCC2)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423189061 337703000 /nfs/dbraw/zinc/70/30/00/337703000.db2.gz OTFJRFQDXKLQLJ-OAQYLSRUSA-N 2 1 323.484 4.082 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(Cl)c(Cl)c1Cl ZINC000423210045 337704229 /nfs/dbraw/zinc/70/42/29/337704229.db2.gz JMNGMNXDDHJJGF-NXEZZACHSA-N 2 1 321.679 4.297 20 0 DIADMP [NH3+][C@@H](C[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1)C1CC1 ZINC000423313558 337711491 /nfs/dbraw/zinc/71/14/91/337711491.db2.gz FVXOEUSJAWCSRA-DLBZAZTESA-N 2 1 320.889 4.012 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000423401240 337715751 /nfs/dbraw/zinc/71/57/51/337715751.db2.gz XBMRJBCZAFHFCG-KKUMJFAQSA-N 2 1 300.446 4.095 20 0 DIADMP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000423383987 337717862 /nfs/dbraw/zinc/71/78/62/337717862.db2.gz FVHAOTMRFYDPSF-CCKFTAQKSA-N 2 1 314.860 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]1 ZINC000423393042 337718601 /nfs/dbraw/zinc/71/86/01/337718601.db2.gz YBNJRZGYBVZRHQ-NIKGAXFTSA-N 2 1 314.860 4.160 20 0 DIADMP C[C@@H]([NH2+][C@@H](C[NH3+])C1CCCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423501053 337723430 /nfs/dbraw/zinc/72/34/30/337723430.db2.gz KWONXVWQGFZTFN-CABNGKKXSA-N 2 1 312.910 4.001 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1 ZINC000119858602 337866620 /nfs/dbraw/zinc/86/66/20/337866620.db2.gz RAJCQZGCOGWZLE-UHFFFAOYSA-N 2 1 314.395 4.058 20 0 DIADMP COc1cccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000119951375 337868150 /nfs/dbraw/zinc/86/81/50/337868150.db2.gz KEKKQAWJOPOGFQ-KRWDZBQOSA-N 2 1 324.468 4.010 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccccc1OC(C)C ZINC000537023232 337868976 /nfs/dbraw/zinc/86/89/76/337868976.db2.gz QJZWCNMSBOWTCX-MRXNPFEDSA-N 2 1 315.461 4.110 20 0 DIADMP CC[C@H](C)[C@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000537113194 337891014 /nfs/dbraw/zinc/89/10/14/337891014.db2.gz BQRDUVCDXUGHNQ-GUYCJALGSA-N 2 1 305.853 4.222 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)[C@@H]1C ZINC000516198403 338007216 /nfs/dbraw/zinc/00/72/16/338007216.db2.gz QGGWMHPNRBEQOC-ZJXIFLPPSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)[C@@H]1C ZINC000516198403 338007217 /nfs/dbraw/zinc/00/72/17/338007217.db2.gz QGGWMHPNRBEQOC-ZJXIFLPPSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1ccncc1CCC[N@@H+]1CCc2sc(Cl)cc2C1 ZINC000516293111 338009952 /nfs/dbraw/zinc/00/99/52/338009952.db2.gz DOUUNCZZSHLPIN-UHFFFAOYSA-N 2 1 306.862 4.096 20 0 DIADMP Cc1ccncc1CCC[N@H+]1CCc2sc(Cl)cc2C1 ZINC000516293111 338009953 /nfs/dbraw/zinc/00/99/53/338009953.db2.gz DOUUNCZZSHLPIN-UHFFFAOYSA-N 2 1 306.862 4.096 20 0 DIADMP Cc1nc(C(C)C)oc1CN[C@@H](C)c1cccc(-n2ccnc2)c1 ZINC000428366595 338048933 /nfs/dbraw/zinc/04/89/33/338048933.db2.gz XPUMBXQWJJCYIH-AWEZNQCLSA-N 2 1 324.428 4.143 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429539685 338083393 /nfs/dbraw/zinc/08/33/93/338083393.db2.gz RNZNNKPAHUNRFW-XJKSGUPXSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H]1C[C@H](N(C)Cc2ccc(F)c(Cl)c2Cl)CC[N@H+]1C ZINC000432753964 338166522 /nfs/dbraw/zinc/16/65/22/338166522.db2.gz HJKZGFSALZHMLN-CMPLNLGQSA-N 2 1 319.251 4.047 20 0 DIADMP CC[C@@H](C)[N@@H+](C)Cc1cc(C[NH+](C)[C@@H](C)CC)cc(OC)c1 ZINC000432831502 338169705 /nfs/dbraw/zinc/16/97/05/338169705.db2.gz KAZOHAONWXAAFG-IYBDPMFKSA-N 2 1 306.494 4.156 20 0 DIADMP CC[C@@H](C)[NH+](C)Cc1cc(C[N@H+](C)[C@@H](C)CC)cc(OC)c1 ZINC000432831502 338169706 /nfs/dbraw/zinc/16/97/06/338169706.db2.gz KAZOHAONWXAAFG-IYBDPMFKSA-N 2 1 306.494 4.156 20 0 DIADMP CC[C@@H](C)[NH+](C)Cc1cc(C[N@@H+](C)[C@@H](C)CC)cc(OC)c1 ZINC000432831502 338169707 /nfs/dbraw/zinc/16/97/07/338169707.db2.gz KAZOHAONWXAAFG-IYBDPMFKSA-N 2 1 306.494 4.156 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1)c1cccc(O)c1 ZINC000433045082 338178194 /nfs/dbraw/zinc/17/81/94/338178194.db2.gz DCVHOVNAYTVMAP-YRNRMSPPSA-N 2 1 316.489 4.086 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1)c1cccc(O)c1 ZINC000433045079 338178227 /nfs/dbraw/zinc/17/82/27/338178227.db2.gz DCVHOVNAYTVMAP-JXXFODFXSA-N 2 1 316.489 4.086 20 0 DIADMP C(=C\c1ccccc1)\C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434674943 338223077 /nfs/dbraw/zinc/22/30/77/338223077.db2.gz JLEBRAGTDXEAHK-TWGQIWQCSA-N 2 1 321.468 4.112 20 0 DIADMP CC1CCC(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)CC1 ZINC000434683791 338223292 /nfs/dbraw/zinc/22/32/92/338223292.db2.gz IJDNVDAAXVGZFQ-UHFFFAOYSA-N 2 1 315.505 4.225 20 0 DIADMP c1[nH+]c(C2CC[NH+](CC3CCCCCC3)CC2)n2c1CCCC2 ZINC000434691613 338223558 /nfs/dbraw/zinc/22/35/58/338223558.db2.gz SZJLDKIPMAHMAJ-UHFFFAOYSA-N 2 1 315.505 4.369 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)C1 ZINC000436228251 338262585 /nfs/dbraw/zinc/26/25/85/338262585.db2.gz AYKZXFWQKZUQCE-PWRODBHTSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436271235 338264754 /nfs/dbraw/zinc/26/47/54/338264754.db2.gz QNRXNAPROKGYMX-HNNXBMFYSA-N 2 1 317.452 4.051 20 0 DIADMP COCCC1(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)CCCCC1 ZINC000436272195 338264795 /nfs/dbraw/zinc/26/47/95/338264795.db2.gz SKQZSMLZFUSGNW-IBGZPJMESA-N 2 1 324.553 4.218 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155593121 338295064 /nfs/dbraw/zinc/29/50/64/338295064.db2.gz YNRJBSYZDHVHSR-WFXMLNOXSA-N 2 1 322.496 4.279 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)C(c1ccccc1)c1ccccc1 ZINC000155593121 338295065 /nfs/dbraw/zinc/29/50/65/338295065.db2.gz YNRJBSYZDHVHSR-WFXMLNOXSA-N 2 1 322.496 4.279 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)[C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437593456 338315579 /nfs/dbraw/zinc/31/55/79/338315579.db2.gz NXHBUJXHKVDYHX-LEWJYISDSA-N 2 1 314.517 4.301 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)[C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437593456 338315580 /nfs/dbraw/zinc/31/55/80/338315580.db2.gz NXHBUJXHKVDYHX-LEWJYISDSA-N 2 1 314.517 4.301 20 0 DIADMP C[NH+](C)[C@H](C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)C1CCCCC1 ZINC000438075895 338329994 /nfs/dbraw/zinc/32/99/94/338329994.db2.gz CACZIVZYACGPIZ-ARFHVFGLSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438079955 338330207 /nfs/dbraw/zinc/33/02/07/338330207.db2.gz ZXIBYVAAIRVZRM-QKPAOTATSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438079960 338330329 /nfs/dbraw/zinc/33/03/29/338330329.db2.gz ZXIBYVAAIRVZRM-XUWVNRHRSA-N 2 1 320.443 4.065 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)cc1 ZINC000446749895 338534788 /nfs/dbraw/zinc/53/47/88/338534788.db2.gz CQBLDIBVSVSFIW-OAQYLSRUSA-N 2 1 312.501 4.443 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449061599 338589387 /nfs/dbraw/zinc/58/93/87/338589387.db2.gz GSYMVIIFXZNEAR-QAPCUYQASA-N 2 1 306.881 4.050 20 0 DIADMP C[C@@H](Cc1ccoc1)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000449149486 338597008 /nfs/dbraw/zinc/59/70/08/338597008.db2.gz NUBSPSJIOCKBHH-IRXDYDNUSA-N 2 1 312.457 4.026 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(Cl)sc1Cl ZINC000449162708 338598234 /nfs/dbraw/zinc/59/82/34/338598234.db2.gz KCRUCGCHNZNINL-UHFFFAOYSA-N 2 1 318.273 4.130 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](Cc2cccc3ccoc32)CC1 ZINC000449290624 338609921 /nfs/dbraw/zinc/60/99/21/338609921.db2.gz XWWGKSRUXHPDIW-UHFFFAOYSA-N 2 1 322.408 4.180 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC000449791595 338653395 /nfs/dbraw/zinc/65/33/95/338653395.db2.gz PNWUUDOPSVCLCB-YJBOKZPZSA-N 2 1 306.881 4.050 20 0 DIADMP Cc1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1Cl ZINC000195445316 338902079 /nfs/dbraw/zinc/90/20/79/338902079.db2.gz UOIQDYICHNVDFQ-UHFFFAOYSA-N 2 1 306.881 4.145 20 0 DIADMP C[C@@H]1C[C@@H]1[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000459403972 339027193 /nfs/dbraw/zinc/02/71/93/339027193.db2.gz BYTAMYRJENRSOK-VMDGZTHMSA-N 2 1 318.892 4.254 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(C2CCCC2)cc1 ZINC000462785299 339088455 /nfs/dbraw/zinc/08/84/55/339088455.db2.gz LWQDOBWTFYFADY-MRXNPFEDSA-N 2 1 311.473 4.275 20 0 DIADMP C[C@H]1CCC[N@H+](CCCCNc2cc[nH+]c3ccsc32)C1 ZINC000462786926 339088603 /nfs/dbraw/zinc/08/86/03/339088603.db2.gz FKQRRTCCPSJREF-AWEZNQCLSA-N 2 1 303.475 4.220 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCCNc2cc[nH+]c3ccsc32)C1 ZINC000462786926 339088604 /nfs/dbraw/zinc/08/86/04/339088604.db2.gz FKQRRTCCPSJREF-AWEZNQCLSA-N 2 1 303.475 4.220 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCCCNc1cc[nH+]c2ccsc21 ZINC000462793324 339089015 /nfs/dbraw/zinc/08/90/15/339089015.db2.gz ZQRXSFDOOZUYHD-CQSZACIVSA-N 2 1 303.475 4.363 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCCNc1cc[nH+]c2ccsc21 ZINC000462793324 339089016 /nfs/dbraw/zinc/08/90/16/339089016.db2.gz ZQRXSFDOOZUYHD-CQSZACIVSA-N 2 1 303.475 4.363 20 0 DIADMP C=Cc1ccc(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000462820591 339092028 /nfs/dbraw/zinc/09/20/28/339092028.db2.gz OLXHAEFQHPIPIP-UHFFFAOYSA-N 2 1 320.480 4.126 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462837006 339093519 /nfs/dbraw/zinc/09/35/19/339093519.db2.gz VJMHPEDTPCVCBB-HGKSCXNLSA-N 2 1 300.490 4.018 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462837006 339093520 /nfs/dbraw/zinc/09/35/20/339093520.db2.gz VJMHPEDTPCVCBB-HGKSCXNLSA-N 2 1 300.490 4.018 20 0 DIADMP Fc1ccc2c(N[C@H]3CC[N@H+](CC4CCCC4)C3)cc[nH+]c2c1 ZINC000462955962 339098960 /nfs/dbraw/zinc/09/89/60/339098960.db2.gz KSSBONJISMLDRY-INIZCTEOSA-N 2 1 313.420 4.050 20 0 DIADMP Fc1ccc2c(N[C@H]3CC[N@@H+](CC4CCCC4)C3)cc[nH+]c2c1 ZINC000462955962 339098961 /nfs/dbraw/zinc/09/89/61/339098961.db2.gz KSSBONJISMLDRY-INIZCTEOSA-N 2 1 313.420 4.050 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC000463023176 339100937 /nfs/dbraw/zinc/10/09/37/339100937.db2.gz GYPZXIVDTQGACQ-SJORKVTESA-N 2 1 318.505 4.246 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463138934 339106941 /nfs/dbraw/zinc/10/69/41/339106941.db2.gz FOYUSKKTYZNUMS-DENIHFKCSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463138934 339106942 /nfs/dbraw/zinc/10/69/42/339106942.db2.gz FOYUSKKTYZNUMS-DENIHFKCSA-N 2 1 322.496 4.180 20 0 DIADMP Fc1ccc(CC[NH+]2CCC([NH2+]C3CCCCCC3)CC2)cc1 ZINC000463138749 339106945 /nfs/dbraw/zinc/10/69/45/339106945.db2.gz QEYAXLXIXQXSLZ-UHFFFAOYSA-N 2 1 318.480 4.145 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463204376 339109140 /nfs/dbraw/zinc/10/91/40/339109140.db2.gz ITASNLBAEXPXPU-SCTDSRPQSA-N 2 1 320.546 4.161 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463204376 339109141 /nfs/dbraw/zinc/10/91/41/339109141.db2.gz ITASNLBAEXPXPU-SCTDSRPQSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000463244070 339111566 /nfs/dbraw/zinc/11/15/66/339111566.db2.gz NKFKGHYSEMACJD-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000463244070 339111567 /nfs/dbraw/zinc/11/15/67/339111567.db2.gz NKFKGHYSEMACJD-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463279853 339112906 /nfs/dbraw/zinc/11/29/06/339112906.db2.gz GLRCGGMBYCXDFH-HLIPFELVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463279853 339112907 /nfs/dbraw/zinc/11/29/07/339112907.db2.gz GLRCGGMBYCXDFH-HLIPFELVSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CSCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463281076 339113123 /nfs/dbraw/zinc/11/31/23/339113123.db2.gz JRKFTFMBQVWRSV-MJGOQNOKSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)CSCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463281076 339113124 /nfs/dbraw/zinc/11/31/24/339113124.db2.gz JRKFTFMBQVWRSV-MJGOQNOKSA-N 2 1 320.546 4.018 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCCc2cccc3ccccc32)C1 ZINC000464771287 339152217 /nfs/dbraw/zinc/15/22/17/339152217.db2.gz CTTJQIKFMHIRSN-IBGZPJMESA-N 2 1 324.512 4.436 20 0 DIADMP C[N@@H+](CCC1CCCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831335 339155791 /nfs/dbraw/zinc/15/57/91/339155791.db2.gz NSBGMNNCVVGMPV-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCC1CCCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464831335 339155792 /nfs/dbraw/zinc/15/57/92/339155792.db2.gz NSBGMNNCVVGMPV-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCC1CCCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464831335 339155793 /nfs/dbraw/zinc/15/57/93/339155793.db2.gz NSBGMNNCVVGMPV-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H](C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841340 339156599 /nfs/dbraw/zinc/15/65/99/339156599.db2.gz YBVKYQIZMNFPTC-PZJWPPBQSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@@H](C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841340 339156600 /nfs/dbraw/zinc/15/66/00/339156600.db2.gz YBVKYQIZMNFPTC-PZJWPPBQSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@@H](C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841340 339156601 /nfs/dbraw/zinc/15/66/01/339156601.db2.gz YBVKYQIZMNFPTC-PZJWPPBQSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@H](C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841341 339156723 /nfs/dbraw/zinc/15/67/23/339156723.db2.gz YBVKYQIZMNFPTC-TZIWHRDSSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@H](C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841341 339156724 /nfs/dbraw/zinc/15/67/24/339156724.db2.gz YBVKYQIZMNFPTC-TZIWHRDSSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@H](C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841341 339156725 /nfs/dbraw/zinc/15/67/25/339156725.db2.gz YBVKYQIZMNFPTC-TZIWHRDSSA-N 2 1 322.496 4.244 20 0 DIADMP CC(C)[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[NH+]1CCCC1 ZINC000466353122 339200423 /nfs/dbraw/zinc/20/04/23/339200423.db2.gz QHHOZDXTGLOWMB-GPANFISMSA-N 2 1 320.443 4.065 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1Cl ZINC000467382218 339235746 /nfs/dbraw/zinc/23/57/46/339235746.db2.gz OIPYGDCTHYUPPB-GOEBONIOSA-N 2 1 324.896 4.091 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1Cl ZINC000467382218 339235747 /nfs/dbraw/zinc/23/57/47/339235747.db2.gz OIPYGDCTHYUPPB-GOEBONIOSA-N 2 1 324.896 4.091 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3cccs3)CCCCC2)[C@H](C)C1 ZINC000468766241 339270306 /nfs/dbraw/zinc/27/03/06/339270306.db2.gz AOBFMGWHGBKSIS-IAGOWNOFSA-N 2 1 320.546 4.270 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3cccs3)CCCCC2)[C@@H](C)C1 ZINC000468766265 339270310 /nfs/dbraw/zinc/27/03/10/339270310.db2.gz AOBFMGWHGBKSIS-IRXDYDNUSA-N 2 1 320.546 4.270 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1csc(Cl)c1)[NH+]1CCCCC1 ZINC000468794924 339271019 /nfs/dbraw/zinc/27/10/19/339271019.db2.gz CGDFXDHAMMRIEW-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)CCC2CC2)CC1 ZINC000469787106 339299942 /nfs/dbraw/zinc/29/99/42/339299942.db2.gz ROSCZVMLHWNVLS-KRWDZBQOSA-N 2 1 300.490 4.128 20 0 DIADMP C[C@@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000469847654 339302438 /nfs/dbraw/zinc/30/24/38/339302438.db2.gz ZKQDMQOCISUIDP-OLZOCXBDSA-N 2 1 320.889 4.238 20 0 DIADMP C[C@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@H]1CCC[NH2+]C1 ZINC000469876118 339303555 /nfs/dbraw/zinc/30/35/55/339303555.db2.gz QERHTLHTPJJYNW-AEFFLSMTSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)CC[C@H]1[NH3+] ZINC000469995419 339307479 /nfs/dbraw/zinc/30/74/79/339307479.db2.gz AHQYCJBISQFOBM-MLGOLLRUSA-N 2 1 320.889 4.238 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)CC[C@@H]1[NH3+] ZINC000469995418 339307620 /nfs/dbraw/zinc/30/76/20/339307620.db2.gz AHQYCJBISQFOBM-LRDDRELGSA-N 2 1 320.889 4.238 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000470354692 339317952 /nfs/dbraw/zinc/31/79/52/339317952.db2.gz RPJQRCXVTQGIHS-CVEARBPZSA-N 2 1 308.897 4.154 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000470975079 339333571 /nfs/dbraw/zinc/33/35/71/339333571.db2.gz MHJQPVKHPUAHBV-VQIMIIECSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000470975079 339333572 /nfs/dbraw/zinc/33/35/72/339333572.db2.gz MHJQPVKHPUAHBV-VQIMIIECSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000470975079 339333573 /nfs/dbraw/zinc/33/35/73/339333573.db2.gz MHJQPVKHPUAHBV-VQIMIIECSA-N 2 1 320.908 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000470975079 339333574 /nfs/dbraw/zinc/33/35/74/339333574.db2.gz MHJQPVKHPUAHBV-VQIMIIECSA-N 2 1 320.908 4.455 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472462683 339372353 /nfs/dbraw/zinc/37/23/53/339372353.db2.gz MDRCLSJGUOINKZ-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472462683 339372354 /nfs/dbraw/zinc/37/23/54/339372354.db2.gz MDRCLSJGUOINKZ-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000472462683 339372355 /nfs/dbraw/zinc/37/23/55/339372355.db2.gz MDRCLSJGUOINKZ-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000472462683 339372356 /nfs/dbraw/zinc/37/23/56/339372356.db2.gz MDRCLSJGUOINKZ-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)C1CCC(F)(F)CC1 ZINC000474037903 339398257 /nfs/dbraw/zinc/39/82/57/339398257.db2.gz BLCFAVLEYYDTSP-MRXNPFEDSA-N 2 1 324.459 4.312 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)[NH+]1CCCCC1)C1CCC(F)(F)CC1 ZINC000474049666 339399225 /nfs/dbraw/zinc/39/92/25/339399225.db2.gz AXNIXZJVIWDKRN-CQSZACIVSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc(F)ccc1F ZINC000480016766 339555547 /nfs/dbraw/zinc/55/55/47/339555547.db2.gz NMPOTAPNHJVKJS-MRXNPFEDSA-N 2 1 310.432 4.315 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cc1 ZINC000483168838 339654919 /nfs/dbraw/zinc/65/49/19/339654919.db2.gz NBYDFPYILSBSEZ-QGZVFWFLSA-N 2 1 323.484 4.272 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1(c2ccccc2)CCCC1 ZINC000483830726 339675481 /nfs/dbraw/zinc/67/54/81/339675481.db2.gz DXZHKIAGIOFIJK-QGZVFWFLSA-N 2 1 312.501 4.103 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccccc1C)C1CCCC1 ZINC000494889972 339963699 /nfs/dbraw/zinc/96/36/99/339963699.db2.gz DKJXWASFGRIACU-HXUWFJFHSA-N 2 1 311.473 4.411 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000499149246 340031168 /nfs/dbraw/zinc/03/11/68/340031168.db2.gz SSQNDJQVROLEAC-LELZANKISA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)C[C@H](C)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000499757122 340044141 /nfs/dbraw/zinc/04/41/41/340044141.db2.gz NJJHIKPSKLZJOY-INIZCTEOSA-N 2 1 303.494 4.081 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CCC[NH+]1CCCC1 ZINC000499951731 340047598 /nfs/dbraw/zinc/04/75/98/340047598.db2.gz HKYULHXNHBILOA-AWEZNQCLSA-N 2 1 314.395 4.184 20 0 DIADMP C(C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006803 340072171 /nfs/dbraw/zinc/07/21/71/340072171.db2.gz KJFCWGUFLUQDGC-VQIMIIECSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006803 340072172 /nfs/dbraw/zinc/07/21/72/340072172.db2.gz KJFCWGUFLUQDGC-VQIMIIECSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006803 340072173 /nfs/dbraw/zinc/07/21/73/340072173.db2.gz KJFCWGUFLUQDGC-VQIMIIECSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006803 340072174 /nfs/dbraw/zinc/07/21/74/340072174.db2.gz KJFCWGUFLUQDGC-VQIMIIECSA-N 2 1 322.562 4.001 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000502691099 340110699 /nfs/dbraw/zinc/11/06/99/340110699.db2.gz GHJLAHBZFWINEM-BBRMVZONSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000502691099 340110700 /nfs/dbraw/zinc/11/07/00/340110700.db2.gz GHJLAHBZFWINEM-BBRMVZONSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@@H]1CCC[N@@H+]1C ZINC000502691099 340110701 /nfs/dbraw/zinc/11/07/01/340110701.db2.gz GHJLAHBZFWINEM-BBRMVZONSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@@H]1CCC[N@H+]1C ZINC000502691099 340110702 /nfs/dbraw/zinc/11/07/02/340110702.db2.gz GHJLAHBZFWINEM-BBRMVZONSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1cnn(C2CCCC2)c1 ZINC000502728158 340112524 /nfs/dbraw/zinc/11/25/24/340112524.db2.gz QZJYNJNMCJCUOQ-QAPCUYQASA-N 2 1 320.525 4.015 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)CC(C)(C)c1ccc(C)cc1 ZINC000502898660 340116032 /nfs/dbraw/zinc/11/60/32/340116032.db2.gz HAZUZBRFRODEQL-UHFFFAOYSA-N 2 1 313.489 4.190 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)CC(C)(C)c1ccc(C)cc1 ZINC000502898660 340116033 /nfs/dbraw/zinc/11/60/33/340116033.db2.gz HAZUZBRFRODEQL-UHFFFAOYSA-N 2 1 313.489 4.190 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[N@H+](C)CCCCn1cc[nH+]c1C ZINC000502912577 340116523 /nfs/dbraw/zinc/11/65/23/340116523.db2.gz DUJAFHBDPICGHA-HXUWFJFHSA-N 2 1 313.489 4.233 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CCCCn1cc[nH+]c1C ZINC000502912577 340116524 /nfs/dbraw/zinc/11/65/24/340116524.db2.gz DUJAFHBDPICGHA-HXUWFJFHSA-N 2 1 313.489 4.233 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@H+](CC)CCCCn1cc[nH+]c1C ZINC000503075548 340120233 /nfs/dbraw/zinc/12/02/33/340120233.db2.gz NFYDUYZZSZWMGI-FQEVSTJZSA-N 2 1 313.489 4.315 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](CC)CCCCn1cc[nH+]c1C ZINC000503075548 340120234 /nfs/dbraw/zinc/12/02/34/340120234.db2.gz NFYDUYZZSZWMGI-FQEVSTJZSA-N 2 1 313.489 4.315 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000506325077 340192277 /nfs/dbraw/zinc/19/22/77/340192277.db2.gz JZJKXUSHGIQVJO-UHFFFAOYSA-N 2 1 312.457 4.192 20 0 DIADMP Cc1cc2cc(C[N@H+](C)C3CC[NH+](C(C)C)CC3)oc2cc1C ZINC000506354146 340193138 /nfs/dbraw/zinc/19/31/38/340193138.db2.gz ALRNGSWSQKSIMK-UHFFFAOYSA-N 2 1 314.473 4.354 20 0 DIADMP CCCCOc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000506358089 340193225 /nfs/dbraw/zinc/19/32/25/340193225.db2.gz UATVPOKFKCCRJR-UHFFFAOYSA-N 2 1 318.505 4.170 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000506639770 340198238 /nfs/dbraw/zinc/19/82/38/340198238.db2.gz NWSIWRIYODWLSA-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000506639770 340198239 /nfs/dbraw/zinc/19/82/39/340198239.db2.gz NWSIWRIYODWLSA-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP Cc1ccc(SCC[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1C ZINC000507350940 340217743 /nfs/dbraw/zinc/21/77/43/340217743.db2.gz UOCKKEWPYVGCBG-UHFFFAOYSA-N 2 1 320.546 4.200 20 0 DIADMP Cc1ccc(SCC[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1C ZINC000507350940 340217744 /nfs/dbraw/zinc/21/77/44/340217744.db2.gz UOCKKEWPYVGCBG-UHFFFAOYSA-N 2 1 320.546 4.200 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CC[C@@H]3C3CCC3)C2)c1 ZINC000510723816 340308302 /nfs/dbraw/zinc/30/83/02/340308302.db2.gz UBTUCYQATYTYCX-ATZDWAIDSA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CC[C@@H]3C3CCC3)C2)c1 ZINC000510723816 340308303 /nfs/dbraw/zinc/30/83/03/340308303.db2.gz UBTUCYQATYTYCX-ATZDWAIDSA-N 2 1 318.530 4.128 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccccc1F)C1CCCC1 ZINC000511054441 340319655 /nfs/dbraw/zinc/31/96/55/340319655.db2.gz MKUGMAPWDZPRRR-LJQANCHMSA-N 2 1 315.436 4.242 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000511132130 340321914 /nfs/dbraw/zinc/32/19/14/340321914.db2.gz RNGJWGYWNQLQEX-QFBILLFUSA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000511132130 340321915 /nfs/dbraw/zinc/32/19/15/340321915.db2.gz RNGJWGYWNQLQEX-QFBILLFUSA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(SC(C)C)cc2)[C@@H](C)C1 ZINC000511132130 340321916 /nfs/dbraw/zinc/32/19/16/340321916.db2.gz RNGJWGYWNQLQEX-QFBILLFUSA-N 2 1 320.546 4.349 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303557429 340333386 /nfs/dbraw/zinc/33/33/86/340333386.db2.gz HTLDVTCKISGURE-QYZOEREBSA-N 2 1 300.490 4.334 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303557429 340333387 /nfs/dbraw/zinc/33/33/87/340333387.db2.gz HTLDVTCKISGURE-QYZOEREBSA-N 2 1 300.490 4.334 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000303557429 340333388 /nfs/dbraw/zinc/33/33/88/340333388.db2.gz HTLDVTCKISGURE-QYZOEREBSA-N 2 1 300.490 4.334 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CCC[C@H](C(C)(C)C)CC2)s1 ZINC000511907955 340342586 /nfs/dbraw/zinc/34/25/86/340342586.db2.gz MSMJGTDSIVEVBP-GJZGRUSLSA-N 2 1 323.550 4.289 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC000512135623 340349600 /nfs/dbraw/zinc/34/96/00/340349600.db2.gz MOCCFILBHLVLFH-QKIRZYONSA-N 2 1 322.443 4.222 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3occc3c2)C1 ZINC000512144353 340349628 /nfs/dbraw/zinc/34/96/28/340349628.db2.gz KBBWHTSGJIKEOO-MRXNPFEDSA-N 2 1 300.446 4.035 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)s1 ZINC000512184179 340351348 /nfs/dbraw/zinc/35/13/48/340351348.db2.gz XGGDWIVVTJQGTR-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)s1 ZINC000512184179 340351349 /nfs/dbraw/zinc/35/13/49/340351349.db2.gz XGGDWIVVTJQGTR-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512313501 340356532 /nfs/dbraw/zinc/35/65/32/340356532.db2.gz JSLBNMJFEKYFDP-HRCADAONSA-N 2 1 306.519 4.360 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000512328519 340357296 /nfs/dbraw/zinc/35/72/96/340357296.db2.gz BERYSFOXDJAMRO-WSTZPKSXSA-N 2 1 323.484 4.033 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(C(C)(C)C)cc2)CC1 ZINC000512415103 340360992 /nfs/dbraw/zinc/36/09/92/340360992.db2.gz JKMTYWKAOMMEGQ-UHFFFAOYSA-N 2 1 300.490 4.044 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000512420400 340361328 /nfs/dbraw/zinc/36/13/28/340361328.db2.gz KRIDGVSPUBXVAQ-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000512420400 340361329 /nfs/dbraw/zinc/36/13/29/340361329.db2.gz KRIDGVSPUBXVAQ-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP CN(Cc1cc(Cl)ccc1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512579225 340367837 /nfs/dbraw/zinc/36/78/37/340367837.db2.gz UBEANHWFXWMLLM-YIONKMFJSA-N 2 1 313.272 4.050 20 0 DIADMP CCc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)cc1 ZINC000512810262 340378665 /nfs/dbraw/zinc/37/86/65/340378665.db2.gz QQSHPCVREWUWMW-UHFFFAOYSA-N 2 1 322.496 4.312 20 0 DIADMP CCCOc1cccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000512826325 340379580 /nfs/dbraw/zinc/37/95/80/340379580.db2.gz GQCWFFQISPBJLH-GOSISDBHSA-N 2 1 318.505 4.220 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2ccc(Cl)cc2)C1 ZINC000513003894 340387774 /nfs/dbraw/zinc/38/77/74/340387774.db2.gz LLVOUCVJOJJARX-HKBKRHGFSA-N 2 1 306.881 4.065 20 0 DIADMP CCCC[C@@H](CC)C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309546284 340430039 /nfs/dbraw/zinc/43/00/39/340430039.db2.gz BTNLSWBNGBVDDR-GOSISDBHSA-N 2 1 302.506 4.457 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CCCCC1 ZINC000237408865 340670770 /nfs/dbraw/zinc/67/07/70/340670770.db2.gz ICPFODRDWOWSQY-GOSISDBHSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccco1 ZINC000126470375 340827370 /nfs/dbraw/zinc/82/73/70/340827370.db2.gz GLSUBIGRWZRJOA-KRWDZBQOSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3(c4ccccc4)CC3)CC2)C1 ZINC000538524064 340831126 /nfs/dbraw/zinc/83/11/26/340831126.db2.gz ZBBOGOOYGHXPSE-FXAWDEMLSA-N 2 1 312.501 4.308 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc2c(c1)CCCC2 ZINC000540168872 340919865 /nfs/dbraw/zinc/91/98/65/340919865.db2.gz NXSRXVRGZYVRME-HOTGVXAUSA-N 2 1 311.473 4.057 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccccc1Cl)C(C)C ZINC000540319338 340926779 /nfs/dbraw/zinc/92/67/79/340926779.db2.gz ZERAAWFPZRJVBK-KBXCAEBGSA-N 2 1 319.880 4.468 20 0 DIADMP CC[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(Cl)s1 ZINC000542557137 341013338 /nfs/dbraw/zinc/01/33/38/341013338.db2.gz ZZUBMQVRCUKTES-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000542486764 341009744 /nfs/dbraw/zinc/00/97/44/341009744.db2.gz MAWRTJDFKBVLAF-HUUCEWRRSA-N 2 1 323.550 4.490 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000542534192 341012558 /nfs/dbraw/zinc/01/25/58/341012558.db2.gz YOMUSFQZDJDBTA-MSOLQXFVSA-N 2 1 300.490 4.046 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1 ZINC000542667740 341016505 /nfs/dbraw/zinc/01/65/05/341016505.db2.gz XESOCLHZNBOIIM-AWEZNQCLSA-N 2 1 311.454 4.271 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C2CCCC2)o1 ZINC000542670856 341016625 /nfs/dbraw/zinc/01/66/25/341016625.db2.gz LDSINCMGEIOENY-HXUWFJFHSA-N 2 1 316.489 4.283 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000542774077 341019952 /nfs/dbraw/zinc/01/99/52/341019952.db2.gz WXWDNTJHZNCJFV-NQIIRXRSSA-N 2 1 308.469 4.016 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000542774077 341019953 /nfs/dbraw/zinc/01/99/53/341019953.db2.gz WXWDNTJHZNCJFV-NQIIRXRSSA-N 2 1 308.469 4.016 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000542840600 341022959 /nfs/dbraw/zinc/02/29/59/341022959.db2.gz BXRJXFLXMICPOO-INIZCTEOSA-N 2 1 315.505 4.092 20 0 DIADMP C[C@@H](CCSc1ccccc1)[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000543191562 341036052 /nfs/dbraw/zinc/03/60/52/341036052.db2.gz HNLUYCALFRUJQC-KRWDZBQOSA-N 2 1 318.530 4.118 20 0 DIADMP C[C@@H](CCSc1ccccc1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000543191562 341036053 /nfs/dbraw/zinc/03/60/53/341036053.db2.gz HNLUYCALFRUJQC-KRWDZBQOSA-N 2 1 318.530 4.118 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2CCC3(CCC[N@@H+]3C)CC2)cc1 ZINC000543192702 341036267 /nfs/dbraw/zinc/03/62/67/341036267.db2.gz SJMSFCBLTSNLOV-QGZVFWFLSA-N 2 1 300.490 4.431 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2CCC3(CCC[N@H+]3C)CC2)cc1 ZINC000543192702 341036268 /nfs/dbraw/zinc/03/62/68/341036268.db2.gz SJMSFCBLTSNLOV-QGZVFWFLSA-N 2 1 300.490 4.431 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000543207295 341036936 /nfs/dbraw/zinc/03/69/36/341036936.db2.gz CITABJVYQUMLNS-ROUUACIJSA-N 2 1 300.490 4.289 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)c1ccc(Cl)s1)[NH+]1CCCCC1 ZINC000543417419 341043422 /nfs/dbraw/zinc/04/34/22/341043422.db2.gz KMSLGQFTJRSLAJ-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP CCC[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cccnc1 ZINC000543609026 341050965 /nfs/dbraw/zinc/05/09/65/341050965.db2.gz TZOASLATYRXTLO-IBGZPJMESA-N 2 1 303.494 4.167 20 0 DIADMP CCC[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cccnc1 ZINC000543609026 341050966 /nfs/dbraw/zinc/05/09/66/341050966.db2.gz TZOASLATYRXTLO-IBGZPJMESA-N 2 1 303.494 4.167 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC[N@@H+]1C ZINC000132217444 341118574 /nfs/dbraw/zinc/11/85/74/341118574.db2.gz DWVWNYPQFJZFAQ-FSPWUOQZSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC[N@H+]1C ZINC000132217444 341118575 /nfs/dbraw/zinc/11/85/75/341118575.db2.gz DWVWNYPQFJZFAQ-FSPWUOQZSA-N 2 1 306.881 4.254 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000545952774 341148211 /nfs/dbraw/zinc/14/82/11/341148211.db2.gz BWCYMUNBHISNJM-UXPWSPDFSA-N 2 1 311.473 4.062 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000237417303 341213747 /nfs/dbraw/zinc/21/37/47/341213747.db2.gz CPZQVZPGUOAQQD-UZLBHIALSA-N 2 1 312.457 4.190 20 0 DIADMP CCSc1cccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000547448900 341214439 /nfs/dbraw/zinc/21/44/39/341214439.db2.gz PCXYOSKHAQAQEP-UHFFFAOYSA-N 2 1 320.546 4.351 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C[N@H+]1Cc1ccccc1 ZINC000548884883 341279850 /nfs/dbraw/zinc/27/98/50/341279850.db2.gz BJMWMVYEYUOVOO-QNDFHXLGSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCC[C@H]3C[C@H]32)C[N@H+]1Cc1ccccc1 ZINC000548884882 341279890 /nfs/dbraw/zinc/27/98/90/341279890.db2.gz BJMWMVYEYUOVOO-OBJCFNGXSA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000549613283 341299062 /nfs/dbraw/zinc/29/90/62/341299062.db2.gz CXINAQDYMHWCOL-QIJZPMMNSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000549804000 341303412 /nfs/dbraw/zinc/30/34/12/341303412.db2.gz RMZFYMDMAHHRIB-UHFFFAOYSA-N 2 1 320.889 4.215 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000245600675 341304500 /nfs/dbraw/zinc/30/45/00/341304500.db2.gz MIPQCAMGNNQECE-PXNSSMCTSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000245600675 341304501 /nfs/dbraw/zinc/30/45/01/341304501.db2.gz MIPQCAMGNNQECE-PXNSSMCTSA-N 2 1 311.473 4.097 20 0 DIADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCCc3cccc4ccccc43)C2)C1 ZINC000549839347 341304554 /nfs/dbraw/zinc/30/45/54/341304554.db2.gz GUHSPPOZUJAQKX-JOCHJYFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCCc3cccc4ccccc43)C2)C1 ZINC000549839347 341304555 /nfs/dbraw/zinc/30/45/55/341304555.db2.gz GUHSPPOZUJAQKX-JOCHJYFZSA-N 2 1 322.496 4.190 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCCc3cccc4ccccc43)C2)C1 ZINC000549839347 341304556 /nfs/dbraw/zinc/30/45/56/341304556.db2.gz GUHSPPOZUJAQKX-JOCHJYFZSA-N 2 1 322.496 4.190 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245656429 341307984 /nfs/dbraw/zinc/30/79/84/341307984.db2.gz DSQACTBMAPFPTC-CZKCSJLSSA-N 2 1 300.490 4.206 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000550621994 341319837 /nfs/dbraw/zinc/31/98/37/341319837.db2.gz HWESMMOHZCXGDE-PIKOESSRSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000550621994 341319838 /nfs/dbraw/zinc/31/98/38/341319838.db2.gz HWESMMOHZCXGDE-PIKOESSRSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700455 341321628 /nfs/dbraw/zinc/32/16/28/341321628.db2.gz JYHGREONGCSFSP-RBBKRZOGSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700455 341321629 /nfs/dbraw/zinc/32/16/29/341321629.db2.gz JYHGREONGCSFSP-RBBKRZOGSA-N 2 1 322.496 4.271 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550700134 341321651 /nfs/dbraw/zinc/32/16/51/341321651.db2.gz BZSCFZINPAZSCZ-CIAFKFPVSA-N 2 1 320.480 4.043 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC000550700134 341321652 /nfs/dbraw/zinc/32/16/52/341321652.db2.gz BZSCFZINPAZSCZ-CIAFKFPVSA-N 2 1 320.480 4.043 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)CCCC2)c(C)c1 ZINC000550921563 341326832 /nfs/dbraw/zinc/32/68/32/341326832.db2.gz SHUQADWNEYFZRV-RTBURBONSA-N 2 1 314.517 4.188 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(c3ccccc3)CCC2)C[C@@H]1c1ccccc1 ZINC000551114765 341332030 /nfs/dbraw/zinc/33/20/30/341332030.db2.gz HHHMARSDICFOSR-NHCUHLMSSA-N 2 1 320.480 4.491 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2(c3ccccc3)CCC2)C[C@@H]1c1ccccc1 ZINC000551114765 341332031 /nfs/dbraw/zinc/33/20/31/341332031.db2.gz HHHMARSDICFOSR-NHCUHLMSSA-N 2 1 320.480 4.491 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCC2(C)C)C[C@H]1c1ccccc1 ZINC000551301054 341337678 /nfs/dbraw/zinc/33/76/78/341337678.db2.gz CLLLDDLZMPQYRU-QYZOEREBSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCCC2(C)C)C[C@H]1c1ccccc1 ZINC000551301054 341337679 /nfs/dbraw/zinc/33/76/79/341337679.db2.gz CLLLDDLZMPQYRU-QYZOEREBSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)[C@@H]2CCC[C@H]21 ZINC000551308027 341337965 /nfs/dbraw/zinc/33/79/65/341337965.db2.gz IUCWJIUJABJHLD-NZMUHZMNSA-N 2 1 318.892 4.048 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551309935 341338138 /nfs/dbraw/zinc/33/81/38/341338138.db2.gz ZPCLHQQWQWAOKW-SGZDXZSOSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)CC[NH+](C)C)cc1Cl ZINC000551529473 341343943 /nfs/dbraw/zinc/34/39/43/341343943.db2.gz CAZFSWPWIBUKEL-ZIAGYGMSSA-N 2 1 312.885 4.118 20 0 DIADMP FCCCCC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000551700449 341349257 /nfs/dbraw/zinc/34/92/57/341349257.db2.gz ZAADFSBCHIBMAI-UXHICEINSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)c2cccs2)CC[N@@H+]1C ZINC000246541678 341353415 /nfs/dbraw/zinc/35/34/15/341353415.db2.gz VZNIFLYHZMXPRX-KBAYOESNSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)c2cccs2)CC[N@H+]1C ZINC000246541678 341353416 /nfs/dbraw/zinc/35/34/16/341353416.db2.gz VZNIFLYHZMXPRX-KBAYOESNSA-N 2 1 314.498 4.104 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC000246906621 341358612 /nfs/dbraw/zinc/35/86/12/341358612.db2.gz GCEOAVXMKOPBOR-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccccc2C(F)(F)F)C1 ZINC000246939331 341358909 /nfs/dbraw/zinc/35/89/09/341358909.db2.gz HNPPXMXSJAXEJX-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cnc2ccsc2c1 ZINC000246994024 341359606 /nfs/dbraw/zinc/35/96/06/341359606.db2.gz SBLLCAOSRNJJEX-LSDHHAIUSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cnc2ccsc2c1 ZINC000246994024 341359607 /nfs/dbraw/zinc/35/96/07/341359607.db2.gz SBLLCAOSRNJJEX-LSDHHAIUSA-N 2 1 317.502 4.211 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(F)cc1F ZINC000552041212 341364089 /nfs/dbraw/zinc/36/40/89/341364089.db2.gz LOEDHRFRLNLYFP-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(F)cc1F ZINC000552041212 341364090 /nfs/dbraw/zinc/36/40/90/341364090.db2.gz LOEDHRFRLNLYFP-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000247883272 341370873 /nfs/dbraw/zinc/37/08/73/341370873.db2.gz CDJKADRKRXCEPK-JRGCBEDISA-N 2 1 308.469 4.043 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000247883272 341370874 /nfs/dbraw/zinc/37/08/74/341370874.db2.gz CDJKADRKRXCEPK-JRGCBEDISA-N 2 1 308.469 4.043 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248407242 341376741 /nfs/dbraw/zinc/37/67/41/341376741.db2.gz UDQGIPUKWJDVFG-SCTDSRPQSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@@H](N[C@@H](C)c1cc(F)cc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405961 341376769 /nfs/dbraw/zinc/37/67/69/341376769.db2.gz RXKDBAOHMMGUPE-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248405961 341376770 /nfs/dbraw/zinc/37/67/70/341376770.db2.gz RXKDBAOHMMGUPE-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248405961 341376771 /nfs/dbraw/zinc/37/67/71/341376771.db2.gz RXKDBAOHMMGUPE-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cccnc1 ZINC000248515278 341379011 /nfs/dbraw/zinc/37/90/11/341379011.db2.gz OAJJFAGUMYFDPS-MJGOQNOKSA-N 2 1 303.494 4.167 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CC23CCCC3)CC1 ZINC000552262454 341382333 /nfs/dbraw/zinc/38/23/33/341382333.db2.gz XGEPPDSPYZIIMA-SOAGJPPSSA-N 2 1 312.501 4.352 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000248754162 341385893 /nfs/dbraw/zinc/38/58/93/341385893.db2.gz UTVWYLRNAFKCNM-SLTXQBBLSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000248754162 341385894 /nfs/dbraw/zinc/38/58/94/341385894.db2.gz UTVWYLRNAFKCNM-SLTXQBBLSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000248754162 341385895 /nfs/dbraw/zinc/38/58/95/341385895.db2.gz UTVWYLRNAFKCNM-SLTXQBBLSA-N 2 1 320.443 4.017 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3CCC34CCCC4)C2)c1 ZINC000249152305 341394786 /nfs/dbraw/zinc/39/47/86/341394786.db2.gz XYGZKLIXBIIINW-WMZOPIPTSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCC34CCCC4)C2)c1 ZINC000249152305 341394787 /nfs/dbraw/zinc/39/47/87/341394787.db2.gz XYGZKLIXBIIINW-WMZOPIPTSA-N 2 1 318.530 4.273 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000249416421 341397372 /nfs/dbraw/zinc/39/73/72/341397372.db2.gz ZNRNDSGQXSVVNZ-PMPSAXMXSA-N 2 1 320.443 4.209 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000249416413 341397422 /nfs/dbraw/zinc/39/74/22/341397422.db2.gz ZNRNDSGQXSVVNZ-BZUAXINKSA-N 2 1 320.443 4.209 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@H](c2cccc(Cl)c2)C1)c1c[nH+]ccc1N ZINC000567639634 341623822 /nfs/dbraw/zinc/62/38/22/341623822.db2.gz ARCCSLXYNVNMQS-DUVNUKRYSA-N 2 1 315.848 4.134 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CCc1ccccc1)C(C)C ZINC000164683742 341706897 /nfs/dbraw/zinc/70/68/97/341706897.db2.gz SGJAUWWUVPLSDK-FQEVSTJZSA-N 2 1 313.489 4.219 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2cnc3ccsc3c2)CC1 ZINC000131217546 519720807 /nfs/dbraw/zinc/72/08/07/519720807.db2.gz HOGSNPRJJSEFCC-AWEZNQCLSA-N 2 1 317.502 4.067 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C(F)F)cc1 ZINC000191512924 521662742 /nfs/dbraw/zinc/66/27/42/521662742.db2.gz UKIDUCFYIFAINK-UHFFFAOYSA-N 2 1 321.415 4.295 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000191512924 521662744 /nfs/dbraw/zinc/66/27/44/521662744.db2.gz UKIDUCFYIFAINK-UHFFFAOYSA-N 2 1 321.415 4.295 20 0 DIADMP C[C@@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1 ZINC000188055451 524736799 /nfs/dbraw/zinc/73/67/99/524736799.db2.gz FPHZSIQEWTTYTH-DXJOGWAWSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000156740096 525401782 /nfs/dbraw/zinc/40/17/82/525401782.db2.gz BTJKGWWKEIVBEN-OAHLLOKOSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccccn1 ZINC000158640078 525440389 /nfs/dbraw/zinc/44/03/89/525440389.db2.gz SGLKHLSZNUEKDO-MSOLQXFVSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1ccncc1 ZINC000266504626 525440979 /nfs/dbraw/zinc/44/09/79/525440979.db2.gz WEMAQDZPQQAYEF-ROUUACIJSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1sccc1C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000339212893 526915391 /nfs/dbraw/zinc/91/53/91/526915391.db2.gz FYGOPNXELGBIMF-OAHLLOKOSA-N 2 1 320.527 4.120 20 0 DIADMP Cc1sccc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000339212893 526915397 /nfs/dbraw/zinc/91/53/97/526915397.db2.gz FYGOPNXELGBIMF-OAHLLOKOSA-N 2 1 320.527 4.120 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000338025788 527419650 /nfs/dbraw/zinc/41/96/50/527419650.db2.gz XUUBGIUYGWOOMX-UHFFFAOYSA-N 2 1 311.473 4.072 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(Cl)cc1Cl ZINC000643545965 1035589355 /nfs/dbraw/zinc/58/93/55/1035589355.db2.gz GKIFLEYXWAVZQW-DGCLKSJQSA-N 2 1 313.272 4.319 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC ZINC000643546510 1035591569 /nfs/dbraw/zinc/59/15/69/1035591569.db2.gz PRJVGYHYVMNCAX-GOEBONIOSA-N 2 1 322.880 4.064 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546342 1035592769 /nfs/dbraw/zinc/59/27/69/1035592769.db2.gz NDRYSYQDFRYBQG-GXTWGEPZSA-N 2 1 321.534 4.074 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1OC(F)F ZINC000643547006 1035594357 /nfs/dbraw/zinc/59/43/57/1035594357.db2.gz YFJJBTMQHMGILW-UKRRQHHQSA-N 2 1 324.415 4.003 20 0 DIADMP c1ccc(C([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643548019 1035605914 /nfs/dbraw/zinc/60/59/14/1035605914.db2.gz MBEXBVPSEZXOSW-IBGZPJMESA-N 2 1 306.453 4.040 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000321148765 1035624259 /nfs/dbraw/zinc/62/42/59/1035624259.db2.gz OQUWNVKRHBGTRH-INIZCTEOSA-N 2 1 314.473 4.207 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001206768722 1035662468 /nfs/dbraw/zinc/66/24/68/1035662468.db2.gz LUNPRKUFZYNNFP-STQMWFEESA-N 2 1 306.500 4.036 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(C)ccc2C)CC1 ZINC001167075810 1035786766 /nfs/dbraw/zinc/78/67/66/1035786766.db2.gz CODHBPNUHNOPMY-UHFFFAOYSA-N 2 1 302.506 4.247 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2ccccc2C)CC1 ZINC001167078742 1035807537 /nfs/dbraw/zinc/80/75/37/1035807537.db2.gz UBPVLSNUTIWUDT-GOSISDBHSA-N 2 1 302.506 4.500 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H]2CCSc3ccccc32)CC1 ZINC000037150134 1035954155 /nfs/dbraw/zinc/95/41/55/1035954155.db2.gz VVVGZPAQGOYLQM-KRWDZBQOSA-N 2 1 304.503 4.078 20 0 DIADMP CC(C)[C@@H](CSc1ccccc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000180028968 1036027332 /nfs/dbraw/zinc/02/73/32/1036027332.db2.gz XKJJIOUCYJMUDY-LJQANCHMSA-N 2 1 318.530 4.020 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c1 ZINC001648795585 1036248888 /nfs/dbraw/zinc/24/88/88/1036248888.db2.gz QEFDRTPVXWJNGJ-QGZVFWFLSA-N 2 1 312.457 4.252 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCC2 ZINC001648802625 1036373920 /nfs/dbraw/zinc/37/39/20/1036373920.db2.gz NNAZTMGCEKRHLD-UHFFFAOYSA-N 2 1 322.496 4.305 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC001648805485 1036409196 /nfs/dbraw/zinc/40/91/96/1036409196.db2.gz SHNPVQRVTZUMSZ-LPHOPBHVSA-N 2 1 302.506 4.441 20 0 DIADMP C1CC1[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683471154 1036422634 /nfs/dbraw/zinc/42/26/34/1036422634.db2.gz AXISSTKJIRWTTG-UHFFFAOYSA-N 2 1 304.522 4.342 20 0 DIADMP CCSc1cccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC001648816693 1036576730 /nfs/dbraw/zinc/57/67/30/1036576730.db2.gz DRQFIOQRPYAHLC-QGZVFWFLSA-N 2 1 320.546 4.400 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c(Cl)c1 ZINC001648817194 1036578357 /nfs/dbraw/zinc/57/83/57/1036578357.db2.gz YIQMPLWRMQDEDL-INIZCTEOSA-N 2 1 308.897 4.393 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@@H]2CCCC[C@H]2C)CC1 ZINC001648826620 1036604711 /nfs/dbraw/zinc/60/47/11/1036604711.db2.gz LVLJRLYAJOVLEJ-MJGOQNOKSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@H](C[NH2+]C[C@@H](C1CC1)[NH+](C)C)Cc1ccc(C(C)(C)C)cc1 ZINC001648837411 1036618016 /nfs/dbraw/zinc/61/80/16/1036618016.db2.gz QEQJRXSJIRZXOG-JXFKEZNVSA-N 2 1 316.533 4.093 20 0 DIADMP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174579 1036629865 /nfs/dbraw/zinc/62/98/65/1036629865.db2.gz ATKKUKQASXQGRR-NWDGAFQWSA-N 2 1 308.878 4.114 20 0 DIADMP C[C@H]([NH3+])[C@@H]1CCC[N@@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174579 1036629872 /nfs/dbraw/zinc/62/98/72/1036629872.db2.gz ATKKUKQASXQGRR-NWDGAFQWSA-N 2 1 308.878 4.114 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCCc1c[nH+]cn1C ZINC000579974560 1036662023 /nfs/dbraw/zinc/66/20/23/1036662023.db2.gz MGRPNXKJDVPCHH-GJZGRUSLSA-N 2 1 319.880 4.130 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000579974560 1036662028 /nfs/dbraw/zinc/66/20/28/1036662028.db2.gz MGRPNXKJDVPCHH-GJZGRUSLSA-N 2 1 319.880 4.130 20 0 DIADMP CCc1cccc2cc(C[NH2+]C[C@@H](C)C[NH+]3CCCCC3)oc21 ZINC001648882379 1036670602 /nfs/dbraw/zinc/67/06/02/1036670602.db2.gz LOWUBRLQYHCKFR-MRXNPFEDSA-N 2 1 314.473 4.207 20 0 DIADMP COCCC1(C[NH2+]C[C@]2([NH+](C)C)CCC[C@H](C)C2)CCCCC1 ZINC001648895831 1036678538 /nfs/dbraw/zinc/67/85/38/1036678538.db2.gz ZREUMPKLFXRZIM-ICSRJNTNSA-N 2 1 324.553 4.074 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1C[C@H](C(C)C)c2ccccc21 ZINC000683691248 1036713979 /nfs/dbraw/zinc/71/39/79/1036713979.db2.gz XATGUTFIZCKEHC-YSGRDPCXSA-N 2 1 311.473 4.302 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000580098431 1036949907 /nfs/dbraw/zinc/94/99/07/1036949907.db2.gz CRBDMCXRPGRFEX-MTQWCTHYSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000580098431 1036949918 /nfs/dbraw/zinc/94/99/18/1036949918.db2.gz CRBDMCXRPGRFEX-MTQWCTHYSA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000683926986 1037112912 /nfs/dbraw/zinc/11/29/12/1037112912.db2.gz FGQBXAHQQNTMIQ-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C[C@@H](C)C1 ZINC000398193535 1037278708 /nfs/dbraw/zinc/27/87/08/1037278708.db2.gz NKYXQLXPRCBQML-LBHSNNGHSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C[C@@H](C)C1 ZINC000398193535 1037278723 /nfs/dbraw/zinc/27/87/23/1037278723.db2.gz NKYXQLXPRCBQML-LBHSNNGHSA-N 2 1 314.517 4.311 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc(C)c1F ZINC000126787784 1037319589 /nfs/dbraw/zinc/31/95/89/1037319589.db2.gz IOORQLDXOMHVCW-MIGBEJBISA-N 2 1 304.453 4.108 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc(C)c1F ZINC000126787784 1037319602 /nfs/dbraw/zinc/31/96/02/1037319602.db2.gz IOORQLDXOMHVCW-MIGBEJBISA-N 2 1 304.453 4.108 20 0 DIADMP Cc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)s1 ZINC000065976587 1037471192 /nfs/dbraw/zinc/47/11/92/1037471192.db2.gz DQVOXCNVTKILBW-UHFFFAOYSA-N 2 1 302.487 4.187 20 0 DIADMP C[N@H+](Cc1ccc(C2CCCC2)cc1)C[C@H]1CCC[NH+](C)C1 ZINC001167478563 1037908521 /nfs/dbraw/zinc/90/85/21/1037908521.db2.gz SPYSMEVQNRHTCM-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+](Cc1ccc(C2CCCC2)cc1)C[C@H]1CCC[N@H+](C)C1 ZINC001167478563 1037908532 /nfs/dbraw/zinc/90/85/32/1037908532.db2.gz SPYSMEVQNRHTCM-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccccc2F)CC1)CC(C)C ZINC001168412616 1038011753 /nfs/dbraw/zinc/01/17/53/1038011753.db2.gz ACOUGUJGYOMLLD-UHFFFAOYSA-N 2 1 320.496 4.406 20 0 DIADMP CSCCCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000602556188 1038035960 /nfs/dbraw/zinc/03/59/60/1038035960.db2.gz JJHDDCNFECLFGD-IEBWSBKVSA-N 2 1 318.530 4.087 20 0 DIADMP CSCCCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000602556188 1038035981 /nfs/dbraw/zinc/03/59/81/1038035981.db2.gz JJHDDCNFECLFGD-IEBWSBKVSA-N 2 1 318.530 4.087 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2s1 ZINC000126482499 1038107495 /nfs/dbraw/zinc/10/74/95/1038107495.db2.gz ZYMPPUUGBSTVDG-ZIAGYGMSSA-N 2 1 300.471 4.036 20 0 DIADMP CCCC[C@@H]([NH2+]CCCn1cc[nH+]c1C)c1ccc(OC)cc1 ZINC000341793757 1038272072 /nfs/dbraw/zinc/27/20/72/1038272072.db2.gz WYLCLSDGCVBHRU-LJQANCHMSA-N 2 1 315.461 4.111 20 0 DIADMP C[N@H+](CC1CCCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000603822414 1038287057 /nfs/dbraw/zinc/28/70/57/1038287057.db2.gz QPHPWUQCJKJLOS-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](CC1CCCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000603822414 1038287067 /nfs/dbraw/zinc/28/70/67/1038287067.db2.gz QPHPWUQCJKJLOS-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Cl)c(F)c2)C1 ZINC000535778083 1038334084 /nfs/dbraw/zinc/33/40/84/1038334084.db2.gz HMEXUGOXLVQFCW-ZIAGYGMSSA-N 2 1 312.860 4.250 20 0 DIADMP c1ccc(-c2ccc(CC[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000090468702 1038447443 /nfs/dbraw/zinc/44/74/43/1038447443.db2.gz IWVHGRQXVFPMES-FCHUYYIVSA-N 2 1 320.480 4.113 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001167499253 1038452629 /nfs/dbraw/zinc/45/26/29/1038452629.db2.gz FGPYBRPJZIKENK-GIVPXCGWSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001167499253 1038452639 /nfs/dbraw/zinc/45/26/39/1038452639.db2.gz FGPYBRPJZIKENK-GIVPXCGWSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001167499253 1038452645 /nfs/dbraw/zinc/45/26/45/1038452645.db2.gz FGPYBRPJZIKENK-GIVPXCGWSA-N 2 1 314.517 4.267 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557985 1038619464 /nfs/dbraw/zinc/61/94/64/1038619464.db2.gz BRRAQNLVVSCWJR-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557985 1038619467 /nfs/dbraw/zinc/61/94/67/1038619467.db2.gz BRRAQNLVVSCWJR-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557985 1038619469 /nfs/dbraw/zinc/61/94/69/1038619469.db2.gz BRRAQNLVVSCWJR-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557985 1038619472 /nfs/dbraw/zinc/61/94/72/1038619472.db2.gz BRRAQNLVVSCWJR-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([NH3+])C[C@@H]3C)s2)cc1 ZINC000563350714 1038661181 /nfs/dbraw/zinc/66/11/81/1038661181.db2.gz QDUJNWQVGXSQON-GOEBONIOSA-N 2 1 300.471 4.035 20 0 DIADMP Cc1nccn1CC[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000342589800 1038681434 /nfs/dbraw/zinc/68/14/34/1038681434.db2.gz VIDANHCRNPDKRG-LLVKDONJSA-N 2 1 312.244 4.191 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCCOC(C)(C)C)CC1)CC1CC1 ZINC001168423026 1038691693 /nfs/dbraw/zinc/69/16/93/1038691693.db2.gz COGLBABPGAHWCX-UHFFFAOYSA-N 2 1 324.553 4.026 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000608061141 1038761378 /nfs/dbraw/zinc/76/13/78/1038761378.db2.gz ABCQFCGHOYBLCI-PXNSSMCTSA-N 2 1 308.469 4.234 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H](C)Cn2cc[nH+]c2C)C2CCCC2)o1 ZINC000342801237 1038804282 /nfs/dbraw/zinc/80/42/82/1038804282.db2.gz CKUAGWPMIATGFD-LIRRHRJNSA-N 2 1 315.461 4.250 20 0 DIADMP CCC[N@@H+](CCCn1ccnc1C)[C@H](C)c1ccccc1OC ZINC000342858610 1038923667 /nfs/dbraw/zinc/92/36/67/1038923667.db2.gz DRLVOIBKMCWVEE-MRXNPFEDSA-N 2 1 315.461 4.063 20 0 DIADMP CCC[N@H+](CCCn1cc[nH+]c1C)[C@H](C)c1ccccc1OC ZINC000342858610 1038923669 /nfs/dbraw/zinc/92/36/69/1038923669.db2.gz DRLVOIBKMCWVEE-MRXNPFEDSA-N 2 1 315.461 4.063 20 0 DIADMP CCC[N@@H+](CCCn1cc[nH+]c1C)[C@H](C)c1ccccc1OC ZINC000342858610 1038923676 /nfs/dbraw/zinc/92/36/76/1038923676.db2.gz DRLVOIBKMCWVEE-MRXNPFEDSA-N 2 1 315.461 4.063 20 0 DIADMP CCC[N@H+](CCCn1cc[nH+]c1C)Cc1c(F)cccc1Cl ZINC000342860516 1038926969 /nfs/dbraw/zinc/92/69/69/1038926969.db2.gz OZJOSTCLYBJMBI-UHFFFAOYSA-N 2 1 323.843 4.286 20 0 DIADMP CCC[N@@H+](CCCn1cc[nH+]c1C)Cc1c(F)cccc1Cl ZINC000342860516 1038926986 /nfs/dbraw/zinc/92/69/86/1038926986.db2.gz OZJOSTCLYBJMBI-UHFFFAOYSA-N 2 1 323.843 4.286 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000342864767 1038930347 /nfs/dbraw/zinc/93/03/47/1038930347.db2.gz QJZAJLHXNCMDJX-CQSZACIVSA-N 2 1 317.864 4.461 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000342864767 1038930366 /nfs/dbraw/zinc/93/03/66/1038930366.db2.gz QJZAJLHXNCMDJX-CQSZACIVSA-N 2 1 317.864 4.461 20 0 DIADMP CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863272 1038931896 /nfs/dbraw/zinc/93/18/96/1038931896.db2.gz HCAOIUWNEKGJHW-MAUKXSAKSA-N 2 1 315.461 4.210 20 0 DIADMP CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863272 1038931907 /nfs/dbraw/zinc/93/19/07/1038931907.db2.gz HCAOIUWNEKGJHW-MAUKXSAKSA-N 2 1 315.461 4.210 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@@]2(C)CC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000657670693 1038983248 /nfs/dbraw/zinc/98/32/48/1038983248.db2.gz NMJTZOOURUQGJZ-NJAFHUGGSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@@]2(C)CC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000657670693 1038983267 /nfs/dbraw/zinc/98/32/67/1038983267.db2.gz NMJTZOOURUQGJZ-NJAFHUGGSA-N 2 1 322.443 4.065 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCSCc2ccccc2)C[C@H]1C ZINC000534138984 1038994044 /nfs/dbraw/zinc/99/40/44/1038994044.db2.gz XKPRSTHLOYXUDK-MJGOQNOKSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCSCc2ccccc2)C[C@H]1C ZINC000534138984 1038994064 /nfs/dbraw/zinc/99/40/64/1038994064.db2.gz XKPRSTHLOYXUDK-MJGOQNOKSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCSCc2ccccc2)C[C@H]1C ZINC000534138984 1038994079 /nfs/dbraw/zinc/99/40/79/1038994079.db2.gz XKPRSTHLOYXUDK-MJGOQNOKSA-N 2 1 320.546 4.115 20 0 DIADMP CCCCC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167646820 1039078750 /nfs/dbraw/zinc/07/87/50/1039078750.db2.gz HKNZLPJSHUFMMF-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167646820 1039078766 /nfs/dbraw/zinc/07/87/66/1039078766.db2.gz HKNZLPJSHUFMMF-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167646820 1039078785 /nfs/dbraw/zinc/07/87/85/1039078785.db2.gz HKNZLPJSHUFMMF-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CO[C@@H](CC(C)C)C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC001167659866 1039208496 /nfs/dbraw/zinc/20/84/96/1039208496.db2.gz VYCQIWFGUHBNPQ-QUCCMNQESA-N 2 1 324.553 4.024 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC000539508965 1039282651 /nfs/dbraw/zinc/28/26/51/1039282651.db2.gz DXEOLHFTVCTYEK-DLBZAZTESA-N 2 1 313.489 4.174 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000539547082 1039286028 /nfs/dbraw/zinc/28/60/28/1039286028.db2.gz NTHFUBGDHFFWMU-BEFAXECRSA-N 2 1 300.446 4.061 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693467 1039322359 /nfs/dbraw/zinc/32/23/59/1039322359.db2.gz IPROWJPYKSGYFS-QFBILLFUSA-N 2 1 317.436 4.482 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693467 1039322375 /nfs/dbraw/zinc/32/23/75/1039322375.db2.gz IPROWJPYKSGYFS-QFBILLFUSA-N 2 1 317.436 4.482 20 0 DIADMP CCCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCC)C2)cc1 ZINC000539824147 1039341772 /nfs/dbraw/zinc/34/17/72/1039341772.db2.gz YRULFIBHLVYEIX-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CCC)C2)cc1 ZINC000539824147 1039341786 /nfs/dbraw/zinc/34/17/86/1039341786.db2.gz YRULFIBHLVYEIX-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CCC)C2)cc1 ZINC000539824147 1039341798 /nfs/dbraw/zinc/34/17/98/1039341798.db2.gz YRULFIBHLVYEIX-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CCC)C2)cc1 ZINC000539824147 1039341808 /nfs/dbraw/zinc/34/18/08/1039341808.db2.gz YRULFIBHLVYEIX-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CC3(CCC3)C2)[C@H]1c1cccs1 ZINC000448060847 1039344596 /nfs/dbraw/zinc/34/45/96/1039344596.db2.gz OYMSLZYCCOHXCX-YOEHRIQHSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CC3(CCC3)C2)[C@H]1c1cccs1 ZINC000448060847 1039344612 /nfs/dbraw/zinc/34/46/12/1039344612.db2.gz OYMSLZYCCOHXCX-YOEHRIQHSA-N 2 1 304.503 4.053 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000539896594 1039382272 /nfs/dbraw/zinc/38/22/72/1039382272.db2.gz MDRGCOGBOAACOL-JXFKEZNVSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000539896594 1039382288 /nfs/dbraw/zinc/38/22/88/1039382288.db2.gz MDRGCOGBOAACOL-JXFKEZNVSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000539896594 1039382304 /nfs/dbraw/zinc/38/23/04/1039382304.db2.gz MDRGCOGBOAACOL-JXFKEZNVSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)o1 ZINC000539900228 1039385941 /nfs/dbraw/zinc/38/59/41/1039385941.db2.gz OOTNQRYRKVKIQD-CTNGQTDRSA-N 2 1 324.468 4.075 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000540162268 1039438720 /nfs/dbraw/zinc/43/87/20/1039438720.db2.gz IBGPPHHTSKEILG-NJAFHUGGSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000540162268 1039438724 /nfs/dbraw/zinc/43/87/24/1039438724.db2.gz IBGPPHHTSKEILG-NJAFHUGGSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000540259873 1039463937 /nfs/dbraw/zinc/46/39/37/1039463937.db2.gz YLDBMNIHOYPHPX-FXAWDEMLSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000540259875 1039464873 /nfs/dbraw/zinc/46/48/73/1039464873.db2.gz YLDBMNIHOYPHPX-XLIONFOSSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cnc2ccsc2c1 ZINC000246994004 1039470486 /nfs/dbraw/zinc/47/04/86/1039470486.db2.gz SBLLCAOSRNJJEX-HUUCEWRRSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cnc2ccsc2c1 ZINC000246994004 1039470491 /nfs/dbraw/zinc/47/04/91/1039470491.db2.gz SBLLCAOSRNJJEX-HUUCEWRRSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1Cl ZINC000278438870 1039472006 /nfs/dbraw/zinc/47/20/06/1039472006.db2.gz KEFNHAKEMFWBBT-BNOWGMLFSA-N 2 1 313.272 4.271 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccsc2)CC1)CC1CC1 ZINC000536142356 1039480615 /nfs/dbraw/zinc/48/06/15/1039480615.db2.gz UVLZHDBYBJQOKU-UHFFFAOYSA-N 2 1 306.519 4.082 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1cccc(F)c1)C(C)(C)C ZINC000540431266 1039493075 /nfs/dbraw/zinc/49/30/75/1039493075.db2.gz ZFRCEVUVRHZRML-QGZVFWFLSA-N 2 1 303.425 4.098 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000540653104 1039535930 /nfs/dbraw/zinc/53/59/30/1039535930.db2.gz QWGOEGDTNKNSCC-OXQOHEQNSA-N 2 1 314.473 4.451 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583994263 1039540433 /nfs/dbraw/zinc/54/04/33/1039540433.db2.gz UHMVJNJNXAHIMW-QGZVFWFLSA-N 2 1 322.443 4.209 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583994263 1039540443 /nfs/dbraw/zinc/54/04/43/1039540443.db2.gz UHMVJNJNXAHIMW-QGZVFWFLSA-N 2 1 322.443 4.209 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+](CCCc1c[nH+]cn1C)C1CCCC1 ZINC000584121588 1039611113 /nfs/dbraw/zinc/61/11/13/1039611113.db2.gz RCBBGRXJVKSCOB-KRWDZBQOSA-N 2 1 311.473 4.359 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](CCCc1c[nH+]cn1C)C1CCCC1 ZINC000584121588 1039611116 /nfs/dbraw/zinc/61/11/16/1039611116.db2.gz RCBBGRXJVKSCOB-KRWDZBQOSA-N 2 1 311.473 4.359 20 0 DIADMP CS[C@@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)C(C)(C)C ZINC000541383384 1039676207 /nfs/dbraw/zinc/67/62/07/1039676207.db2.gz IRWFERVARAKRIP-SFHVURJKSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)C(C)(C)C(F)F)CC1 ZINC000657889068 1040036991 /nfs/dbraw/zinc/03/69/91/1040036991.db2.gz PXOKJXNLFQZBGF-CABCVRRESA-N 2 1 324.459 4.481 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]C2CCC(c3ccc(F)cc3)CC2)[C@H](C)C1 ZINC000493078442 1040079408 /nfs/dbraw/zinc/07/94/08/1040079408.db2.gz JKVZKSMRGHXWLV-DNEKHIABSA-N 2 1 318.480 4.172 20 0 DIADMP Cc1cccc(C)c1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000708563599 1040083993 /nfs/dbraw/zinc/08/39/93/1040083993.db2.gz ZSUWPEYTRVKGFK-FPOVZHCZSA-N 2 1 322.496 4.161 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000708571427 1040088694 /nfs/dbraw/zinc/08/86/94/1040088694.db2.gz SKUXVAXCAWQVMB-WRJHFWDFSA-N 2 1 314.517 4.169 20 0 DIADMP Cc1ccsc1C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309763116 1040092973 /nfs/dbraw/zinc/09/29/73/1040092973.db2.gz FHVIPDVUWZCXHC-AEFFLSMTSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCCC[C@H]1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309749959 1040094094 /nfs/dbraw/zinc/09/40/94/1040094094.db2.gz ZAHBHBNFLGZDBW-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCCC[C@H]1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309749958 1040095884 /nfs/dbraw/zinc/09/58/84/1040095884.db2.gz ZAHBHBNFLGZDBW-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]CC1(C)CCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309900149 1040101056 /nfs/dbraw/zinc/10/10/56/1040101056.db2.gz HYCIJTPLKZTPQK-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000309928418 1040102358 /nfs/dbraw/zinc/10/23/58/1040102358.db2.gz UWIYTLPLJHMQRQ-ZWOKBUDYSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC000310069753 1040105441 /nfs/dbraw/zinc/10/54/41/1040105441.db2.gz CVVJJWZINBUHLO-KNQAVFIVSA-N 2 1 320.480 4.094 20 0 DIADMP Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc2[nH+]1 ZINC000310088809 1040105496 /nfs/dbraw/zinc/10/54/96/1040105496.db2.gz POOVCAGJYMWMQT-GOSISDBHSA-N 2 1 317.436 4.230 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310197479 1040112483 /nfs/dbraw/zinc/11/24/83/1040112483.db2.gz ASZVBOGXECCEQN-RBDMOPTHSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000310380610 1040118892 /nfs/dbraw/zinc/11/88/92/1040118892.db2.gz BIQDBZNNMXOERK-LZNRXBQRSA-N 2 1 320.480 4.347 20 0 DIADMP C[C@@H]([NH2+]CCSC(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309720046 1040213128 /nfs/dbraw/zinc/21/31/28/1040213128.db2.gz NKYJNXOYWLDBGN-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)CC(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000694031517 1040242459 /nfs/dbraw/zinc/24/24/59/1040242459.db2.gz VILYBHIFGRRMER-DOTOQJQBSA-N 2 1 324.459 4.311 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)CC(F)F)CC[N@H+]1Cc1ccccc1 ZINC000694031517 1040242475 /nfs/dbraw/zinc/24/24/75/1040242475.db2.gz VILYBHIFGRRMER-DOTOQJQBSA-N 2 1 324.459 4.311 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658228488 1040368984 /nfs/dbraw/zinc/36/89/84/1040368984.db2.gz IUZUUNWSXCXSRW-KGLIPLIRSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658228488 1040368999 /nfs/dbraw/zinc/36/89/99/1040368999.db2.gz IUZUUNWSXCXSRW-KGLIPLIRSA-N 2 1 306.416 4.104 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC000236610759 1040606935 /nfs/dbraw/zinc/60/69/35/1040606935.db2.gz LFVAPVBGKPHWSH-QGZVFWFLSA-N 2 1 312.457 4.157 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC000236610759 1040606941 /nfs/dbraw/zinc/60/69/41/1040606941.db2.gz LFVAPVBGKPHWSH-QGZVFWFLSA-N 2 1 312.457 4.157 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000531140063 1040620663 /nfs/dbraw/zinc/62/06/63/1040620663.db2.gz HBRJNUWVCJMSHE-CZUORRHYSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000531140063 1040620673 /nfs/dbraw/zinc/62/06/73/1040620673.db2.gz HBRJNUWVCJMSHE-CZUORRHYSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000531140063 1040620683 /nfs/dbraw/zinc/62/06/83/1040620683.db2.gz HBRJNUWVCJMSHE-CZUORRHYSA-N 2 1 314.395 4.010 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cc(C)ccc3C)CC2)[nH+]c1 ZINC000163471429 1040684917 /nfs/dbraw/zinc/68/49/17/1040684917.db2.gz YSFLIAVCSUBBTA-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000309695592 1040722037 /nfs/dbraw/zinc/72/20/37/1040722037.db2.gz DWWUXGQBXKCBNW-AEFFLSMTSA-N 2 1 314.498 4.311 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000414062066 1040803809 /nfs/dbraw/zinc/80/38/09/1040803809.db2.gz CFRAADIPOABJNF-WMZOPIPTSA-N 2 1 317.864 4.161 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000414212455 1041012181 /nfs/dbraw/zinc/01/21/81/1041012181.db2.gz QCJGSROEFBVIKA-ODMWJAAVSA-N 2 1 312.501 4.208 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000414280381 1041075323 /nfs/dbraw/zinc/07/53/23/1041075323.db2.gz CYEWKPOFUBTQST-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000414287699 1041081111 /nfs/dbraw/zinc/08/11/11/1041081111.db2.gz PBURIDAXBRPTFC-OUUBHVDSSA-N 2 1 316.464 4.052 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000809705664 1041227761 /nfs/dbraw/zinc/22/77/61/1041227761.db2.gz ZETKFJXCLUSULN-WCRBZPEASA-N 2 1 320.480 4.411 20 0 DIADMP C[NH+](Cc1ccccc1-c1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000809705664 1041227775 /nfs/dbraw/zinc/22/77/75/1041227775.db2.gz ZETKFJXCLUSULN-WCRBZPEASA-N 2 1 320.480 4.411 20 0 DIADMP C[NH+](Cc1ccccc1-c1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000809705664 1041227793 /nfs/dbraw/zinc/22/77/93/1041227793.db2.gz ZETKFJXCLUSULN-WCRBZPEASA-N 2 1 320.480 4.411 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(F)cc(Cl)c2)cc1 ZINC000809739073 1041239610 /nfs/dbraw/zinc/23/96/10/1041239610.db2.gz WMRPRVHVIOOHAT-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2coc3ccccc23)cc1 ZINC000809738110 1041239972 /nfs/dbraw/zinc/23/99/72/1041239972.db2.gz PCPAJYUZZPXYTE-UHFFFAOYSA-N 2 1 308.425 4.126 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccccc2C2CC2)cc1 ZINC000809739111 1041241210 /nfs/dbraw/zinc/24/12/10/1041241210.db2.gz XTGYYOCKRUVQGA-UHFFFAOYSA-N 2 1 308.469 4.258 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2sccc2Cl)cc1 ZINC000809738957 1041241928 /nfs/dbraw/zinc/24/19/28/1041241928.db2.gz RDWKUONXICHWPM-UHFFFAOYSA-N 2 1 308.878 4.095 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2sccc2Cl)cc1 ZINC000809738957 1041241944 /nfs/dbraw/zinc/24/19/44/1041241944.db2.gz RDWKUONXICHWPM-UHFFFAOYSA-N 2 1 308.878 4.095 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331153 1041271768 /nfs/dbraw/zinc/27/17/68/1041271768.db2.gz RKNBBPCJSVXWNK-UYAOXDASSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331153 1041271787 /nfs/dbraw/zinc/27/17/87/1041271787.db2.gz RKNBBPCJSVXWNK-UYAOXDASSA-N 2 1 323.484 4.035 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1 ZINC001170594663 1041294133 /nfs/dbraw/zinc/29/41/33/1041294133.db2.gz WCJIAXWCTDWZKQ-FXAWDEMLSA-N 2 1 300.490 4.289 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC001170594663 1041294148 /nfs/dbraw/zinc/29/41/48/1041294148.db2.gz WCJIAXWCTDWZKQ-FXAWDEMLSA-N 2 1 300.490 4.289 20 0 DIADMP COc1cc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc2ccccc21 ZINC000924593133 1041341382 /nfs/dbraw/zinc/34/13/82/1041341382.db2.gz VVONZHKGINDPRS-HNNXBMFYSA-N 2 1 324.468 4.126 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1F ZINC000893107426 1041489184 /nfs/dbraw/zinc/48/91/84/1041489184.db2.gz CEIJRLBZJMWIIL-KRWWSPQJSA-N 2 1 308.416 4.021 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1F ZINC000893107426 1041489189 /nfs/dbraw/zinc/48/91/89/1041489189.db2.gz CEIJRLBZJMWIIL-KRWWSPQJSA-N 2 1 308.416 4.021 20 0 DIADMP C[N@H+](Cc1ccccc1-c1cccs1)CC1CC[NH+](C)CC1 ZINC001141095039 1041586841 /nfs/dbraw/zinc/58/68/41/1041586841.db2.gz FTBBNWKFKMNTMU-UHFFFAOYSA-N 2 1 314.498 4.189 20 0 DIADMP CC(C)CC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001170662257 1041594418 /nfs/dbraw/zinc/59/44/18/1041594418.db2.gz YKAFMTQTYOGFKH-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417313716 1041656835 /nfs/dbraw/zinc/65/68/35/1041656835.db2.gz WTDILZDMHKUBGO-XWTMOSNGSA-N 2 1 320.546 4.198 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1F ZINC000364088282 1041660154 /nfs/dbraw/zinc/66/01/54/1041660154.db2.gz XJGJBPNNJJTSBI-ZENOOKHLSA-N 2 1 310.844 4.147 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1F ZINC000364088282 1041660155 /nfs/dbraw/zinc/66/01/55/1041660155.db2.gz XJGJBPNNJJTSBI-ZENOOKHLSA-N 2 1 310.844 4.147 20 0 DIADMP CSc1cccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660258088 1041692659 /nfs/dbraw/zinc/69/26/59/1041692659.db2.gz ZWOPQBSHPHGBEN-DOTOQJQBSA-N 2 1 318.530 4.151 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000417872240 1041707930 /nfs/dbraw/zinc/70/79/30/1041707930.db2.gz NFMCPAFCFKLDGF-IHPCNDPISA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000813789826 1041732907 /nfs/dbraw/zinc/73/29/07/1041732907.db2.gz DYPODBZVPYWNGA-VZHSDHNVSA-N 2 1 312.501 4.350 20 0 DIADMP CC1(C)CC[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813878705 1041741485 /nfs/dbraw/zinc/74/14/85/1041741485.db2.gz FLVBNZXEDMAVSC-NXEWRWPSSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC000813881647 1041742364 /nfs/dbraw/zinc/74/23/64/1041742364.db2.gz RJTUJKVZEXTOQL-OTYNDTSQSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1(C)CC1 ZINC000813881327 1041742744 /nfs/dbraw/zinc/74/27/44/1041742744.db2.gz OCUAYBSJTNXWIT-OHSMVPPVSA-N 2 1 312.501 4.350 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(SC)c1 ZINC000660416092 1041782475 /nfs/dbraw/zinc/78/24/75/1041782475.db2.gz CHORBFBNVHRIJV-UHFFFAOYSA-N 2 1 317.502 4.080 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(SC)c1 ZINC000660416092 1041782481 /nfs/dbraw/zinc/78/24/81/1041782481.db2.gz CHORBFBNVHRIJV-UHFFFAOYSA-N 2 1 317.502 4.080 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc12 ZINC000364439478 1041790635 /nfs/dbraw/zinc/79/06/35/1041790635.db2.gz DZXFPKHNBNFTPQ-ULQDDVLXSA-N 2 1 324.468 4.126 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([N@H+]3CC[C@]4(CC[NH+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761502 1041858773 /nfs/dbraw/zinc/85/87/73/1041858773.db2.gz MVLKDJOOQDQVBF-IIZPIQPGSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH+]3CC[C@]4(CC[N@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761502 1041858777 /nfs/dbraw/zinc/85/87/77/1041858777.db2.gz MVLKDJOOQDQVBF-IIZPIQPGSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH+]3CC[C@]4(CC[N@@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761502 1041858782 /nfs/dbraw/zinc/85/87/82/1041858782.db2.gz MVLKDJOOQDQVBF-IIZPIQPGSA-N 2 1 324.512 4.019 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2)cn1)C[NH+]1CCCC1 ZINC000651682228 1041880162 /nfs/dbraw/zinc/88/01/62/1041880162.db2.gz QMGZIHZYDQVIMQ-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP CN1CCC[C@]2(CC[N@H+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143200 1041925182 /nfs/dbraw/zinc/92/51/82/1041925182.db2.gz GNGVVTBRPCGIPX-QFIPXVFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[N@@H+]1CCC[C@]2(CC[NH+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143200 1041925186 /nfs/dbraw/zinc/92/51/86/1041925186.db2.gz GNGVVTBRPCGIPX-QFIPXVFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[N@H+]1CCC[C@]2(CC[NH+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143200 1041925193 /nfs/dbraw/zinc/92/51/93/1041925193.db2.gz GNGVVTBRPCGIPX-QFIPXVFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@@H+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143200 1041925198 /nfs/dbraw/zinc/92/51/98/1041925198.db2.gz GNGVVTBRPCGIPX-QFIPXVFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@H+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143200 1041925200 /nfs/dbraw/zinc/92/52/00/1041925200.db2.gz GNGVVTBRPCGIPX-QFIPXVFZSA-N 2 1 320.480 4.194 20 0 DIADMP CC[N@@H+](CCC[NH2+]C1CCC2(CCCO2)CC1)C1CCCCC1 ZINC000651910514 1041949670 /nfs/dbraw/zinc/94/96/70/1041949670.db2.gz WRAUHFBCDDECFX-UHFFFAOYSA-N 2 1 322.537 4.113 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CCC1(F)F ZINC001170805978 1042001124 /nfs/dbraw/zinc/00/11/24/1042001124.db2.gz VSJMQWTYVYZNBA-MRXNPFEDSA-N 2 1 322.443 4.150 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1OC ZINC000817898608 1042128454 /nfs/dbraw/zinc/12/84/54/1042128454.db2.gz JWQZYBFQIZXSQX-IHPCNDPISA-N 2 1 324.468 4.229 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170918069 1042164894 /nfs/dbraw/zinc/16/48/94/1042164894.db2.gz SRHLVLFZVLGPEW-WBVHZDCISA-N 2 1 320.908 4.038 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466102 1042177089 /nfs/dbraw/zinc/17/70/89/1042177089.db2.gz OBPHNTCJSMDMLL-SJLPKXTDSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466102 1042177090 /nfs/dbraw/zinc/17/70/90/1042177090.db2.gz OBPHNTCJSMDMLL-SJLPKXTDSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470294 1042181827 /nfs/dbraw/zinc/18/18/27/1042181827.db2.gz UJXUCLOGTWPNEF-WBVHZDCISA-N 2 1 312.457 4.205 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470294 1042181830 /nfs/dbraw/zinc/18/18/30/1042181830.db2.gz UJXUCLOGTWPNEF-WBVHZDCISA-N 2 1 312.457 4.205 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472208 1042182868 /nfs/dbraw/zinc/18/28/68/1042182868.db2.gz ZSQVJPKNOWOHQV-AEFFLSMTSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472208 1042182870 /nfs/dbraw/zinc/18/28/70/1042182870.db2.gz ZSQVJPKNOWOHQV-AEFFLSMTSA-N 2 1 323.484 4.007 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1ccc(OC)cc1 ZINC001167824687 1042212582 /nfs/dbraw/zinc/21/25/82/1042212582.db2.gz FKLPNUNJFKCPHY-PXNSSMCTSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC001167825625 1042214222 /nfs/dbraw/zinc/21/42/22/1042214222.db2.gz KUDZRFNSQBHYKS-ICSRJNTNSA-N 2 1 302.506 4.377 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)C12CC3CC(CC(C3)C1)C2 ZINC001167827124 1042217466 /nfs/dbraw/zinc/21/74/66/1042217466.db2.gz TUFUCQAMEFQXSS-KUNTWMTDSA-N 2 1 306.538 4.398 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)CCc1cccc(Cl)c1 ZINC001167827162 1042217911 /nfs/dbraw/zinc/21/79/11/1042217911.db2.gz UGBGBGDDUFSTNX-INIZCTEOSA-N 2 1 310.913 4.325 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccccc1OC ZINC001167827426 1042219826 /nfs/dbraw/zinc/21/98/26/1042219826.db2.gz VUHWDNMAZSFDOX-IEBWSBKVSA-N 2 1 318.505 4.343 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000643522253 1042221708 /nfs/dbraw/zinc/22/17/08/1042221708.db2.gz KNSMXAXLFKUWPV-MWLCHTKSSA-N 2 1 319.301 4.164 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001167833623 1042236500 /nfs/dbraw/zinc/23/65/00/1042236500.db2.gz CXJGRXBOEZXPSW-MJGOQNOKSA-N 2 1 303.494 4.037 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)CCCc1cccc(OC)c1 ZINC001167836637 1042248308 /nfs/dbraw/zinc/24/83/08/1042248308.db2.gz GGAJCIMINSTOOY-SFHVURJKSA-N 2 1 320.521 4.070 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)Cc1csc(C(C)C)n1 ZINC001167838374 1042250312 /nfs/dbraw/zinc/25/03/12/1042250312.db2.gz UCVLFOVCRKHWGZ-OAHLLOKOSA-N 2 1 311.539 4.209 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001167840687 1042254117 /nfs/dbraw/zinc/25/41/17/1042254117.db2.gz HMGVCDHWHRIBTJ-QFBILLFUSA-N 2 1 306.469 4.473 20 0 DIADMP c1csc([C@@H]([NH2+]C[C@@H]2CCc3[nH+]ccn3C2)C2CCCC2)c1 ZINC000279035141 1042262434 /nfs/dbraw/zinc/26/24/34/1042262434.db2.gz WPCAKVYNFLMGGT-KSSFIOAISA-N 2 1 315.486 4.028 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(-c2ccccc2)o1 ZINC000279054411 1042266367 /nfs/dbraw/zinc/26/63/67/1042266367.db2.gz YKFVJQDECBGCLG-HOTGVXAUSA-N 2 1 321.424 4.056 20 0 DIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]C1CC[NH+](C(C)C)CC1)CCS2 ZINC000187316588 1042310889 /nfs/dbraw/zinc/31/08/89/1042310889.db2.gz QBFVNTZNMPQSFF-SFHVURJKSA-N 2 1 318.530 4.303 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc2ccccc2n1 ZINC000178344969 1042314659 /nfs/dbraw/zinc/31/46/59/1042314659.db2.gz NMECXXOQWWSJHB-CQSZACIVSA-N 2 1 311.473 4.195 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2c(Cl)cccc2C1 ZINC001171018638 1042328368 /nfs/dbraw/zinc/32/83/68/1042328368.db2.gz UYVIPQYYCGZMEV-WBVHZDCISA-N 2 1 320.908 4.051 20 0 DIADMP CC[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000401770767 1042410316 /nfs/dbraw/zinc/41/03/16/1042410316.db2.gz JHSFILSUGPAOCT-HNNXBMFYSA-N 2 1 312.244 4.010 20 0 DIADMP C[N@H+]1CCC[C@H](CNc2[nH+]ccc3[nH]ccc32)[C@H]1c1ccccc1 ZINC000663899342 1042420011 /nfs/dbraw/zinc/42/00/11/1042420011.db2.gz LVRWVSAZTVCHHW-VQIMIIECSA-N 2 1 320.440 4.058 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1cccnc1 ZINC000246607307 1042422435 /nfs/dbraw/zinc/42/24/35/1042422435.db2.gz RMNXHXLEJJPOOI-QZTJIDSGSA-N 2 1 323.484 4.307 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000513501429 1042548774 /nfs/dbraw/zinc/54/87/74/1042548774.db2.gz SXJYPNLSBGNBCG-YVGNARHYSA-N 2 1 317.864 4.174 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]C2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC000513545418 1042551984 /nfs/dbraw/zinc/55/19/84/1042551984.db2.gz QQGQINLDFJKZHC-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[N@H+](Cc1cc(-c2ccccc2)cs1)CC1CC[NH+](C)CC1 ZINC000513736588 1042620746 /nfs/dbraw/zinc/62/07/46/1042620746.db2.gz GCGHZNLLLRNSRY-UHFFFAOYSA-N 2 1 314.498 4.189 20 0 DIADMP Cc1cccc(N2CCC([NH2+]C3CC4(C3)CCCCC4)CC2)[nH+]1 ZINC000421338235 1042632377 /nfs/dbraw/zinc/63/23/77/1042632377.db2.gz BWNZJDKBXBURQK-UHFFFAOYSA-N 2 1 313.489 4.061 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccs2)CC1 ZINC000513754178 1042648050 /nfs/dbraw/zinc/64/80/50/1042648050.db2.gz IQWJSNSMNJKFHS-UHFFFAOYSA-N 2 1 314.498 4.092 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccncc1Cl ZINC000421819845 1042653521 /nfs/dbraw/zinc/65/35/21/1042653521.db2.gz JHQDORFJDLKERZ-LSDHHAIUSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccncc1Cl ZINC000421819843 1042653539 /nfs/dbraw/zinc/65/35/39/1042653539.db2.gz JHQDORFJDLKERZ-GJZGRUSLSA-N 2 1 309.885 4.040 20 0 DIADMP COc1cc(Cl)ccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000421824523 1042653610 /nfs/dbraw/zinc/65/36/10/1042653610.db2.gz JEOJBIJGLULIIO-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP COc1cc(Cl)ccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000421824523 1042653613 /nfs/dbraw/zinc/65/36/13/1042653613.db2.gz JEOJBIJGLULIIO-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP [NH3+][C@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)c2ccccc21 ZINC000422935313 1042693008 /nfs/dbraw/zinc/69/30/08/1042693008.db2.gz HEEVKUBKIDYVCW-ZWKOTPCHSA-N 2 1 312.844 4.454 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c1 ZINC000924959933 1042696466 /nfs/dbraw/zinc/69/64/66/1042696466.db2.gz QHBPPVQBWHQUOF-NRFANRHFSA-N 2 1 323.484 4.164 20 0 DIADMP COCCCC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000423085321 1042697138 /nfs/dbraw/zinc/69/71/38/1042697138.db2.gz KCXQWZWQMAHOHM-QHAWAJNXSA-N 2 1 324.468 4.279 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CC1([NH3+])CCCCC1 ZINC000423180003 1042699302 /nfs/dbraw/zinc/69/93/02/1042699302.db2.gz NDVKPPIPTBMFHB-GFCCVEGCSA-N 2 1 309.523 4.061 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc21 ZINC000423190887 1042700130 /nfs/dbraw/zinc/70/01/30/1042700130.db2.gz RYVMNBWCUHFTKC-RTWAWAEBSA-N 2 1 323.484 4.036 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C[NH3+])CC(C)C ZINC000423262365 1042701983 /nfs/dbraw/zinc/70/19/83/1042701983.db2.gz METOPKXUQHUEKE-CZUORRHYSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CC(C)(C)[NH3+] ZINC000423283203 1042704488 /nfs/dbraw/zinc/70/44/88/1042704488.db2.gz DWSPAKRLSVCMOW-JTQLQIEISA-N 2 1 323.893 4.160 20 0 DIADMP [NH3+][C@@H](C[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1)C1CC1 ZINC000423313560 1042705389 /nfs/dbraw/zinc/70/53/89/1042705389.db2.gz FVXOEUSJAWCSRA-IRXDYDNUSA-N 2 1 320.889 4.012 20 0 DIADMP CCCC[C@H](C[NH3+])[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423298092 1042706033 /nfs/dbraw/zinc/70/60/33/1042706033.db2.gz NCZOHVGFXJAWGZ-FVCCEPFGSA-N 2 1 300.899 4.001 20 0 DIADMP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423336359 1042707011 /nfs/dbraw/zinc/70/70/11/1042707011.db2.gz SKDBTOVMKQJAAA-IAQYHMDHSA-N 2 1 301.261 4.034 20 0 DIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H](C)[C@@H](C)[NH3+] ZINC000423451015 1042712728 /nfs/dbraw/zinc/71/27/28/1042712728.db2.gz UIGLCWZQNYGACI-MXWKQRLJSA-N 2 1 323.893 4.158 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](C(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000514083311 1042770169 /nfs/dbraw/zinc/77/01/69/1042770169.db2.gz MJPPXWVSVSCFMG-LEWJYISDSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](C(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000514083311 1042770172 /nfs/dbraw/zinc/77/01/72/1042770172.db2.gz MJPPXWVSVSCFMG-LEWJYISDSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](C(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000514083311 1042770176 /nfs/dbraw/zinc/77/01/76/1042770176.db2.gz MJPPXWVSVSCFMG-LEWJYISDSA-N 2 1 320.480 4.192 20 0 DIADMP c1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)cc1 ZINC001167958521 1042790401 /nfs/dbraw/zinc/79/04/01/1042790401.db2.gz GQLCLYVHWWGOHR-VTHDOGFWSA-N 2 1 310.485 4.133 20 0 DIADMP FC(F)c1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167961632 1042847890 /nfs/dbraw/zinc/84/78/90/1042847890.db2.gz MDGAWOJVEPEFLH-ALOPSCKCSA-N 2 1 320.427 4.119 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@@H+]1Cc1ccccc1 ZINC000712517554 1042862156 /nfs/dbraw/zinc/86/21/56/1042862156.db2.gz NPPQEFGYPAFXPC-SDZDHKAXSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@H+]1Cc1ccccc1 ZINC000712517554 1042862164 /nfs/dbraw/zinc/86/21/64/1042862164.db2.gz NPPQEFGYPAFXPC-SDZDHKAXSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H](Cc1ccsc1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000517068693 1042866215 /nfs/dbraw/zinc/86/62/15/1042866215.db2.gz NTOXCGFIPIBQMY-YJBOKZPZSA-N 2 1 306.519 4.066 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc3ccc(C)cc3o2)CC1 ZINC000425922479 1042875017 /nfs/dbraw/zinc/87/50/17/1042875017.db2.gz SMVCSXBWDHGVEA-OAHLLOKOSA-N 2 1 300.446 4.266 20 0 DIADMP c1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCCC2)cc1 ZINC001167963779 1042914819 /nfs/dbraw/zinc/91/48/19/1042914819.db2.gz DGZNOOBBHYVXMV-SEJPIABJSA-N 2 1 324.512 4.451 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(F)cc1F ZINC001167964815 1042921435 /nfs/dbraw/zinc/92/14/35/1042921435.db2.gz YIOPSVFIVAHVEY-RJCAOGMDSA-N 2 1 320.427 4.021 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)cc1F ZINC001167964815 1042921437 /nfs/dbraw/zinc/92/14/37/1042921437.db2.gz YIOPSVFIVAHVEY-RJCAOGMDSA-N 2 1 320.427 4.021 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000519478472 1042950410 /nfs/dbraw/zinc/95/04/10/1042950410.db2.gz IQWAOVCHCPYSBF-SJPCQFCGSA-N 2 1 306.881 4.014 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000519478472 1042950414 /nfs/dbraw/zinc/95/04/14/1042950414.db2.gz IQWAOVCHCPYSBF-SJPCQFCGSA-N 2 1 306.881 4.014 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000519478472 1042950419 /nfs/dbraw/zinc/95/04/19/1042950419.db2.gz IQWAOVCHCPYSBF-SJPCQFCGSA-N 2 1 306.881 4.014 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC(C)(C)C1 ZINC001167967600 1042954283 /nfs/dbraw/zinc/95/42/83/1042954283.db2.gz IKLVASCBNYFUAU-OWZPZPLSSA-N 2 1 304.522 4.196 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc21 ZINC001167967901 1042954977 /nfs/dbraw/zinc/95/49/77/1042954977.db2.gz KONWITHECRGTAB-FMDCNDCGSA-N 2 1 310.485 4.230 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc21 ZINC001167967903 1042954996 /nfs/dbraw/zinc/95/49/96/1042954996.db2.gz KONWITHECRGTAB-OQUIJUHXSA-N 2 1 310.485 4.230 20 0 DIADMP C(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)CC1CCCCC1 ZINC001167973114 1042965881 /nfs/dbraw/zinc/96/58/81/1042965881.db2.gz HBKPTJHTLZIKNN-IHWFROFDSA-N 2 1 304.522 4.342 20 0 DIADMP Cc1cccc(C(C)(C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167975886 1042972283 /nfs/dbraw/zinc/97/22/83/1042972283.db2.gz YXKWCOOQAMTHBQ-IHWFROFDSA-N 2 1 312.501 4.225 20 0 DIADMP Cc1ccc([C@H]2CCCCC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000441310939 1043034604 /nfs/dbraw/zinc/03/46/04/1043034604.db2.gz MDROILWCEGOTBU-QGZVFWFLSA-N 2 1 301.434 4.100 20 0 DIADMP Cc1ccc([C@H]2CCCCC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000441310939 1043034607 /nfs/dbraw/zinc/03/46/07/1043034607.db2.gz MDROILWCEGOTBU-QGZVFWFLSA-N 2 1 301.434 4.100 20 0 DIADMP CC[C@H]1C[N@@H+](CCCn2ccnc2C)CC[C@H]1c1ccccc1 ZINC000441319526 1043035471 /nfs/dbraw/zinc/03/54/71/1043035471.db2.gz VUALBAFZFHBQIT-AZUAARDMSA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@H]1C[N@H+](CCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000441319526 1043035477 /nfs/dbraw/zinc/03/54/77/1043035477.db2.gz VUALBAFZFHBQIT-AZUAARDMSA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@H]1C[N@@H+](CCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000441319526 1043035481 /nfs/dbraw/zinc/03/54/81/1043035481.db2.gz VUALBAFZFHBQIT-AZUAARDMSA-N 2 1 311.473 4.097 20 0 DIADMP C[N@@H+](CCCc1ccc(Cl)cc1)CC[C@@H]1CCCC[NH+]1C ZINC000441359284 1043038177 /nfs/dbraw/zinc/03/81/77/1043038177.db2.gz QWZWZAUCRSJJKY-SFHVURJKSA-N 2 1 308.897 4.079 20 0 DIADMP C[NH+](CCCc1ccc(Cl)cc1)CC[C@@H]1CCCC[N@@H+]1C ZINC000441359284 1043038180 /nfs/dbraw/zinc/03/81/80/1043038180.db2.gz QWZWZAUCRSJJKY-SFHVURJKSA-N 2 1 308.897 4.079 20 0 DIADMP C[NH+](CCCc1ccc(Cl)cc1)CC[C@@H]1CCCC[N@H+]1C ZINC000441359284 1043038186 /nfs/dbraw/zinc/03/81/86/1043038186.db2.gz QWZWZAUCRSJJKY-SFHVURJKSA-N 2 1 308.897 4.079 20 0 DIADMP c1ccc([C@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)cc1 ZINC001167991986 1043055302 /nfs/dbraw/zinc/05/53/02/1043055302.db2.gz GDCSHMLHMVXWST-CCDCCJRHSA-N 2 1 324.512 4.271 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167991986 1043055314 /nfs/dbraw/zinc/05/53/14/1043055314.db2.gz GDCSHMLHMVXWST-CCDCCJRHSA-N 2 1 324.512 4.271 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167991986 1043055327 /nfs/dbraw/zinc/05/53/27/1043055327.db2.gz GDCSHMLHMVXWST-CCDCCJRHSA-N 2 1 324.512 4.271 20 0 DIADMP CN(C/C=C/c1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167994979 1043066554 /nfs/dbraw/zinc/06/65/54/1043066554.db2.gz SEXKTGFWUHXAPT-HNYZGRMPSA-N 2 1 310.485 4.037 20 0 DIADMP C[N@H+](C/C=C/c1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994979 1043066566 /nfs/dbraw/zinc/06/65/66/1043066566.db2.gz SEXKTGFWUHXAPT-HNYZGRMPSA-N 2 1 310.485 4.037 20 0 DIADMP C[N@@H+](C/C=C/c1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994979 1043066575 /nfs/dbraw/zinc/06/65/75/1043066575.db2.gz SEXKTGFWUHXAPT-HNYZGRMPSA-N 2 1 310.485 4.037 20 0 DIADMP C[NH+](C/C=C/c1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167994979 1043066585 /nfs/dbraw/zinc/06/65/85/1043066585.db2.gz SEXKTGFWUHXAPT-HNYZGRMPSA-N 2 1 310.485 4.037 20 0 DIADMP C[NH+](C/C=C/c1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167994979 1043066592 /nfs/dbraw/zinc/06/65/92/1043066592.db2.gz SEXKTGFWUHXAPT-HNYZGRMPSA-N 2 1 310.485 4.037 20 0 DIADMP CCc1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167994824 1043066747 /nfs/dbraw/zinc/06/67/47/1043066747.db2.gz QNMNEJYOTLZQNI-WCRBZPEASA-N 2 1 312.501 4.086 20 0 DIADMP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000794827911 1043068321 /nfs/dbraw/zinc/06/83/21/1043068321.db2.gz MBGRMVYOVVQCOX-DENIHFKCSA-N 2 1 320.480 4.094 20 0 DIADMP c1ccc(C[NH+](C2CC2)C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167994434 1043070188 /nfs/dbraw/zinc/07/01/88/1043070188.db2.gz CZEQVOYVLHLTQY-WCRBZPEASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@H+](C2CC2)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167994434 1043070194 /nfs/dbraw/zinc/07/01/94/1043070194.db2.gz CZEQVOYVLHLTQY-WCRBZPEASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+](C2CC2)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167994434 1043070202 /nfs/dbraw/zinc/07/02/02/1043070202.db2.gz CZEQVOYVLHLTQY-WCRBZPEASA-N 2 1 310.485 4.056 20 0 DIADMP c1csc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167995869 1043079887 /nfs/dbraw/zinc/07/98/87/1043079887.db2.gz TYTQURQIOMYPGU-UJJTZGENSA-N 2 1 316.514 4.290 20 0 DIADMP c1csc([C@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995869 1043079900 /nfs/dbraw/zinc/07/99/00/1043079900.db2.gz TYTQURQIOMYPGU-UJJTZGENSA-N 2 1 316.514 4.290 20 0 DIADMP c1csc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995869 1043079912 /nfs/dbraw/zinc/07/99/12/1043079912.db2.gz TYTQURQIOMYPGU-UJJTZGENSA-N 2 1 316.514 4.290 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC[N@@H+]1C ZINC000536303151 1043091525 /nfs/dbraw/zinc/09/15/25/1043091525.db2.gz WESWUJZAJIDHSS-SIVJFFJCSA-N 2 1 313.272 4.053 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC[N@H+]1C ZINC000536303151 1043091538 /nfs/dbraw/zinc/09/15/38/1043091538.db2.gz WESWUJZAJIDHSS-SIVJFFJCSA-N 2 1 313.272 4.053 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC[N@@H+]1C ZINC000536303150 1043092761 /nfs/dbraw/zinc/09/27/61/1043092761.db2.gz WESWUJZAJIDHSS-RSAASHCRSA-N 2 1 313.272 4.053 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC[N@H+]1C ZINC000536303150 1043092773 /nfs/dbraw/zinc/09/27/73/1043092773.db2.gz WESWUJZAJIDHSS-RSAASHCRSA-N 2 1 313.272 4.053 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000188938655 1043134189 /nfs/dbraw/zinc/13/41/89/1043134189.db2.gz CDNCIOFLHDPCMT-HNNXBMFYSA-N 2 1 300.446 4.265 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000178699384 1043136528 /nfs/dbraw/zinc/13/65/28/1043136528.db2.gz AFPJBXIFWIDWNI-SLEUVZQESA-N 2 1 321.515 4.104 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2sc(C)nc2C)c1 ZINC000178737150 1043137437 /nfs/dbraw/zinc/13/74/37/1043137437.db2.gz JZQNNRLZASWWHZ-ZDUSSCGKSA-N 2 1 317.502 4.062 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)nc2)c1 ZINC000179121354 1043140633 /nfs/dbraw/zinc/14/06/33/1043140633.db2.gz FZPQCNHTFCFNNS-CQSZACIVSA-N 2 1 317.864 4.038 20 0 DIADMP Clc1ccc(CCC[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000441463915 1043143597 /nfs/dbraw/zinc/14/35/97/1043143597.db2.gz MAGKZSWDIFDJAQ-SFHVURJKSA-N 2 1 320.908 4.080 20 0 DIADMP c1ccc(C2CCC(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000166545459 1043155453 /nfs/dbraw/zinc/15/54/53/1043155453.db2.gz DESSBGODUADGLT-CGNZLSCGSA-N 2 1 312.501 4.177 20 0 DIADMP Cc1cc(CNC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(C)o1 ZINC000120950049 1043159030 /nfs/dbraw/zinc/15/90/30/1043159030.db2.gz OAJDZMFWGVZEKG-QAPCUYQASA-N 2 1 318.486 4.131 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c(C)o1 ZINC000120950049 1043159034 /nfs/dbraw/zinc/15/90/34/1043159034.db2.gz OAJDZMFWGVZEKG-QAPCUYQASA-N 2 1 318.486 4.131 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(C)o1 ZINC000120950049 1043159040 /nfs/dbraw/zinc/15/90/40/1043159040.db2.gz OAJDZMFWGVZEKG-QAPCUYQASA-N 2 1 318.486 4.131 20 0 DIADMP c1cc2cccc3c2c(c1)CC[C@@H]3[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000866220069 1043161197 /nfs/dbraw/zinc/16/11/97/1043161197.db2.gz BECWAGRMLBFMEA-FQEVSTJZSA-N 2 1 306.453 4.044 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cc2c(ccnc2Cl)o1 ZINC000866281538 1043172650 /nfs/dbraw/zinc/17/26/50/1043172650.db2.gz JDSHKYSPIYNSSR-AVGNSLFASA-N 2 1 321.852 4.005 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866289422 1043173855 /nfs/dbraw/zinc/17/38/55/1043173855.db2.gz CSKXVPXMHPUWAL-LBPRGKRZSA-N 2 1 321.852 4.005 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000184277862 1043180413 /nfs/dbraw/zinc/18/04/13/1043180413.db2.gz VQBCCEIYSFSWIC-QGZVFWFLSA-N 2 1 311.473 4.081 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000184284210 1043181527 /nfs/dbraw/zinc/18/15/27/1043181527.db2.gz RXIYMHITRODXRD-GOSISDBHSA-N 2 1 323.484 4.014 20 0 DIADMP c1ccc(C[NH+](C2CCC2)C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001168002398 1043209734 /nfs/dbraw/zinc/20/97/34/1043209734.db2.gz QXHNAECZUWUOTQ-CBQGHPETSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@H+](C2CCC2)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168002398 1043209746 /nfs/dbraw/zinc/20/97/46/1043209746.db2.gz QXHNAECZUWUOTQ-CBQGHPETSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+](C2CCC2)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168002398 1043209753 /nfs/dbraw/zinc/20/97/53/1043209753.db2.gz QXHNAECZUWUOTQ-CBQGHPETSA-N 2 1 324.512 4.447 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)C1 ZINC000427610494 1043242611 /nfs/dbraw/zinc/24/26/11/1043242611.db2.gz VAJIAZLGFABCRU-FUHWJXTLSA-N 2 1 318.530 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008236 1043270988 /nfs/dbraw/zinc/27/09/88/1043270988.db2.gz WSAWOLIWXKRMGW-XEMDLRDOSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1[nH+]ccn1Cc1ccc(-c2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000665199584 1043281660 /nfs/dbraw/zinc/28/16/60/1043281660.db2.gz OIVLNXRNWZEARZ-UHFFFAOYSA-N 2 1 323.415 4.108 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@@H+]1C ZINC000427691650 1043297750 /nfs/dbraw/zinc/29/77/50/1043297750.db2.gz VVVDOMPMKBIPCI-BSLALVQMSA-N 2 1 320.480 4.413 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@H+]1C ZINC000427691650 1043297754 /nfs/dbraw/zinc/29/77/54/1043297754.db2.gz VVVDOMPMKBIPCI-BSLALVQMSA-N 2 1 320.480 4.413 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1-c1ccccc1 ZINC000427860265 1043312120 /nfs/dbraw/zinc/31/21/20/1043312120.db2.gz YNSSTOULBRPXLT-FXAWDEMLSA-N 2 1 308.469 4.234 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1-c1ccccc1 ZINC000427860277 1043312208 /nfs/dbraw/zinc/31/22/08/1043312208.db2.gz YNSSTOULBRPXLT-PXNSSMCTSA-N 2 1 308.469 4.234 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(Oc3ccccc3)c2)C1 ZINC000520944970 1043342088 /nfs/dbraw/zinc/34/20/88/1043342088.db2.gz ZQEXUHQUZWSLHT-IBGZPJMESA-N 2 1 324.468 4.300 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000271343442 1043411490 /nfs/dbraw/zinc/41/14/90/1043411490.db2.gz CKEUJVADAGTNKG-KRWDZBQOSA-N 2 1 311.473 4.081 20 0 DIADMP Cc1ccncc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000271343446 1043413045 /nfs/dbraw/zinc/41/30/45/1043413045.db2.gz CKEUJVADAGTNKG-QGZVFWFLSA-N 2 1 311.473 4.081 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000442764721 1043421967 /nfs/dbraw/zinc/42/19/67/1043421967.db2.gz DFUNXJUHZLSEPD-UHFFFAOYSA-N 2 1 310.432 4.052 20 0 DIADMP FC(F)C1CCC([NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)CC1 ZINC000442857183 1043443308 /nfs/dbraw/zinc/44/33/08/1043443308.db2.gz PHIILJWSHJRRMM-DQPZFDDXSA-N 2 1 314.464 4.197 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCC[N@H+](C)Cc1ccccc1 ZINC000521821485 1043486775 /nfs/dbraw/zinc/48/67/75/1043486775.db2.gz YNLJWCSYKLTCMC-KNTRCKAVSA-N 2 1 308.469 4.202 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCc2c(C)ccc(C)c21 ZINC000349826637 1043526646 /nfs/dbraw/zinc/52/66/46/1043526646.db2.gz FBXNSOZEVMXFAR-IBGZPJMESA-N 2 1 311.473 4.256 20 0 DIADMP COc1cc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc2ccccc21 ZINC000926540602 1043596680 /nfs/dbraw/zinc/59/66/80/1043596680.db2.gz JNWCNMQHNSWDOV-AQXGTKIOSA-N 2 1 324.468 4.124 20 0 DIADMP CC(C)CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccoc1 ZINC000353520277 1043613823 /nfs/dbraw/zinc/61/38/23/1043613823.db2.gz NSNUCZBSCJOTOF-MJGOQNOKSA-N 2 1 306.494 4.467 20 0 DIADMP CC(C)CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccoc1 ZINC000353520277 1043613832 /nfs/dbraw/zinc/61/38/32/1043613832.db2.gz NSNUCZBSCJOTOF-MJGOQNOKSA-N 2 1 306.494 4.467 20 0 DIADMP C[C@H]1C[C@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@@H+]1Cc1ccccc1 ZINC000353581344 1043620809 /nfs/dbraw/zinc/62/08/09/1043620809.db2.gz YWQYXLVGOBUPIA-OXJNMPFZSA-N 2 1 321.468 4.424 20 0 DIADMP C[C@H]1C[C@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@H+]1Cc1ccccc1 ZINC000353581344 1043620817 /nfs/dbraw/zinc/62/08/17/1043620817.db2.gz YWQYXLVGOBUPIA-OXJNMPFZSA-N 2 1 321.468 4.424 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000353815263 1043649271 /nfs/dbraw/zinc/64/92/71/1043649271.db2.gz KHPGWZHMKCXPDS-KRWDZBQOSA-N 2 1 312.457 4.192 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)cc1 ZINC000926949212 1043661216 /nfs/dbraw/zinc/66/12/16/1043661216.db2.gz LOIYLEYAHDZZIN-DIOULYMOSA-N 2 1 323.362 4.030 20 0 DIADMP CC(C)C[C@@H](C[NH+](C)C[C@H]1CCC[N@@H+](C)C1)c1ccccc1 ZINC000474152418 1043664745 /nfs/dbraw/zinc/66/47/45/1043664745.db2.gz HHLMHRMXYXRODX-ICSRJNTNSA-N 2 1 302.506 4.090 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@H]1CCN(C)[C@H](C)C1)c1ccccc1 ZINC000474284510 1043721909 /nfs/dbraw/zinc/72/19/09/1043721909.db2.gz RLMVJOBHLZGMOV-RLLQIKCJSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1)c1ccccc1 ZINC000474284510 1043721921 /nfs/dbraw/zinc/72/19/21/1043721921.db2.gz RLMVJOBHLZGMOV-RLLQIKCJSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1)c1ccccc1 ZINC000474284510 1043721924 /nfs/dbraw/zinc/72/19/24/1043721924.db2.gz RLMVJOBHLZGMOV-RLLQIKCJSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1 ZINC000474284510 1043721933 /nfs/dbraw/zinc/72/19/33/1043721933.db2.gz RLMVJOBHLZGMOV-RLLQIKCJSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1 ZINC000474284510 1043721938 /nfs/dbraw/zinc/72/19/38/1043721938.db2.gz RLMVJOBHLZGMOV-RLLQIKCJSA-N 2 1 302.506 4.231 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCC(=C3CCC3)CC2)cn1 ZINC000876951347 1043728540 /nfs/dbraw/zinc/72/85/40/1043728540.db2.gz KTHSFBXSKOSJFV-UHFFFAOYSA-N 2 1 322.456 4.088 20 0 DIADMP CC[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C(C)C ZINC000777693971 1043759304 /nfs/dbraw/zinc/75/93/04/1043759304.db2.gz KWGPHPUSTLDRDH-HXUWFJFHSA-N 2 1 317.521 4.311 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@H](C)c1ccc(Cl)cc1 ZINC000474483398 1043798593 /nfs/dbraw/zinc/79/85/93/1043798593.db2.gz WFPXSQMHVUUUTP-UONOGXRCSA-N 2 1 306.881 4.048 20 0 DIADMP CC1([NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834844 1043804218 /nfs/dbraw/zinc/80/42/18/1043804218.db2.gz XUYRMSRXJIHDQB-NVXWUHKLSA-N 2 1 320.427 4.132 20 0 DIADMP CC1([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834844 1043804238 /nfs/dbraw/zinc/80/42/38/1043804238.db2.gz XUYRMSRXJIHDQB-NVXWUHKLSA-N 2 1 320.427 4.132 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cscc2C(F)(F)F)C[C@H]1C ZINC000356132463 1043814168 /nfs/dbraw/zinc/81/41/68/1043814168.db2.gz HVAUOIXPZFPYHC-YPMHNXCESA-N 2 1 320.424 4.072 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@](C)(F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039728 1043856607 /nfs/dbraw/zinc/85/66/07/1043856607.db2.gz HUFSMARPTDJDEY-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@](C)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039728 1043856627 /nfs/dbraw/zinc/85/66/27/1043856627.db2.gz HUFSMARPTDJDEY-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039728 1043856646 /nfs/dbraw/zinc/85/66/46/1043856646.db2.gz HUFSMARPTDJDEY-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@](C)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039728 1043856662 /nfs/dbraw/zinc/85/66/62/1043856662.db2.gz HUFSMARPTDJDEY-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[N@H+](CCCC(C)(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000929981745 1043862859 /nfs/dbraw/zinc/86/28/59/1043862859.db2.gz LNUYQMFXHJENJY-UHFFFAOYSA-N 2 1 310.432 4.018 20 0 DIADMP C[N@@H+](CCCC(C)(F)F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000929981745 1043862878 /nfs/dbraw/zinc/86/28/78/1043862878.db2.gz LNUYQMFXHJENJY-UHFFFAOYSA-N 2 1 310.432 4.018 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC[C@@H](F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039913 1043869352 /nfs/dbraw/zinc/86/93/52/1043869352.db2.gz IMNSKBUXEYRCHP-ZHALLVOQSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@@H](F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039913 1043869364 /nfs/dbraw/zinc/86/93/64/1043869364.db2.gz IMNSKBUXEYRCHP-ZHALLVOQSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCC[C@H]3C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039980 1043869556 /nfs/dbraw/zinc/86/95/56/1043869556.db2.gz JFHZLRYVYSINBX-ZZEDZQHJSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1CC([N@H+](C)C2CC(F)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040197 1043874362 /nfs/dbraw/zinc/87/43/62/1043874362.db2.gz KSJVHUKIYUUWHV-HUUCEWRRSA-N 2 1 322.443 4.158 20 0 DIADMP C[C@@H]1CC([N@@H+](C)C2CC(F)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040197 1043874382 /nfs/dbraw/zinc/87/43/82/1043874382.db2.gz KSJVHUKIYUUWHV-HUUCEWRRSA-N 2 1 322.443 4.158 20 0 DIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1nccc2ccccc21 ZINC000289875920 1043891132 /nfs/dbraw/zinc/89/11/32/1043891132.db2.gz SKKAVOSNDXWXCN-AWEZNQCLSA-N 2 1 311.473 4.195 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCC[C@@H](C(C)C)C3)CC2)[nH+]1 ZINC000474725304 1043897216 /nfs/dbraw/zinc/89/72/16/1043897216.db2.gz LYTYCJIRXITKJC-MJGOQNOKSA-N 2 1 315.505 4.163 20 0 DIADMP CC(C)OCC[NH+]1CCC([NH2+][C@H](C)[C@H](C)C2CCCCC2)CC1 ZINC000474795853 1043918469 /nfs/dbraw/zinc/91/84/69/1043918469.db2.gz QSRMFURFWDWDCC-ZWKOTPCHSA-N 2 1 324.553 4.070 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCC[C@H](C(C)C)C3)CC2)[nH+]c1 ZINC000474796233 1043920154 /nfs/dbraw/zinc/92/01/54/1043920154.db2.gz LPWXTINCBYINCZ-HKUYNNGSSA-N 2 1 315.505 4.163 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)Sc3sccc32)CC1 ZINC000358025525 1044009881 /nfs/dbraw/zinc/00/98/81/1044009881.db2.gz SBKLYVDYMCWPPU-CZUORRHYSA-N 2 1 324.559 4.384 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)cc(F)c1 ZINC000561970570 1044038290 /nfs/dbraw/zinc/03/82/90/1044038290.db2.gz AOTVREMXZWWOCF-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000346344087 1044096330 /nfs/dbraw/zinc/09/63/30/1044096330.db2.gz GRBLDIFDYGMJSF-UHFFFAOYSA-N 2 1 324.255 4.163 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000346344087 1044096344 /nfs/dbraw/zinc/09/63/44/1044096344.db2.gz GRBLDIFDYGMJSF-UHFFFAOYSA-N 2 1 324.255 4.163 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1F ZINC000359411653 1044164154 /nfs/dbraw/zinc/16/41/54/1044164154.db2.gz DWKMNTGAIHMFKT-MLGOLLRUSA-N 2 1 323.843 4.361 20 0 DIADMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1F ZINC000359411651 1044164480 /nfs/dbraw/zinc/16/44/80/1044164480.db2.gz DWKMNTGAIHMFKT-LRDDRELGSA-N 2 1 323.843 4.361 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc2cccnc21 ZINC001137177937 1044166258 /nfs/dbraw/zinc/16/62/58/1044166258.db2.gz HWQMPMYQOMWGER-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc2cccnc21 ZINC001137177937 1044166261 /nfs/dbraw/zinc/16/62/61/1044166261.db2.gz HWQMPMYQOMWGER-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc2cccnc21 ZINC001137177937 1044166266 /nfs/dbraw/zinc/16/62/66/1044166266.db2.gz HWQMPMYQOMWGER-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCCOc2ccccc21)Cc1ccccc1 ZINC000359617671 1044182484 /nfs/dbraw/zinc/18/24/84/1044182484.db2.gz DVGRPICPMXKAIM-HXUWFJFHSA-N 2 1 324.468 4.012 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCSc2ccccc21 ZINC000359944463 1044218427 /nfs/dbraw/zinc/21/84/27/1044218427.db2.gz UQQJWRGJWCYPLE-AEFFLSMTSA-N 2 1 318.530 4.468 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCOc3ccccc32)C1 ZINC000359943557 1044218848 /nfs/dbraw/zinc/21/88/48/1044218848.db2.gz QJJYQHOXMZCCNL-HKUYNNGSSA-N 2 1 316.489 4.002 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCc2sccc21 ZINC000359949317 1044219525 /nfs/dbraw/zinc/21/95/25/1044219525.db2.gz IJVSNMMQKBAIPZ-DOTOQJQBSA-N 2 1 306.519 4.370 20 0 DIADMP Clc1sccc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000359978118 1044222971 /nfs/dbraw/zinc/22/29/71/1044222971.db2.gz WBAKQKOLZNHDAB-UHFFFAOYSA-N 2 1 320.889 4.287 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CCSc2ccc(F)cc21)C[NH+]1CCCCC1 ZINC000360151991 1044241784 /nfs/dbraw/zinc/24/17/84/1044241784.db2.gz XJKLDYFVUXNXFN-WMLDXEAASA-N 2 1 322.493 4.074 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(Cl)cc1F ZINC000563353017 1044250841 /nfs/dbraw/zinc/25/08/41/1044250841.db2.gz GNNHNCMRRYHIHI-QGZVFWFLSA-N 2 1 323.843 4.132 20 0 DIADMP C[C@H]1CC([N@H+](CC2CC2)C2CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168056059 1044268007 /nfs/dbraw/zinc/26/80/07/1044268007.db2.gz BXSNAFHMPMORCG-IRXDYDNUSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@H]1CC([N@@H+](CC2CC2)C2CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168056059 1044268020 /nfs/dbraw/zinc/26/80/20/1044268020.db2.gz BXSNAFHMPMORCG-IRXDYDNUSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2ccsc2S1 ZINC000360494201 1044276297 /nfs/dbraw/zinc/27/62/97/1044276297.db2.gz DBDFNSPTAZFGPO-LRDDRELGSA-N 2 1 322.543 4.280 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](c2cccnc2)C2CCC2)c1 ZINC000360840031 1044318171 /nfs/dbraw/zinc/31/81/71/1044318171.db2.gz KOINENWYWAJVQA-OAQYLSRUSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+][C@H](C)CC[NH+](C)C)cs2)cs1 ZINC000360862953 1044320105 /nfs/dbraw/zinc/32/01/05/1044320105.db2.gz YBURXOICJNUSFY-NEPJUHHUSA-N 2 1 323.531 4.171 20 0 DIADMP Clc1ccc(CC2([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)cc1 ZINC000293780238 1044326414 /nfs/dbraw/zinc/32/64/14/1044326414.db2.gz TVTXDUSABDEVPV-MSOLQXFVSA-N 2 1 318.892 4.022 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069563 1044353690 /nfs/dbraw/zinc/35/36/90/1044353690.db2.gz RDEDKVLKJRMKQA-DOTOQJQBSA-N 2 1 304.478 4.003 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069563 1044353704 /nfs/dbraw/zinc/35/37/04/1044353704.db2.gz RDEDKVLKJRMKQA-DOTOQJQBSA-N 2 1 304.478 4.003 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069954 1044354390 /nfs/dbraw/zinc/35/43/90/1044354390.db2.gz SNQJKWMZHUJLGE-IIAWOOMASA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069954 1044354402 /nfs/dbraw/zinc/35/44/02/1044354402.db2.gz SNQJKWMZHUJLGE-IIAWOOMASA-N 2 1 324.559 4.384 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000564969450 1044407471 /nfs/dbraw/zinc/40/74/71/1044407471.db2.gz XMJWUNARWNXIPS-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000564969450 1044407477 /nfs/dbraw/zinc/40/74/77/1044407477.db2.gz XMJWUNARWNXIPS-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CC(C)[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000361577588 1044419797 /nfs/dbraw/zinc/41/97/97/1044419797.db2.gz LOUOFUFWYKOOHH-INIZCTEOSA-N 2 1 300.446 4.046 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000361588524 1044422852 /nfs/dbraw/zinc/42/28/52/1044422852.db2.gz FNGMVRSZOJQPFA-CABCVRRESA-N 2 1 317.399 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000361588524 1044422857 /nfs/dbraw/zinc/42/28/57/1044422857.db2.gz FNGMVRSZOJQPFA-CABCVRRESA-N 2 1 317.399 4.025 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000565269221 1044423747 /nfs/dbraw/zinc/42/37/47/1044423747.db2.gz AFGBFEPFORVYOP-ASFAAARLSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cccnc1 ZINC000112528165 1044442339 /nfs/dbraw/zinc/44/23/39/1044442339.db2.gz AKWPYYRYABEFRY-MSOLQXFVSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1cccnc1 ZINC000112527752 1044443603 /nfs/dbraw/zinc/44/36/03/1044443603.db2.gz KLDMJIPIOAMFSH-ROUUACIJSA-N 2 1 323.484 4.164 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000565663697 1044448922 /nfs/dbraw/zinc/44/89/22/1044448922.db2.gz BCQYHPMLTBGKBF-HXUWFJFHSA-N 2 1 323.484 4.360 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000565663697 1044448928 /nfs/dbraw/zinc/44/89/28/1044448928.db2.gz BCQYHPMLTBGKBF-HXUWFJFHSA-N 2 1 323.484 4.360 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+](C)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000566429074 1044492067 /nfs/dbraw/zinc/49/20/67/1044492067.db2.gz PGVHTOUSPNESNS-PMACEKPBSA-N 2 1 311.473 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+](C)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000566429074 1044492075 /nfs/dbraw/zinc/49/20/75/1044492075.db2.gz PGVHTOUSPNESNS-PMACEKPBSA-N 2 1 311.473 4.011 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000121432172 1044525237 /nfs/dbraw/zinc/52/52/37/1044525237.db2.gz RIKXXPQGGLWCST-STQMWFEESA-N 2 1 320.506 4.067 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(F)cc1F ZINC000339073661 1044548483 /nfs/dbraw/zinc/54/84/83/1044548483.db2.gz CTDUJNHRLRDCEJ-VKJFTORMSA-N 2 1 308.416 4.022 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1F ZINC000339073661 1044548508 /nfs/dbraw/zinc/54/85/08/1044548508.db2.gz CTDUJNHRLRDCEJ-VKJFTORMSA-N 2 1 308.416 4.022 20 0 DIADMP Cc1ncc(CNc2ccc([N@H+]3CCCC[C@H]3C)cc2C)n1C ZINC000567367835 1044560810 /nfs/dbraw/zinc/56/08/10/1044560810.db2.gz AVABJJPTHFQBNR-OAHLLOKOSA-N 2 1 312.461 4.028 20 0 DIADMP Cc1ncc(CNc2ccc([N@@H+]3CCCC[C@H]3C)cc2C)n1C ZINC000567367835 1044560821 /nfs/dbraw/zinc/56/08/21/1044560821.db2.gz AVABJJPTHFQBNR-OAHLLOKOSA-N 2 1 312.461 4.028 20 0 DIADMP CC(C)CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccoc1 ZINC000353520275 1044576425 /nfs/dbraw/zinc/57/64/25/1044576425.db2.gz NSNUCZBSCJOTOF-HKUYNNGSSA-N 2 1 306.494 4.467 20 0 DIADMP CC(C)CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccoc1 ZINC000353520275 1044576437 /nfs/dbraw/zinc/57/64/37/1044576437.db2.gz NSNUCZBSCJOTOF-HKUYNNGSSA-N 2 1 306.494 4.467 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc2cc(Cl)ccc2o1 ZINC000295984424 1044578470 /nfs/dbraw/zinc/57/84/70/1044578470.db2.gz PAHCSWLYYMCKPB-GVZPALNKSA-N 2 1 318.848 4.362 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2cc(Cl)ccc2o1 ZINC000295984424 1044578486 /nfs/dbraw/zinc/57/84/86/1044578486.db2.gz PAHCSWLYYMCKPB-GVZPALNKSA-N 2 1 318.848 4.362 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[C@@H](c2cccc(Cl)c2)C1)c1c[nH+]ccc1N ZINC000567639633 1044579171 /nfs/dbraw/zinc/57/91/71/1044579171.db2.gz ARCCSLXYNVNMQS-BJJXKVORSA-N 2 1 315.848 4.134 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CCN1C ZINC000444649484 1044581899 /nfs/dbraw/zinc/58/18/99/1044581899.db2.gz KCORXSVDDSNPAR-HNAYVOBHSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649484 1044581937 /nfs/dbraw/zinc/58/19/37/1044581937.db2.gz KCORXSVDDSNPAR-HNAYVOBHSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649484 1044581942 /nfs/dbraw/zinc/58/19/42/1044581942.db2.gz KCORXSVDDSNPAR-HNAYVOBHSA-N 2 1 314.498 4.330 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccccc3C2)c1 ZINC001649171205 1044589442 /nfs/dbraw/zinc/58/94/42/1044589442.db2.gz MFBJGFXRBXCKGY-JOCHJYFZSA-N 2 1 322.496 4.176 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000885923193 1044592501 /nfs/dbraw/zinc/59/25/01/1044592501.db2.gz SSZUWRSIODVTIB-RTBURBONSA-N 2 1 322.537 4.113 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccc1F ZINC000568377295 1044622048 /nfs/dbraw/zinc/62/20/48/1044622048.db2.gz MNPIFIDSQKCNRY-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(OC(C)(C)C)cc1 ZINC000296592123 1044631526 /nfs/dbraw/zinc/63/15/26/1044631526.db2.gz VAPQDMJPACFFSF-CCNLRDMRSA-N 2 1 316.489 4.140 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(OC(C)(C)C)cc1 ZINC000296592139 1044631579 /nfs/dbraw/zinc/63/15/79/1044631579.db2.gz VAPQDMJPACFFSF-MIGBEJBISA-N 2 1 316.489 4.140 20 0 DIADMP Cc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cs1 ZINC000296586198 1044632118 /nfs/dbraw/zinc/63/21/18/1044632118.db2.gz XFCHWIHKGCMHNC-UHFFFAOYSA-N 2 1 302.487 4.187 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@@H](C)c3ccc(F)cc3)CC2)[nH+]c1C ZINC000886667878 1044676531 /nfs/dbraw/zinc/67/65/31/1044676531.db2.gz KDKIXCXJSPEXGQ-AWEZNQCLSA-N 2 1 301.409 4.106 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000569290980 1044693453 /nfs/dbraw/zinc/69/34/53/1044693453.db2.gz OPXLNYYBFZXXGU-IEBWSBKVSA-N 2 1 309.457 4.021 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(-c3ccncc3)cc2)CC1 ZINC000366226563 1044715946 /nfs/dbraw/zinc/71/59/46/1044715946.db2.gz CKRYWUITZJREPG-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)C[C@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000445576006 1044765435 /nfs/dbraw/zinc/76/54/35/1044765435.db2.gz UWPMCLUSMKSYGP-KRWDZBQOSA-N 2 1 303.494 4.055 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000571096810 1044796194 /nfs/dbraw/zinc/79/61/94/1044796194.db2.gz UBGOKCKHXHXZGU-IPMKNSEASA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000571096810 1044796206 /nfs/dbraw/zinc/79/62/06/1044796206.db2.gz UBGOKCKHXHXZGU-IPMKNSEASA-N 2 1 317.521 4.126 20 0 DIADMP Cc1cc(C)c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(C)c1 ZINC000524597483 1044884765 /nfs/dbraw/zinc/88/47/65/1044884765.db2.gz BJUXNDJHVNPJDT-LJQANCHMSA-N 2 1 300.490 4.062 20 0 DIADMP Cc1ccccc1[C@@H](C)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000372524860 1044915694 /nfs/dbraw/zinc/91/56/94/1044915694.db2.gz GDDRPFMWCBWSOU-LMNJBCLMSA-N 2 1 323.484 4.076 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000524758102 1044915891 /nfs/dbraw/zinc/91/58/91/1044915891.db2.gz PRTRXUQGDIQGON-CRAIPNDOSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000524758102 1044915898 /nfs/dbraw/zinc/91/58/98/1044915898.db2.gz PRTRXUQGDIQGON-CRAIPNDOSA-N 2 1 306.881 4.209 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2C[C@@H](C)c3ccccc32)c1 ZINC000574073727 1044937932 /nfs/dbraw/zinc/93/79/32/1044937932.db2.gz BWGISOSMDKJWNN-IIBYNOLFSA-N 2 1 308.469 4.476 20 0 DIADMP Clc1ccc(CCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000524893262 1044943413 /nfs/dbraw/zinc/94/34/13/1044943413.db2.gz JEKUEHFWYLILLX-IBGZPJMESA-N 2 1 320.908 4.223 20 0 DIADMP C[N@H+](CCC(F)(F)F)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411211023 1044982887 /nfs/dbraw/zinc/98/28/87/1044982887.db2.gz HAAJHRBUPOWRBS-UHFFFAOYSA-N 2 1 314.395 4.057 20 0 DIADMP C[N@@H+](CCC(F)(F)F)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411211023 1044982902 /nfs/dbraw/zinc/98/29/02/1044982902.db2.gz HAAJHRBUPOWRBS-UHFFFAOYSA-N 2 1 314.395 4.057 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC000151143026 1045017220 /nfs/dbraw/zinc/01/72/20/1045017220.db2.gz GCEOAVXMKOPBOR-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP CCC1CC([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000576058197 1045028742 /nfs/dbraw/zinc/02/87/42/1045028742.db2.gz FZXUYFNOHODVIN-UHFFFAOYSA-N 2 1 312.457 4.190 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)cc1 ZINC000446748889 1045028950 /nfs/dbraw/zinc/02/89/50/1045028950.db2.gz VBEXYJOQTGGNMO-PCCBWWKXSA-N 2 1 312.501 4.443 20 0 DIADMP C[N@H+](C[C@@H]1CCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000576296541 1045048324 /nfs/dbraw/zinc/04/83/24/1045048324.db2.gz WAYXKCIXOAYLII-QGZVFWFLSA-N 2 1 322.443 4.018 20 0 DIADMP C[N@@H+](C[C@@H]1CCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000576296541 1045048341 /nfs/dbraw/zinc/04/83/41/1045048341.db2.gz WAYXKCIXOAYLII-QGZVFWFLSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@H]1CCCN(C)C1 ZINC000525488194 1045076413 /nfs/dbraw/zinc/07/64/13/1045076413.db2.gz FRFZBXFRSUYRFG-SJORKVTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000525488194 1045076428 /nfs/dbraw/zinc/07/64/28/1045076428.db2.gz FRFZBXFRSUYRFG-SJORKVTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000525488194 1045076442 /nfs/dbraw/zinc/07/64/42/1045076442.db2.gz FRFZBXFRSUYRFG-SJORKVTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000525488194 1045076456 /nfs/dbraw/zinc/07/64/56/1045076456.db2.gz FRFZBXFRSUYRFG-SJORKVTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000525488194 1045076462 /nfs/dbraw/zinc/07/64/62/1045076462.db2.gz FRFZBXFRSUYRFG-SJORKVTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771716 1045077720 /nfs/dbraw/zinc/07/77/20/1045077720.db2.gz CGXTZCOYNDPYPH-DBVUQKKJSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771716 1045077732 /nfs/dbraw/zinc/07/77/32/1045077732.db2.gz CGXTZCOYNDPYPH-DBVUQKKJSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000525694439 1045113303 /nfs/dbraw/zinc/11/33/03/1045113303.db2.gz WWKFYJRTPUUBCA-KRWDZBQOSA-N 2 1 312.457 4.252 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447594171 1045154406 /nfs/dbraw/zinc/15/44/06/1045154406.db2.gz XIOHIFABYXFNPU-LRGNLBRXSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H](CC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000447726446 1045167693 /nfs/dbraw/zinc/16/76/93/1045167693.db2.gz FUXOEBRQHQBPMG-ICSRJNTNSA-N 2 1 300.490 4.131 20 0 DIADMP C[C@@H](CC[NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccc1 ZINC000447822215 1045178004 /nfs/dbraw/zinc/17/80/04/1045178004.db2.gz PCOMNXWAAUOCSZ-OALUTQOASA-N 2 1 302.506 4.424 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694631 1045191123 /nfs/dbraw/zinc/19/11/23/1045191123.db2.gz FSTHQVYTCSKUOH-UHTWSYAYSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694631 1045191137 /nfs/dbraw/zinc/19/11/37/1045191137.db2.gz FSTHQVYTCSKUOH-UHTWSYAYSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000527100336 1045193993 /nfs/dbraw/zinc/19/39/93/1045193993.db2.gz QCFWVODFTXJRKP-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000527100336 1045193997 /nfs/dbraw/zinc/19/39/97/1045193997.db2.gz QCFWVODFTXJRKP-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000527100337 1045194466 /nfs/dbraw/zinc/19/44/66/1045194466.db2.gz QCFWVODFTXJRKP-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2CC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000527100337 1045194469 /nfs/dbraw/zinc/19/44/69/1045194469.db2.gz QCFWVODFTXJRKP-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)C[C@H](C)c2cccc(Cl)c2)CC1 ZINC000527106764 1045195989 /nfs/dbraw/zinc/19/59/89/1045195989.db2.gz CVUCYXRKFHXJHD-HNNXBMFYSA-N 2 1 308.897 4.248 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC2(CCC2)C1 ZINC000448059156 1045201664 /nfs/dbraw/zinc/20/16/64/1045201664.db2.gz XLAATLJLFJZSMG-UHFFFAOYSA-N 2 1 324.468 4.334 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192206 1045218860 /nfs/dbraw/zinc/21/88/60/1045218860.db2.gz HELATJLJCACYNZ-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192206 1045218873 /nfs/dbraw/zinc/21/88/73/1045218873.db2.gz HELATJLJCACYNZ-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192207 1045219934 /nfs/dbraw/zinc/21/99/34/1045219934.db2.gz HELATJLJCACYNZ-XLIONFOSSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192207 1045219943 /nfs/dbraw/zinc/21/99/43/1045219943.db2.gz HELATJLJCACYNZ-XLIONFOSSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1C[C@H]1C1CC1 ZINC000527656573 1045250300 /nfs/dbraw/zinc/25/03/00/1045250300.db2.gz CWYPXFOUHOVFAO-ONJAGBEBSA-N 2 1 324.512 4.206 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1C[C@H]1C1CC1 ZINC000527656568 1045250434 /nfs/dbraw/zinc/25/04/34/1045250434.db2.gz CWYPXFOUHOVFAO-LEDNWFQWSA-N 2 1 324.512 4.206 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768599 1045270206 /nfs/dbraw/zinc/27/02/06/1045270206.db2.gz JLHWUPOZKVHGRL-YQVWRLOYSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768599 1045270211 /nfs/dbraw/zinc/27/02/11/1045270211.db2.gz JLHWUPOZKVHGRL-YQVWRLOYSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352744 1045308716 /nfs/dbraw/zinc/30/87/16/1045308716.db2.gz JFTYHEIYFKIFMU-RTWAWAEBSA-N 2 1 324.512 4.352 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352744 1045308723 /nfs/dbraw/zinc/30/87/23/1045308723.db2.gz JFTYHEIYFKIFMU-RTWAWAEBSA-N 2 1 324.512 4.352 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@H]3CC[N@H+](C)C[C@@H]3C)CCCC2)c(C)c1 ZINC000579383092 1045311615 /nfs/dbraw/zinc/31/16/15/1045311615.db2.gz GJSCYQJTSRQVHJ-ICSRJNTNSA-N 2 1 314.517 4.045 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccccc1-c1ccccc1C ZINC000449087322 1045343270 /nfs/dbraw/zinc/34/32/70/1045343270.db2.gz FXXPJAKHCCJLRE-UHFFFAOYSA-N 2 1 319.452 4.347 20 0 DIADMP Clc1ccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000449071734 1045344130 /nfs/dbraw/zinc/34/41/30/1045344130.db2.gz OLHXCYAEOURVNP-CRAIPNDOSA-N 2 1 318.892 4.193 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)Cc2coc3ccccc23)C1 ZINC000449129632 1045350318 /nfs/dbraw/zinc/35/03/18/1045350318.db2.gz DABVCRFRUPCUBS-IRXDYDNUSA-N 2 1 314.473 4.074 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000449175092 1045354451 /nfs/dbraw/zinc/35/44/51/1045354451.db2.gz QGBZZODTQZNLPC-MJGOQNOKSA-N 2 1 308.469 4.234 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)C(C)(F)F ZINC000697138459 1045410675 /nfs/dbraw/zinc/41/06/75/1045410675.db2.gz ZXMUSYSNJJIQBR-DOTOQJQBSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)C[C@@H](c2ccccc2)C1 ZINC000389742323 1045426992 /nfs/dbraw/zinc/42/69/92/1045426992.db2.gz SSRRRDPDYPHRTP-HNULKUCHSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)C[C@@H](c2ccccc2)C1 ZINC000389742323 1045426993 /nfs/dbraw/zinc/42/69/93/1045426993.db2.gz SSRRRDPDYPHRTP-HNULKUCHSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CC(F)(F)C1 ZINC000529547227 1045492955 /nfs/dbraw/zinc/49/29/55/1045492955.db2.gz VYUCIYVTAKRGGN-VKJFTORMSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CC(F)(F)C1 ZINC000529547227 1045492958 /nfs/dbraw/zinc/49/29/58/1045492958.db2.gz VYUCIYVTAKRGGN-VKJFTORMSA-N 2 1 322.443 4.063 20 0 DIADMP C(=C/c1ccccc1)\CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000450602779 1045522900 /nfs/dbraw/zinc/52/29/00/1045522900.db2.gz RTRXKWZQUAGLSC-KTKBRETHSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C/c1ccccc1)\CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000450602779 1045522910 /nfs/dbraw/zinc/52/29/10/1045522910.db2.gz RTRXKWZQUAGLSC-KTKBRETHSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C/c1ccccc1)\CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000450602779 1045522926 /nfs/dbraw/zinc/52/29/26/1045522926.db2.gz RTRXKWZQUAGLSC-KTKBRETHSA-N 2 1 310.485 4.039 20 0 DIADMP CC(C)(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390626028 1045569680 /nfs/dbraw/zinc/56/96/80/1045569680.db2.gz DDDNFSJRRAQTJI-YQQQUEKLSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000720184282 1045577643 /nfs/dbraw/zinc/57/76/43/1045577643.db2.gz MQOZFDKKTXYBIP-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC000720184282 1045577650 /nfs/dbraw/zinc/57/76/50/1045577650.db2.gz MQOZFDKKTXYBIP-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC2CCC1CC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381944221 1045584848 /nfs/dbraw/zinc/58/48/48/1045584848.db2.gz BLHYAWBEXOBBBX-RCJXNYLRSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC2CCC1CC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381944220 1045584957 /nfs/dbraw/zinc/58/49/57/1045584957.db2.gz BLHYAWBEXOBBBX-PEFJLDGTSA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390867220 1045585150 /nfs/dbraw/zinc/58/51/50/1045585150.db2.gz ONLPRHOBCHNUOH-IHWFROFDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccccc2)cc1 ZINC000392195650 1045642449 /nfs/dbraw/zinc/64/24/49/1045642449.db2.gz SDSVVPABRMBUTO-QGZVFWFLSA-N 2 1 306.453 4.266 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1cc2ccccc2o1)C(C)(C)C ZINC000530354977 1045651311 /nfs/dbraw/zinc/65/13/11/1045651311.db2.gz NQCCXLCDTZBHRN-GOSISDBHSA-N 2 1 311.429 4.086 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000451294946 1045660286 /nfs/dbraw/zinc/66/02/86/1045660286.db2.gz JATIDOFNIKYIGS-GJZGRUSLSA-N 2 1 317.399 4.073 20 0 DIADMP CC[C@H](c1ccc(F)cc1F)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000530863915 1045741326 /nfs/dbraw/zinc/74/13/26/1045741326.db2.gz RGJFFMUMLPKHDG-HNAYVOBHSA-N 2 1 322.443 4.080 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cccc(C(F)(F)F)c2)C[C@H]1C ZINC000530905612 1045748673 /nfs/dbraw/zinc/74/86/73/1045748673.db2.gz PXAGAUKGYJKEKP-CJNGLKHVSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@H]1C ZINC000530905612 1045748692 /nfs/dbraw/zinc/74/86/92/1045748692.db2.gz PXAGAUKGYJKEKP-CJNGLKHVSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@H]1C ZINC000530905612 1045748705 /nfs/dbraw/zinc/74/87/05/1045748705.db2.gz PXAGAUKGYJKEKP-CJNGLKHVSA-N 2 1 314.395 4.010 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ncccc32)c1 ZINC000631577721 1045876381 /nfs/dbraw/zinc/87/63/81/1045876381.db2.gz VGFWQFZDPRYQFB-OAQYLSRUSA-N 2 1 323.484 4.089 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3c4ccccc4sc32)C1 ZINC000531715406 1045903472 /nfs/dbraw/zinc/90/34/72/1045903472.db2.gz XSOGNCRPLWOVPO-WMLDXEAASA-N 2 1 314.498 4.210 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3c4ccccc4sc32)C1 ZINC000531715404 1045904607 /nfs/dbraw/zinc/90/46/07/1045904607.db2.gz XSOGNCRPLWOVPO-PBHICJAKSA-N 2 1 314.498 4.210 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1csc2ccccc12 ZINC000754793416 1045927587 /nfs/dbraw/zinc/92/75/87/1045927587.db2.gz HLHPSDZTKOLJBW-ZNMIVQPWSA-N 2 1 300.471 4.179 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2sccc21 ZINC000453082661 1045929888 /nfs/dbraw/zinc/92/98/88/1045929888.db2.gz MEGMNDCLBTZYOE-CXAGYDPISA-N 2 1 304.503 4.293 20 0 DIADMP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC001137687837 1045935290 /nfs/dbraw/zinc/93/52/90/1045935290.db2.gz FKQNKYWNENGHDF-MRXNPFEDSA-N 2 1 324.449 4.258 20 0 DIADMP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC001137687837 1045935296 /nfs/dbraw/zinc/93/52/96/1045935296.db2.gz FKQNKYWNENGHDF-MRXNPFEDSA-N 2 1 324.449 4.258 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CC[C@H](C)c2ccsc21 ZINC000453106337 1045938483 /nfs/dbraw/zinc/93/84/83/1045938483.db2.gz ISQFXMGQVAELPH-DVOMOZLQSA-N 2 1 303.475 4.117 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)[C@H]1c1cccs1 ZINC000453124163 1045946236 /nfs/dbraw/zinc/94/62/36/1045946236.db2.gz NRFGSAXLZTZTST-QRQLOZEOSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)[C@H]1c1cccs1 ZINC000453124163 1045946242 /nfs/dbraw/zinc/94/62/42/1045946242.db2.gz NRFGSAXLZTZTST-QRQLOZEOSA-N 2 1 318.530 4.299 20 0 DIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192918332 1045954213 /nfs/dbraw/zinc/95/42/13/1045954213.db2.gz YLHQAVCBAGJTHQ-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cs1 ZINC000453193606 1045973614 /nfs/dbraw/zinc/97/36/14/1045973614.db2.gz FMKVCFIKWPOVIX-OWCLPIDISA-N 2 1 306.519 4.360 20 0 DIADMP [NH3+]CCCC[C@H]([NH2+]Cc1ccccc1F)c1ccc(F)cc1F ZINC000902331980 1045976173 /nfs/dbraw/zinc/97/61/73/1045976173.db2.gz XTUMCZIAFHLVNN-SFHVURJKSA-N 2 1 322.374 4.064 20 0 DIADMP COc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC000902406870 1045992876 /nfs/dbraw/zinc/99/28/76/1045992876.db2.gz VTPLYGSFDMEIKO-AHRSYUTCSA-N 2 1 324.468 4.148 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2sccc21 ZINC000453225055 1045993387 /nfs/dbraw/zinc/99/33/87/1045993387.db2.gz SJHLAWXWERQMBF-PBMMVSLJSA-N 2 1 304.503 4.293 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(Cl)ccc1OC ZINC000453335749 1046042727 /nfs/dbraw/zinc/04/27/27/1046042727.db2.gz DRELOQAUQDAVCY-BTFYYFJDSA-N 2 1 322.880 4.015 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(Cl)ccc1OC ZINC000453335749 1046042742 /nfs/dbraw/zinc/04/27/42/1046042742.db2.gz DRELOQAUQDAVCY-BTFYYFJDSA-N 2 1 322.880 4.015 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1Cl ZINC000453341984 1046046572 /nfs/dbraw/zinc/04/65/72/1046046572.db2.gz HWFJTYBHGYXFGG-KRWWSPQJSA-N 2 1 306.881 4.252 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1Cl ZINC000453341984 1046046588 /nfs/dbraw/zinc/04/65/88/1046046588.db2.gz HWFJTYBHGYXFGG-KRWWSPQJSA-N 2 1 306.881 4.252 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453347520 1046050246 /nfs/dbraw/zinc/05/02/46/1046050246.db2.gz KPQNQCWUNKSARC-HZTRTUMWSA-N 2 1 304.503 4.074 20 0 DIADMP CC(C)[C@@H](CSc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453353239 1046053345 /nfs/dbraw/zinc/05/33/45/1046053345.db2.gz NONAAAZYUJVPFH-RGPMPMONSA-N 2 1 318.530 4.018 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(C(F)(F)F)s1 ZINC000902754658 1046060919 /nfs/dbraw/zinc/06/09/19/1046060919.db2.gz FSRPDJPCIFKESV-JTQLQIEISA-N 2 1 317.380 4.013 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2ccccc2o1 ZINC000453378728 1046073855 /nfs/dbraw/zinc/07/38/55/1046073855.db2.gz ZQEFJMDLJCGOLS-KRXYWNSISA-N 2 1 312.457 4.345 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@H](C)c1ccc(Cl)cc1 ZINC000453399281 1046075396 /nfs/dbraw/zinc/07/53/96/1046075396.db2.gz LFZHUOJTILLRLQ-LSDHHAIUSA-N 2 1 308.897 4.296 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]CCCC[N@@H+](C)C3CC3)oc2c1 ZINC000453410057 1046078952 /nfs/dbraw/zinc/07/89/52/1046078952.db2.gz USPUQULBXCDMBK-OAHLLOKOSA-N 2 1 300.446 4.266 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453410113 1046080737 /nfs/dbraw/zinc/08/07/37/1046080737.db2.gz VAATVCYHPOROJF-HNNXBMFYSA-N 2 1 306.519 4.324 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000453419060 1046085900 /nfs/dbraw/zinc/08/59/00/1046085900.db2.gz KWZXSXKVYJEQTL-QAPCUYQASA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000453419060 1046085911 /nfs/dbraw/zinc/08/59/11/1046085911.db2.gz KWZXSXKVYJEQTL-QAPCUYQASA-N 2 1 322.443 4.065 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCCOc2cc(Cl)ccc21)C1CC1 ZINC000453420558 1046087355 /nfs/dbraw/zinc/08/73/55/1046087355.db2.gz ZQZQJDNHBPKPRL-KRWDZBQOSA-N 2 1 322.880 4.018 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc2ncccc2c1 ZINC001138111901 1046098398 /nfs/dbraw/zinc/09/83/98/1046098398.db2.gz WDRURBGFIDDQCG-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc2ncccc2c1 ZINC001138111901 1046098414 /nfs/dbraw/zinc/09/84/14/1046098414.db2.gz WDRURBGFIDDQCG-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc2ncccc2c1 ZINC001138111901 1046098426 /nfs/dbraw/zinc/09/84/26/1046098426.db2.gz WDRURBGFIDDQCG-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CC(c2ccccc2)c2ccccc2)[C@H](C)C1 ZINC000532203438 1046114635 /nfs/dbraw/zinc/11/46/35/1046114635.db2.gz ZJFMGRUUYDUEDF-GCJKJVERSA-N 2 1 322.496 4.138 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000532234955 1046123554 /nfs/dbraw/zinc/12/35/54/1046123554.db2.gz INKPGRCUEJOROG-NKGKWGDASA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)CC[N@H+]1C ZINC000532234955 1046123564 /nfs/dbraw/zinc/12/35/64/1046123564.db2.gz INKPGRCUEJOROG-NKGKWGDASA-N 2 1 306.881 4.048 20 0 DIADMP c1ccc2c(c1)cccc2CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903067700 1046155204 /nfs/dbraw/zinc/15/52/04/1046155204.db2.gz WAEBSPUYAJDACF-VCSGRIEYSA-N 2 1 320.480 4.130 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000903068663 1046155498 /nfs/dbraw/zinc/15/54/98/1046155498.db2.gz JXGZUIBHGCJLJD-NRFANRHFSA-N 2 1 323.484 4.163 20 0 DIADMP c1c2ccccc2sc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903078269 1046156433 /nfs/dbraw/zinc/15/64/33/1046156433.db2.gz FBWXMJLGKTWBLL-ZXFUBFMLSA-N 2 1 312.482 4.149 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903083024 1046158514 /nfs/dbraw/zinc/15/85/14/1046158514.db2.gz YYSNIZBTMXEWEL-PNFOFYCQSA-N 2 1 318.892 4.018 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903084108 1046159609 /nfs/dbraw/zinc/15/96/09/1046159609.db2.gz VNEXBGSFPXBTNE-SOXMVSPVSA-N 2 1 316.876 4.075 20 0 DIADMP c1cc2cc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)ccc2s1 ZINC000903171175 1046182765 /nfs/dbraw/zinc/18/27/65/1046182765.db2.gz DZVGXVGSHCITHU-ZNXRZULTSA-N 2 1 312.482 4.149 20 0 DIADMP c1cc2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)c2s1 ZINC000903192940 1046189467 /nfs/dbraw/zinc/18/94/67/1046189467.db2.gz BHJXCAAQJKOSNH-ZNXRZULTSA-N 2 1 312.482 4.149 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccccc1F ZINC000903193224 1046190132 /nfs/dbraw/zinc/19/01/32/1046190132.db2.gz DERNXJCFSDRMST-RFXRPKLXSA-N 2 1 302.437 4.024 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccccc1F ZINC000903193224 1046190137 /nfs/dbraw/zinc/19/01/37/1046190137.db2.gz DERNXJCFSDRMST-RFXRPKLXSA-N 2 1 302.437 4.024 20 0 DIADMP CC[C@@H](CCc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903207417 1046193648 /nfs/dbraw/zinc/19/36/48/1046193648.db2.gz XZRYHBPGGBXPGC-XAJVHEMHSA-N 2 1 312.501 4.145 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(CCC)s2)CC1 ZINC001138528852 1046215059 /nfs/dbraw/zinc/21/50/59/1046215059.db2.gz KGUYKOUHVBECLR-UHFFFAOYSA-N 2 1 308.535 4.397 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(CCC)s2)CC1 ZINC001138528852 1046215071 /nfs/dbraw/zinc/21/50/71/1046215071.db2.gz KGUYKOUHVBECLR-UHFFFAOYSA-N 2 1 308.535 4.397 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001138542698 1046217777 /nfs/dbraw/zinc/21/77/77/1046217777.db2.gz FMPQGXQDJIMENF-HXUWFJFHSA-N 2 1 317.436 4.170 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC001138542698 1046217792 /nfs/dbraw/zinc/21/77/92/1046217792.db2.gz FMPQGXQDJIMENF-HXUWFJFHSA-N 2 1 317.436 4.170 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168163635 1046219874 /nfs/dbraw/zinc/21/98/74/1046219874.db2.gz AWNFIBDOCWYYLZ-LSBZLQRGSA-N 2 1 320.908 4.395 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)CCc2cccc(C)c2)cc1 ZINC001138547084 1046223902 /nfs/dbraw/zinc/22/39/02/1046223902.db2.gz DWXUVFKRPYIOAV-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)CCc2cccc(C)c2)cc1 ZINC001138547084 1046223915 /nfs/dbraw/zinc/22/39/15/1046223915.db2.gz DWXUVFKRPYIOAV-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(-n2cc[nH+]c2C)cc1 ZINC001138548301 1046223995 /nfs/dbraw/zinc/22/39/95/1046223995.db2.gz DNPMNELEGCCUPM-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)Cc1ccc(-n2cc[nH+]c2C)cc1 ZINC001138548301 1046224005 /nfs/dbraw/zinc/22/40/05/1046224005.db2.gz DNPMNELEGCCUPM-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP Cc1cc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)c(C)s1 ZINC001138571434 1046230085 /nfs/dbraw/zinc/23/00/85/1046230085.db2.gz XSVYLCUMGCSPFJ-ROUUACIJSA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c(C)s1 ZINC001138571434 1046230094 /nfs/dbraw/zinc/23/00/94/1046230094.db2.gz XSVYLCUMGCSPFJ-ROUUACIJSA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c(C)s1 ZINC001138571434 1046230109 /nfs/dbraw/zinc/23/01/09/1046230109.db2.gz XSVYLCUMGCSPFJ-ROUUACIJSA-N 2 1 306.519 4.204 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001168168657 1046235139 /nfs/dbraw/zinc/23/51/39/1046235139.db2.gz BMEBWOLDHUTMFV-MRXNPFEDSA-N 2 1 320.908 4.221 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc3occc3c2)CC1 ZINC001138825994 1046303623 /nfs/dbraw/zinc/30/36/23/1046303623.db2.gz LKBQZNBQAGIMRS-UHFFFAOYSA-N 2 1 300.446 4.129 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000237669504 1046311709 /nfs/dbraw/zinc/31/17/09/1046311709.db2.gz APGIKBFAGHUQOG-WNZNBFKUSA-N 2 1 300.490 4.334 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000638319613 1046313529 /nfs/dbraw/zinc/31/35/29/1046313529.db2.gz YVBSGKURIGEBCW-SCWSEQNSSA-N 2 1 321.468 4.100 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1cccnc1 ZINC000638319613 1046313544 /nfs/dbraw/zinc/31/35/44/1046313544.db2.gz YVBSGKURIGEBCW-SCWSEQNSSA-N 2 1 321.468 4.100 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639273785 1046376738 /nfs/dbraw/zinc/37/67/38/1046376738.db2.gz NOWQGEFQMAWYPT-VBSBHUPXSA-N 2 1 322.452 4.093 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639273785 1046376757 /nfs/dbraw/zinc/37/67/57/1046376757.db2.gz NOWQGEFQMAWYPT-VBSBHUPXSA-N 2 1 322.452 4.093 20 0 DIADMP c1coc(CCC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639335730 1046383330 /nfs/dbraw/zinc/38/33/30/1046383330.db2.gz RFWLGWXIUYKRQW-WIYYLYMNSA-N 2 1 324.468 4.170 20 0 DIADMP c1coc(CCC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639335730 1046383344 /nfs/dbraw/zinc/38/33/44/1046383344.db2.gz RFWLGWXIUYKRQW-WIYYLYMNSA-N 2 1 324.468 4.170 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2ccc3cnccc3c2)CC1 ZINC000639376133 1046388414 /nfs/dbraw/zinc/38/84/14/1046388414.db2.gz VLERCCLLKSKKDY-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP c1cnc2cc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2c1 ZINC001139169190 1046402458 /nfs/dbraw/zinc/40/24/58/1046402458.db2.gz JUCGECCQUBFZIB-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP c1cnc2cc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2c1 ZINC001139169191 1046403180 /nfs/dbraw/zinc/40/31/80/1046403180.db2.gz JUCGECCQUBFZIB-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000124480055 1046456866 /nfs/dbraw/zinc/45/68/66/1046456866.db2.gz YJWMYMPHOJQFNO-HNAYVOBHSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000124480055 1046456869 /nfs/dbraw/zinc/45/68/69/1046456869.db2.gz YJWMYMPHOJQFNO-HNAYVOBHSA-N 2 1 315.436 4.194 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCc3c2cc(F)cc3F)C1 ZINC000677129146 1046466188 /nfs/dbraw/zinc/46/61/88/1046466188.db2.gz HCGBNWVJFGYFAB-KUHUBIRLSA-N 2 1 322.443 4.054 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCc3c2cc(F)cc3F)C1 ZINC000677129147 1046467102 /nfs/dbraw/zinc/46/71/02/1046467102.db2.gz HCGBNWVJFGYFAB-LIRRHRJNSA-N 2 1 322.443 4.054 20 0 DIADMP C[C@H](c1nc2ccccc2o1)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC000640533804 1046468527 /nfs/dbraw/zinc/46/85/27/1046468527.db2.gz VQENPQKSPKUUJL-MRXNPFEDSA-N 2 1 315.461 4.087 20 0 DIADMP Cc1cccc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCCC2)c1 ZINC000677237420 1046475176 /nfs/dbraw/zinc/47/51/76/1046475176.db2.gz GTVRKZSDTBSOEU-PMACEKPBSA-N 2 1 312.501 4.023 20 0 DIADMP CCSc1ccccc1C[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206606089 1046491338 /nfs/dbraw/zinc/49/13/38/1046491338.db2.gz CUGUFZXVRCWCRW-KRWDZBQOSA-N 2 1 306.519 4.151 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1cccnc1 ZINC000359864103 1046528003 /nfs/dbraw/zinc/52/80/03/1046528003.db2.gz ABRPJJURSGBZAV-QHAWAJNXSA-N 2 1 323.484 4.205 20 0 DIADMP CCc1ccc(C[N@H+](C)Cc2ccccc2-n2cc[nH+]c2C)cc1 ZINC001140025452 1046571354 /nfs/dbraw/zinc/57/13/54/1046571354.db2.gz AHFCAFRJQITGDF-UHFFFAOYSA-N 2 1 319.452 4.375 20 0 DIADMP CCc1ccc(C[N@@H+](C)Cc2ccccc2-n2cc[nH+]c2C)cc1 ZINC001140025452 1046571366 /nfs/dbraw/zinc/57/13/66/1046571366.db2.gz AHFCAFRJQITGDF-UHFFFAOYSA-N 2 1 319.452 4.375 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)CCCc1ccccc1 ZINC001140027897 1046572653 /nfs/dbraw/zinc/57/26/53/1046572653.db2.gz GAUOYBLFFJDVCB-UHFFFAOYSA-N 2 1 319.452 4.245 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)CCCc1ccccc1 ZINC001140027897 1046572671 /nfs/dbraw/zinc/57/26/71/1046572671.db2.gz GAUOYBLFFJDVCB-UHFFFAOYSA-N 2 1 319.452 4.245 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)CCc1ccc(C)cc1 ZINC001140028322 1046572711 /nfs/dbraw/zinc/57/27/11/1046572711.db2.gz QVQGVUMUWATMON-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)CCc1ccc(C)cc1 ZINC001140028322 1046572728 /nfs/dbraw/zinc/57/27/28/1046572728.db2.gz QVQGVUMUWATMON-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000195136767 1046590775 /nfs/dbraw/zinc/59/07/75/1046590775.db2.gz LJBRVRZFHBHZFH-CTNGQTDRSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000237707942 1046597188 /nfs/dbraw/zinc/59/71/88/1046597188.db2.gz QRTOCTVONVNSNF-QFBILLFUSA-N 2 1 312.457 4.190 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248412000 1046610459 /nfs/dbraw/zinc/61/04/59/1046610459.db2.gz ZUZYJKPMQYYOEH-PMPSAXMXSA-N 2 1 312.567 4.149 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000245547569 1046613961 /nfs/dbraw/zinc/61/39/61/1046613961.db2.gz NNNCWOPIYSBDLZ-WBVHZDCISA-N 2 1 301.434 4.038 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000245547569 1046613964 /nfs/dbraw/zinc/61/39/64/1046613964.db2.gz NNNCWOPIYSBDLZ-WBVHZDCISA-N 2 1 301.434 4.038 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)c(C)n1 ZINC000678411055 1046629928 /nfs/dbraw/zinc/62/99/28/1046629928.db2.gz GJWPVDAUELNRFY-INIZCTEOSA-N 2 1 303.494 4.004 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)c(C)n1 ZINC000678411055 1046629933 /nfs/dbraw/zinc/62/99/33/1046629933.db2.gz GJWPVDAUELNRFY-INIZCTEOSA-N 2 1 303.494 4.004 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(C)n1 ZINC000678413611 1046630843 /nfs/dbraw/zinc/63/08/43/1046630843.db2.gz LEAHRKKDGFFNKZ-DLBZAZTESA-N 2 1 303.494 4.004 20 0 DIADMP C[C@@H]1C[C@@H]1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000248825288 1046636610 /nfs/dbraw/zinc/63/66/10/1046636610.db2.gz FYMVSILIKKXRRI-LXJFHXKKSA-N 2 1 318.892 4.252 20 0 DIADMP C[C@@H]1C[C@H]1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000248825301 1046636771 /nfs/dbraw/zinc/63/67/71/1046636771.db2.gz FYMVSILIKKXRRI-SAPAJUPCSA-N 2 1 318.892 4.252 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1ccc2ccccc2c1 ZINC000533080645 1046649699 /nfs/dbraw/zinc/64/96/99/1046649699.db2.gz HKXNNSBICWSLPE-INIZCTEOSA-N 2 1 307.441 4.428 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1ccc2ccccc2c1 ZINC000533080645 1046649708 /nfs/dbraw/zinc/64/97/08/1046649708.db2.gz HKXNNSBICWSLPE-INIZCTEOSA-N 2 1 307.441 4.428 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H]2CCc3c2cccc3Cl)CC1 ZINC000533099588 1046652307 /nfs/dbraw/zinc/65/23/07/1046652307.db2.gz LSWWFXRECSEULN-LJQANCHMSA-N 2 1 320.908 4.380 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@H](C)c2ccncc2)CC1)CC(C)C ZINC000678636078 1046681963 /nfs/dbraw/zinc/68/19/63/1046681963.db2.gz ZCRBLPOSZQADEK-GOSISDBHSA-N 2 1 317.521 4.223 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394595 1046715813 /nfs/dbraw/zinc/71/58/13/1046715813.db2.gz HILBCVFKVOLXNZ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394595 1046715820 /nfs/dbraw/zinc/71/58/20/1046715820.db2.gz HILBCVFKVOLXNZ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394595 1046715833 /nfs/dbraw/zinc/71/58/33/1046715833.db2.gz HILBCVFKVOLXNZ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394595 1046715847 /nfs/dbraw/zinc/71/58/47/1046715847.db2.gz HILBCVFKVOLXNZ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC000533425953 1046720067 /nfs/dbraw/zinc/72/00/67/1046720067.db2.gz ULILGJMEJOZVMI-RTBURBONSA-N 2 1 300.490 4.091 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(C)c(OC)c(Cl)c2)C1 ZINC000796703051 1046720558 /nfs/dbraw/zinc/72/05/58/1046720558.db2.gz QBQKYHCRPUCFMQ-CABCVRRESA-N 2 1 324.896 4.040 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000678892289 1046728352 /nfs/dbraw/zinc/72/83/52/1046728352.db2.gz FNYIYGORPASLSE-FZKQIMNGSA-N 2 1 321.415 4.093 20 0 DIADMP CC[N@@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860800 1046749555 /nfs/dbraw/zinc/74/95/55/1046749555.db2.gz YHIKTRUXCQLTQA-XUVXKRRUSA-N 2 1 315.505 4.206 20 0 DIADMP CC[N@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860800 1046749573 /nfs/dbraw/zinc/74/95/73/1046749573.db2.gz YHIKTRUXCQLTQA-XUVXKRRUSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860800 1046749589 /nfs/dbraw/zinc/74/95/89/1046749589.db2.gz YHIKTRUXCQLTQA-XUVXKRRUSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860800 1046749604 /nfs/dbraw/zinc/74/96/04/1046749604.db2.gz YHIKTRUXCQLTQA-XUVXKRRUSA-N 2 1 315.505 4.206 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cc1 ZINC000679073864 1046768405 /nfs/dbraw/zinc/76/84/05/1046768405.db2.gz NRTIURMCMUBTBW-SWLSCSKDSA-N 2 1 305.372 4.019 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1C(C)(C)C ZINC000533637934 1046770787 /nfs/dbraw/zinc/77/07/87/1046770787.db2.gz BMMJNOYUBGXCSO-JKSUJKDBSA-N 2 1 300.490 4.119 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(F)cc(Cl)c2)CC1 ZINC001140541018 1046774465 /nfs/dbraw/zinc/77/44/65/1046774465.db2.gz VXWORFGZVZVNFC-UHFFFAOYSA-N 2 1 312.860 4.175 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(F)cc(Cl)c2)CC1 ZINC001140541018 1046774479 /nfs/dbraw/zinc/77/44/79/1046774479.db2.gz VXWORFGZVZVNFC-UHFFFAOYSA-N 2 1 312.860 4.175 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000645465496 1046792921 /nfs/dbraw/zinc/79/29/21/1046792921.db2.gz IGNMSPUUIYCLOY-LEWJYISDSA-N 2 1 312.501 4.451 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000645457570 1046793507 /nfs/dbraw/zinc/79/35/07/1046793507.db2.gz QPPMUJLHEGMSGW-CMOCDZPBSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000645457570 1046793518 /nfs/dbraw/zinc/79/35/18/1046793518.db2.gz QPPMUJLHEGMSGW-CMOCDZPBSA-N 2 1 320.480 4.358 20 0 DIADMP Cc1nc2c(s1)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCC2 ZINC000246984951 1046821321 /nfs/dbraw/zinc/82/13/21/1046821321.db2.gz JYBFCQYSESVIDN-GDBMZVCRSA-N 2 1 321.534 4.073 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@@H+]1Cc1c[nH]c2cc[nH+]cc12 ZINC001140802805 1046909310 /nfs/dbraw/zinc/90/93/10/1046909310.db2.gz FFUUKSQBYHYFLU-LJQANCHMSA-N 2 1 309.388 4.429 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1c[nH]c2cc[nH+]cc12 ZINC001140802805 1046909318 /nfs/dbraw/zinc/90/93/18/1046909318.db2.gz FFUUKSQBYHYFLU-LJQANCHMSA-N 2 1 309.388 4.429 20 0 DIADMP CCCN1CCC([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000161602753 1046909919 /nfs/dbraw/zinc/90/99/19/1046909919.db2.gz CKYMRRKDWIZDKX-KRWDZBQOSA-N 2 1 322.880 4.018 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000161602753 1046909929 /nfs/dbraw/zinc/90/99/29/1046909929.db2.gz CKYMRRKDWIZDKX-KRWDZBQOSA-N 2 1 322.880 4.018 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176190 1046949635 /nfs/dbraw/zinc/94/96/35/1046949635.db2.gz XTTFUOCSTOXDPA-QUCCMNQESA-N 2 1 310.485 4.130 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C[C@@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176190 1046949641 /nfs/dbraw/zinc/94/96/41/1046949641.db2.gz XTTFUOCSTOXDPA-QUCCMNQESA-N 2 1 310.485 4.130 20 0 DIADMP C(CCC[N@H+]1CCC[C@@H]1C1CC1)CC[NH+]1CCC[C@H]1C1CC1 ZINC000729814709 1046959480 /nfs/dbraw/zinc/95/94/80/1046959480.db2.gz UOZMXDDOXPJAKB-BGYRXZFFSA-N 2 1 304.522 4.296 20 0 DIADMP C(CCC[N@@H+]1CCC[C@H]1C1CC1)CC[NH+]1CCC[C@@H]1C1CC1 ZINC000729814709 1046959487 /nfs/dbraw/zinc/95/94/87/1046959487.db2.gz UOZMXDDOXPJAKB-BGYRXZFFSA-N 2 1 304.522 4.296 20 0 DIADMP C(CCC[N@H+]1CCC[C@H]1C1CC1)CC[NH+]1CCC[C@@H]1C1CC1 ZINC000729814709 1046959501 /nfs/dbraw/zinc/95/95/01/1046959501.db2.gz UOZMXDDOXPJAKB-BGYRXZFFSA-N 2 1 304.522 4.296 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1ccco1 ZINC000680351867 1046969387 /nfs/dbraw/zinc/96/93/87/1046969387.db2.gz GZJDTICPJIXKPN-FRYIKTPZSA-N 2 1 324.468 4.231 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccco1 ZINC000680351867 1046969399 /nfs/dbraw/zinc/96/93/99/1046969399.db2.gz GZJDTICPJIXKPN-FRYIKTPZSA-N 2 1 324.468 4.231 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccoc1 ZINC000680351855 1046970544 /nfs/dbraw/zinc/97/05/44/1046970544.db2.gz GTLHIPXROXIYKA-RCVZYCBYSA-N 2 1 324.468 4.231 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](C)CC(F)F)cc1 ZINC000647317935 1046975608 /nfs/dbraw/zinc/97/56/08/1046975608.db2.gz AFBJQVDRGDMDKZ-QWHCGFSZSA-N 2 1 307.388 4.123 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000647344173 1046984100 /nfs/dbraw/zinc/98/41/00/1046984100.db2.gz KXZVJZAICXZEQC-NXHRZFHOSA-N 2 1 314.498 4.053 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CCCC2)o1 ZINC000680461179 1046984574 /nfs/dbraw/zinc/98/45/74/1046984574.db2.gz HHWGLGIGLKQPFQ-ZHALLVOQSA-N 2 1 302.462 4.036 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)o1 ZINC000680461179 1046984586 /nfs/dbraw/zinc/98/45/86/1046984586.db2.gz HHWGLGIGLKQPFQ-ZHALLVOQSA-N 2 1 302.462 4.036 20 0 DIADMP C[C@H]([NH2+]CC1CCC(F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000647350064 1046990305 /nfs/dbraw/zinc/99/03/05/1046990305.db2.gz UCICEMUVCKNFON-YMPIPDKKSA-N 2 1 318.480 4.015 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC000647354478 1046991610 /nfs/dbraw/zinc/99/16/10/1046991610.db2.gz KSGZHCRPSPVIPS-ILFOVFQQSA-N 2 1 312.501 4.208 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3cccc4ccccc43)C2)CC1 ZINC000798958015 1046991930 /nfs/dbraw/zinc/99/19/30/1046991930.db2.gz XLWIWGCHVGNTHY-UHFFFAOYSA-N 2 1 308.469 4.148 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799177568 1047008537 /nfs/dbraw/zinc/00/85/37/1047008537.db2.gz VCCRXRUQTQZDTJ-HNNXBMFYSA-N 2 1 306.881 4.209 20 0 DIADMP [NH3+]C1CC[NH+](Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1 ZINC000647811289 1047017420 /nfs/dbraw/zinc/01/74/20/1047017420.db2.gz CIGFOCRKOSTHBR-UHFFFAOYSA-N 2 1 316.832 4.055 20 0 DIADMP CC[N@H+](Cc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536711287 1047085323 /nfs/dbraw/zinc/08/53/23/1047085323.db2.gz YBIVWYGTRBRQCS-OAQYLSRUSA-N 2 1 308.469 4.031 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536711287 1047085337 /nfs/dbraw/zinc/08/53/37/1047085337.db2.gz YBIVWYGTRBRQCS-OAQYLSRUSA-N 2 1 308.469 4.031 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536711287 1047085357 /nfs/dbraw/zinc/08/53/57/1047085357.db2.gz YBIVWYGTRBRQCS-OAQYLSRUSA-N 2 1 308.469 4.031 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536724771 1047086436 /nfs/dbraw/zinc/08/64/36/1047086436.db2.gz SRDJEMYDODSDCM-SFHVURJKSA-N 2 1 323.484 4.381 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000191492695 1047086861 /nfs/dbraw/zinc/08/68/61/1047086861.db2.gz NOWQTEAAOBIVDV-UHFFFAOYSA-N 2 1 323.843 4.150 20 0 DIADMP Cc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379651977 1047089680 /nfs/dbraw/zinc/08/96/80/1047089680.db2.gz VOJPAGVKISWNKI-RXVVDRJESA-N 2 1 308.469 4.138 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651553 1047091727 /nfs/dbraw/zinc/09/17/27/1047091727.db2.gz UVCVCKIRKQPCKV-NJAFHUGGSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CCCC1 ZINC000379654475 1047092203 /nfs/dbraw/zinc/09/22/03/1047092203.db2.gz IPWACZFBMFWBCO-ABSDTBQOSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CCCC1 ZINC000379654475 1047092221 /nfs/dbraw/zinc/09/22/21/1047092221.db2.gz IPWACZFBMFWBCO-ABSDTBQOSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379653607 1047092791 /nfs/dbraw/zinc/09/27/91/1047092791.db2.gz GKGQZBVJRNAUNV-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379653607 1047092806 /nfs/dbraw/zinc/09/28/06/1047092806.db2.gz GKGQZBVJRNAUNV-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1ccccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379641896 1047093061 /nfs/dbraw/zinc/09/30/61/1047093061.db2.gz DMKVQPBWGBCQIY-GHTZIAJQSA-N 2 1 308.469 4.138 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccsc1 ZINC000379641851 1047094686 /nfs/dbraw/zinc/09/46/86/1047094686.db2.gz YPIMXLVTGUOUTA-HZPDHXFCSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccsc1 ZINC000379641851 1047094700 /nfs/dbraw/zinc/09/47/00/1047094700.db2.gz YPIMXLVTGUOUTA-HZPDHXFCSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657515 1047096918 /nfs/dbraw/zinc/09/69/18/1047096918.db2.gz TUMSJRMAXGHLMA-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657515 1047096930 /nfs/dbraw/zinc/09/69/30/1047096930.db2.gz TUMSJRMAXGHLMA-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379657298 1047097281 /nfs/dbraw/zinc/09/72/81/1047097281.db2.gz RZXMJMFELKSXIP-DXIQSLLYSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379657298 1047097292 /nfs/dbraw/zinc/09/72/92/1047097292.db2.gz RZXMJMFELKSXIP-DXIQSLLYSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657082 1047098100 /nfs/dbraw/zinc/09/81/00/1047098100.db2.gz RPSSLXHAGOVGMP-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657082 1047098113 /nfs/dbraw/zinc/09/81/13/1047098113.db2.gz RPSSLXHAGOVGMP-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)cc1 ZINC000536830615 1047102750 /nfs/dbraw/zinc/10/27/50/1047102750.db2.gz DMNYDFLDNKEIHJ-YLJYHZDGSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000536825765 1047104226 /nfs/dbraw/zinc/10/42/26/1047104226.db2.gz JMEGZNUQXAIPJN-AOIWGVFYSA-N 2 1 312.457 4.231 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000536825775 1047104757 /nfs/dbraw/zinc/10/47/57/1047104757.db2.gz JMEGZNUQXAIPJN-LNLFQRSKSA-N 2 1 312.457 4.231 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]C(C2CC2)C2CC2)C[N@H+]1Cc1ccccc1 ZINC000536831475 1047113196 /nfs/dbraw/zinc/11/31/96/1047113196.db2.gz IUODFVSOGYCWRU-WMZOPIPTSA-N 2 1 312.501 4.065 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](CCc1ccccc1)C(C)C ZINC000536861294 1047115540 /nfs/dbraw/zinc/11/55/40/1047115540.db2.gz BULIYNRWAYFOHJ-PXNSSMCTSA-N 2 1 313.489 4.075 20 0 DIADMP CC[N@H+]1CCC[C@@H](CN[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293251 1047127938 /nfs/dbraw/zinc/12/79/38/1047127938.db2.gz KXMPUAWPOBICFL-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293251 1047127942 /nfs/dbraw/zinc/12/79/42/1047127942.db2.gz KXMPUAWPOBICFL-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293251 1047127946 /nfs/dbraw/zinc/12/79/46/1047127946.db2.gz KXMPUAWPOBICFL-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(F)c(C)c1)C1CC1 ZINC000537015889 1047131800 /nfs/dbraw/zinc/13/18/00/1047131800.db2.gz ORQNKDZKFOPIBH-BFUOFWGJSA-N 2 1 315.436 4.016 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC2CCCCC2)CC1)CC1CC1 ZINC001459815016 1047139549 /nfs/dbraw/zinc/13/95/49/1047139549.db2.gz AGDYWYBSSUEPEO-UHFFFAOYSA-N 2 1 306.538 4.401 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]C1(c2cccc(Cl)c2)CCCC1 ZINC000537125754 1047139789 /nfs/dbraw/zinc/13/97/89/1047139789.db2.gz DFTAVUKXDPMMKQ-UHFFFAOYSA-N 2 1 317.864 4.294 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCc2ccccc21 ZINC000682068985 1047167676 /nfs/dbraw/zinc/16/76/76/1047167676.db2.gz BIQPSGOEALLWSS-KNQAVFIVSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCc2ccccc21 ZINC000682068985 1047167685 /nfs/dbraw/zinc/16/76/85/1047167685.db2.gz BIQPSGOEALLWSS-KNQAVFIVSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCc2ccccc21 ZINC000682068985 1047167691 /nfs/dbraw/zinc/16/76/91/1047167691.db2.gz BIQPSGOEALLWSS-KNQAVFIVSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000682734771 1047217336 /nfs/dbraw/zinc/21/73/36/1047217336.db2.gz ZRKDPXXMVSBTMY-YSIASYRMSA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)(C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001117714715 1047237634 /nfs/dbraw/zinc/23/76/34/1047237634.db2.gz KJMWFOXCRMIPNE-YQQQUEKLSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCSC(C)(C)C ZINC000398178825 1047326815 /nfs/dbraw/zinc/32/68/15/1047326815.db2.gz WMXISQJNVYVDFB-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)s1 ZINC001142029061 1047352386 /nfs/dbraw/zinc/35/23/86/1047352386.db2.gz HSWWMXVLADLUCH-LSDHHAIUSA-N 2 1 324.559 4.309 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)s1 ZINC001142029061 1047352397 /nfs/dbraw/zinc/35/23/97/1047352397.db2.gz HSWWMXVLADLUCH-LSDHHAIUSA-N 2 1 324.559 4.309 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)s1 ZINC001142029061 1047352408 /nfs/dbraw/zinc/35/24/08/1047352408.db2.gz HSWWMXVLADLUCH-LSDHHAIUSA-N 2 1 324.559 4.309 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)s1 ZINC001142029061 1047352416 /nfs/dbraw/zinc/35/24/16/1047352416.db2.gz HSWWMXVLADLUCH-LSDHHAIUSA-N 2 1 324.559 4.309 20 0 DIADMP C[NH+](C)C1CCC([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001168314989 1047423616 /nfs/dbraw/zinc/42/36/16/1047423616.db2.gz JYPRLNPDCILPMK-UHFFFAOYSA-N 2 1 318.892 4.302 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC001168318774 1047426820 /nfs/dbraw/zinc/42/68/20/1047426820.db2.gz FQZBNCHGYALDNO-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001168323731 1047448361 /nfs/dbraw/zinc/44/83/61/1047448361.db2.gz BOYLSLIEFARFSH-FHERZECASA-N 2 1 306.881 4.002 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617221 1047455489 /nfs/dbraw/zinc/45/54/89/1047455489.db2.gz WKDXYIOTFRXLRT-VQIMIIECSA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617221 1047455496 /nfs/dbraw/zinc/45/54/96/1047455496.db2.gz WKDXYIOTFRXLRT-VQIMIIECSA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617221 1047455504 /nfs/dbraw/zinc/45/55/04/1047455504.db2.gz WKDXYIOTFRXLRT-VQIMIIECSA-N 2 1 312.457 4.109 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617221 1047455510 /nfs/dbraw/zinc/45/55/10/1047455510.db2.gz WKDXYIOTFRXLRT-VQIMIIECSA-N 2 1 312.457 4.109 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC001168327630 1047457049 /nfs/dbraw/zinc/45/70/49/1047457049.db2.gz PXFSHDIPCALRIN-XEVCZEQESA-N 2 1 300.490 4.129 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001168329238 1047463455 /nfs/dbraw/zinc/46/34/55/1047463455.db2.gz RCHRDBXNQOOJSI-DAWZGUTISA-N 2 1 306.881 4.350 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341922 1047509670 /nfs/dbraw/zinc/50/96/70/1047509670.db2.gz UYXOSIYUCRSIQH-MTYUVTTFSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341922 1047509675 /nfs/dbraw/zinc/50/96/75/1047509675.db2.gz UYXOSIYUCRSIQH-MTYUVTTFSA-N 2 1 320.908 4.296 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000121361493 1047520114 /nfs/dbraw/zinc/52/01/14/1047520114.db2.gz IWSSHLQZHUXLDR-QGZVFWFLSA-N 2 1 317.864 4.115 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000121361493 1047520120 /nfs/dbraw/zinc/52/01/20/1047520120.db2.gz IWSSHLQZHUXLDR-QGZVFWFLSA-N 2 1 317.864 4.115 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(F)cc2)s1)C1CCC([NH3+])CC1 ZINC000843055539 1047525626 /nfs/dbraw/zinc/52/56/26/1047525626.db2.gz GNTRRIVJVLGKIN-UHFFFAOYSA-N 2 1 318.461 4.256 20 0 DIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)C1CCC([NH3+])CC1 ZINC000843055083 1047525640 /nfs/dbraw/zinc/52/56/40/1047525640.db2.gz PVMRRKJNXVAMNR-UHFFFAOYSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)C1CCC([NH3+])CC1 ZINC000843056111 1047525895 /nfs/dbraw/zinc/52/58/95/1047525895.db2.gz ZPVFRGPOYPPBEQ-UHFFFAOYSA-N 2 1 320.786 4.061 20 0 DIADMP C[C@H](C[N@@H+](C)C1CCC([NH3+])CC1)c1ccc(C(F)(F)F)cc1 ZINC000843054885 1047526433 /nfs/dbraw/zinc/52/64/33/1047526433.db2.gz MEXPUKBOJMGCOM-UWTIGNOOSA-N 2 1 314.395 4.011 20 0 DIADMP Clc1c2ccccc2sc1C[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843364269 1047543354 /nfs/dbraw/zinc/54/33/54/1047543354.db2.gz YVPVMTFKBOLGCI-UHFFFAOYSA-N 2 1 320.889 4.130 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCCC[C@@H](C[NH3+])C3)c(C)c12 ZINC001206631843 1047568285 /nfs/dbraw/zinc/56/82/85/1047568285.db2.gz AWUGBGXFIGMMMY-ZDUSSCGKSA-N 2 1 308.516 4.140 20 0 DIADMP CC[C@@H](C)C[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000537865175 1047641220 /nfs/dbraw/zinc/64/12/20/1047641220.db2.gz VKJJSXVAIUUCDD-MRXNPFEDSA-N 2 1 300.446 4.047 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000538099165 1047657492 /nfs/dbraw/zinc/65/74/92/1047657492.db2.gz RUJVHEQRXXGMBJ-FXAWDEMLSA-N 2 1 300.490 4.156 20 0 DIADMP CC(C)(C)C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1 ZINC000538398078 1047674808 /nfs/dbraw/zinc/67/48/08/1047674808.db2.gz DDRWCGPBTQQQDV-DNVCBOLYSA-N 2 1 318.480 4.377 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C3(c4ccccc4)CC3)CC2)C1 ZINC000538524065 1047683356 /nfs/dbraw/zinc/68/33/56/1047683356.db2.gz ZBBOGOOYGHXPSE-PXNSSMCTSA-N 2 1 312.501 4.308 20 0 DIADMP CC[C@@H](C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000538719204 1047699197 /nfs/dbraw/zinc/69/91/97/1047699197.db2.gz RPVDLEBAZVFMRY-ICSRJNTNSA-N 2 1 300.490 4.131 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2csc3ccccc23)C1 ZINC000538752232 1047709396 /nfs/dbraw/zinc/70/93/96/1047709396.db2.gz RYZGCWMIFGJKMM-MRXNPFEDSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2csc3ccccc23)C1 ZINC000538752232 1047709402 /nfs/dbraw/zinc/70/94/02/1047709402.db2.gz RYZGCWMIFGJKMM-MRXNPFEDSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000538752232 1047709407 /nfs/dbraw/zinc/70/94/07/1047709407.db2.gz RYZGCWMIFGJKMM-MRXNPFEDSA-N 2 1 314.498 4.065 20 0 DIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752130 1047709456 /nfs/dbraw/zinc/70/94/56/1047709456.db2.gz KIBLXWUKTUYLGX-GOSISDBHSA-N 2 1 324.468 4.110 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752130 1047709460 /nfs/dbraw/zinc/70/94/60/1047709460.db2.gz KIBLXWUKTUYLGX-GOSISDBHSA-N 2 1 324.468 4.110 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752130 1047709464 /nfs/dbraw/zinc/70/94/64/1047709464.db2.gz KIBLXWUKTUYLGX-GOSISDBHSA-N 2 1 324.468 4.110 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752130 1047709468 /nfs/dbraw/zinc/70/94/68/1047709468.db2.gz KIBLXWUKTUYLGX-GOSISDBHSA-N 2 1 324.468 4.110 20 0 DIADMP CC[C@H](C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000538796164 1047710899 /nfs/dbraw/zinc/71/08/99/1047710899.db2.gz STGCCZBGWICQBC-QFUCXCTJSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000538796164 1047710904 /nfs/dbraw/zinc/71/09/04/1047710904.db2.gz STGCCZBGWICQBC-QFUCXCTJSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000538796164 1047710907 /nfs/dbraw/zinc/71/09/07/1047710907.db2.gz STGCCZBGWICQBC-QFUCXCTJSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(OC)c1 ZINC000539052590 1047728098 /nfs/dbraw/zinc/72/80/98/1047728098.db2.gz JGHKCTRKDSORCI-XLIONFOSSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000539058929 1047729166 /nfs/dbraw/zinc/72/91/66/1047729166.db2.gz APRHABXVOVTOFH-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000539058929 1047729170 /nfs/dbraw/zinc/72/91/70/1047729170.db2.gz APRHABXVOVTOFH-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)s2)C1 ZINC000539046266 1047731755 /nfs/dbraw/zinc/73/17/55/1047731755.db2.gz IYXSJHQKBMFLQW-KGLIPLIRSA-N 2 1 314.926 4.420 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(Nc2ccc([C@@H]3CCC[NH2+]3)cc2)cc1 ZINC001159511143 1047858032 /nfs/dbraw/zinc/85/80/32/1047858032.db2.gz ZLKNYXCEHMPHOM-FQEVSTJZSA-N 2 1 318.424 4.349 20 0 DIADMP Cc1c[nH+]ccc1Nc1ccc2c(c1)C[N@H+](Cc1ccccc1)C2 ZINC001174537668 1047866429 /nfs/dbraw/zinc/86/64/29/1047866429.db2.gz LVTWACAEUWETOL-UHFFFAOYSA-N 2 1 315.420 4.071 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCCCCC2)[C@H]1c1cccs1 ZINC000553514300 1047867624 /nfs/dbraw/zinc/86/76/24/1047867624.db2.gz LMUJTBCJUFXAPH-YJBOKZPZSA-N 2 1 306.519 4.443 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CCCCCC2)[C@H]1c1cccs1 ZINC000553514300 1047867640 /nfs/dbraw/zinc/86/76/40/1047867640.db2.gz LMUJTBCJUFXAPH-YJBOKZPZSA-N 2 1 306.519 4.443 20 0 DIADMP Clc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)s1 ZINC000553537170 1047869792 /nfs/dbraw/zinc/86/97/92/1047869792.db2.gz FMSUSYMGHKDIOK-UHFFFAOYSA-N 2 1 312.910 4.288 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)cc1Cl ZINC001183065742 1047887324 /nfs/dbraw/zinc/88/73/24/1047887324.db2.gz OYRNHGWXCWKVLT-CRAIPNDOSA-N 2 1 308.897 4.201 20 0 DIADMP Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)cc1Cl ZINC001183065742 1047887338 /nfs/dbraw/zinc/88/73/38/1047887338.db2.gz OYRNHGWXCWKVLT-CRAIPNDOSA-N 2 1 308.897 4.201 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001183378718 1047926447 /nfs/dbraw/zinc/92/64/47/1047926447.db2.gz ATXPOVCAKHXJNY-JXFKEZNVSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001183378718 1047926456 /nfs/dbraw/zinc/92/64/56/1047926456.db2.gz ATXPOVCAKHXJNY-JXFKEZNVSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)s2)CC1 ZINC001205273454 1047936962 /nfs/dbraw/zinc/93/69/62/1047936962.db2.gz LFHHLVOCPSNLLG-INIZCTEOSA-N 2 1 306.500 4.180 20 0 DIADMP CCc1cccc2cc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)oc21 ZINC000667533072 1047949704 /nfs/dbraw/zinc/94/97/04/1047949704.db2.gz FAMNGPSZYGGNNN-INIZCTEOSA-N 2 1 309.413 4.098 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCC1CC[NH2+]CC1 ZINC000479691782 1047953953 /nfs/dbraw/zinc/95/39/53/1047953953.db2.gz LZSBHJMBDJMCNF-CYBMUJFWSA-N 2 1 314.395 4.088 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC001184024243 1047989924 /nfs/dbraw/zinc/98/99/24/1047989924.db2.gz YBZCNCYYXNGYMN-RBUKOAKNSA-N 2 1 300.490 4.177 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000479908499 1048003832 /nfs/dbraw/zinc/00/38/32/1048003832.db2.gz AKESXAAWLDERPH-CABCVRRESA-N 2 1 323.550 4.490 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC000479908499 1048003844 /nfs/dbraw/zinc/00/38/44/1048003844.db2.gz AKESXAAWLDERPH-CABCVRRESA-N 2 1 323.550 4.490 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@H]2C1 ZINC001184304046 1048021982 /nfs/dbraw/zinc/02/19/82/1048021982.db2.gz UTSANQYYJUXGQY-YESZJQIVSA-N 2 1 320.908 4.065 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)cc1 ZINC001184292410 1048025573 /nfs/dbraw/zinc/02/55/73/1048025573.db2.gz YOVISWCIIDSVPK-PCCBWWKXSA-N 2 1 314.517 4.015 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](CC)CC2)cc1 ZINC000480031888 1048033296 /nfs/dbraw/zinc/03/32/96/1048033296.db2.gz ZXHQXMWETVBMAN-KRWDZBQOSA-N 2 1 318.505 4.391 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)cc1C ZINC001184375672 1048033545 /nfs/dbraw/zinc/03/35/45/1048033545.db2.gz WFBNVJMYRYQVQA-HJWRWDBZSA-N 2 1 314.517 4.478 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)cc1C ZINC001184375672 1048033555 /nfs/dbraw/zinc/03/35/55/1048033555.db2.gz WFBNVJMYRYQVQA-HJWRWDBZSA-N 2 1 314.517 4.478 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](CCC(C)C)c2ccc(OC)cc2)CC1 ZINC000480050559 1048040003 /nfs/dbraw/zinc/04/00/03/1048040003.db2.gz WMUBWFBWIKTWCN-HXUWFJFHSA-N 2 1 318.505 4.246 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001203319507 1048045068 /nfs/dbraw/zinc/04/50/68/1048045068.db2.gz ZGFIUOLGRHBHMY-VXKWHMMOSA-N 2 1 320.480 4.031 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)CCCC(F)(F)F)C1 ZINC000480145680 1048068813 /nfs/dbraw/zinc/06/88/13/1048068813.db2.gz HNZHCWWYODJRAR-HUUCEWRRSA-N 2 1 308.432 4.065 20 0 DIADMP CC(C)SCC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000554372129 1048076294 /nfs/dbraw/zinc/07/62/94/1048076294.db2.gz IMSOUQSWNLITHS-UHFFFAOYSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480239317 1048101088 /nfs/dbraw/zinc/10/10/88/1048101088.db2.gz DYEWXQXWFZJRRY-OWCLPIDISA-N 2 1 322.459 4.455 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC1(C)C ZINC001199873901 1048114250 /nfs/dbraw/zinc/11/42/50/1048114250.db2.gz ABFAPPYGPIZWKD-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC1(C)C ZINC001199873901 1048114260 /nfs/dbraw/zinc/11/42/60/1048114260.db2.gz ABFAPPYGPIZWKD-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC1(C)C ZINC001199873905 1048114985 /nfs/dbraw/zinc/11/49/85/1048114985.db2.gz ABFAPPYGPIZWKD-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC1(C)C ZINC001199873905 1048115001 /nfs/dbraw/zinc/11/50/01/1048115001.db2.gz ABFAPPYGPIZWKD-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP CC[N@H+](CC[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1)C(C)C ZINC001199991118 1048132210 /nfs/dbraw/zinc/13/22/10/1048132210.db2.gz RDRCOPAUBNCYOC-DFQSSKMNSA-N 2 1 302.506 4.279 20 0 DIADMP CC[N@@H+](CC[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1)C(C)C ZINC001199991118 1048132217 /nfs/dbraw/zinc/13/22/17/1048132217.db2.gz RDRCOPAUBNCYOC-DFQSSKMNSA-N 2 1 302.506 4.279 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000554742147 1048170422 /nfs/dbraw/zinc/17/04/22/1048170422.db2.gz QCAMGROJWNLADG-IPMKNSEASA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000554742147 1048170426 /nfs/dbraw/zinc/17/04/26/1048170426.db2.gz QCAMGROJWNLADG-IPMKNSEASA-N 2 1 317.521 4.126 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H](Cc2ccccc2)C2CC2)C1 ZINC000480613488 1048192232 /nfs/dbraw/zinc/19/22/32/1048192232.db2.gz JPDOIXNCQZBPBT-RXVVDRJESA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc(F)cc(F)c1 ZINC000480628190 1048195999 /nfs/dbraw/zinc/19/59/99/1048195999.db2.gz WPRCHCRPVVWGFA-GJZGRUSLSA-N 2 1 310.432 4.128 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc(F)cc(F)c1 ZINC000480628192 1048196278 /nfs/dbraw/zinc/19/62/78/1048196278.db2.gz WPRCHCRPVVWGFA-LSDHHAIUSA-N 2 1 310.432 4.128 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1cccc2F ZINC000480635036 1048201342 /nfs/dbraw/zinc/20/13/42/1048201342.db2.gz VJLRKOOKYQEMBK-HNAYVOBHSA-N 2 1 304.453 4.057 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)cc(F)c1 ZINC000480634759 1048201626 /nfs/dbraw/zinc/20/16/26/1048201626.db2.gz VHAPAFOHUVEJGK-HUUCEWRRSA-N 2 1 310.432 4.270 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000480718795 1048227708 /nfs/dbraw/zinc/22/77/08/1048227708.db2.gz FSRCKDINVKYJDH-IEBWSBKVSA-N 2 1 320.546 4.020 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000480718795 1048227724 /nfs/dbraw/zinc/22/77/24/1048227724.db2.gz FSRCKDINVKYJDH-IEBWSBKVSA-N 2 1 320.546 4.020 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](CC2CCCCC2)CC1 ZINC001201401496 1048250283 /nfs/dbraw/zinc/25/02/83/1048250283.db2.gz JZVMMFQMBYBQBX-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](CC2CCCCC2)CC1 ZINC001201401496 1048250289 /nfs/dbraw/zinc/25/02/89/1048250289.db2.gz JZVMMFQMBYBQBX-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001201426699 1048263649 /nfs/dbraw/zinc/26/36/49/1048263649.db2.gz HFUGWCWMZPTUIL-QGZVFWFLSA-N 2 1 316.464 4.078 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001201426699 1048263661 /nfs/dbraw/zinc/26/36/61/1048263661.db2.gz HFUGWCWMZPTUIL-QGZVFWFLSA-N 2 1 316.464 4.078 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001201427997 1048265696 /nfs/dbraw/zinc/26/56/96/1048265696.db2.gz OWULSGJMLXAGCW-QGZVFWFLSA-N 2 1 316.464 4.078 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001201427997 1048265703 /nfs/dbraw/zinc/26/57/03/1048265703.db2.gz OWULSGJMLXAGCW-QGZVFWFLSA-N 2 1 316.464 4.078 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](CC(C)(C)C)CC2 ZINC001201434132 1048272244 /nfs/dbraw/zinc/27/22/44/1048272244.db2.gz CKUGUSREKDBWNM-KRWDZBQOSA-N 2 1 304.478 4.002 20 0 DIADMP [NH3+][C@H]1CCC[C@H](Nc2[nH+]ccc3cc(-c4ccc(F)cc4)[nH]c32)C1 ZINC001162394243 1048272372 /nfs/dbraw/zinc/27/23/72/1048272372.db2.gz OLPCKMNQEUFJCK-HOTGVXAUSA-N 2 1 324.403 4.051 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](CC(C)(C)C)CC2 ZINC001201434133 1048273127 /nfs/dbraw/zinc/27/31/27/1048273127.db2.gz CKUGUSREKDBWNM-QGZVFWFLSA-N 2 1 304.478 4.002 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC(C)(C)C)CC1 ZINC001201441748 1048274487 /nfs/dbraw/zinc/27/44/87/1048274487.db2.gz MAJWDZVSWDLECT-UHFFFAOYSA-N 2 1 308.897 4.282 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC(C)(C)C)CC1 ZINC001201441748 1048274495 /nfs/dbraw/zinc/27/44/95/1048274495.db2.gz MAJWDZVSWDLECT-UHFFFAOYSA-N 2 1 308.897 4.282 20 0 DIADMP CC(C)=CCC[C@@H](C)C[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001201486660 1048278415 /nfs/dbraw/zinc/27/84/15/1048278415.db2.gz LTQOLGZBESEITP-QGZVFWFLSA-N 2 1 315.505 4.311 20 0 DIADMP CC[C@@H](C)C[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201501394 1048287225 /nfs/dbraw/zinc/28/72/25/1048287225.db2.gz JNYDCJBQAOOIPE-AEFFLSMTSA-N 2 1 304.478 4.002 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026048 1048296392 /nfs/dbraw/zinc/29/63/92/1048296392.db2.gz RKJLQFNFZSXBHE-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026048 1048296405 /nfs/dbraw/zinc/29/64/05/1048296405.db2.gz RKJLQFNFZSXBHE-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC(C)C[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001201478669 1048297597 /nfs/dbraw/zinc/29/75/97/1048297597.db2.gz XXGSOYFUXSLORN-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)C1 ZINC000481035354 1048298009 /nfs/dbraw/zinc/29/80/09/1048298009.db2.gz KTZQABQVVXOHTP-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC000481042444 1048301335 /nfs/dbraw/zinc/30/13/35/1048301335.db2.gz QVXGIZWCXCDEEK-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC000481042444 1048301350 /nfs/dbraw/zinc/30/13/50/1048301350.db2.gz QVXGIZWCXCDEEK-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053958 1048303207 /nfs/dbraw/zinc/30/32/07/1048303207.db2.gz QVHDPTROLCANHP-LSDHHAIUSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053958 1048303219 /nfs/dbraw/zinc/30/32/19/1048303219.db2.gz QVHDPTROLCANHP-LSDHHAIUSA-N 2 1 324.896 4.121 20 0 DIADMP CC(C)CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C1CC1 ZINC000555235890 1048305631 /nfs/dbraw/zinc/30/56/31/1048305631.db2.gz OGTUJHCXNOSMCB-HQRMLTQVSA-N 2 1 306.538 4.444 20 0 DIADMP CC[C@H](C)C[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201518020 1048308560 /nfs/dbraw/zinc/30/85/60/1048308560.db2.gz YOQNQTCNQLAVNJ-HNNXBMFYSA-N 2 1 308.897 4.282 20 0 DIADMP CC[C@H](C)C[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201518020 1048308571 /nfs/dbraw/zinc/30/85/71/1048308571.db2.gz YOQNQTCNQLAVNJ-HNNXBMFYSA-N 2 1 308.897 4.282 20 0 DIADMP CC(C)CC[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201617356 1048332749 /nfs/dbraw/zinc/33/27/49/1048332749.db2.gz IHLGMCSJGBTCPO-UHFFFAOYSA-N 2 1 306.519 4.082 20 0 DIADMP CC(C)CC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201626535 1048338993 /nfs/dbraw/zinc/33/89/93/1048338993.db2.gz JZKFWCUFPATYQJ-UHFFFAOYSA-N 2 1 308.897 4.282 20 0 DIADMP CC(C)CC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201626535 1048339010 /nfs/dbraw/zinc/33/90/10/1048339010.db2.gz JZKFWCUFPATYQJ-UHFFFAOYSA-N 2 1 308.897 4.282 20 0 DIADMP CCCC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201706458 1048351449 /nfs/dbraw/zinc/35/14/49/1048351449.db2.gz NIQZFEPSKGYMCH-JQHSSLGASA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201706458 1048351464 /nfs/dbraw/zinc/35/14/64/1048351464.db2.gz NIQZFEPSKGYMCH-JQHSSLGASA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201706458 1048351477 /nfs/dbraw/zinc/35/14/77/1048351477.db2.gz NIQZFEPSKGYMCH-JQHSSLGASA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001201744367 1048363077 /nfs/dbraw/zinc/36/30/77/1048363077.db2.gz JRHXAEFPIVZVKC-UXHICEINSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001201744367 1048363092 /nfs/dbraw/zinc/36/30/92/1048363092.db2.gz JRHXAEFPIVZVKC-UXHICEINSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001201744367 1048363106 /nfs/dbraw/zinc/36/31/06/1048363106.db2.gz JRHXAEFPIVZVKC-UXHICEINSA-N 2 1 300.490 4.021 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3c4ccccc4sc32)C1 ZINC000481321104 1048365801 /nfs/dbraw/zinc/36/58/01/1048365801.db2.gz KLRQRZJHLCXKKW-WMLDXEAASA-N 2 1 314.498 4.210 20 0 DIADMP CCc1ccc[nH+]c1N[C@H]1CC2(CC[NH2+]CC2)c2ccc(C)cc21 ZINC001163023256 1048404432 /nfs/dbraw/zinc/40/44/32/1048404432.db2.gz AQJXCYNAODOHEW-IBGZPJMESA-N 2 1 321.468 4.131 20 0 DIADMP CCc1cccc(N[C@H]2CC3(CC[NH2+]CC3)c3ccc(C)cc32)[nH+]1 ZINC001163035850 1048406002 /nfs/dbraw/zinc/40/60/02/1048406002.db2.gz DKZWHOPGCBYCMG-IBGZPJMESA-N 2 1 321.468 4.131 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000157350113 1048421034 /nfs/dbraw/zinc/42/10/34/1048421034.db2.gz REWYCUAQYPZIOX-KZNAEPCWSA-N 2 1 304.865 4.008 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CCCC2)CC[N@H+]1C ZINC000481554236 1048426974 /nfs/dbraw/zinc/42/69/74/1048426974.db2.gz ASWGMHNMEIVOSV-QAPCUYQASA-N 2 1 320.908 4.224 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@@H+]1C ZINC000481717207 1048464113 /nfs/dbraw/zinc/46/41/13/1048464113.db2.gz JKVPPGDXJXIFAR-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@H+]1C ZINC000481717207 1048464122 /nfs/dbraw/zinc/46/41/22/1048464122.db2.gz JKVPPGDXJXIFAR-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP CCCCOc1ccccc1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC001202242073 1048502153 /nfs/dbraw/zinc/50/21/53/1048502153.db2.gz JAGKWHOYMDLOHN-UHFFFAOYSA-N 2 1 318.505 4.077 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556037637 1048518199 /nfs/dbraw/zinc/51/81/99/1048518199.db2.gz HBRAZUFTIXSUJS-COPCDDAFSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556037637 1048518212 /nfs/dbraw/zinc/51/82/12/1048518212.db2.gz HBRAZUFTIXSUJS-COPCDDAFSA-N 2 1 322.496 4.433 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+](C)C[C@H]3C)c2)c1 ZINC000481935505 1048532823 /nfs/dbraw/zinc/53/28/23/1048532823.db2.gz YTRZFXARXLLPFB-DYESRHJHSA-N 2 1 308.469 4.092 20 0 DIADMP CCCCCOc1ccc([C@@H](C)[NH2+]CCn2cc[nH+]c2C)cc1 ZINC000482135556 1048561375 /nfs/dbraw/zinc/56/13/75/1048561375.db2.gz NJCKETXWBRDVGQ-MRXNPFEDSA-N 2 1 315.461 4.111 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc(C)c1F ZINC000482326098 1048587032 /nfs/dbraw/zinc/58/70/32/1048587032.db2.gz YEFKGTXTZIAJSR-IRXDYDNUSA-N 2 1 306.469 4.214 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)C(C)(C)c2ccccc2)C1 ZINC000482343530 1048589537 /nfs/dbraw/zinc/58/95/37/1048589537.db2.gz HRLJKQGLTQXKLS-QZTJIDSGSA-N 2 1 302.506 4.063 20 0 DIADMP CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000482352180 1048591376 /nfs/dbraw/zinc/59/13/76/1048591376.db2.gz AIVMOGZNBUIYGH-ICSRJNTNSA-N 2 1 320.496 4.103 20 0 DIADMP C[N@H+]1CCc2ccc(Nc3cccc(C[NH+]4CCCC4)c3)cc2C1 ZINC001176196880 1048594636 /nfs/dbraw/zinc/59/46/36/1048594636.db2.gz IQWXMVGAPNWDDV-UHFFFAOYSA-N 2 1 321.468 4.014 20 0 DIADMP Cc1cccc2c1cc[nH+]c2N1CCC(C2CC[NH+](C)CC2)CC1 ZINC001165065806 1048657418 /nfs/dbraw/zinc/65/74/18/1048657418.db2.gz NVBGICBSVNIBCA-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000482693124 1048659745 /nfs/dbraw/zinc/65/97/45/1048659745.db2.gz NUGADUFRGBUNHQ-MOPGFXCFSA-N 2 1 300.490 4.049 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1NCC[C@@H]1CCC[N@@H+](C)C1 ZINC001165300273 1048677003 /nfs/dbraw/zinc/67/70/03/1048677003.db2.gz KESXXKMMDNNDBD-SFHVURJKSA-N 2 1 315.505 4.129 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1NCC[C@@H]1CCC[N@H+](C)C1 ZINC001165300273 1048677009 /nfs/dbraw/zinc/67/70/09/1048677009.db2.gz KESXXKMMDNNDBD-SFHVURJKSA-N 2 1 315.505 4.129 20 0 DIADMP C[C@@H](c1nc2ccccc2o1)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC000640533803 1048680368 /nfs/dbraw/zinc/68/03/68/1048680368.db2.gz VQENPQKSPKUUJL-INIZCTEOSA-N 2 1 315.461 4.087 20 0 DIADMP Cc1c[nH+]c(NCC2C[NH+](Cc3ccccc3)C2)c2ccccc12 ZINC001165427016 1048688541 /nfs/dbraw/zinc/68/85/41/1048688541.db2.gz HMRMFRFDTSGURZ-UHFFFAOYSA-N 2 1 317.436 4.087 20 0 DIADMP Cc1cc[nH+]c2cc(NCC3C[NH+](Cc4ccccc4)C3)ccc12 ZINC001165452922 1048690878 /nfs/dbraw/zinc/69/08/78/1048690878.db2.gz BNQSRCKSZZRAIK-UHFFFAOYSA-N 2 1 317.436 4.087 20 0 DIADMP Cc1cc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)cnc1Cl ZINC000775368120 1048709914 /nfs/dbraw/zinc/70/99/14/1048709914.db2.gz ZGINSMDWZYMJPF-UHFFFAOYSA-N 2 1 323.912 4.178 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCC(C)(C)C[C@H]3C)CC2)[nH+]1 ZINC000483158999 1048744046 /nfs/dbraw/zinc/74/40/46/1048744046.db2.gz MTRXVPRMJYOTAP-QAPCUYQASA-N 2 1 315.505 4.163 20 0 DIADMP CC[NH+](CC)CCCS[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001166392448 1048748692 /nfs/dbraw/zinc/74/86/92/1048748692.db2.gz DCOLMKXZGTZOIR-IBGZPJMESA-N 2 1 320.546 4.116 20 0 DIADMP CC[NH+](CC)CCCS[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001166392449 1048748850 /nfs/dbraw/zinc/74/88/50/1048748850.db2.gz DCOLMKXZGTZOIR-LJQANCHMSA-N 2 1 320.546 4.116 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000483234190 1048760241 /nfs/dbraw/zinc/76/02/41/1048760241.db2.gz JMFLQEGAJQPEDC-SFHVURJKSA-N 2 1 308.469 4.066 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]([NH2+]CC[C@H]2CC=CCC2)C3)cc1 ZINC000716654379 1048786368 /nfs/dbraw/zinc/78/63/68/1048786368.db2.gz GAEZJDCFMPDMHM-QESAQDPVSA-N 2 1 324.512 4.376 20 0 DIADMP CCC[C@@H]1CCC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001176782418 1048786985 /nfs/dbraw/zinc/78/69/85/1048786985.db2.gz CUWQFVFGPXMOSP-HXUWFJFHSA-N 2 1 300.490 4.437 20 0 DIADMP Cc1ccc2cc(C[NH2+]CCC[N@H+](C)Cc3ccccc3)[nH]c2c1 ZINC001177136613 1048837255 /nfs/dbraw/zinc/83/72/55/1048837255.db2.gz SUNRVMNGLYBIBE-UHFFFAOYSA-N 2 1 321.468 4.088 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721997 1048847477 /nfs/dbraw/zinc/84/74/77/1048847477.db2.gz CRAYOZYNXIGAMA-LLGFUMIMSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721997 1048847495 /nfs/dbraw/zinc/84/74/95/1048847495.db2.gz CRAYOZYNXIGAMA-LLGFUMIMSA-N 2 1 308.469 4.487 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000483732921 1048850285 /nfs/dbraw/zinc/85/02/85/1048850285.db2.gz URZSYJYBGNCFAE-MNEFBYGVSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000483732921 1048850302 /nfs/dbraw/zinc/85/03/02/1048850302.db2.gz URZSYJYBGNCFAE-MNEFBYGVSA-N 2 1 322.924 4.370 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3c4ccccc4sc32)CC[N@@H+]1C ZINC000483747995 1048854716 /nfs/dbraw/zinc/85/47/16/1048854716.db2.gz QARTVXOZCCZFJT-KEYYUXOJSA-N 2 1 314.498 4.351 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3c4ccccc4sc32)CC[N@H+]1C ZINC000483747995 1048854727 /nfs/dbraw/zinc/85/47/27/1048854727.db2.gz QARTVXOZCCZFJT-KEYYUXOJSA-N 2 1 314.498 4.351 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC[N@@H+]1C ZINC000483747989 1048855020 /nfs/dbraw/zinc/85/50/20/1048855020.db2.gz QARTVXOZCCZFJT-CKEIUWERSA-N 2 1 314.498 4.351 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC[N@H+]1C ZINC000483747989 1048855033 /nfs/dbraw/zinc/85/50/33/1048855033.db2.gz QARTVXOZCCZFJT-CKEIUWERSA-N 2 1 314.498 4.351 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001177245508 1048854721 /nfs/dbraw/zinc/85/47/21/1048854721.db2.gz UCZACFDLGKLDOK-WIYYLYMNSA-N 2 1 314.517 4.383 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001177245508 1048854734 /nfs/dbraw/zinc/85/47/34/1048854734.db2.gz UCZACFDLGKLDOK-WIYYLYMNSA-N 2 1 314.517 4.383 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@@H]1C ZINC001191184318 1048893135 /nfs/dbraw/zinc/89/31/35/1048893135.db2.gz XHIQATGMLACDHP-QZTJIDSGSA-N 2 1 300.490 4.293 20 0 DIADMP CC[C@@H](C[NH2+]CC(C)(C)[N@@H+]1CCC[C@H](C)C1)c1ccccc1 ZINC001177483619 1048896528 /nfs/dbraw/zinc/89/65/28/1048896528.db2.gz ZNBGFYGVAGNEPT-ROUUACIJSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@@H](C[NH2+]CC(C)(C)[N@H+]1CCC[C@H](C)C1)c1ccccc1 ZINC001177483619 1048896535 /nfs/dbraw/zinc/89/65/35/1048896535.db2.gz ZNBGFYGVAGNEPT-ROUUACIJSA-N 2 1 302.506 4.280 20 0 DIADMP C[N@@H+](CCCC1CCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191235117 1048907656 /nfs/dbraw/zinc/90/76/56/1048907656.db2.gz YNQUBNUHCACGMD-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCCC1CCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191235117 1048907675 /nfs/dbraw/zinc/90/76/75/1048907675.db2.gz YNQUBNUHCACGMD-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCCC1CCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191235117 1048907689 /nfs/dbraw/zinc/90/76/89/1048907689.db2.gz YNQUBNUHCACGMD-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000484154335 1048909522 /nfs/dbraw/zinc/90/95/22/1048909522.db2.gz BMVKRVJBYOCGQS-QZTJIDSGSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC001177741591 1048939769 /nfs/dbraw/zinc/93/97/69/1048939769.db2.gz AUTGYVRJUCZHBK-MRXNPFEDSA-N 2 1 306.494 4.096 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC001177741591 1048939777 /nfs/dbraw/zinc/93/97/77/1048939777.db2.gz AUTGYVRJUCZHBK-MRXNPFEDSA-N 2 1 306.494 4.096 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2CC(C)C)C[C@@H]1C ZINC001191417643 1048940399 /nfs/dbraw/zinc/94/03/99/1048940399.db2.gz QDFQKRKAFPUDBX-PXNSSMCTSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2CC(C)C)C[C@@H]1C ZINC001191417643 1048940416 /nfs/dbraw/zinc/94/04/16/1048940416.db2.gz QDFQKRKAFPUDBX-PXNSSMCTSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2CC(C)C)C[C@@H]1C ZINC001191417643 1048940427 /nfs/dbraw/zinc/94/04/27/1048940427.db2.gz QDFQKRKAFPUDBX-PXNSSMCTSA-N 2 1 302.506 4.190 20 0 DIADMP Cc1cc(C)cc(-c2ccc(C[NH2+]C[C@@H]3CCC[N@H+](C)C3)cc2)c1 ZINC001177795451 1048946422 /nfs/dbraw/zinc/94/64/22/1048946422.db2.gz SQQNSYBTRQMXIK-FQEVSTJZSA-N 2 1 322.496 4.402 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191521812 1048958679 /nfs/dbraw/zinc/95/86/79/1048958679.db2.gz WEEGCYAYZVZACK-DFQSSKMNSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191521812 1048958691 /nfs/dbraw/zinc/95/86/91/1048958691.db2.gz WEEGCYAYZVZACK-DFQSSKMNSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191521812 1048958709 /nfs/dbraw/zinc/95/87/09/1048958709.db2.gz WEEGCYAYZVZACK-DFQSSKMNSA-N 2 1 300.490 4.162 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H]1CCCCS1 ZINC001178291008 1049011651 /nfs/dbraw/zinc/01/16/51/1049011651.db2.gz QBMMWSHDEHFECL-SFHVURJKSA-N 2 1 320.546 4.020 20 0 DIADMP CCc1oc2ccccc2c1C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001178463057 1049043996 /nfs/dbraw/zinc/04/39/96/1049043996.db2.gz MIXVWGIKKYDYQZ-INIZCTEOSA-N 2 1 314.473 4.349 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cccc3ccccc32)CC1 ZINC001203981579 1049048873 /nfs/dbraw/zinc/04/88/73/1049048873.db2.gz CLNRXDWJTPSLJZ-UHFFFAOYSA-N 2 1 310.485 4.392 20 0 DIADMP Cc1ccc(F)c(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)c1 ZINC001178529516 1049051710 /nfs/dbraw/zinc/05/17/10/1049051710.db2.gz ZATVSYBZACWONB-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]Cc2c[nH+]ccc2N(C)C)CC(C)(C)C1 ZINC001178601296 1049064711 /nfs/dbraw/zinc/06/47/11/1049064711.db2.gz NTACQAHQRCSESQ-HOTGVXAUSA-N 2 1 303.494 4.090 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1c[nH]c2ccccc12 ZINC001204048651 1049073080 /nfs/dbraw/zinc/07/30/80/1049073080.db2.gz OFILRBVZZPPMPG-ROUUACIJSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1c[nH]c2ccccc12 ZINC001204048651 1049073096 /nfs/dbraw/zinc/07/30/96/1049073096.db2.gz OFILRBVZZPPMPG-ROUUACIJSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1c[nH]c2ccccc12 ZINC001204048651 1049073106 /nfs/dbraw/zinc/07/31/06/1049073106.db2.gz OFILRBVZZPPMPG-ROUUACIJSA-N 2 1 311.473 4.007 20 0 DIADMP C[C@@H]1CCC[C@H](CC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC001192325648 1049078955 /nfs/dbraw/zinc/07/89/55/1049078955.db2.gz ONYDWBAYCLLBIL-XSYGEPLQSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001192325648 1049078967 /nfs/dbraw/zinc/07/89/67/1049078967.db2.gz ONYDWBAYCLLBIL-XSYGEPLQSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001192325648 1049078980 /nfs/dbraw/zinc/07/89/80/1049078980.db2.gz ONYDWBAYCLLBIL-XSYGEPLQSA-N 2 1 304.522 4.152 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192324789 1049080170 /nfs/dbraw/zinc/08/01/70/1049080170.db2.gz LURIUJXBCNIBIK-CTNGQTDRSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192324789 1049080183 /nfs/dbraw/zinc/08/01/83/1049080183.db2.gz LURIUJXBCNIBIK-CTNGQTDRSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192324789 1049080195 /nfs/dbraw/zinc/08/01/95/1049080195.db2.gz LURIUJXBCNIBIK-CTNGQTDRSA-N 2 1 312.501 4.259 20 0 DIADMP c1ccc(-c2ccc(C[NH+]3CCC([NH+]4CCC4)CC3)cc2)cc1 ZINC001204139669 1049094444 /nfs/dbraw/zinc/09/44/44/1049094444.db2.gz PFJFOADQDHFWIK-UHFFFAOYSA-N 2 1 306.453 4.024 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178922196 1049109762 /nfs/dbraw/zinc/10/97/62/1049109762.db2.gz RFSMRFRBQMXFKT-MTFMMBMASA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178922196 1049109769 /nfs/dbraw/zinc/10/97/69/1049109769.db2.gz RFSMRFRBQMXFKT-MTFMMBMASA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)CC1 ZINC001204283399 1049128029 /nfs/dbraw/zinc/12/80/29/1049128029.db2.gz TYIRDBJUSRGMBW-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC[C@@H]1CC=CCC1 ZINC001179359568 1049160720 /nfs/dbraw/zinc/16/07/20/1049160720.db2.gz YNDRGFJJKSGSQD-LJQANCHMSA-N 2 1 314.517 4.481 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c1 ZINC001204521679 1049180552 /nfs/dbraw/zinc/18/05/52/1049180552.db2.gz IMKXTOMORBWBMW-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c1 ZINC001204521679 1049180557 /nfs/dbraw/zinc/18/05/57/1049180557.db2.gz IMKXTOMORBWBMW-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC001204550053 1049187548 /nfs/dbraw/zinc/18/75/48/1049187548.db2.gz FNWBPWWIHRDXCI-JKSUJKDBSA-N 2 1 322.924 4.496 20 0 DIADMP C[N@@H+](CC[C@@H]1CCC[NH2+]C1)C(c1ccccc1)c1ccccc1 ZINC001204646450 1049211019 /nfs/dbraw/zinc/21/10/19/1049211019.db2.gz SIPVRFDGCSKTCK-SFHVURJKSA-N 2 1 308.469 4.098 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000858098510 1049217611 /nfs/dbraw/zinc/21/76/11/1049217611.db2.gz NQUYMSPQFVKCAW-ANULTFPQSA-N 2 1 312.501 4.319 20 0 DIADMP C[C@H]1CCCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001193517167 1049221870 /nfs/dbraw/zinc/22/18/70/1049221870.db2.gz OQGUNUQNOCNCCV-SFHVURJKSA-N 2 1 300.490 4.295 20 0 DIADMP C[C@H](c1nccc2ccccc21)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001179877731 1049225868 /nfs/dbraw/zinc/22/58/68/1049225868.db2.gz IKZUNAYEUXISBC-QZTJIDSGSA-N 2 1 323.484 4.104 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(CC3CCC3)c2)CC1 ZINC001204713861 1049238594 /nfs/dbraw/zinc/23/85/94/1049238594.db2.gz JEDLDCPADZUHPC-UHFFFAOYSA-N 2 1 314.517 4.335 20 0 DIADMP C[N@@H+](C[C@@]1(C(C)(C)C)CC[NH+](Cc2ccccc2)C1)C1CC1 ZINC001179909791 1049238814 /nfs/dbraw/zinc/23/88/14/1049238814.db2.gz VNYOYHXSZAFKMF-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1)C1CC1 ZINC001179909791 1049238816 /nfs/dbraw/zinc/23/88/16/1049238816.db2.gz VNYOYHXSZAFKMF-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC001179909791 1049238830 /nfs/dbraw/zinc/23/88/30/1049238830.db2.gz VNYOYHXSZAFKMF-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@@H+](C[C@]1(C(C)(C)C)CC[NH+](Cc2ccccc2)C1)C1CC1 ZINC001179909792 1049238989 /nfs/dbraw/zinc/23/89/89/1049238989.db2.gz VNYOYHXSZAFKMF-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1)C1CC1 ZINC001179909792 1049239000 /nfs/dbraw/zinc/23/90/00/1049239000.db2.gz VNYOYHXSZAFKMF-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC001179909792 1049239011 /nfs/dbraw/zinc/23/90/11/1049239011.db2.gz VNYOYHXSZAFKMF-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001179919550 1049242323 /nfs/dbraw/zinc/24/23/23/1049242323.db2.gz NEUDPYRYFYIZQX-HBQIIQRFSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919550 1049242329 /nfs/dbraw/zinc/24/23/29/1049242329.db2.gz NEUDPYRYFYIZQX-HBQIIQRFSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919550 1049242333 /nfs/dbraw/zinc/24/23/33/1049242333.db2.gz NEUDPYRYFYIZQX-HBQIIQRFSA-N 2 1 312.501 4.041 20 0 DIADMP c1cc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)n(-c2cc[nH+]cc2)n1 ZINC001204730246 1049243978 /nfs/dbraw/zinc/24/39/78/1049243978.db2.gz OKCYOLIERDFCBM-LJQANCHMSA-N 2 1 324.472 4.202 20 0 DIADMP c1cc(C[N@@H+]2CCC[C@@H]2CC2CCCCC2)n(-c2cc[nH+]cc2)n1 ZINC001204730246 1049243989 /nfs/dbraw/zinc/24/39/89/1049243989.db2.gz OKCYOLIERDFCBM-LJQANCHMSA-N 2 1 324.472 4.202 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2CCCC[C@@H]2C)CC1 ZINC001193872530 1049276918 /nfs/dbraw/zinc/27/69/18/1049276918.db2.gz OJCJITOJDANZDI-DOTOQJQBSA-N 2 1 302.462 4.060 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001180129500 1049279299 /nfs/dbraw/zinc/27/92/99/1049279299.db2.gz USNNGEZUUNNEPH-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2ccns2)cc1 ZINC000858577463 1049280520 /nfs/dbraw/zinc/28/05/20/1049280520.db2.gz QCJCLEAENYIXOM-QWHCGFSZSA-N 2 1 312.442 4.049 20 0 DIADMP CC(C)(C[N@@H+]1CCC[C@](C)([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001204938861 1049318103 /nfs/dbraw/zinc/31/81/03/1049318103.db2.gz NQDIUPZLPHHXPG-INIZCTEOSA-N 2 1 312.910 4.024 20 0 DIADMP CC(C)(C[N@H+]1CCC[C@](C)([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001204938861 1049318116 /nfs/dbraw/zinc/31/81/16/1049318116.db2.gz NQDIUPZLPHHXPG-INIZCTEOSA-N 2 1 312.910 4.024 20 0 DIADMP CCCCCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001194153544 1049329521 /nfs/dbraw/zinc/32/95/21/1049329521.db2.gz PFUAXYNAFGWXAT-QGZVFWFLSA-N 2 1 308.535 4.391 20 0 DIADMP CCCCCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC001194153544 1049329534 /nfs/dbraw/zinc/32/95/34/1049329534.db2.gz PFUAXYNAFGWXAT-QGZVFWFLSA-N 2 1 308.535 4.391 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001180291893 1049337461 /nfs/dbraw/zinc/33/74/61/1049337461.db2.gz HMYDSPPCWYYIIU-FQEVSTJZSA-N 2 1 302.506 4.438 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2ccc(F)cc2)C2CCCCC2)CC1 ZINC001180297438 1049339637 /nfs/dbraw/zinc/33/96/37/1049339637.db2.gz XLYGJIQBHZNLNV-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(Oc3ccccc3)c(C)c2)C1 ZINC001205015787 1049342352 /nfs/dbraw/zinc/34/23/52/1049342352.db2.gz FTNHNWVZTHEWAQ-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(Oc3ccccc3)c(C)c2)C1 ZINC001205015787 1049342367 /nfs/dbraw/zinc/34/23/67/1049342367.db2.gz FTNHNWVZTHEWAQ-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2sc3scc(C)c3c2C)C1 ZINC001205016184 1049343990 /nfs/dbraw/zinc/34/39/90/1049343990.db2.gz GDUXATDSWNTKGA-ZDUSSCGKSA-N 2 1 308.516 4.011 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccc(-c3c(C)cccc3C)c2)C1 ZINC001205018707 1049344374 /nfs/dbraw/zinc/34/43/74/1049344374.db2.gz YIRPQWLFPVSGNR-HXUWFJFHSA-N 2 1 322.496 4.402 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+](CCCC4CCC4)C3)C2)cc1 ZINC001194267728 1049355082 /nfs/dbraw/zinc/35/50/82/1049355082.db2.gz ACHSUJYQXJNEKK-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+](CCCC4CCC4)C3)C2)cc1 ZINC001194267728 1049355093 /nfs/dbraw/zinc/35/50/93/1049355093.db2.gz ACHSUJYQXJNEKK-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](CCCC4CCC4)C3)C2)cc1 ZINC001194267728 1049355103 /nfs/dbraw/zinc/35/51/03/1049355103.db2.gz ACHSUJYQXJNEKK-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCC[C@@H]([NH3+])CC3)c2)cc1 ZINC001205109519 1049381722 /nfs/dbraw/zinc/38/17/22/1049381722.db2.gz HKBACTWPCTWQCY-GOSISDBHSA-N 2 1 310.441 4.101 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001180622768 1049387118 /nfs/dbraw/zinc/38/71/18/1049387118.db2.gz JXQOWNKUVHCEOF-SMVGOTRKSA-N 2 1 312.501 4.161 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CC1 ZINC001205266302 1049421023 /nfs/dbraw/zinc/42/10/23/1049421023.db2.gz SRWCZELUWJXQFD-SFHVURJKSA-N 2 1 318.848 4.303 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205266995 1049421246 /nfs/dbraw/zinc/42/12/46/1049421246.db2.gz ZOQNJXYSMDBHPD-FQEVSTJZSA-N 2 1 318.505 4.349 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2cccc3c4ccccc4oc32)CC1 ZINC001205273150 1049423822 /nfs/dbraw/zinc/42/38/22/1049423822.db2.gz GGIWDIWJDSSSSB-FQEVSTJZSA-N 2 1 308.425 4.289 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC001205269584 1049423844 /nfs/dbraw/zinc/42/38/44/1049423844.db2.gz KMEDHBPKSXTCLP-UHFFFAOYSA-N 2 1 314.473 4.341 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1C[NH3+] ZINC001205306623 1049433016 /nfs/dbraw/zinc/43/30/16/1049433016.db2.gz YIBCUPCVHNTBSV-HOCLYGCPSA-N 2 1 308.425 4.003 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C[C@H]1C[NH3+] ZINC001205303770 1049433151 /nfs/dbraw/zinc/43/31/51/1049433151.db2.gz JYBWQOAPMKUPHW-UONOGXRCSA-N 2 1 318.848 4.017 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cccc1-c1ccccc1 ZINC001205318969 1049436418 /nfs/dbraw/zinc/43/64/18/1049436418.db2.gz XHBQRRTWYIMHKV-OXQOHEQNSA-N 2 1 308.469 4.079 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc2ccccc2[nH]1 ZINC000775621352 1049445770 /nfs/dbraw/zinc/44/57/70/1049445770.db2.gz KRFMVHXUCXSHRY-DLBZAZTESA-N 2 1 313.489 4.331 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCC3(CC3)CC2)[C@H]1c1cccs1 ZINC000486690261 1049455001 /nfs/dbraw/zinc/45/50/01/1049455001.db2.gz FEIUVZUKWSKQPO-YJBOKZPZSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CCC3(CC3)CC2)[C@H]1c1cccs1 ZINC000486690261 1049455006 /nfs/dbraw/zinc/45/50/06/1049455006.db2.gz FEIUVZUKWSKQPO-YJBOKZPZSA-N 2 1 318.530 4.443 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H](C2CC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385832 1049455654 /nfs/dbraw/zinc/45/56/54/1049455654.db2.gz RRTLIPQRFTWZPZ-GDAAHCPNSA-N 2 1 304.522 4.198 20 0 DIADMP c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001181275219 1049458334 /nfs/dbraw/zinc/45/83/34/1049458334.db2.gz AGOMLVGBWCPNFO-JBACZVJFSA-N 2 1 312.501 4.177 20 0 DIADMP c1ccc([C@@H]2C[C@H]2C[NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001181275224 1049458392 /nfs/dbraw/zinc/45/83/92/1049458392.db2.gz AGOMLVGBWCPNFO-TYPHKJRUSA-N 2 1 312.501 4.177 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775627031 1049458818 /nfs/dbraw/zinc/45/88/18/1049458818.db2.gz FOSQBOQTEYSGEI-DLBZAZTESA-N 2 1 313.489 4.187 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181314800 1049464575 /nfs/dbraw/zinc/46/45/75/1049464575.db2.gz ICIPSVWQCCLRNB-PWRODBHTSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@H]1CCCC[C@@H]1C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001181383833 1049469594 /nfs/dbraw/zinc/46/95/94/1049469594.db2.gz ZOMQRASFGTZYGK-ZWKOTPCHSA-N 2 1 316.489 4.450 20 0 DIADMP CC[C@]1(C)CCC[C@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001181349056 1049470332 /nfs/dbraw/zinc/47/03/32/1049470332.db2.gz KGINFQQCHXBCCH-VAMGGRTRSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCC[C@H]1C ZINC001181349615 1049470387 /nfs/dbraw/zinc/47/03/87/1049470387.db2.gz LNIHDQUAUQOQEB-ZFMNYDKASA-N 2 1 314.517 4.313 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCC[C@@H](C)C1 ZINC001181483882 1049485712 /nfs/dbraw/zinc/48/57/12/1049485712.db2.gz AWOCEEMFSDMJPF-YLJYHZDGSA-N 2 1 302.506 4.396 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001181485937 1049486038 /nfs/dbraw/zinc/48/60/38/1049486038.db2.gz LDRRMWMBDUQVOD-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCC[C@H](C)C1 ZINC001181483880 1049486741 /nfs/dbraw/zinc/48/67/41/1049486741.db2.gz AWOCEEMFSDMJPF-PXNSSMCTSA-N 2 1 302.506 4.396 20 0 DIADMP CC(C)=CC[N@@H+](Cc1ccc(Cl)cc1)CC1CC[NH+](C)CC1 ZINC001205507226 1049487641 /nfs/dbraw/zinc/48/76/41/1049487641.db2.gz SESNGOIIYCVTGX-UHFFFAOYSA-N 2 1 320.908 4.450 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@](F)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001205545534 1049495264 /nfs/dbraw/zinc/49/52/64/1049495264.db2.gz IZBCFDUYMYZFOM-UZLBHIALSA-N 2 1 314.448 4.096 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2sccc2Cl)C1 ZINC000486951718 1049496439 /nfs/dbraw/zinc/49/64/39/1049496439.db2.gz UIPQLPQGTNCIGK-ZDUSSCGKSA-N 2 1 300.899 4.003 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc(F)cc1 ZINC001205555063 1049497391 /nfs/dbraw/zinc/49/73/91/1049497391.db2.gz OGFAXVNYDYQMOY-JXFKEZNVSA-N 2 1 318.480 4.316 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CCC[C@](F)(C[NH3+])CC2)cc1 ZINC001205579470 1049503043 /nfs/dbraw/zinc/50/30/43/1049503043.db2.gz MWMFYSRDFZGMMA-LJQANCHMSA-N 2 1 306.469 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@@H](C)[C@H](C[NH3+])CC3)cc2)o1 ZINC001205636821 1049517895 /nfs/dbraw/zinc/51/78/95/1049517895.db2.gz FGXZCPCKYIIWDW-BEFAXECRSA-N 2 1 312.457 4.062 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)c1Cl ZINC001205672153 1049529249 /nfs/dbraw/zinc/52/92/49/1049529249.db2.gz UCDAURZILNZIBS-CYBMUJFWSA-N 2 1 315.288 4.122 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)c1Cl ZINC001205672153 1049529262 /nfs/dbraw/zinc/52/92/62/1049529262.db2.gz UCDAURZILNZIBS-CYBMUJFWSA-N 2 1 315.288 4.122 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001205672164 1049529293 /nfs/dbraw/zinc/52/92/93/1049529293.db2.gz UFEOYCFGIAEWLS-QGZVFWFLSA-N 2 1 312.501 4.261 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)CC1CCC(c2ccccc2)CC1 ZINC001205693437 1049536325 /nfs/dbraw/zinc/53/63/25/1049536325.db2.gz VOLKXIPMIKLKMS-UHFFFAOYSA-N 2 1 302.506 4.234 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703139 1049537847 /nfs/dbraw/zinc/53/78/47/1049537847.db2.gz WTCWQDQUDHBVHY-BEFAXECRSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703139 1049537862 /nfs/dbraw/zinc/53/78/62/1049537862.db2.gz WTCWQDQUDHBVHY-BEFAXECRSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703139 1049537876 /nfs/dbraw/zinc/53/78/76/1049537876.db2.gz WTCWQDQUDHBVHY-BEFAXECRSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703139 1049537888 /nfs/dbraw/zinc/53/78/88/1049537888.db2.gz WTCWQDQUDHBVHY-BEFAXECRSA-N 2 1 322.452 4.358 20 0 DIADMP Cc1ccc(CN2CCC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)o1 ZINC001203301135 1049541086 /nfs/dbraw/zinc/54/10/86/1049541086.db2.gz DETCYSHGXWKGKX-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@@H]1[NH3+] ZINC001205880938 1049591206 /nfs/dbraw/zinc/59/12/06/1049591206.db2.gz UFFFFYZLLUHZLB-KUHUBIRLSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@@H]1[NH3+] ZINC001205880938 1049591217 /nfs/dbraw/zinc/59/12/17/1049591217.db2.gz UFFFFYZLLUHZLB-KUHUBIRLSA-N 2 1 314.860 4.176 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H]2C)cc1 ZINC001205904508 1049598077 /nfs/dbraw/zinc/59/80/77/1049598077.db2.gz VQMRIFVGQLSADU-HKUYNNGSSA-N 2 1 318.505 4.205 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205913407 1049600109 /nfs/dbraw/zinc/60/01/09/1049600109.db2.gz ICCVEMMSVBUMIU-NVXWUHKLSA-N 2 1 312.432 4.052 20 0 DIADMP [NH3+][C@@H]1CCCC[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001205932033 1049607141 /nfs/dbraw/zinc/60/71/41/1049607141.db2.gz NSQXILGTXPLQMK-GOSISDBHSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@@H]1CCCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001205932033 1049607146 /nfs/dbraw/zinc/60/71/46/1049607146.db2.gz NSQXILGTXPLQMK-GOSISDBHSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3)cc2)CCC[C@@H]1C[NH3+] ZINC001205996176 1049621310 /nfs/dbraw/zinc/62/13/10/1049621310.db2.gz VSWUNPHHODJHTB-LAUBAEHRSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc3c4ccccc4oc32)CCC[C@H]1C[NH3+] ZINC001206003602 1049625545 /nfs/dbraw/zinc/62/55/45/1049625545.db2.gz KDNHJNPGQSTTHB-CVEARBPZSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3cccs3)s2)CCC[C@H]1C[NH3+] ZINC001206002789 1049626169 /nfs/dbraw/zinc/62/61/69/1049626169.db2.gz BFSVGZSEWSTVQW-KBPBESRZSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@H](C[NH3+])[C@H](C)C3)cc2)o1 ZINC001206011274 1049627558 /nfs/dbraw/zinc/62/75/58/1049627558.db2.gz BETURMQMRDRHCU-DNVCBOLYSA-N 2 1 312.457 4.062 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(-c3ccccc3)c2)CCC[C@H]1C[NH3+] ZINC001206011859 1049629332 /nfs/dbraw/zinc/62/93/32/1049629332.db2.gz GYEFKLNHPGCYFK-UTKZUKDTSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@H]1[NH3+] ZINC001206043716 1049639856 /nfs/dbraw/zinc/63/98/56/1049639856.db2.gz UFFFFYZLLUHZLB-AUUYWEPGSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C[C@H]1[NH3+] ZINC001206043716 1049639861 /nfs/dbraw/zinc/63/98/61/1049639861.db2.gz UFFFFYZLLUHZLB-AUUYWEPGSA-N 2 1 314.860 4.176 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)CS1 ZINC000488419027 1049648021 /nfs/dbraw/zinc/64/80/21/1049648021.db2.gz ZJBGOBONBXENCW-MOPGFXCFSA-N 2 1 320.546 4.147 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC001206083971 1049650571 /nfs/dbraw/zinc/65/05/71/1049650571.db2.gz BHQDWFZUAQADGH-IRXDYDNUSA-N 2 1 315.505 4.199 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC001206083971 1049650573 /nfs/dbraw/zinc/65/05/73/1049650573.db2.gz BHQDWFZUAQADGH-IRXDYDNUSA-N 2 1 315.505 4.199 20 0 DIADMP CC(C)C1CC([NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)C1 ZINC000488451001 1049657843 /nfs/dbraw/zinc/65/78/43/1049657843.db2.gz RGZLZJCONUMDJS-USSHROBNSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)C1CC([NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C1 ZINC000488451001 1049657845 /nfs/dbraw/zinc/65/78/45/1049657845.db2.gz RGZLZJCONUMDJS-USSHROBNSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001206225003 1049685933 /nfs/dbraw/zinc/68/59/33/1049685933.db2.gz XVTFKBSEHITAFB-JYRKZWEQSA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001206225003 1049685938 /nfs/dbraw/zinc/68/59/38/1049685938.db2.gz XVTFKBSEHITAFB-JYRKZWEQSA-N 2 1 312.501 4.379 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001206263265 1049693087 /nfs/dbraw/zinc/69/30/87/1049693087.db2.gz JUJCRTFCNIWDGF-VQIMIIECSA-N 2 1 320.908 4.440 20 0 DIADMP CCC[NH+](CCC)c1ccc(N[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC001182694650 1049702470 /nfs/dbraw/zinc/70/24/70/1049702470.db2.gz WPESHXPGGPRQEN-SFHVURJKSA-N 2 1 303.494 4.209 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](CC(c2ccccc2)c2ccccc2)CC1 ZINC001206293237 1049703662 /nfs/dbraw/zinc/70/36/62/1049703662.db2.gz GVICAMQXHBPRRU-QFIPXVFZSA-N 2 1 322.496 4.269 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2Cc2ccccc2Cl)CC1 ZINC001196937163 1049705525 /nfs/dbraw/zinc/70/55/25/1049705525.db2.gz XOBSTOWGSPGRMC-GOSISDBHSA-N 2 1 320.908 4.426 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2Cc2ccccc2Cl)CC1 ZINC001196937163 1049705534 /nfs/dbraw/zinc/70/55/34/1049705534.db2.gz XOBSTOWGSPGRMC-GOSISDBHSA-N 2 1 320.908 4.426 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC1 ZINC001206324751 1049711614 /nfs/dbraw/zinc/71/16/14/1049711614.db2.gz DBFRQYIOTOYMKT-QGZVFWFLSA-N 2 1 320.527 4.428 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206327089 1049713489 /nfs/dbraw/zinc/71/34/89/1049713489.db2.gz SJPVMHHMHORMJP-MRXNPFEDSA-N 2 1 312.910 4.013 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2cccc(-c3ccsc3)c2)C1 ZINC001206352448 1049719630 /nfs/dbraw/zinc/71/96/30/1049719630.db2.gz XNXCSJXBPWMCMI-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2cccc(-c3ccsc3)c2)C1 ZINC001206352448 1049719639 /nfs/dbraw/zinc/71/96/39/1049719639.db2.gz XNXCSJXBPWMCMI-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP C[N@H+](CC/C=C\c1ccccc1)CCCC[NH+]1CCCCC1 ZINC001197285481 1049738359 /nfs/dbraw/zinc/73/83/59/1049738359.db2.gz QNQNLFQXSVQJCY-NSIKDUERSA-N 2 1 300.490 4.288 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206542240 1049753435 /nfs/dbraw/zinc/75/34/35/1049753435.db2.gz VXSZBRRRMHRYMZ-MJGOQNOKSA-N 2 1 312.542 4.059 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccccc2-c2cccs2)C1 ZINC001206556447 1049755028 /nfs/dbraw/zinc/75/50/28/1049755028.db2.gz RYKHALKMCDWVEL-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCCC[C@](C)(C[NH3+])C3)cc2)o1 ZINC001206564221 1049756456 /nfs/dbraw/zinc/75/64/56/1049756456.db2.gz NDRUPJNBYZGHFV-HXUWFJFHSA-N 2 1 312.457 4.206 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206574173 1049759307 /nfs/dbraw/zinc/75/93/07/1049759307.db2.gz PYJJYQLHLMBKPE-MRXNPFEDSA-N 2 1 312.910 4.013 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206574173 1049759310 /nfs/dbraw/zinc/75/93/10/1049759310.db2.gz PYJJYQLHLMBKPE-MRXNPFEDSA-N 2 1 312.910 4.013 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(C(C)(C)C)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206591741 1049763853 /nfs/dbraw/zinc/76/38/53/1049763853.db2.gz VSYCJEWWRAGVAS-LJQANCHMSA-N 2 1 302.506 4.337 20 0 DIADMP CCOc1ccc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c(Cl)c1 ZINC001206597405 1049765502 /nfs/dbraw/zinc/76/55/02/1049765502.db2.gz CBTNGBKIRGZOGV-MRXNPFEDSA-N 2 1 324.896 4.091 20 0 DIADMP CCOc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c(Cl)c1 ZINC001206597405 1049765511 /nfs/dbraw/zinc/76/55/11/1049765511.db2.gz CBTNGBKIRGZOGV-MRXNPFEDSA-N 2 1 324.896 4.091 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC001206622572 1049772607 /nfs/dbraw/zinc/77/26/07/1049772607.db2.gz GBYAPQDQTTWYPZ-AWEZNQCLSA-N 2 1 318.848 4.161 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2sc(Cl)c3ccccc32)C1 ZINC001206646296 1049775090 /nfs/dbraw/zinc/77/50/90/1049775090.db2.gz AIPBENIRRDHCNI-GFCCVEGCSA-N 2 1 308.878 4.116 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC001206680860 1049778152 /nfs/dbraw/zinc/77/81/52/1049778152.db2.gz VOABZRXUQNXDPG-IBGZPJMESA-N 2 1 322.496 4.140 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001206767813 1049794873 /nfs/dbraw/zinc/79/48/73/1049794873.db2.gz FLLGDWCKABZBCR-KGLIPLIRSA-N 2 1 318.848 4.159 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@@H]3C)c2)cc1 ZINC001206768010 1049795398 /nfs/dbraw/zinc/79/53/98/1049795398.db2.gz GRABIHVBMXJUPV-PKOBYXMFSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001206767815 1049795962 /nfs/dbraw/zinc/79/59/62/1049795962.db2.gz FLLGDWCKABZBCR-ZIAGYGMSSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001206770643 1049796333 /nfs/dbraw/zinc/79/63/33/1049796333.db2.gz SXSDMGJZFVHKPM-RDJZCZTQSA-N 2 1 312.432 4.052 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@@H]3C)cc2)cc1 ZINC001206769672 1049796874 /nfs/dbraw/zinc/79/68/74/1049796874.db2.gz PEIRKWYGUANVRK-PKOBYXMFSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001206771413 1049797027 /nfs/dbraw/zinc/79/70/27/1049797027.db2.gz WQKMNOFWFKTOGM-HOTGVXAUSA-N 2 1 312.432 4.052 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@H]1C ZINC000490058953 1049797926 /nfs/dbraw/zinc/79/79/26/1049797926.db2.gz TYVLFGICNNOSKP-XLIONFOSSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2ccc(C)cc2)C[C@H]1C ZINC000490058953 1049797930 /nfs/dbraw/zinc/79/79/30/1049797930.db2.gz TYVLFGICNNOSKP-XLIONFOSSA-N 2 1 311.473 4.158 20 0 DIADMP Fc1ccc(C2CCC([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000490150477 1049802458 /nfs/dbraw/zinc/80/24/58/1049802458.db2.gz MWCIEQKDETXHQK-QUDVFMAMSA-N 2 1 316.464 4.068 20 0 DIADMP CC(C)[C@H](CSc1ccccc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000490145561 1049802712 /nfs/dbraw/zinc/80/27/12/1049802712.db2.gz VFVVWEQAKVMYSV-LMMKCTJWSA-N 2 1 318.530 4.020 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001206807234 1049803671 /nfs/dbraw/zinc/80/36/71/1049803671.db2.gz HYIQBZUBWZMDSS-QWHCGFSZSA-N 2 1 306.500 4.036 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@@H]3C)c2)cc1 ZINC001206806544 1049804071 /nfs/dbraw/zinc/80/40/71/1049804071.db2.gz GNBHMYUTKYWETC-PKOBYXMFSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1c(C[N@@H+]2C[C@@H](C[NH3+])CC[C@@H]2C)cccc1-c1ccccc1 ZINC001206805287 1049804569 /nfs/dbraw/zinc/80/45/69/1049804569.db2.gz BQTVGRXESIJMGL-FUHWJXTLSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccccc1CCc1ccccc1 ZINC001206805678 1049804650 /nfs/dbraw/zinc/80/46/50/1049804650.db2.gz CGQOVGXQGSTJDB-ICSRJNTNSA-N 2 1 322.496 4.031 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001206807233 1049804783 /nfs/dbraw/zinc/80/47/83/1049804783.db2.gz HYIQBZUBWZMDSS-OLZOCXBDSA-N 2 1 306.500 4.036 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1 ZINC001206828363 1049808426 /nfs/dbraw/zinc/80/84/26/1049808426.db2.gz WLJRMDBBCJCZEI-NVXWUHKLSA-N 2 1 320.908 4.155 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000490167187 1049808934 /nfs/dbraw/zinc/80/89/34/1049808934.db2.gz GVFLMTUAKPCDCS-GOSISDBHSA-N 2 1 308.469 4.098 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000490167187 1049808949 /nfs/dbraw/zinc/80/89/49/1049808949.db2.gz GVFLMTUAKPCDCS-GOSISDBHSA-N 2 1 308.469 4.098 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1 ZINC001206828361 1049809069 /nfs/dbraw/zinc/80/90/69/1049809069.db2.gz WLJRMDBBCJCZEI-DOTOQJQBSA-N 2 1 320.908 4.155 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCCN1Cc1cccc(C(F)F)c1 ZINC001207133431 1049842387 /nfs/dbraw/zinc/84/23/87/1049842387.db2.gz RZZVFVSIYQMIBB-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc(C(F)F)c1 ZINC001207133431 1049842398 /nfs/dbraw/zinc/84/23/98/1049842398.db2.gz RZZVFVSIYQMIBB-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc(C(F)F)c1 ZINC001207133431 1049842410 /nfs/dbraw/zinc/84/24/10/1049842410.db2.gz RZZVFVSIYQMIBB-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc(C(F)F)c1 ZINC001207133431 1049842429 /nfs/dbraw/zinc/84/24/29/1049842429.db2.gz RZZVFVSIYQMIBB-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC001207133431 1049842446 /nfs/dbraw/zinc/84/24/46/1049842446.db2.gz RZZVFVSIYQMIBB-ROUUACIJSA-N 2 1 322.443 4.463 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)c1 ZINC001207252718 1049871556 /nfs/dbraw/zinc/87/15/56/1049871556.db2.gz SIDCMCFCSIKWPK-UHFFFAOYSA-N 2 1 322.924 4.448 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491061209 1049883398 /nfs/dbraw/zinc/88/33/98/1049883398.db2.gz ZSAYHHWFAHNAFM-MSOLQXFVSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491061209 1049883406 /nfs/dbraw/zinc/88/34/06/1049883406.db2.gz ZSAYHHWFAHNAFM-MSOLQXFVSA-N 2 1 318.480 4.475 20 0 DIADMP C1=CCC(CC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001207509640 1049901416 /nfs/dbraw/zinc/90/14/16/1049901416.db2.gz NTYLGBGKGRWKSB-CTNGQTDRSA-N 2 1 310.485 4.300 20 0 DIADMP C1=CCC(CC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001207509640 1049901425 /nfs/dbraw/zinc/90/14/25/1049901425.db2.gz NTYLGBGKGRWKSB-CTNGQTDRSA-N 2 1 310.485 4.300 20 0 DIADMP CC(C)=CCC[C@H](C)CC[N@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@@H]2C1 ZINC001207783451 1049938561 /nfs/dbraw/zinc/93/85/61/1049938561.db2.gz GUMACBNCSXFWCO-VNTMZGSJSA-N 2 1 306.538 4.421 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+]C1CC(OC(C)C)C1)c1ccccc1 ZINC001207806111 1049941486 /nfs/dbraw/zinc/94/14/86/1049941486.db2.gz RBKAPGPIXAAQEG-MHJFOBGBSA-N 2 1 318.505 4.005 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+]CC3CCC4(CCCCC4)CC3)[C@@H]2C1 ZINC001207836661 1049942700 /nfs/dbraw/zinc/94/27/00/1049942700.db2.gz KOFPLPLTOQIAMC-OTWHNJEPSA-N 2 1 304.522 4.057 20 0 DIADMP C[C@H](C[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC001207910718 1049952471 /nfs/dbraw/zinc/95/24/71/1049952471.db2.gz XDEHKVCOINGKSS-LJQANCHMSA-N 2 1 322.496 4.387 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+](C)C2CC[NH+](C)CC2)CC1 ZINC001207936120 1049957307 /nfs/dbraw/zinc/95/73/07/1049957307.db2.gz AUIJAGOWGVVPQA-IBGZPJMESA-N 2 1 304.522 4.485 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+](C)C2CC[NH+](C)CC2)CC1 ZINC001207936120 1049957313 /nfs/dbraw/zinc/95/73/13/1049957313.db2.gz AUIJAGOWGVVPQA-IBGZPJMESA-N 2 1 304.522 4.485 20 0 DIADMP CC/C=C\CCC[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001208137423 1049976951 /nfs/dbraw/zinc/97/69/51/1049976951.db2.gz HMDFFGWDQZACCK-PLNGDYQASA-N 2 1 318.480 4.468 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)o1 ZINC001208155756 1049979154 /nfs/dbraw/zinc/97/91/54/1049979154.db2.gz OKMYHZPEKBZLMO-MJGOQNOKSA-N 2 1 318.505 4.422 20 0 DIADMP C[NH+](C)CC1(C[N@H+]2CCC[C@H]2c2ccccc2F)CCCC1 ZINC001208192704 1049983473 /nfs/dbraw/zinc/98/34/73/1049983473.db2.gz XHYBVVINVIVLFN-SFHVURJKSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@@H](CCc1ccco1)N[C@@H](C[NH3+])c1ccc2ccccc2c1 ZINC000572112043 1049994335 /nfs/dbraw/zinc/99/43/35/1049994335.db2.gz AIGHHHBOMIIIKS-YWZLYKJASA-N 2 1 308.425 4.044 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](CC[C@@H](C)CC(C)(C)C)CC1 ZINC001208654623 1049999384 /nfs/dbraw/zinc/99/93/84/1049999384.db2.gz MHAFDIHWJHDVKT-MRXNPFEDSA-N 2 1 317.521 4.391 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CCC3CC3)C[C@@H]21 ZINC001208683133 1050001206 /nfs/dbraw/zinc/00/12/06/1050001206.db2.gz YODLMQADXGQRIP-NZSAHSFTSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CCC3CC3)C[C@@H]21 ZINC001208683133 1050001208 /nfs/dbraw/zinc/00/12/08/1050001208.db2.gz YODLMQADXGQRIP-NZSAHSFTSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](CCC3CC3)C[C@@H]21 ZINC001208683133 1050001211 /nfs/dbraw/zinc/00/12/11/1050001211.db2.gz YODLMQADXGQRIP-NZSAHSFTSA-N 2 1 318.530 4.081 20 0 DIADMP CC[NH+]1CCC([N@H+](C)C[C@@H](C)c2cccc3ccccc32)CC1 ZINC001208719319 1050005282 /nfs/dbraw/zinc/00/52/82/1050005282.db2.gz SWSWMKZOWHINTH-QGZVFWFLSA-N 2 1 310.485 4.359 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)C[C@@H](C)c2cccc3ccccc32)CC1 ZINC001208719319 1050005288 /nfs/dbraw/zinc/00/52/88/1050005288.db2.gz SWSWMKZOWHINTH-QGZVFWFLSA-N 2 1 310.485 4.359 20 0 DIADMP CC/C=C\CCN1CCCC2=C[C@H]3C[C@H](C[N@H+]4CCCC[C@H]34)[C@@H]21 ZINC001208730153 1050006836 /nfs/dbraw/zinc/00/68/36/1050006836.db2.gz QQXZCRVQQXRGKV-YSBDSVRWSA-N 2 1 314.517 4.238 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1CCCc1ccc(F)cc1 ZINC001208770268 1050009285 /nfs/dbraw/zinc/00/92/85/1050009285.db2.gz MNRCZPKRHPNDRU-PMACEKPBSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCCc1ccc(F)cc1 ZINC001208770268 1050009289 /nfs/dbraw/zinc/00/92/89/1050009289.db2.gz MNRCZPKRHPNDRU-PMACEKPBSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCCc1ccc(F)cc1 ZINC001208770268 1050009293 /nfs/dbraw/zinc/00/92/93/1050009293.db2.gz MNRCZPKRHPNDRU-PMACEKPBSA-N 2 1 318.480 4.097 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)C1CC[NH+](CC2CC2)CC1 ZINC001168387401 1050022307 /nfs/dbraw/zinc/02/23/07/1050022307.db2.gz GZQBDEMLSYISNC-AWEZNQCLSA-N 2 1 306.881 4.207 20 0 DIADMP C[N@@H+](C1CCC(C(C)(C)C)CC1)C1CC[NH+](CC2CC2)CC1 ZINC001168387562 1050022870 /nfs/dbraw/zinc/02/28/70/1050022870.db2.gz KPQSNOXCWUTZDT-UHFFFAOYSA-N 2 1 306.538 4.398 20 0 DIADMP C[N@H+](Cc1ccccc1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929104 1050024576 /nfs/dbraw/zinc/02/45/76/1050024576.db2.gz NMLAJCQBFYYFIZ-NRFANRHFSA-N 2 1 308.469 4.031 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929104 1050024583 /nfs/dbraw/zinc/02/45/83/1050024583.db2.gz NMLAJCQBFYYFIZ-NRFANRHFSA-N 2 1 308.469 4.031 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929104 1050024590 /nfs/dbraw/zinc/02/45/90/1050024590.db2.gz NMLAJCQBFYYFIZ-NRFANRHFSA-N 2 1 308.469 4.031 20 0 DIADMP C[N@@H+](CCc1ccccc1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208930051 1050024800 /nfs/dbraw/zinc/02/48/00/1050024800.db2.gz YWEGXGUNPZZREJ-JOCHJYFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCc1ccccc1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208930051 1050024807 /nfs/dbraw/zinc/02/48/07/1050024807.db2.gz YWEGXGUNPZZREJ-JOCHJYFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCc1ccccc1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208930051 1050024812 /nfs/dbraw/zinc/02/48/12/1050024812.db2.gz YWEGXGUNPZZREJ-JOCHJYFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[N@H+](C[C@@H]1CCC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928329 1050026006 /nfs/dbraw/zinc/02/60/06/1050026006.db2.gz FWTJSQOCJBBHBP-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](C[C@@H]1CCC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928329 1050026012 /nfs/dbraw/zinc/02/60/12/1050026012.db2.gz FWTJSQOCJBBHBP-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928329 1050026017 /nfs/dbraw/zinc/02/60/17/1050026017.db2.gz FWTJSQOCJBBHBP-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208928329 1050026024 /nfs/dbraw/zinc/02/60/24/1050026024.db2.gz FWTJSQOCJBBHBP-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP CCC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208931787 1050026118 /nfs/dbraw/zinc/02/61/18/1050026118.db2.gz MRTWVYRUTDQZAU-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1cccc2c1C[N@H+](C[C@@H]1CCC[NH+](Cc3ccccc3)C1)C2 ZINC001208930681 1050026153 /nfs/dbraw/zinc/02/61/53/1050026153.db2.gz CKDQARRATBIUGF-HXUWFJFHSA-N 2 1 320.480 4.223 20 0 DIADMP Cc1cccc2c1C[N@@H+](C[C@@H]1CCC[NH+](Cc3ccccc3)C1)C2 ZINC001208930681 1050026157 /nfs/dbraw/zinc/02/61/57/1050026157.db2.gz CKDQARRATBIUGF-HXUWFJFHSA-N 2 1 320.480 4.223 20 0 DIADMP Cc1cccc2c1C[NH+](C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001208930681 1050026161 /nfs/dbraw/zinc/02/61/61/1050026161.db2.gz CKDQARRATBIUGF-HXUWFJFHSA-N 2 1 320.480 4.223 20 0 DIADMP Cc1cccc2c1C[NH+](C[C@@H]1CCC[N@@H+](Cc3ccccc3)C1)C2 ZINC001208930681 1050026166 /nfs/dbraw/zinc/02/61/66/1050026166.db2.gz CKDQARRATBIUGF-HXUWFJFHSA-N 2 1 320.480 4.223 20 0 DIADMP C[N@@H+](CC1CCCC1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208939112 1050026841 /nfs/dbraw/zinc/02/68/41/1050026841.db2.gz FHNGESAPRIVHCL-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CC1CCCC1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208939112 1050026847 /nfs/dbraw/zinc/02/68/47/1050026847.db2.gz FHNGESAPRIVHCL-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CC1CCCC1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208939112 1050026850 /nfs/dbraw/zinc/02/68/50/1050026850.db2.gz FHNGESAPRIVHCL-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC4(C3)CCCCC4)C2)cc1 ZINC001208938252 1050027102 /nfs/dbraw/zinc/02/71/02/1050027102.db2.gz AIBCPYJXYUDQIH-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208948894 1050029618 /nfs/dbraw/zinc/02/96/18/1050029618.db2.gz SZCQOVQOUAOFNG-QFIPXVFZSA-N 2 1 322.496 4.419 20 0 DIADMP CC(C)[N@H+](Cc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208948894 1050029622 /nfs/dbraw/zinc/02/96/22/1050029622.db2.gz SZCQOVQOUAOFNG-QFIPXVFZSA-N 2 1 322.496 4.419 20 0 DIADMP CC(C)[NH+](Cc1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208948894 1050029625 /nfs/dbraw/zinc/02/96/25/1050029625.db2.gz SZCQOVQOUAOFNG-QFIPXVFZSA-N 2 1 322.496 4.419 20 0 DIADMP CC(C)[NH+](Cc1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208948894 1050029628 /nfs/dbraw/zinc/02/96/28/1050029628.db2.gz SZCQOVQOUAOFNG-QFIPXVFZSA-N 2 1 322.496 4.419 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949335 1050030101 /nfs/dbraw/zinc/03/01/01/1050030101.db2.gz LBCJGSRQGHSFGR-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H]1CCCC[NH+]1C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949335 1050030103 /nfs/dbraw/zinc/03/01/03/1050030103.db2.gz LBCJGSRQGHSFGR-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H]1CCCC[NH+]1C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949335 1050030105 /nfs/dbraw/zinc/03/01/05/1050030105.db2.gz LBCJGSRQGHSFGR-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CC/C=C\CCCCCCN1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001209286887 1050050842 /nfs/dbraw/zinc/05/08/42/1050050842.db2.gz KNNNDHONTUFYQN-ARJAWSKDSA-N 2 1 304.522 4.321 20 0 DIADMP Clc1ccccc1C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC001209452213 1050061317 /nfs/dbraw/zinc/06/13/17/1050061317.db2.gz IEWJQGBNEVQLKS-UHFFFAOYSA-N 2 1 320.908 4.395 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccccc1Cl ZINC000589999695 1050069884 /nfs/dbraw/zinc/06/98/84/1050069884.db2.gz TXNNUVDBQWFBGE-UHFFFAOYSA-N 2 1 316.876 4.424 20 0 DIADMP C(=C\C[N@@H+](C1CC1)C1CCCC1)\C[NH+](C1CC1)C1CCCC1 ZINC000590925994 1050113916 /nfs/dbraw/zinc/11/39/16/1050113916.db2.gz IAPKWRFLKFCCPL-WAYWQWQTSA-N 2 1 302.506 4.357 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000760803706 1050117118 /nfs/dbraw/zinc/11/71/18/1050117118.db2.gz IGANBJFVMSZGAT-SFHVURJKSA-N 2 1 323.484 4.131 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000760803706 1050117121 /nfs/dbraw/zinc/11/71/21/1050117121.db2.gz IGANBJFVMSZGAT-SFHVURJKSA-N 2 1 323.484 4.131 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000760803706 1050117125 /nfs/dbraw/zinc/11/71/25/1050117125.db2.gz IGANBJFVMSZGAT-SFHVURJKSA-N 2 1 323.484 4.131 20 0 DIADMP c1cc2cc(Nc3c[nH+]ccc3N3CCCCC3)ccc2c[nH+]1 ZINC001210047167 1050129209 /nfs/dbraw/zinc/12/92/09/1050129209.db2.gz OONUNILXPFMQNG-UHFFFAOYSA-N 2 1 304.397 4.364 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000348049178 1050170034 /nfs/dbraw/zinc/17/00/34/1050170034.db2.gz PQESPBDNEDGDND-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000348049178 1050170039 /nfs/dbraw/zinc/17/00/39/1050170039.db2.gz PQESPBDNEDGDND-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)Cc1ccc(F)cc1 ZINC000348065715 1050179722 /nfs/dbraw/zinc/17/97/22/1050179722.db2.gz CFVKBBADXCZNGF-UHFFFAOYSA-N 2 1 303.425 4.023 20 0 DIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)Cc1ccc(F)cc1 ZINC000348065715 1050179728 /nfs/dbraw/zinc/17/97/28/1050179728.db2.gz CFVKBBADXCZNGF-UHFFFAOYSA-N 2 1 303.425 4.023 20 0 DIADMP CCCC[C@H](CC)CC[NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1 ZINC000770727367 1050186337 /nfs/dbraw/zinc/18/63/37/1050186337.db2.gz YOUPAGDLBHCGBY-KRWDZBQOSA-N 2 1 314.477 4.272 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000591692606 1050196622 /nfs/dbraw/zinc/19/66/22/1050196622.db2.gz VUNFFJSWKUWHKD-VXKWHMMOSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)c1 ZINC000591692606 1050196628 /nfs/dbraw/zinc/19/66/28/1050196628.db2.gz VUNFFJSWKUWHKD-VXKWHMMOSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000771389430 1050248659 /nfs/dbraw/zinc/24/86/59/1050248659.db2.gz RNSAPTRBTFXKLS-KRWDZBQOSA-N 2 1 315.505 4.085 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000480234309 1050349838 /nfs/dbraw/zinc/34/98/38/1050349838.db2.gz WCFCZRDGACFSEZ-LSDHHAIUSA-N 2 1 308.432 4.352 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000178750622 1050481509 /nfs/dbraw/zinc/48/15/09/1050481509.db2.gz FSAZRIZLIPHJDA-WMLDXEAASA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000178750622 1050481513 /nfs/dbraw/zinc/48/15/13/1050481513.db2.gz FSAZRIZLIPHJDA-WMLDXEAASA-N 2 1 322.493 4.073 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000786679010 1050510619 /nfs/dbraw/zinc/51/06/19/1050510619.db2.gz VJWGUDNGVMOJGP-PKOBYXMFSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)CC[C@H]2[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000786679010 1050510633 /nfs/dbraw/zinc/51/06/33/1050510633.db2.gz VJWGUDNGVMOJGP-PKOBYXMFSA-N 2 1 318.892 4.278 20 0 DIADMP CCc1cccc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)c1 ZINC001144329301 1050545622 /nfs/dbraw/zinc/54/56/22/1050545622.db2.gz VDSSITXTRBHAFC-UHFFFAOYSA-N 2 1 314.517 4.478 20 0 DIADMP Cc1ccc([C@H]([NH2+]CCc2c[nH+]cn2C)C2CCCCC2)cc1 ZINC000575041435 1050625745 /nfs/dbraw/zinc/62/57/45/1050625745.db2.gz LTOCDSHZAXPIBQ-HXUWFJFHSA-N 2 1 311.473 4.182 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](CC1CC[NH+](C)CC1)C1CC1 ZINC000788477707 1050688246 /nfs/dbraw/zinc/68/82/46/1050688246.db2.gz YOXYBFVBISWQEB-AWEZNQCLSA-N 2 1 306.881 4.207 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCC[C@H]2c2cccc3ccccc32)CC1 ZINC000788479662 1050688451 /nfs/dbraw/zinc/68/84/51/1050688451.db2.gz ZJVGEAIRMHJSGJ-NRFANRHFSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000788761337 1050739763 /nfs/dbraw/zinc/73/97/63/1050739763.db2.gz YXYQNNZKZSSGRY-OTBHMBEGSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCSC(C)(C)C)cc1 ZINC000772950218 1050742744 /nfs/dbraw/zinc/74/27/44/1050742744.db2.gz GLWSDKRFZFMXHL-CQSZACIVSA-N 2 1 317.502 4.363 20 0 DIADMP CCCCCCOc1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000742374903 1050834658 /nfs/dbraw/zinc/83/46/58/1050834658.db2.gz KCVFPRDJEKSQOB-MJGOQNOKSA-N 2 1 318.505 4.218 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccccc1-c1ccccc1 ZINC000742373055 1050834909 /nfs/dbraw/zinc/83/49/09/1050834909.db2.gz DZWROXDQIWLSOY-UHFFFAOYSA-N 2 1 319.452 4.429 20 0 DIADMP C[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170119499 1050881704 /nfs/dbraw/zinc/88/17/04/1050881704.db2.gz XLVPMVQRFMPFOR-LEUOFYLZSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4cccs4)C3)CC2)C1 ZINC001170137059 1050963591 /nfs/dbraw/zinc/96/35/91/1050963591.db2.gz MRXIYWBBPHTDHJ-SJORKVTESA-N 2 1 318.530 4.225 20 0 DIADMP C[C@H]1CC[C@@H]([N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC001170149193 1051030237 /nfs/dbraw/zinc/03/02/37/1051030237.db2.gz AUUDRHHVGGIULS-AZUAARDMSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccccc1SC(C)(C)C ZINC000791136046 1051031765 /nfs/dbraw/zinc/03/17/65/1051031765.db2.gz LROGAYZGWYPAHS-CQSZACIVSA-N 2 1 306.519 4.322 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC([N@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156275 1051060553 /nfs/dbraw/zinc/06/05/53/1051060553.db2.gz CDKYFUGIRKTDBW-BEFAXECRSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156275 1051060567 /nfs/dbraw/zinc/06/05/67/1051060567.db2.gz CDKYFUGIRKTDBW-BEFAXECRSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H]1CC[C@@H]([N@H+]2CCC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001170158332 1051072585 /nfs/dbraw/zinc/07/25/85/1051072585.db2.gz NTXAKTYCLNRZIN-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158332 1051072596 /nfs/dbraw/zinc/07/25/96/1051072596.db2.gz NTXAKTYCLNRZIN-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158332 1051072609 /nfs/dbraw/zinc/07/26/09/1051072609.db2.gz NTXAKTYCLNRZIN-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001170259063 1051166360 /nfs/dbraw/zinc/16/63/60/1051166360.db2.gz ATKFVDDBYYTECJ-OAHLLOKOSA-N 2 1 320.908 4.255 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+]2CCc3ccc(Cl)cc3C2)CC1(C)C ZINC001171628932 1051172634 /nfs/dbraw/zinc/17/26/34/1051172634.db2.gz MUXNAYNBVGNKJT-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCc3ccc(Cl)cc3C2)CC1(C)C ZINC001171628932 1051172637 /nfs/dbraw/zinc/17/26/37/1051172637.db2.gz MUXNAYNBVGNKJT-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC000744423884 1051174567 /nfs/dbraw/zinc/17/45/67/1051174567.db2.gz PPFIGBAWEZGEPY-KRWDZBQOSA-N 2 1 322.452 4.360 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC000744423884 1051174573 /nfs/dbraw/zinc/17/45/73/1051174573.db2.gz PPFIGBAWEZGEPY-KRWDZBQOSA-N 2 1 322.452 4.360 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC000744423884 1051174576 /nfs/dbraw/zinc/17/45/76/1051174576.db2.gz PPFIGBAWEZGEPY-KRWDZBQOSA-N 2 1 322.452 4.360 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC(F)(F)C(C)(C)C2)CC1(C)C ZINC001171632196 1051174669 /nfs/dbraw/zinc/17/46/69/1051174669.db2.gz WLRQNXZKICNZMN-UHFFFAOYSA-N 2 1 302.453 4.005 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H](C)Cc2ccccc2Cl)CC1 ZINC001170292269 1051177146 /nfs/dbraw/zinc/17/71/46/1051177146.db2.gz INMLGDLVQWJJTN-MRXNPFEDSA-N 2 1 322.924 4.467 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H](C)Cc2ccccc2Cl)CC1 ZINC001170284465 1051181349 /nfs/dbraw/zinc/18/13/49/1051181349.db2.gz NTXVPXWKYRURRC-MRXNPFEDSA-N 2 1 322.924 4.323 20 0 DIADMP CCc1cccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[nH+]1 ZINC001170333729 1051188385 /nfs/dbraw/zinc/18/83/85/1051188385.db2.gz VGOIAKWTAHDDLJ-OWZKRDHZSA-N 2 1 321.468 4.252 20 0 DIADMP CCc1cccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[nH+]1 ZINC001170333729 1051188392 /nfs/dbraw/zinc/18/83/92/1051188392.db2.gz VGOIAKWTAHDDLJ-OWZKRDHZSA-N 2 1 321.468 4.252 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@@H](c3ccc(F)cc3)C2)CC1(C)C ZINC001171639972 1051193746 /nfs/dbraw/zinc/19/37/46/1051193746.db2.gz XFMGJNRTGKEIRR-MRXNPFEDSA-N 2 1 318.480 4.266 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@@H](c3ccccc3F)C2)CC1(C)C ZINC001171636853 1051194318 /nfs/dbraw/zinc/19/43/18/1051194318.db2.gz IGHPRDCYIIPPJO-OAHLLOKOSA-N 2 1 318.480 4.266 20 0 DIADMP CCc1ccc(C[N@@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171641131 1051196501 /nfs/dbraw/zinc/19/65/01/1051196501.db2.gz DFNLTNZBSFBAAL-UHFFFAOYSA-N 2 1 302.506 4.332 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171641030 1051197339 /nfs/dbraw/zinc/19/73/39/1051197339.db2.gz ASISKBYKKIGFOO-UHFFFAOYSA-N 2 1 306.469 4.299 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C[C@@H]2CCC[C@H]2F)CC[N@H+]1Cc1ccccc1 ZINC001171961735 1051246003 /nfs/dbraw/zinc/24/60/03/1051246003.db2.gz BBCUVCXCPTWZOJ-GBESFXJTSA-N 2 1 318.480 4.157 20 0 DIADMP CC1(C)C[C@H](Nc2cccc(C[NH3+])c2)CC[N@H+]1Cc1ccccc1 ZINC001171967734 1051249799 /nfs/dbraw/zinc/24/97/99/1051249799.db2.gz MXYRLSJFEYPEAD-HXUWFJFHSA-N 2 1 323.484 4.000 20 0 DIADMP CC1(C)C[C@H]([NH2+]Cc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC001171964640 1051250346 /nfs/dbraw/zinc/25/03/46/1051250346.db2.gz MAWJMMAXSRJJEB-QGZVFWFLSA-N 2 1 314.498 4.281 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171971333 1051261228 /nfs/dbraw/zinc/26/12/28/1051261228.db2.gz GXQKKVFOIMTION-IEBWSBKVSA-N 2 1 302.506 4.454 20 0 DIADMP CC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCC1 ZINC001171973456 1051262923 /nfs/dbraw/zinc/26/29/23/1051262923.db2.gz ZFGWGTHFOMAIBF-SFHVURJKSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@H]2CC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171976088 1051263398 /nfs/dbraw/zinc/26/33/98/1051263398.db2.gz PJCRTPFNPWIXME-OALUTQOASA-N 2 1 312.501 4.352 20 0 DIADMP CSc1ccccc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000793231201 1051264380 /nfs/dbraw/zinc/26/43/80/1051264380.db2.gz AKMPLOAPFVTENK-UHFFFAOYSA-N 2 1 314.498 4.102 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC3(CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171981493 1051267221 /nfs/dbraw/zinc/26/72/21/1051267221.db2.gz MDBDVRFQAZLDEW-LJQANCHMSA-N 2 1 312.501 4.306 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC3(CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171981493 1051267231 /nfs/dbraw/zinc/26/72/31/1051267231.db2.gz MDBDVRFQAZLDEW-LJQANCHMSA-N 2 1 312.501 4.306 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@H](F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171978529 1051267930 /nfs/dbraw/zinc/26/79/30/1051267930.db2.gz ZBDZDTADZNWUGN-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@H](F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978529 1051267940 /nfs/dbraw/zinc/26/79/40/1051267940.db2.gz ZBDZDTADZNWUGN-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978529 1051267950 /nfs/dbraw/zinc/26/79/50/1051267950.db2.gz ZBDZDTADZNWUGN-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC[C@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978529 1051267957 /nfs/dbraw/zinc/26/79/57/1051267957.db2.gz ZBDZDTADZNWUGN-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC3(CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171981491 1051270346 /nfs/dbraw/zinc/27/03/46/1051270346.db2.gz MDBDVRFQAZLDEW-IBGZPJMESA-N 2 1 312.501 4.306 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC3(CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171981491 1051270353 /nfs/dbraw/zinc/27/03/53/1051270353.db2.gz MDBDVRFQAZLDEW-IBGZPJMESA-N 2 1 312.501 4.306 20 0 DIADMP C[N@H+](C1CCCC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985355 1051270891 /nfs/dbraw/zinc/27/08/91/1051270891.db2.gz VQZPGNHJRNPONK-LJQANCHMSA-N 2 1 300.490 4.304 20 0 DIADMP C[N@@H+](C1CCCC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985355 1051270902 /nfs/dbraw/zinc/27/09/02/1051270902.db2.gz VQZPGNHJRNPONK-LJQANCHMSA-N 2 1 300.490 4.304 20 0 DIADMP C[NH+](C1CCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985355 1051270914 /nfs/dbraw/zinc/27/09/14/1051270914.db2.gz VQZPGNHJRNPONK-LJQANCHMSA-N 2 1 300.490 4.304 20 0 DIADMP C[NH+](C1CCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985355 1051270925 /nfs/dbraw/zinc/27/09/25/1051270925.db2.gz VQZPGNHJRNPONK-LJQANCHMSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC(CF)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171987986 1051271730 /nfs/dbraw/zinc/27/17/30/1051271730.db2.gz NLWUZPSWEJRTFE-LJQANCHMSA-N 2 1 318.480 4.111 20 0 DIADMP C[N@H+]([C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1)C(C)(C)C ZINC001172072168 1051274168 /nfs/dbraw/zinc/27/41/68/1051274168.db2.gz HTVUEXNQXCXYKH-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@@H+]([C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1)C(C)(C)C ZINC001172072168 1051274181 /nfs/dbraw/zinc/27/41/81/1051274181.db2.gz HTVUEXNQXCXYKH-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]([C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC001172072168 1051274191 /nfs/dbraw/zinc/27/41/91/1051274191.db2.gz HTVUEXNQXCXYKH-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]([C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC001172072168 1051274204 /nfs/dbraw/zinc/27/42/04/1051274204.db2.gz HTVUEXNQXCXYKH-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP FC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172080338 1051276939 /nfs/dbraw/zinc/27/69/39/1051276939.db2.gz UCUTUZJDKXXIDK-PMOLBWCYSA-N 2 1 316.464 4.006 20 0 DIADMP FC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172080338 1051276949 /nfs/dbraw/zinc/27/69/49/1051276949.db2.gz UCUTUZJDKXXIDK-PMOLBWCYSA-N 2 1 316.464 4.006 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1 ZINC001172101632 1051278764 /nfs/dbraw/zinc/27/87/64/1051278764.db2.gz GOMWURPSWILHAD-MHORFTMASA-N 2 1 306.881 4.396 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC001172101632 1051278774 /nfs/dbraw/zinc/27/87/74/1051278774.db2.gz GOMWURPSWILHAD-MHORFTMASA-N 2 1 306.881 4.396 20 0 DIADMP C[C@H]1CCCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075625 1051280268 /nfs/dbraw/zinc/28/02/68/1051280268.db2.gz COKVPGUTYFPSGJ-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075625 1051280275 /nfs/dbraw/zinc/28/02/75/1051280275.db2.gz COKVPGUTYFPSGJ-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172075625 1051280283 /nfs/dbraw/zinc/28/02/83/1051280283.db2.gz COKVPGUTYFPSGJ-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172075625 1051280289 /nfs/dbraw/zinc/28/02/89/1051280289.db2.gz COKVPGUTYFPSGJ-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076188 1051280414 /nfs/dbraw/zinc/28/04/14/1051280414.db2.gz WSCZAWSCGRUOJW-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076188 1051280424 /nfs/dbraw/zinc/28/04/24/1051280424.db2.gz WSCZAWSCGRUOJW-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076188 1051280435 /nfs/dbraw/zinc/28/04/35/1051280435.db2.gz WSCZAWSCGRUOJW-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076188 1051280445 /nfs/dbraw/zinc/28/04/45/1051280445.db2.gz WSCZAWSCGRUOJW-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@H+](CC2CC2)C2CC2)C3)cc1 ZINC001172087824 1051282627 /nfs/dbraw/zinc/28/26/27/1051282627.db2.gz MIFOSSBLQGUHFY-KOUNCHBCSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@@H+](CC2CC2)C2CC2)C3)cc1 ZINC001172087824 1051282636 /nfs/dbraw/zinc/28/26/36/1051282636.db2.gz MIFOSSBLQGUHFY-KOUNCHBCSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001172087824 1051282649 /nfs/dbraw/zinc/28/26/49/1051282649.db2.gz MIFOSSBLQGUHFY-KOUNCHBCSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001172087824 1051282662 /nfs/dbraw/zinc/28/26/62/1051282662.db2.gz MIFOSSBLQGUHFY-KOUNCHBCSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2C=CCCC2)C3)cc1 ZINC001172067580 1051284122 /nfs/dbraw/zinc/28/41/22/1051284122.db2.gz HDNGEYXAYZXGNQ-BURNTYAHSA-N 2 1 310.485 4.270 20 0 DIADMP CC(C)(C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172066823 1051284625 /nfs/dbraw/zinc/28/46/25/1051284625.db2.gz KJMWFOXCRMIPNE-REPLKXPHSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172064893 1051284828 /nfs/dbraw/zinc/28/48/28/1051284828.db2.gz IHBNQBRMKFGHAH-OWZKRDHZSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100257 1051284839 /nfs/dbraw/zinc/28/48/39/1051284839.db2.gz CBRPBKQNKPAJLX-KQLYMOGASA-N 2 1 312.501 4.231 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100257 1051284841 /nfs/dbraw/zinc/28/48/41/1051284841.db2.gz CBRPBKQNKPAJLX-KQLYMOGASA-N 2 1 312.501 4.231 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2C[C@H]4CC[C@@H]2C4)C3)cc1 ZINC001172063609 1051284939 /nfs/dbraw/zinc/28/49/39/1051284939.db2.gz CEZHFQJYKKMABZ-LUDAKILFSA-N 2 1 324.512 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2C[C@@H]4CC[C@H]2C4)C3)cc1 ZINC001172066645 1051284972 /nfs/dbraw/zinc/28/49/72/1051284972.db2.gz CEZHFQJYKKMABZ-RKYRPXKFSA-N 2 1 324.512 4.350 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)o1 ZINC001172063775 1051285252 /nfs/dbraw/zinc/28/52/52/1051285252.db2.gz CKSSQMBBUGQEJQ-OWZKRDHZSA-N 2 1 324.468 4.263 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)o1 ZINC001172063775 1051285257 /nfs/dbraw/zinc/28/52/57/1051285257.db2.gz CKSSQMBBUGQEJQ-OWZKRDHZSA-N 2 1 324.468 4.263 20 0 DIADMP CC(C)CC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172064892 1051285341 /nfs/dbraw/zinc/28/53/41/1051285341.db2.gz IHBNQBRMKFGHAH-ACDBMABISA-N 2 1 300.490 4.208 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc(-c3ccccc3)c1)C2 ZINC001172100517 1051285775 /nfs/dbraw/zinc/28/57/75/1051285775.db2.gz DGACUJWSQWYWTN-DKUWSORSSA-N 2 1 320.480 4.459 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100255 1051286831 /nfs/dbraw/zinc/28/68/31/1051286831.db2.gz CBRPBKQNKPAJLX-FCRQHZQGSA-N 2 1 312.501 4.231 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100255 1051286840 /nfs/dbraw/zinc/28/68/40/1051286840.db2.gz CBRPBKQNKPAJLX-FCRQHZQGSA-N 2 1 312.501 4.231 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104758 1051295664 /nfs/dbraw/zinc/29/56/64/1051295664.db2.gz CRCPVDJAYMXLFZ-AKHDSKFASA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104758 1051295677 /nfs/dbraw/zinc/29/56/77/1051295677.db2.gz CRCPVDJAYMXLFZ-AKHDSKFASA-N 2 1 304.453 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)C2 ZINC001172103771 1051296556 /nfs/dbraw/zinc/29/65/56/1051296556.db2.gz XPQVHHVEBBXFJU-REPLKXPHSA-N 2 1 300.490 4.089 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105923 1051296976 /nfs/dbraw/zinc/29/69/76/1051296976.db2.gz LEYJMTPAZQVDFN-OKYOBFRVSA-N 2 1 318.892 4.396 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105923 1051296991 /nfs/dbraw/zinc/29/69/91/1051296991.db2.gz LEYJMTPAZQVDFN-OKYOBFRVSA-N 2 1 318.892 4.396 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104767 1051298105 /nfs/dbraw/zinc/29/81/05/1051298105.db2.gz CRCPVDJAYMXLFZ-OKYOBFRVSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104767 1051298118 /nfs/dbraw/zinc/29/81/18/1051298118.db2.gz CRCPVDJAYMXLFZ-OKYOBFRVSA-N 2 1 304.453 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccccc1F)C1CCC1)C2 ZINC001172111040 1051301204 /nfs/dbraw/zinc/30/12/04/1051301204.db2.gz PVVXJHLIUGLWRD-PDOICOKGSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccccc1F)C1CCC1)C2 ZINC001172111040 1051301212 /nfs/dbraw/zinc/30/12/12/1051301212.db2.gz PVVXJHLIUGLWRD-PDOICOKGSA-N 2 1 316.464 4.272 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172110754 1051301694 /nfs/dbraw/zinc/30/16/94/1051301694.db2.gz OROMZSNEXHWZRT-GGXPGOJBSA-N 2 1 304.453 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CC1)c1ccccc1F)C2 ZINC001172110189 1051301944 /nfs/dbraw/zinc/30/19/44/1051301944.db2.gz ISNYQGCKKVKQPG-CLWJZODNSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110312 1051302405 /nfs/dbraw/zinc/30/24/05/1051302405.db2.gz MKYWHGLZIDHXFK-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110312 1051302410 /nfs/dbraw/zinc/30/24/10/1051302410.db2.gz MKYWHGLZIDHXFK-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP CCC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172110756 1051302511 /nfs/dbraw/zinc/30/25/11/1051302511.db2.gz OROMZSNEXHWZRT-RCJHGTSTSA-N 2 1 304.453 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c([C@@H]3CCC[NH2+]3)cc3ccccc31)C2 ZINC001172124300 1051304908 /nfs/dbraw/zinc/30/49/08/1051304908.db2.gz KNJSVMBLLARBFS-MANSERQUSA-N 2 1 323.484 4.254 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3ccc(F)cc3)CC1)C2 ZINC001172120905 1051305311 /nfs/dbraw/zinc/30/53/11/1051305311.db2.gz HAJLVZKMQZWNQL-ACDBMABISA-N 2 1 316.464 4.020 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3ccc(F)cc3)CC1)C2 ZINC001172120905 1051305322 /nfs/dbraw/zinc/30/53/22/1051305322.db2.gz HAJLVZKMQZWNQL-ACDBMABISA-N 2 1 316.464 4.020 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)c(C)c1 ZINC001172118273 1051305342 /nfs/dbraw/zinc/30/53/42/1051305342.db2.gz QRQVVMBJJOTBBO-IYWMVGAKSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)c(C)c1 ZINC001172118273 1051305343 /nfs/dbraw/zinc/30/53/43/1051305343.db2.gz QRQVVMBJJOTBBO-IYWMVGAKSA-N 2 1 300.490 4.359 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@]13C[C@H]4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172119005 1051306703 /nfs/dbraw/zinc/30/67/03/1051306703.db2.gz UTICVJWMLHPHHA-TULFDMJUSA-N 2 1 316.533 4.340 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@]13C[C@H]4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172119005 1051306713 /nfs/dbraw/zinc/30/67/13/1051306713.db2.gz UTICVJWMLHPHHA-TULFDMJUSA-N 2 1 316.533 4.340 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1F ZINC001172116319 1051306736 /nfs/dbraw/zinc/30/67/36/1051306736.db2.gz GVTMAILDJVKQMR-BASYENTBSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001172362241 1051374721 /nfs/dbraw/zinc/37/47/21/1051374721.db2.gz SBIJLVISTICIPK-ZWKOTPCHSA-N 2 1 324.553 4.309 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172390606 1051394447 /nfs/dbraw/zinc/39/44/47/1051394447.db2.gz WHMFOMVCGCPMSF-DFQSSKMNSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172390606 1051394459 /nfs/dbraw/zinc/39/44/59/1051394459.db2.gz WHMFOMVCGCPMSF-DFQSSKMNSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](CC(C)C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172397779 1051398593 /nfs/dbraw/zinc/39/85/93/1051398593.db2.gz CAKHNANHNPTREB-OAHLLOKOSA-N 2 1 308.897 4.415 20 0 DIADMP CC1(C)CC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390643890 1051404309 /nfs/dbraw/zinc/40/43/09/1051404309.db2.gz LRHNBDGNRFIDAA-QZTJIDSGSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390643890 1051404317 /nfs/dbraw/zinc/40/43/17/1051404317.db2.gz LRHNBDGNRFIDAA-QZTJIDSGSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001170451062 1051412708 /nfs/dbraw/zinc/41/27/08/1051412708.db2.gz GYGPSIMOOSIHQT-DYESRHJHSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001170451062 1051412717 /nfs/dbraw/zinc/41/27/17/1051412717.db2.gz GYGPSIMOOSIHQT-DYESRHJHSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001170451062 1051412723 /nfs/dbraw/zinc/41/27/23/1051412723.db2.gz GYGPSIMOOSIHQT-DYESRHJHSA-N 2 1 314.517 4.463 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c(C)c1 ZINC001170452288 1051415818 /nfs/dbraw/zinc/41/58/18/1051415818.db2.gz UXEKSVOEHGRYMI-AZUAARDMSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)c(C)c1 ZINC001170452288 1051415824 /nfs/dbraw/zinc/41/58/24/1051415824.db2.gz UXEKSVOEHGRYMI-AZUAARDMSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CCC[C@]3(CC[N@@H+](C)C3)C2)c(C)c1 ZINC001170452288 1051415829 /nfs/dbraw/zinc/41/58/29/1051415829.db2.gz UXEKSVOEHGRYMI-AZUAARDMSA-N 2 1 300.490 4.091 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172556160 1051438735 /nfs/dbraw/zinc/43/87/35/1051438735.db2.gz KJNWHDLEIPZHHX-UKAVVXHISA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172543734 1051455443 /nfs/dbraw/zinc/45/54/43/1051455443.db2.gz RWWGHSMMCPISLI-ZRNYENFQSA-N 2 1 300.490 4.175 20 0 DIADMP CC[C@H]1CC[C@H](C2CCC([NH2+]C3CC[NH+](C)CC3)CC2)CC1 ZINC001172588788 1051464397 /nfs/dbraw/zinc/46/43/97/1051464397.db2.gz SSKPAHASLMKCHS-POSCCBCBSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)c1ccc([C@H]2CCC[N@H+]2CC[C@@H]2CCC[NH+]2C)cc1 ZINC001168919118 1051468307 /nfs/dbraw/zinc/46/83/07/1051468307.db2.gz VNTVFXUWANWPKP-VQTJNVASSA-N 2 1 300.490 4.431 20 0 DIADMP CC1(C)CC([N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC(C)(C)O1 ZINC001172653770 1051472463 /nfs/dbraw/zinc/47/24/63/1051472463.db2.gz RHEDTEAVBKCALQ-JCNLHEQBSA-N 2 1 322.537 4.237 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)C2CCC3(CCCC3)CC2)CC1 ZINC001172726896 1051485866 /nfs/dbraw/zinc/48/58/66/1051485866.db2.gz FYNVAUUEQDJACK-IYARVYRRSA-N 2 1 304.522 4.471 20 0 DIADMP CC(C)C[N@@H+]([C@@H]1Cc2ccc(Cl)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172713282 1051496914 /nfs/dbraw/zinc/49/69/14/1051496914.db2.gz SSSFWCKTNQKXKR-GUDVDZBRSA-N 2 1 320.908 4.035 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1)C2 ZINC001169081268 1051515229 /nfs/dbraw/zinc/51/52/29/1051515229.db2.gz PNHAHCQELJAGRW-CIAFKFPVSA-N 2 1 320.480 4.185 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N[C@@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116972 1051520443 /nfs/dbraw/zinc/52/04/43/1051520443.db2.gz VBPXXTLNPVUCRJ-CLWJZODNSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116972 1051520451 /nfs/dbraw/zinc/52/04/51/1051520451.db2.gz VBPXXTLNPVUCRJ-CLWJZODNSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(c3ccc(Cl)cc3)CC1)C2 ZINC001169126311 1051522649 /nfs/dbraw/zinc/52/26/49/1051522649.db2.gz RNQVAOXVJWUNEC-BWTSREIZSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139651 1051529504 /nfs/dbraw/zinc/52/95/04/1051529504.db2.gz CSVMEVIZSBYGKI-KRXQYRFLSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139651 1051529512 /nfs/dbraw/zinc/52/95/12/1051529512.db2.gz CSVMEVIZSBYGKI-KRXQYRFLSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139651 1051529521 /nfs/dbraw/zinc/52/95/21/1051529521.db2.gz CSVMEVIZSBYGKI-KRXQYRFLSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139651 1051529530 /nfs/dbraw/zinc/52/95/30/1051529530.db2.gz CSVMEVIZSBYGKI-KRXQYRFLSA-N 2 1 304.865 4.102 20 0 DIADMP CC1(C)C[C@H](Nc2[nH+]ccc3cc(F)ccc32)C[C@@](C)(C[NH3+])C1 ZINC001169148598 1051534408 /nfs/dbraw/zinc/53/44/08/1051534408.db2.gz XQQLPEQFLXYNRB-HNAYVOBHSA-N 2 1 315.436 4.330 20 0 DIADMP CC1(C)C[C@H](Nc2[nH+]ccc3cc(F)ccc32)C[C@](C)(C[NH3+])C1 ZINC001169148600 1051535928 /nfs/dbraw/zinc/53/59/28/1051535928.db2.gz XQQLPEQFLXYNRB-KXBFYZLASA-N 2 1 315.436 4.330 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001172848852 1051537412 /nfs/dbraw/zinc/53/74/12/1051537412.db2.gz YHCCOECQPYVSMI-ZDUSSCGKSA-N 2 1 324.871 4.004 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)c(C(C)C)c1 ZINC001169178059 1051546025 /nfs/dbraw/zinc/54/60/25/1051546025.db2.gz OOGBUXBMOLYKQH-QGZVFWFLSA-N 2 1 302.506 4.317 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc3oc4ccccc4c3c2)CCC[C@@H]1C[NH3+] ZINC001206003858 1051546696 /nfs/dbraw/zinc/54/66/96/1051546696.db2.gz MZFVOQCKEPUECG-DOTOQJQBSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc3oc4ccccc4c3c2)CCC[C@H]1C[NH3+] ZINC001206003861 1051547154 /nfs/dbraw/zinc/54/71/54/1051547154.db2.gz MZFVOQCKEPUECG-WBVHZDCISA-N 2 1 322.452 4.393 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](Cc2ccc(C)cc2)c2ccccc2)CC1 ZINC001169238862 1051562340 /nfs/dbraw/zinc/56/23/40/1051562340.db2.gz MRTJMIZIOBWNAX-QFIPXVFZSA-N 2 1 322.496 4.353 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2ccsc2)CC1 ZINC000178166850 1051563004 /nfs/dbraw/zinc/56/30/04/1051563004.db2.gz WBJCSEMXWNMRMG-MRXNPFEDSA-N 2 1 314.498 4.372 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccsc1 ZINC000178335773 1051568719 /nfs/dbraw/zinc/56/87/19/1051568719.db2.gz NHQSHZHBRNWUIL-BXWFABGCSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccsc1 ZINC000178335773 1051568735 /nfs/dbraw/zinc/56/87/35/1051568735.db2.gz NHQSHZHBRNWUIL-BXWFABGCSA-N 2 1 314.498 4.452 20 0 DIADMP COCCC[C@H](C)[NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1 ZINC000178532788 1051576576 /nfs/dbraw/zinc/57/65/76/1051576576.db2.gz LWQLIVAMBDTWPF-ZWKOTPCHSA-N 2 1 318.505 4.055 20 0 DIADMP COCCC[C@H](C)[NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1 ZINC000178532759 1051577220 /nfs/dbraw/zinc/57/72/20/1051577220.db2.gz LWQLIVAMBDTWPF-ROUUACIJSA-N 2 1 318.505 4.055 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)c1 ZINC001170469340 1051585843 /nfs/dbraw/zinc/58/58/43/1051585843.db2.gz NZLVLTBFIMUKCX-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP CCCOC1CCC([N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173094107 1051599286 /nfs/dbraw/zinc/59/92/86/1051599286.db2.gz RPJYFSBIEPFEJA-CAAWEGIDSA-N 2 1 324.553 4.485 20 0 DIADMP CCCOC1CCC([N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)CC1 ZINC001173100646 1051607341 /nfs/dbraw/zinc/60/73/41/1051607341.db2.gz QUJGBEJXQQGNIG-FUFFSDJGSA-N 2 1 322.537 4.063 20 0 DIADMP CCCOC1CCC([NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)CC1 ZINC001173100646 1051607343 /nfs/dbraw/zinc/60/73/43/1051607343.db2.gz QUJGBEJXQQGNIG-FUFFSDJGSA-N 2 1 322.537 4.063 20 0 DIADMP CCCOC1CCC([NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)CC1 ZINC001173100646 1051607350 /nfs/dbraw/zinc/60/73/50/1051607350.db2.gz QUJGBEJXQQGNIG-FUFFSDJGSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H]2c2ccccc2)CC1 ZINC001173111701 1051610525 /nfs/dbraw/zinc/61/05/25/1051610525.db2.gz KBPDZTCYYHNYDW-MHJFOBGBSA-N 2 1 300.490 4.477 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](c3ccccc3F)C2)CC1 ZINC001173115182 1051612298 /nfs/dbraw/zinc/61/22/98/1051612298.db2.gz YAOVFKRPSJRBIP-AOCRQIFASA-N 2 1 318.480 4.268 20 0 DIADMP CCC[NH+](CCC)CC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173194932 1051629691 /nfs/dbraw/zinc/62/96/91/1051629691.db2.gz HJOMAAOEJHQUSM-UHFFFAOYSA-N 2 1 318.505 4.088 20 0 DIADMP C[C@H](C[NH3+])C[N@@H+](C)[C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173211528 1051650219 /nfs/dbraw/zinc/65/02/19/1051650219.db2.gz QZZKAPDCGXJQMO-MSOLQXFVSA-N 2 1 310.485 4.124 20 0 DIADMP CCCC[C@H](CC(C)C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173256906 1051659528 /nfs/dbraw/zinc/65/95/28/1051659528.db2.gz OUTMJAGUADQZOJ-QWFCFKBJSA-N 2 1 324.553 4.342 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173269093 1051667785 /nfs/dbraw/zinc/66/77/85/1051667785.db2.gz SSLCWTOHNDBEMO-RKFFNLMFSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173270609 1051668752 /nfs/dbraw/zinc/66/87/52/1051668752.db2.gz NZDBHXRSCKHULA-HUYLIWGRSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001173271014 1051669564 /nfs/dbraw/zinc/66/95/64/1051669564.db2.gz OYIGDZFUXCYPRE-GJZGRUSLSA-N 2 1 306.881 4.169 20 0 DIADMP Cc1[nH]c2ccc(N3CCC[C@@H]([NH3+])c4cc(C)ccc43)cc2[nH+]1 ZINC001169699100 1051676839 /nfs/dbraw/zinc/67/68/39/1051676839.db2.gz UZSVLLZCEPSXNX-MRXNPFEDSA-N 2 1 306.413 4.111 20 0 DIADMP Cc1[nH]c2ccc(N3CCC[C@H]([NH3+])c4cc(C)ccc43)cc2[nH+]1 ZINC001169699099 1051677512 /nfs/dbraw/zinc/67/75/12/1051677512.db2.gz UZSVLLZCEPSXNX-INIZCTEOSA-N 2 1 306.413 4.111 20 0 DIADMP CCSC[C@@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173296613 1051678445 /nfs/dbraw/zinc/67/84/45/1051678445.db2.gz VDMXECNCTDLOGH-ZTFGCOKTSA-N 2 1 324.509 4.039 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001173280690 1051686847 /nfs/dbraw/zinc/68/68/47/1051686847.db2.gz PMNPSKCCMGGLFM-MJGOQNOKSA-N 2 1 316.489 4.146 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001173288852 1051689959 /nfs/dbraw/zinc/68/99/59/1051689959.db2.gz PKVOPSSMPBCLLZ-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288852 1051689975 /nfs/dbraw/zinc/68/99/75/1051689975.db2.gz PKVOPSSMPBCLLZ-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288852 1051689984 /nfs/dbraw/zinc/68/99/84/1051689984.db2.gz PKVOPSSMPBCLLZ-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001173288843 1051690932 /nfs/dbraw/zinc/69/09/32/1051690932.db2.gz PKVOPSSMPBCLLZ-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288843 1051690936 /nfs/dbraw/zinc/69/09/36/1051690936.db2.gz PKVOPSSMPBCLLZ-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288843 1051690938 /nfs/dbraw/zinc/69/09/38/1051690938.db2.gz PKVOPSSMPBCLLZ-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP CNc1cc(Nc2cccc(Cn3cc[nH+]c3C(C)C)c2)cc[nH+]1 ZINC001216335078 1051706398 /nfs/dbraw/zinc/70/63/98/1051706398.db2.gz IUWMKYKGHCAGAF-UHFFFAOYSA-N 2 1 321.428 4.235 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000183185615 1051712289 /nfs/dbraw/zinc/71/22/89/1051712289.db2.gz VPHBYAIICHPPAD-YQVWRLOYSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c(Cl)cc1Cl ZINC001206023604 1051717368 /nfs/dbraw/zinc/71/73/68/1051717368.db2.gz FXSNOVFMDBXDSR-STQMWFEESA-N 2 1 315.288 4.109 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c1 ZINC001206211679 1051786521 /nfs/dbraw/zinc/78/65/21/1051786521.db2.gz OQOCJOPXISNIHC-IAGOWNOFSA-N 2 1 312.498 4.132 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCC34CCCC4)C2)c1 ZINC000189100272 1051879254 /nfs/dbraw/zinc/87/92/54/1051879254.db2.gz XYGZKLIXBIIINW-SJLPKXTDSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCC34CCCC4)C2)c1 ZINC000189100272 1051879262 /nfs/dbraw/zinc/87/92/62/1051879262.db2.gz XYGZKLIXBIIINW-SJLPKXTDSA-N 2 1 318.530 4.273 20 0 DIADMP CCN1CCC([N@@H+](C)Cc2ccccc2-c2ccccc2)CC1 ZINC000768233016 1051907108 /nfs/dbraw/zinc/90/71/08/1051907108.db2.gz IMRILBVDOIHZPI-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccccc2-c2ccccc2)CC1 ZINC000768233016 1051907118 /nfs/dbraw/zinc/90/71/18/1051907118.db2.gz IMRILBVDOIHZPI-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccccc2-c2ccccc2)CC1 ZINC000768233016 1051907130 /nfs/dbraw/zinc/90/71/30/1051907130.db2.gz IMRILBVDOIHZPI-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768228857 1051907885 /nfs/dbraw/zinc/90/78/85/1051907885.db2.gz KPOUQYCTMAHWMJ-CQSZACIVSA-N 2 1 318.411 4.219 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000195139632 1052035679 /nfs/dbraw/zinc/03/56/79/1052035679.db2.gz LOGPTBMMDQRVDR-FUHWJXTLSA-N 2 1 312.457 4.015 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000195139632 1052035693 /nfs/dbraw/zinc/03/56/93/1052035693.db2.gz LOGPTBMMDQRVDR-FUHWJXTLSA-N 2 1 312.457 4.015 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000195139613 1052035998 /nfs/dbraw/zinc/03/59/98/1052035998.db2.gz LOGPTBMMDQRVDR-WMZOPIPTSA-N 2 1 312.457 4.015 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000195139613 1052036005 /nfs/dbraw/zinc/03/60/05/1052036005.db2.gz LOGPTBMMDQRVDR-WMZOPIPTSA-N 2 1 312.457 4.015 20 0 DIADMP CCCCCCOc1cccc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c1 ZINC000769404908 1052041697 /nfs/dbraw/zinc/04/16/97/1052041697.db2.gz SNWBOQYDMHWISM-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCCOc1cccc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)c1 ZINC000769404908 1052041707 /nfs/dbraw/zinc/04/17/07/1052041707.db2.gz SNWBOQYDMHWISM-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000226128612 1052047969 /nfs/dbraw/zinc/04/79/69/1052047969.db2.gz VXEAFZVPIZNYIE-RBSFLKMASA-N 2 1 308.432 4.208 20 0 DIADMP CCCCC[C@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)C(C)(C)C ZINC000808692738 1052063489 /nfs/dbraw/zinc/06/34/89/1052063489.db2.gz SKUDBXYVUWKHHG-SFHVURJKSA-N 2 1 324.553 4.216 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc3ccccc3o2)cc1 ZINC000769500005 1052068634 /nfs/dbraw/zinc/06/86/34/1052068634.db2.gz ZKXQVZZCIBKNSO-UHFFFAOYSA-N 2 1 308.425 4.126 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2-c2ccccc2)C1 ZINC000769517206 1052071971 /nfs/dbraw/zinc/07/19/71/1052071971.db2.gz ZYIGEKBLQCKZAS-GOSISDBHSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC000769517206 1052071986 /nfs/dbraw/zinc/07/19/86/1052071986.db2.gz ZYIGEKBLQCKZAS-GOSISDBHSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC000769517206 1052072001 /nfs/dbraw/zinc/07/20/01/1052072001.db2.gz ZYIGEKBLQCKZAS-GOSISDBHSA-N 2 1 308.469 4.127 20 0 DIADMP Clc1ccc2c(NC3CC[NH+](CC4CC4)CC3)cc[nH+]c2c1 ZINC000195669090 1052078140 /nfs/dbraw/zinc/07/81/40/1052078140.db2.gz PDMVHBLURPYFGB-UHFFFAOYSA-N 2 1 315.848 4.175 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(C)sc2C)CC1 ZINC000195686804 1052079170 /nfs/dbraw/zinc/07/91/70/1052079170.db2.gz JXSWKIYYCOEDFC-UHFFFAOYSA-N 2 1 308.535 4.309 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](c2ccccc2C)C2CCCC2)CC1 ZINC000494871797 1052156062 /nfs/dbraw/zinc/15/60/62/1052156062.db2.gz CLYKIYFXWSXUIP-HXUWFJFHSA-N 2 1 300.490 4.300 20 0 DIADMP CCC(CC)[C@@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218296818 1052218655 /nfs/dbraw/zinc/21/86/55/1052218655.db2.gz QGASSJRFNCHFRY-HXUWFJFHSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218297188 1052219114 /nfs/dbraw/zinc/21/91/14/1052219114.db2.gz ZYDDZVBLSCOEIU-VQIMIIECSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@@H](C)CC[C@@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218358205 1052230257 /nfs/dbraw/zinc/23/02/57/1052230257.db2.gz PYKZSKBQTXYYDP-IAGOWNOFSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@@H](C)CC[C@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218358207 1052230839 /nfs/dbraw/zinc/23/08/39/1052230839.db2.gz PYKZSKBQTXYYDP-SJORKVTESA-N 2 1 318.505 4.203 20 0 DIADMP CCCC/C=C/[C@@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218354565 1052230983 /nfs/dbraw/zinc/23/09/83/1052230983.db2.gz GUQAEHPIZUTWMV-RCMYXZNBSA-N 2 1 316.489 4.123 20 0 DIADMP CCC[C@H](C)[C@@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218438286 1052239067 /nfs/dbraw/zinc/23/90/67/1052239067.db2.gz IRPRMWYCDJJVTR-OXJNMPFZSA-N 2 1 318.505 4.203 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@@H]3CCC[C@@H]4C[C@@H]43)C2)cc1 ZINC000310024953 1052253996 /nfs/dbraw/zinc/25/39/96/1052253996.db2.gz UERFFAUBMPZUJW-MXEMCNAFSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1cc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc(C)[nH+]1 ZINC000310273568 1052262886 /nfs/dbraw/zinc/26/28/86/1052262886.db2.gz UGMSKGIKUMIMOT-CEWLAPEOSA-N 2 1 321.468 4.021 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)[C@H](C)C1 ZINC000495400495 1052335797 /nfs/dbraw/zinc/33/57/97/1052335797.db2.gz BQTUBEAKDVSCDA-XPGWFJOJSA-N 2 1 316.464 4.082 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000495409561 1052338904 /nfs/dbraw/zinc/33/89/04/1052338904.db2.gz OJWYBMHPMDVAQE-HBFSDRIKSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000495409560 1052339068 /nfs/dbraw/zinc/33/90/68/1052339068.db2.gz OJWYBMHPMDVAQE-GGPKGHCWSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCSC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000089516533 1052379393 /nfs/dbraw/zinc/37/93/93/1052379393.db2.gz FZOYZDGJDJLURK-AEFFLSMTSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCSC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000089516533 1052379399 /nfs/dbraw/zinc/37/93/99/1052379399.db2.gz FZOYZDGJDJLURK-AEFFLSMTSA-N 2 1 320.546 4.161 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]Cc3ccc(C4CC4)cc3)CC2)cc1 ZINC000236731100 1052430695 /nfs/dbraw/zinc/43/06/95/1052430695.db2.gz SSUHWSWSTBONKK-UHFFFAOYSA-N 2 1 320.480 4.318 20 0 DIADMP CC[N@@H+](CC1CC[NH2+]CC1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000237008758 1052434576 /nfs/dbraw/zinc/43/45/76/1052434576.db2.gz KUNWCEQZMAPUCE-CYBMUJFWSA-N 2 1 314.395 4.088 20 0 DIADMP Cc1csc2sc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)c(C)c12 ZINC001222149486 1052451407 /nfs/dbraw/zinc/45/14/07/1052451407.db2.gz YXOHTMIHCLOXKU-KRWDZBQOSA-N 2 1 320.527 4.155 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)o1 ZINC001222155296 1052452603 /nfs/dbraw/zinc/45/26/03/1052452603.db2.gz ZNJLPPPSSPPUTO-PXNSSMCTSA-N 2 1 318.505 4.327 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222161920 1052453516 /nfs/dbraw/zinc/45/35/16/1052453516.db2.gz TVZBWGITQIYEFL-IBGZPJMESA-N 2 1 318.530 4.154 20 0 DIADMP c1c2ccccc2oc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222160843 1052454006 /nfs/dbraw/zinc/45/40/06/1052454006.db2.gz JDRHKNCVMMZTOU-FQEVSTJZSA-N 2 1 312.457 4.179 20 0 DIADMP Clc1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222160772 1052454145 /nfs/dbraw/zinc/45/41/45/1052454145.db2.gz IQNPBSRLZDUCAW-GOSISDBHSA-N 2 1 306.881 4.086 20 0 DIADMP Clc1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222160772 1052454147 /nfs/dbraw/zinc/45/41/47/1052454147.db2.gz IQNPBSRLZDUCAW-GOSISDBHSA-N 2 1 306.881 4.086 20 0 DIADMP Clc1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)s1 ZINC001222160270 1052454239 /nfs/dbraw/zinc/45/42/39/1052454239.db2.gz DMSORKYXDJNNQE-INIZCTEOSA-N 2 1 312.910 4.147 20 0 DIADMP Clc1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)s1 ZINC001222160270 1052454241 /nfs/dbraw/zinc/45/42/41/1052454241.db2.gz DMSORKYXDJNNQE-INIZCTEOSA-N 2 1 312.910 4.147 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)s1 ZINC001222167095 1052455047 /nfs/dbraw/zinc/45/50/47/1052455047.db2.gz HVJONTSXRDUDEF-QGZVFWFLSA-N 2 1 324.559 4.216 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)s1 ZINC001222167095 1052455053 /nfs/dbraw/zinc/45/50/53/1052455053.db2.gz HVJONTSXRDUDEF-QGZVFWFLSA-N 2 1 324.559 4.216 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)([NH+](C)C)C1 ZINC000316209926 1052457779 /nfs/dbraw/zinc/45/77/79/1052457779.db2.gz VSXUTMNZRIZJKE-WCVJEAGWSA-N 2 1 320.443 4.208 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@]23CCC[NH2+]C3)CC1 ZINC001222192568 1052458971 /nfs/dbraw/zinc/45/89/71/1052458971.db2.gz WWJSLERHEPEJAT-VQTJNVASSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@]23CCC[NH2+]C3)CC1 ZINC001222192568 1052458976 /nfs/dbraw/zinc/45/89/76/1052458976.db2.gz WWJSLERHEPEJAT-VQTJNVASSA-N 2 1 302.506 4.287 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001222259779 1052469887 /nfs/dbraw/zinc/46/98/87/1052469887.db2.gz ZCKTZWQSDRYKRI-GCJKJVERSA-N 2 1 322.496 4.409 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222258458 1052470305 /nfs/dbraw/zinc/47/03/05/1052470305.db2.gz ATBAEWFOXMGRRK-AZUAARDMSA-N 2 1 324.553 4.074 20 0 DIADMP c1cc(-c2ccccc2)sc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000316726748 1052470917 /nfs/dbraw/zinc/47/09/17/1052470917.db2.gz GDNLXGUQLANAMO-SJORKVTESA-N 2 1 312.482 4.132 20 0 DIADMP c1cc(-c2ccccc2)sc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000316726744 1052471090 /nfs/dbraw/zinc/47/10/90/1052471090.db2.gz GDNLXGUQLANAMO-DLBZAZTESA-N 2 1 312.482 4.132 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]C3)C2)c2ccccc12 ZINC001222265757 1052471181 /nfs/dbraw/zinc/47/11/81/1052471181.db2.gz XKSUSBCKCHBMCL-NRFANRHFSA-N 2 1 308.469 4.114 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CCC[NH2+]C4)C3)cc2)o1 ZINC001222271598 1052471837 /nfs/dbraw/zinc/47/18/37/1052471837.db2.gz IFGDAEZHBATVSD-NRFANRHFSA-N 2 1 324.468 4.221 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222271277 1052471889 /nfs/dbraw/zinc/47/18/89/1052471889.db2.gz FCQYRRMVQDZQJF-LJQANCHMSA-N 2 1 314.498 4.175 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CCC[C@@]3(CC[NH2+]3)C2)CC1 ZINC001222277647 1052472640 /nfs/dbraw/zinc/47/26/40/1052472640.db2.gz QCOVHRHAELKHNQ-WOJBJXKFSA-N 2 1 302.506 4.287 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC2(CCCC[NH2+]2)CC1 ZINC001222287422 1052473757 /nfs/dbraw/zinc/47/37/57/1052473757.db2.gz JKEUUZIRQLCDOF-GOSISDBHSA-N 2 1 324.553 4.216 20 0 DIADMP CC(C)(C)c1ccc(C[NH+]2CCC3(CCCC[NH2+]3)CC2)cc1 ZINC001222293247 1052474773 /nfs/dbraw/zinc/47/47/73/1052474773.db2.gz RMWDXEBNTSYAMK-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP c1ccc(-c2ccc(C[NH+]3CCC4(CCCC[NH2+]4)CC3)cc2)cc1 ZINC001222292947 1052474873 /nfs/dbraw/zinc/47/48/73/1052474873.db2.gz OCFNBGRZFPYFPT-UHFFFAOYSA-N 2 1 320.480 4.462 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222308044 1052478695 /nfs/dbraw/zinc/47/86/95/1052478695.db2.gz FWPHIYGDYGVNRJ-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)s1 ZINC001222314895 1052479859 /nfs/dbraw/zinc/47/98/59/1052479859.db2.gz KLDXVKRASSDASW-SFHVURJKSA-N 2 1 306.519 4.199 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222316410 1052480562 /nfs/dbraw/zinc/48/05/62/1052480562.db2.gz VUDXIEADMBFKHK-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c1 ZINC001222321504 1052481637 /nfs/dbraw/zinc/48/16/37/1052481637.db2.gz XTIMUZYFVNYGER-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)cc2s1 ZINC001222320591 1052481850 /nfs/dbraw/zinc/48/18/50/1052481850.db2.gz KVVGOYPMHWHRKH-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c(C)c1Cl ZINC001222326306 1052483734 /nfs/dbraw/zinc/48/37/34/1052483734.db2.gz UJCHQAZUTWCTBE-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000322368322 1052485052 /nfs/dbraw/zinc/48/50/52/1052485052.db2.gz DBSVDGREGLVYQR-FBVQUNGASA-N 2 1 306.881 4.396 20 0 DIADMP C[C@H](C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345074 1052487768 /nfs/dbraw/zinc/48/77/68/1052487768.db2.gz IFTGRNZKPGCLDP-DYESRHJHSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345074 1052487772 /nfs/dbraw/zinc/48/77/72/1052487772.db2.gz IFTGRNZKPGCLDP-DYESRHJHSA-N 2 1 308.469 4.161 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222355708 1052489735 /nfs/dbraw/zinc/48/97/35/1052489735.db2.gz UAAXSUFIPIJLDA-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222355708 1052489741 /nfs/dbraw/zinc/48/97/41/1052489741.db2.gz UAAXSUFIPIJLDA-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222361520 1052490757 /nfs/dbraw/zinc/49/07/57/1052490757.db2.gz ZLOKMMXMCNPUDY-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@]3(CCC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222361520 1052490760 /nfs/dbraw/zinc/49/07/60/1052490760.db2.gz ZLOKMMXMCNPUDY-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)c2ccccc12 ZINC001222385388 1052494290 /nfs/dbraw/zinc/49/42/90/1052494290.db2.gz LTUFAKWPXDWJAT-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)c2ccccc12 ZINC001222385388 1052494291 /nfs/dbraw/zinc/49/42/91/1052494291.db2.gz LTUFAKWPXDWJAT-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C[C@H](c2ccccc2)C1 ZINC000322814583 1052497577 /nfs/dbraw/zinc/49/75/77/1052497577.db2.gz ALNJNFXUNUZBQL-REUDGBKOSA-N 2 1 312.501 4.174 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322844539 1052498552 /nfs/dbraw/zinc/49/85/52/1052498552.db2.gz MAQWWISQBMXBBG-WZYMTQMTSA-N 2 1 312.457 4.271 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000322844539 1052498556 /nfs/dbraw/zinc/49/85/56/1052498556.db2.gz MAQWWISQBMXBBG-WZYMTQMTSA-N 2 1 312.457 4.271 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@H]2C[NH2+]CC[C@H]21 ZINC001222620481 1052518684 /nfs/dbraw/zinc/51/86/84/1052518684.db2.gz UUCXKBVWXNGNGO-KBXCAEBGSA-N 2 1 322.477 4.238 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[N@@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC001222634988 1052521575 /nfs/dbraw/zinc/52/15/75/1052521575.db2.gz LTFRHHHSSAYZAC-OYRHEFFESA-N 2 1 312.501 4.166 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC000320557745 1052531138 /nfs/dbraw/zinc/53/11/38/1052531138.db2.gz JQKZJNOVGIWZOH-FUHWJXTLSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1 ZINC000398024648 1052562244 /nfs/dbraw/zinc/56/22/44/1052562244.db2.gz LONIPBNYVRKZLP-DENIHFKCSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCc1ccccc1 ZINC000398024648 1052562246 /nfs/dbraw/zinc/56/22/46/1052562246.db2.gz LONIPBNYVRKZLP-DENIHFKCSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050977 1052563784 /nfs/dbraw/zinc/56/37/84/1052563784.db2.gz XOQITRKPQDLMHJ-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050977 1052563791 /nfs/dbraw/zinc/56/37/91/1052563791.db2.gz XOQITRKPQDLMHJ-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCC[C@H]1C ZINC000398052602 1052565070 /nfs/dbraw/zinc/56/50/70/1052565070.db2.gz YJEFYBNNRCEKEY-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCC[C@H]1C ZINC000398052602 1052565077 /nfs/dbraw/zinc/56/50/77/1052565077.db2.gz YJEFYBNNRCEKEY-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccccc1)c1cc(C)ccc1C ZINC000326606682 1052565903 /nfs/dbraw/zinc/56/59/03/1052565903.db2.gz IDIFZHMEVUCRLT-NRFANRHFSA-N 2 1 319.452 4.188 20 0 DIADMP CC1(C)CC([NH2+]Cc2cc(Cl)cc(Cl)c2)CC(C)(C)[NH2+]1 ZINC000037423676 1052624191 /nfs/dbraw/zinc/62/41/91/1052624191.db2.gz GNTLTKHPYCFTAZ-UHFFFAOYSA-N 2 1 315.288 4.392 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644330 1052627911 /nfs/dbraw/zinc/62/79/11/1052627911.db2.gz FVZFHIIJJQJGMC-BLLLJJGKSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644330 1052627913 /nfs/dbraw/zinc/62/79/13/1052627913.db2.gz FVZFHIIJJQJGMC-BLLLJJGKSA-N 2 1 315.288 4.376 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000037649029 1052627979 /nfs/dbraw/zinc/62/79/79/1052627979.db2.gz DDAQXDZMMXAYPU-RYUDHWBXSA-N 2 1 313.272 4.128 20 0 DIADMP c1csc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCC2)c1 ZINC000037649474 1052628128 /nfs/dbraw/zinc/62/81/28/1052628128.db2.gz FOYAGXRYGRKXNG-RDTXWAMCSA-N 2 1 304.503 4.053 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(F)c(Cl)c1 ZINC000037786521 1052629388 /nfs/dbraw/zinc/62/93/88/1052629388.db2.gz MDRYYYIEMHRYAH-LBPRGKRZSA-N 2 1 312.860 4.393 20 0 DIADMP C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123499666 1052631938 /nfs/dbraw/zinc/63/19/38/1052631938.db2.gz KLDLERGZPORKSF-OAHLLOKOSA-N 2 1 321.509 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000124432763 1052640724 /nfs/dbraw/zinc/64/07/24/1052640724.db2.gz MIPQCAMGNNQECE-XLIONFOSSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000124432763 1052640728 /nfs/dbraw/zinc/64/07/28/1052640728.db2.gz MIPQCAMGNNQECE-XLIONFOSSA-N 2 1 311.473 4.097 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CC1 ZINC000125186592 1052646190 /nfs/dbraw/zinc/64/61/90/1052646190.db2.gz UFEQBDFXUKHDTK-OXJNMPFZSA-N 2 1 300.490 4.236 20 0 DIADMP COc1ccc(Cl)cc1C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000916834717 1052657938 /nfs/dbraw/zinc/65/79/38/1052657938.db2.gz VVMJNDVFNUHHGM-HNNXBMFYSA-N 2 1 324.896 4.093 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000126183310 1052666842 /nfs/dbraw/zinc/66/68/42/1052666842.db2.gz PLTFQICXSWCXHF-HXUWFJFHSA-N 2 1 309.457 4.124 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000126183310 1052666845 /nfs/dbraw/zinc/66/68/45/1052666845.db2.gz PLTFQICXSWCXHF-HXUWFJFHSA-N 2 1 309.457 4.124 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCCOc3ccc(C(C)C)cc32)CC1 ZINC000126472542 1052669892 /nfs/dbraw/zinc/66/98/92/1052669892.db2.gz OAAUNTRWPJUSIW-IBGZPJMESA-N 2 1 316.489 4.098 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCOc3ccc(C(C)C)cc32)CC1 ZINC000126472288 1052670310 /nfs/dbraw/zinc/67/03/10/1052670310.db2.gz OAAUNTRWPJUSIW-LJQANCHMSA-N 2 1 316.489 4.098 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000126666213 1052673521 /nfs/dbraw/zinc/67/35/21/1052673521.db2.gz YQOWHYFYFKIZEU-RBUKOAKNSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000126666213 1052673526 /nfs/dbraw/zinc/67/35/26/1052673526.db2.gz YQOWHYFYFKIZEU-RBUKOAKNSA-N 2 1 322.452 4.195 20 0 DIADMP Cc1cccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1C ZINC000065976662 1052683163 /nfs/dbraw/zinc/68/31/63/1052683163.db2.gz KFLBVEJUUSIRCK-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000556060400 1052795050 /nfs/dbraw/zinc/79/50/50/1052795050.db2.gz GQTLYDQLNXAWGU-QFBILLFUSA-N 2 1 314.498 4.236 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000556060400 1052795057 /nfs/dbraw/zinc/79/50/57/1052795057.db2.gz GQTLYDQLNXAWGU-QFBILLFUSA-N 2 1 314.498 4.236 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)C[C@H]1c1ccccc1 ZINC000556063006 1052795456 /nfs/dbraw/zinc/79/54/56/1052795456.db2.gz YTYVYKZDFQWFHY-JBACZVJFSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)C[C@H]1c1ccccc1 ZINC000556063006 1052795460 /nfs/dbraw/zinc/79/54/60/1052795460.db2.gz YTYVYKZDFQWFHY-JBACZVJFSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)C[C@@H]1c1ccccc1 ZINC000556063007 1052795591 /nfs/dbraw/zinc/79/55/91/1052795591.db2.gz YTYVYKZDFQWFHY-SESVDKBCSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3cc(F)ccc32)C[C@@H]1c1ccccc1 ZINC000556063007 1052795593 /nfs/dbraw/zinc/79/55/93/1052795593.db2.gz YTYVYKZDFQWFHY-SESVDKBCSA-N 2 1 324.443 4.238 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc3c(s2)CCCC3)CC1 ZINC000129793884 1052811271 /nfs/dbraw/zinc/81/12/71/1052811271.db2.gz OZXDLSYPMIJRHT-AWEZNQCLSA-N 2 1 306.519 4.152 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C[C@H]1c1ccccc1 ZINC000556178514 1052817079 /nfs/dbraw/zinc/81/70/79/1052817079.db2.gz IVTMBPWIYSDJQE-SZMVWBNQSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C[C@H]1c1ccccc1 ZINC000556178514 1052817081 /nfs/dbraw/zinc/81/70/81/1052817081.db2.gz IVTMBPWIYSDJQE-SZMVWBNQSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000556225499 1052823432 /nfs/dbraw/zinc/82/34/32/1052823432.db2.gz VLDFXBCZOFYNPW-MYGLTJDJSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000556225499 1052823433 /nfs/dbraw/zinc/82/34/33/1052823433.db2.gz VLDFXBCZOFYNPW-MYGLTJDJSA-N 2 1 320.480 4.358 20 0 DIADMP c1ccc([C@@H]2CCCC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000498374846 1052826130 /nfs/dbraw/zinc/82/61/30/1052826130.db2.gz NRNPGPKJRUGETJ-PLACYPQZSA-N 2 1 312.501 4.319 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@H]2CCC[C@H]21 ZINC000556880249 1052893685 /nfs/dbraw/zinc/89/36/85/1052893685.db2.gz XYQARARHDBSPJU-RXABAKJHSA-N 2 1 318.892 4.048 20 0 DIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888112 1052894898 /nfs/dbraw/zinc/89/48/98/1052894898.db2.gz XUDOVFDKOBDXOD-HXUWFJFHSA-N 2 1 323.484 4.055 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888112 1052894903 /nfs/dbraw/zinc/89/49/03/1052894903.db2.gz XUDOVFDKOBDXOD-HXUWFJFHSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888112 1052894908 /nfs/dbraw/zinc/89/49/08/1052894908.db2.gz XUDOVFDKOBDXOD-HXUWFJFHSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888112 1052894910 /nfs/dbraw/zinc/89/49/10/1052894910.db2.gz XUDOVFDKOBDXOD-HXUWFJFHSA-N 2 1 323.484 4.055 20 0 DIADMP Cc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000078402435 1052983805 /nfs/dbraw/zinc/98/38/05/1052983805.db2.gz XHLOEXZHYIYCQY-FQEVSTJZSA-N 2 1 300.490 4.083 20 0 DIADMP c1ccc(-c2cccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)c2)cc1 ZINC001228556832 1053134327 /nfs/dbraw/zinc/13/43/27/1053134327.db2.gz RHJUQFHSLVJLKT-UHFFFAOYSA-N 2 1 306.453 4.072 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[NH+]1CCC2(CCC[NH2+]2)CC1 ZINC001228555243 1053134626 /nfs/dbraw/zinc/13/46/26/1053134626.db2.gz DEDKBTZYTHOVLZ-UHFFFAOYSA-N 2 1 312.501 4.452 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187323 1053224306 /nfs/dbraw/zinc/22/43/06/1053224306.db2.gz MEVDWFYHSSNVIT-PBHICJAKSA-N 2 1 324.896 4.121 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187323 1053224315 /nfs/dbraw/zinc/22/43/15/1053224315.db2.gz MEVDWFYHSSNVIT-PBHICJAKSA-N 2 1 324.896 4.121 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC001319199193 1053226298 /nfs/dbraw/zinc/22/62/98/1053226298.db2.gz RWBAVNCFVXETBV-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC001319199193 1053226310 /nfs/dbraw/zinc/22/63/10/1053226310.db2.gz RWBAVNCFVXETBV-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccco2)C1 ZINC000069708781 1053285087 /nfs/dbraw/zinc/28/50/87/1053285087.db2.gz DWJCBBUQNAYOST-IAGOWNOFSA-N 2 1 312.457 4.047 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC001319992471 1053292152 /nfs/dbraw/zinc/29/21/52/1053292152.db2.gz SYPNEONAOIBVEO-GOSISDBHSA-N 2 1 323.484 4.054 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CCN1C ZINC000093644857 1053431133 /nfs/dbraw/zinc/43/11/33/1053431133.db2.gz GDJLPDJWOBEYKR-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644857 1053431141 /nfs/dbraw/zinc/43/11/41/1053431141.db2.gz GDJLPDJWOBEYKR-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644857 1053431150 /nfs/dbraw/zinc/43/11/50/1053431150.db2.gz GDJLPDJWOBEYKR-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644857 1053431156 /nfs/dbraw/zinc/43/11/56/1053431156.db2.gz GDJLPDJWOBEYKR-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644857 1053431160 /nfs/dbraw/zinc/43/11/60/1053431160.db2.gz GDJLPDJWOBEYKR-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644857 1053431167 /nfs/dbraw/zinc/43/11/67/1053431167.db2.gz GDJLPDJWOBEYKR-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644857 1053431177 /nfs/dbraw/zinc/43/11/77/1053431177.db2.gz GDJLPDJWOBEYKR-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)C1 ZINC000324548925 1053463784 /nfs/dbraw/zinc/46/37/84/1053463784.db2.gz PJOSCCVPUZYHLL-GOSISDBHSA-N 2 1 310.441 4.040 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+]CC(C)(C)c1ccccc1 ZINC001200254116 1053501487 /nfs/dbraw/zinc/50/14/87/1053501487.db2.gz GIHPBEQYXXHDIZ-IBGZPJMESA-N 2 1 302.506 4.208 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+]CC(C)(C)c1ccccc1 ZINC001200254116 1053501498 /nfs/dbraw/zinc/50/14/98/1053501498.db2.gz GIHPBEQYXXHDIZ-IBGZPJMESA-N 2 1 302.506 4.208 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(C)c1 ZINC001200255901 1053502804 /nfs/dbraw/zinc/50/28/04/1053502804.db2.gz RCDGSJDADHNVGW-QKWWCAPFSA-N 2 1 314.517 4.335 20 0 DIADMP CC[C@H](C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001324115832 1053626674 /nfs/dbraw/zinc/62/66/74/1053626674.db2.gz NQNGWZULUXCUFY-OHSMVPPVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000153703632 1053708735 /nfs/dbraw/zinc/70/87/35/1053708735.db2.gz CEPNNUXEQWWARV-HZPDHXFCSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000153703632 1053708751 /nfs/dbraw/zinc/70/87/51/1053708751.db2.gz CEPNNUXEQWWARV-HZPDHXFCSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCCC(F)(F)F)C1 ZINC000153703632 1053708766 /nfs/dbraw/zinc/70/87/66/1053708766.db2.gz CEPNNUXEQWWARV-HZPDHXFCSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000153703632 1053708775 /nfs/dbraw/zinc/70/87/75/1053708775.db2.gz CEPNNUXEQWWARV-HZPDHXFCSA-N 2 1 320.443 4.305 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccccc2C)cc1F ZINC000153720654 1053709242 /nfs/dbraw/zinc/70/92/42/1053709242.db2.gz DKURQHGWYUHYOH-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2)cc1F ZINC000153730792 1053711451 /nfs/dbraw/zinc/71/14/51/1053711451.db2.gz KRMZZYMDLQVGOS-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP CC1(C)CCCC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309762162 1053749046 /nfs/dbraw/zinc/74/90/46/1053749046.db2.gz YKDZFXCVMRZJTF-OALUTQOASA-N 2 1 300.490 4.067 20 0 DIADMP c1csc(-c2ccc(C[NH+]3CCC([NH+]4CCC4)CC3)cc2)c1 ZINC001231431028 1053751476 /nfs/dbraw/zinc/75/14/76/1053751476.db2.gz MZBGJNDENMAWJF-UHFFFAOYSA-N 2 1 312.482 4.085 20 0 DIADMP C[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCCCC1 ZINC000309933444 1053754690 /nfs/dbraw/zinc/75/46/90/1053754690.db2.gz XHRSFGNJDOQUJM-GOSISDBHSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCCCC1 ZINC000309933445 1053756133 /nfs/dbraw/zinc/75/61/33/1053756133.db2.gz XHRSFGNJDOQUJM-SFHVURJKSA-N 2 1 314.517 4.457 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2cc(C)c(C)cc2C)CC1 ZINC001231483453 1053764202 /nfs/dbraw/zinc/76/42/02/1053764202.db2.gz RWZJADUKSZIGEP-UHFFFAOYSA-N 2 1 323.484 4.054 20 0 DIADMP Cc1cc(C)c(C[NH+]2CCC([NH+]3CCCCC3)CC2)cc1C ZINC001231482091 1053764346 /nfs/dbraw/zinc/76/43/46/1053764346.db2.gz CXSFELHPGOQDLP-UHFFFAOYSA-N 2 1 300.490 4.062 20 0 DIADMP CC(C)(CCCc1ccccc1)C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001200562943 1053765506 /nfs/dbraw/zinc/76/55/06/1053765506.db2.gz RZAAKKLARJIWRJ-PMACEKPBSA-N 2 1 314.517 4.252 20 0 DIADMP CC[N@@H+](C)C1CCN(Cc2cccc(-c3ccccc3)c2)CC1 ZINC001231511279 1053773952 /nfs/dbraw/zinc/77/39/52/1053773952.db2.gz KSBRNYZBXYHGCU-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC001231511279 1053773962 /nfs/dbraw/zinc/77/39/62/1053773962.db2.gz KSBRNYZBXYHGCU-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC001231511279 1053773968 /nfs/dbraw/zinc/77/39/68/1053773968.db2.gz KSBRNYZBXYHGCU-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccco1 ZINC000155773946 1053786239 /nfs/dbraw/zinc/78/62/39/1053786239.db2.gz CKHFNKNBCVPSDI-SJORKVTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000156049064 1053794691 /nfs/dbraw/zinc/79/46/91/1053794691.db2.gz XSOQYMNELBTVCQ-KGVIQGDOSA-N 2 1 322.496 4.137 20 0 DIADMP C[NH+](C)[C@@H]1CCCC[C@H]1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001327569892 1053864162 /nfs/dbraw/zinc/86/41/62/1053864162.db2.gz OUGRYRPGDRBSSY-NVXWUHKLSA-N 2 1 303.837 4.173 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)C1CC[NH+](C)CC1 ZINC001231806293 1053865202 /nfs/dbraw/zinc/86/52/02/1053865202.db2.gz BXSHKYRYJXVNAB-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)C1CC[NH+](C)CC1 ZINC001231806293 1053865213 /nfs/dbraw/zinc/86/52/13/1053865213.db2.gz BXSHKYRYJXVNAB-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(OC(C)(C)C)cc1 ZINC001231807643 1053865495 /nfs/dbraw/zinc/86/54/95/1053865495.db2.gz GJPCQLRWBVXFQP-UHFFFAOYSA-N 2 1 306.494 4.028 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3-c3ccc(F)cc3)C2)C1 ZINC001231824441 1053878391 /nfs/dbraw/zinc/87/83/91/1053878391.db2.gz DSSIBKMCHMVMEV-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3-c3ccc(F)cc3)C2)C1 ZINC001231824441 1053878406 /nfs/dbraw/zinc/87/84/06/1053878406.db2.gz DSSIBKMCHMVMEV-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3-c3ccc(F)cc3)C2)C1 ZINC001231824441 1053878420 /nfs/dbraw/zinc/87/84/20/1053878420.db2.gz DSSIBKMCHMVMEV-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)C3CC[NH+](C)CC3)c(C)c12 ZINC001231829111 1053883630 /nfs/dbraw/zinc/88/36/30/1053883630.db2.gz QIMYEKOHHGJWHC-UHFFFAOYSA-N 2 1 308.516 4.106 20 0 DIADMP Cc1csc2sc(C[N@H+](C)C3CC[NH+](C)CC3)c(C)c12 ZINC001231829111 1053883643 /nfs/dbraw/zinc/88/36/43/1053883643.db2.gz QIMYEKOHHGJWHC-UHFFFAOYSA-N 2 1 308.516 4.106 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)C(C)(C)c1ccccc1 ZINC001200702872 1053905288 /nfs/dbraw/zinc/90/52/88/1053905288.db2.gz HLFFCZJLXRADTJ-ZWKOTPCHSA-N 2 1 302.506 4.205 20 0 DIADMP COc1cccc([C@@H]2CCCC[N@H+]2Cc2cc3c[nH+]ccc3[nH]2)c1 ZINC001232013842 1053938473 /nfs/dbraw/zinc/93/84/73/1053938473.db2.gz GXGPELQJVPINJC-FQEVSTJZSA-N 2 1 321.424 4.299 20 0 DIADMP Cc1ccc(C[N@H+](C)Cc2cc(F)cc(C[NH+](C)C)c2)cc1C ZINC001232150205 1053973155 /nfs/dbraw/zinc/97/31/55/1053973155.db2.gz UMJBUKCEBSGPFJ-UHFFFAOYSA-N 2 1 314.448 4.136 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000163486679 1054042375 /nfs/dbraw/zinc/04/23/75/1054042375.db2.gz ZMLRMXRTXJFLTH-OAHLLOKOSA-N 2 1 315.486 4.080 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(C)cc3C)CC2)[nH+]c1 ZINC000163512088 1054043540 /nfs/dbraw/zinc/04/35/40/1054043540.db2.gz GEXKCLUDONIOPM-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000163534115 1054044621 /nfs/dbraw/zinc/04/46/21/1054044621.db2.gz RFIHQYWAHQVCKM-KRWDZBQOSA-N 2 1 309.457 4.018 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000165604203 1054080175 /nfs/dbraw/zinc/08/01/75/1054080175.db2.gz VOAAREYYWDKMTD-OAHLLOKOSA-N 2 1 312.457 4.266 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2ccccc2s1 ZINC000296560277 1054091082 /nfs/dbraw/zinc/09/10/82/1054091082.db2.gz SFEGHXCIXWRIBN-WWTUQBGBSA-N 2 1 300.471 4.177 20 0 DIADMP CC(C)[N@@H+](Cc1csc(C(F)(F)F)c1)C1CCN(C)CC1 ZINC001233176897 1054196728 /nfs/dbraw/zinc/19/67/28/1054196728.db2.gz AJATUVSVVOXDOH-UHFFFAOYSA-N 2 1 320.424 4.072 20 0 DIADMP CC(C)N(Cc1csc(C(F)(F)F)c1)C1CC[NH+](C)CC1 ZINC001233176897 1054196735 /nfs/dbraw/zinc/19/67/35/1054196735.db2.gz AJATUVSVVOXDOH-UHFFFAOYSA-N 2 1 320.424 4.072 20 0 DIADMP CC[N@@H+](Cc1ccc(Cc2ccccc2)cc1)C1CCN(C)CC1 ZINC001233331120 1054235377 /nfs/dbraw/zinc/23/53/77/1054235377.db2.gz HXTSHFMQAJYIDR-UHFFFAOYSA-N 2 1 322.496 4.194 20 0 DIADMP CC(C)(C)n1c[nH+]cc1[C@@H]1CCCN(c2cc[nH+]cc2C2CC2)C1 ZINC001336855045 1054249227 /nfs/dbraw/zinc/24/92/27/1054249227.db2.gz ICNCELWWYYVYLN-MRXNPFEDSA-N 2 1 324.472 4.295 20 0 DIADMP CCCn1cc[nH+]c1CCCN(C)c1c(C)c[nH+]c2ccccc21 ZINC001339030968 1054319060 /nfs/dbraw/zinc/31/90/60/1054319060.db2.gz XWUDITMVOPKPOV-UHFFFAOYSA-N 2 1 322.456 4.219 20 0 DIADMP C[C@@H](CC[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000379849446 1054426153 /nfs/dbraw/zinc/42/61/53/1054426153.db2.gz GIVOUSLPMPYLOX-PZJWPPBQSA-N 2 1 322.496 4.292 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000671294819 1054525315 /nfs/dbraw/zinc/52/53/15/1054525315.db2.gz LQKHKYHIGLIKLS-UHOSZYNNSA-N 2 1 316.489 4.143 20 0 DIADMP CC1(C)CC([NH2+]Cc2csc(C(F)(F)F)c2)CC(C)(C)[NH2+]1 ZINC000623341040 1054568263 /nfs/dbraw/zinc/56/82/63/1054568263.db2.gz KTFYCOQOQXFBHA-UHFFFAOYSA-N 2 1 320.424 4.166 20 0 DIADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)o1 ZINC000192710318 1054572354 /nfs/dbraw/zinc/57/23/54/1054572354.db2.gz WRAUAARUSKCDKT-OXQOHEQNSA-N 2 1 324.468 4.289 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)CC1(C)C ZINC000623511881 1054609761 /nfs/dbraw/zinc/60/97/61/1054609761.db2.gz KQRJBGXLYXFDNO-DJIMGWMZSA-N 2 1 306.881 4.048 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)CC1(C)C ZINC000623516862 1054612134 /nfs/dbraw/zinc/61/21/34/1054612134.db2.gz ITXOTXHXNYOFMM-ZDUSSCGKSA-N 2 1 314.926 4.187 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001234991438 1054637199 /nfs/dbraw/zinc/63/71/99/1054637199.db2.gz GAJXAKVCPJYQAV-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001234992125 1054637607 /nfs/dbraw/zinc/63/76/07/1054637607.db2.gz JBHGDWFPDCLKKZ-DYESRHJHSA-N 2 1 308.469 4.019 20 0 DIADMP Clc1sc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c2ccccc12 ZINC001234996374 1054638613 /nfs/dbraw/zinc/63/86/13/1054638613.db2.gz AGNYXFRQNHUTGR-KRWDZBQOSA-N 2 1 320.889 4.130 20 0 DIADMP Clc1sc(C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c2ccccc12 ZINC001234996374 1054638617 /nfs/dbraw/zinc/63/86/17/1054638617.db2.gz AGNYXFRQNHUTGR-KRWDZBQOSA-N 2 1 320.889 4.130 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CCC[C@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234992566 1054638690 /nfs/dbraw/zinc/63/86/90/1054638690.db2.gz KMQRYKUKICTXOR-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234992566 1054638695 /nfs/dbraw/zinc/63/86/95/1054638695.db2.gz KMQRYKUKICTXOR-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1cc(-c2csc(C[N@@H+]3CCC[C@@]4(CC[NH2+]C4)C3)c2)cs1 ZINC001234998785 1054640197 /nfs/dbraw/zinc/64/01/97/1054640197.db2.gz JVQFQKUUJSZKTO-KRWDZBQOSA-N 2 1 318.511 4.052 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)c2)cs1 ZINC001234998785 1054640202 /nfs/dbraw/zinc/64/02/02/1054640202.db2.gz JVQFQKUUJSZKTO-KRWDZBQOSA-N 2 1 318.511 4.052 20 0 DIADMP C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC000178079198 1054642326 /nfs/dbraw/zinc/64/23/26/1054642326.db2.gz NCWAYSYTEHBHBI-FAXKSRBJSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccoc1 ZINC000178079198 1054642332 /nfs/dbraw/zinc/64/23/32/1054642332.db2.gz NCWAYSYTEHBHBI-FAXKSRBJSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC000178079198 1054642337 /nfs/dbraw/zinc/64/23/37/1054642337.db2.gz NCWAYSYTEHBHBI-FAXKSRBJSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccoc1 ZINC000178092125 1054643318 /nfs/dbraw/zinc/64/33/18/1054643318.db2.gz VVHZHSSVJRSYOR-SJORKVTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccoc1 ZINC000178092125 1054643329 /nfs/dbraw/zinc/64/33/29/1054643329.db2.gz VVHZHSSVJRSYOR-SJORKVTESA-N 2 1 312.457 4.362 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235038416 1054643426 /nfs/dbraw/zinc/64/34/26/1054643426.db2.gz JAUSWELVRAPKSW-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235041716 1054645932 /nfs/dbraw/zinc/64/59/32/1054645932.db2.gz RWVPATXWLUXCQV-UYAOXDASSA-N 2 1 324.553 4.216 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001235047254 1054646069 /nfs/dbraw/zinc/64/60/69/1054646069.db2.gz UKVZLTAEZXOQLV-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(C2(C[N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)CCCC2)cc1 ZINC001235040718 1054646255 /nfs/dbraw/zinc/64/62/55/1054646255.db2.gz NJFSXVWQKSVWPB-NRFANRHFSA-N 2 1 312.501 4.107 20 0 DIADMP CC/C=C\CCCCCC[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001235093007 1054654236 /nfs/dbraw/zinc/65/42/36/1054654236.db2.gz YDFYQSXEDPOVBC-LIMHQNJXSA-N 2 1 314.464 4.224 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)s1 ZINC000178706695 1054657198 /nfs/dbraw/zinc/65/71/98/1054657198.db2.gz JRKNYVDFNPALRG-DGCLKSJQSA-N 2 1 311.882 4.283 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[NH+]2CCC3(CC[NH2+]3)CC2)c1 ZINC001235111681 1054659446 /nfs/dbraw/zinc/65/94/46/1054659446.db2.gz SDJCINHAVSYJSP-UHFFFAOYSA-N 2 1 320.480 4.298 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCCC12CC[NH2+]CC2 ZINC001235141334 1054664736 /nfs/dbraw/zinc/66/47/36/1054664736.db2.gz RDUIDGANVISSQT-UHFFFAOYSA-N 2 1 320.436 4.304 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1 ZINC001235156958 1054666934 /nfs/dbraw/zinc/66/69/34/1054666934.db2.gz OIFDKGXPUNLPSM-FQEVSTJZSA-N 2 1 300.490 4.164 20 0 DIADMP Cc1c(F)ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1Cl ZINC001235158661 1054667266 /nfs/dbraw/zinc/66/72/66/1054667266.db2.gz VBUQSRHMSDLNIW-KRWDZBQOSA-N 2 1 324.871 4.142 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC001235193934 1054680650 /nfs/dbraw/zinc/68/06/50/1054680650.db2.gz SSMQAUBMDJQFRX-XUVXKRRUSA-N 2 1 302.506 4.001 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235189619 1054681060 /nfs/dbraw/zinc/68/10/60/1054681060.db2.gz NUHCKNJZMNOKGD-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235189525 1054681937 /nfs/dbraw/zinc/68/19/37/1054681937.db2.gz LABOWOMKFUNIHB-UHFFFAOYSA-N 2 1 314.498 4.318 20 0 DIADMP c1cc2ccc(C[N@H+]3CCCCC34CC[NH2+]CC4)cc2s1 ZINC001235190027 1054682124 /nfs/dbraw/zinc/68/21/24/1054682124.db2.gz RYJKEEBIQICTPY-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP Fc1cccc2c(C[N@H+]3CCCCC34CC[NH2+]CC4)cccc12 ZINC001235191654 1054682265 /nfs/dbraw/zinc/68/22/65/1054682265.db2.gz USXLMPHKHFWDHL-UHFFFAOYSA-N 2 1 312.432 4.087 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc3cccc(F)c3[nH]2)CC1 ZINC001235248423 1054692338 /nfs/dbraw/zinc/69/23/38/1054692338.db2.gz CEPMPEXBBADSRA-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc3cccc(F)c3[nH]2)CC1 ZINC001235248423 1054692347 /nfs/dbraw/zinc/69/23/47/1054692347.db2.gz CEPMPEXBBADSRA-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(F)c(F)c1)C(C)C ZINC000179676543 1054695171 /nfs/dbraw/zinc/69/51/71/1054695171.db2.gz JCSKEDNTIMBWFP-FZKQIMNGSA-N 2 1 321.415 4.093 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@@H]2[NH2+]CC[C@@H]2C1 ZINC001235272721 1054696857 /nfs/dbraw/zinc/69/68/57/1054696857.db2.gz QVDPMNUJIPGRFG-KDOFPFPSSA-N 2 1 322.477 4.238 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)cc12 ZINC001235274116 1054696878 /nfs/dbraw/zinc/69/68/78/1054696878.db2.gz UUZMJAGTTWBEIB-MAUKXSAKSA-N 2 1 322.477 4.238 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)cc12 ZINC001235274116 1054696880 /nfs/dbraw/zinc/69/68/80/1054696880.db2.gz UUZMJAGTTWBEIB-MAUKXSAKSA-N 2 1 322.477 4.238 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235272501 1054698237 /nfs/dbraw/zinc/69/82/37/1054698237.db2.gz QCTXGNPIRSNUQJ-NHCUHLMSSA-N 2 1 320.480 4.154 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H](C3C[NH2+]C3)C2)CC1 ZINC001235337918 1054703284 /nfs/dbraw/zinc/70/32/84/1054703284.db2.gz LXBJOOVGEQVOHQ-RBUKOAKNSA-N 2 1 302.506 4.001 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@H](C3C[NH2+]C3)C2)c1 ZINC001235338446 1054703870 /nfs/dbraw/zinc/70/38/70/1054703870.db2.gz AMUZDOUYHDCUTI-FQEVSTJZSA-N 2 1 320.480 4.012 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)CCN1C ZINC000179906140 1054714526 /nfs/dbraw/zinc/71/45/26/1054714526.db2.gz MLQWHLCZGIRVPY-YOEHRIQHSA-N 2 1 316.420 4.000 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC001235428556 1054717208 /nfs/dbraw/zinc/71/72/08/1054717208.db2.gz QQCLKHXDSMSNMK-WOJBJXKFSA-N 2 1 300.490 4.022 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3sc21)CC1CC[NH2+]CC1 ZINC001235433526 1054718242 /nfs/dbraw/zinc/71/82/42/1054718242.db2.gz LPAIZPZOZYUXHH-UHFFFAOYSA-N 2 1 324.493 4.486 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+](C)CC3CC[NH2+]CC3)c2)cc1 ZINC001235432642 1054718285 /nfs/dbraw/zinc/71/82/85/1054718285.db2.gz PDZZAOHYCFJRBY-UHFFFAOYSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235427810 1054719704 /nfs/dbraw/zinc/71/97/04/1054719704.db2.gz OHUFHLXTWYLEJQ-IRXDYDNUSA-N 2 1 320.908 4.168 20 0 DIADMP C[N@@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C1CC[NH2+]CC1 ZINC001235467343 1054728603 /nfs/dbraw/zinc/72/86/03/1054728603.db2.gz YSJFGQHEBQBYAJ-BQYQJAHWSA-N 2 1 306.453 4.041 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001235673459 1054766644 /nfs/dbraw/zinc/76/66/44/1054766644.db2.gz IFFWVHFXEXWKQG-LJQANCHMSA-N 2 1 312.844 4.280 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001235676616 1054770848 /nfs/dbraw/zinc/77/08/48/1054770848.db2.gz BYZZHRMPQWGYAE-FQEVSTJZSA-N 2 1 310.416 4.156 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2)c2cccs2)CC[N@@H+]1C ZINC000180944950 1054782865 /nfs/dbraw/zinc/78/28/65/1054782865.db2.gz VZNIFLYHZMXPRX-NJAFHUGGSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2)c2cccs2)CC[N@H+]1C ZINC000180944950 1054782878 /nfs/dbraw/zinc/78/28/78/1054782878.db2.gz VZNIFLYHZMXPRX-NJAFHUGGSA-N 2 1 314.498 4.104 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(-c2ccccc2)cc1 ZINC001235714568 1054786136 /nfs/dbraw/zinc/78/61/36/1054786136.db2.gz NVFKEDNAQSLVQT-UHFFFAOYSA-N 2 1 308.469 4.175 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2cccc(-c3ccccc3)c2C)CC1 ZINC001235725458 1054788216 /nfs/dbraw/zinc/78/82/16/1054788216.db2.gz HUZBTBOMGOEWSY-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP COc1cccc([C@H]2CCCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC001235727997 1054792771 /nfs/dbraw/zinc/79/27/71/1054792771.db2.gz WTMAAHVXFYVCGB-OAQYLSRUSA-N 2 1 322.452 4.026 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2sc3scc(C)c3c2C)CC1 ZINC001235726976 1054793118 /nfs/dbraw/zinc/79/31/18/1054793118.db2.gz TZTPAXADKNKNEY-UHFFFAOYSA-N 2 1 308.516 4.154 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(C)sc1C ZINC000623866237 1054794970 /nfs/dbraw/zinc/79/49/70/1054794970.db2.gz PHSNVHFKEBFCFP-RYRKJORJSA-N 2 1 306.519 4.423 20 0 DIADMP CC[N@@H+](C[C@H](C)Cc1ccc(C(C)C)cc1)C1CC[NH2+]CC1 ZINC001235758314 1054800211 /nfs/dbraw/zinc/80/02/11/1054800211.db2.gz DCODYLHUSXDVMD-QGZVFWFLSA-N 2 1 302.506 4.063 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C1CC[NH2+]CC1 ZINC001235762342 1054801532 /nfs/dbraw/zinc/80/15/32/1054801532.db2.gz SISNDUWHMHZQTA-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C1CC[NH2+]CC1 ZINC001235762342 1054801542 /nfs/dbraw/zinc/80/15/42/1054801542.db2.gz SISNDUWHMHZQTA-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP CC[N@@H+](C[C@@H](C)Cc1ccc(C(C)C)cc1)C1CC[NH2+]CC1 ZINC001235758313 1054801695 /nfs/dbraw/zinc/80/16/95/1054801695.db2.gz DCODYLHUSXDVMD-KRWDZBQOSA-N 2 1 302.506 4.063 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2cccc(-c3c(C)cccc3C)c2)CC1 ZINC001235790006 1054807516 /nfs/dbraw/zinc/80/75/16/1054807516.db2.gz YUOHUYBHNKBGDQ-UHFFFAOYSA-N 2 1 308.469 4.154 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH3+])C2 ZINC001235810745 1054811705 /nfs/dbraw/zinc/81/17/05/1054811705.db2.gz NILHLGPPFLSGNE-QLIIJSOBSA-N 2 1 314.517 4.117 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001235840367 1054820214 /nfs/dbraw/zinc/82/02/14/1054820214.db2.gz KQXQZISFRWYBPP-NRFANRHFSA-N 2 1 322.452 4.026 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001235840368 1054820444 /nfs/dbraw/zinc/82/04/44/1054820444.db2.gz KQXQZISFRWYBPP-OAQYLSRUSA-N 2 1 322.452 4.026 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001235926318 1054851100 /nfs/dbraw/zinc/85/11/00/1054851100.db2.gz XXCWPNSEFWDFFF-SHBDEGQCSA-N 2 1 306.453 4.170 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+](C)C[C@H]2CCC[NH2+]C2)CC1 ZINC001235951384 1054865920 /nfs/dbraw/zinc/86/59/20/1054865920.db2.gz RSRXBKZCCPDXCR-PMACEKPBSA-N 2 1 304.522 4.391 20 0 DIADMP C[N@@H+](CCC12CC([NH3+])(C1)C2)Cc1ccc(Oc2ccccc2)cc1 ZINC001235949735 1054867246 /nfs/dbraw/zinc/86/72/46/1054867246.db2.gz GVVFVMWPIWQWGD-UHFFFAOYSA-N 2 1 322.452 4.182 20 0 DIADMP CCCCCCc1ccc(C[N@@H+](C)C[C@H]2CCC[NH2+]C2)s1 ZINC001235960490 1054871861 /nfs/dbraw/zinc/87/18/61/1054871861.db2.gz XPPKGUAEYVXTFI-INIZCTEOSA-N 2 1 308.535 4.302 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC001235960574 1054872045 /nfs/dbraw/zinc/87/20/45/1054872045.db2.gz TZBVYYZTBLVZEP-UHFFFAOYSA-N 2 1 314.860 4.008 20 0 DIADMP C[N@@H+](CCCCCC[NH3+])Cc1ccccc1Oc1ccccc1 ZINC001235970258 1054876309 /nfs/dbraw/zinc/87/63/09/1054876309.db2.gz ZQADDJNRSLHIPZ-UHFFFAOYSA-N 2 1 312.457 4.430 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000624119453 1054884948 /nfs/dbraw/zinc/88/49/48/1054884948.db2.gz BJZNUAUBXQAPEH-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624119453 1054884970 /nfs/dbraw/zinc/88/49/70/1054884970.db2.gz BJZNUAUBXQAPEH-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045326 1054912077 /nfs/dbraw/zinc/91/20/77/1054912077.db2.gz BXKMKSXOWGYJNI-DOTOQJQBSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045326 1054912093 /nfs/dbraw/zinc/91/20/93/1054912093.db2.gz BXKMKSXOWGYJNI-DOTOQJQBSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045327 1054912523 /nfs/dbraw/zinc/91/25/23/1054912523.db2.gz BXKMKSXOWGYJNI-NVXWUHKLSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045327 1054912534 /nfs/dbraw/zinc/91/25/34/1054912534.db2.gz BXKMKSXOWGYJNI-NVXWUHKLSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481237 1054917127 /nfs/dbraw/zinc/91/71/27/1054917127.db2.gz VUPRAVWDMICOOR-STQMWFEESA-N 2 1 318.848 4.221 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481237 1054917136 /nfs/dbraw/zinc/91/71/36/1054917136.db2.gz VUPRAVWDMICOOR-STQMWFEESA-N 2 1 318.848 4.221 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(F)c(F)c1)C(C)C ZINC000181601509 1054924567 /nfs/dbraw/zinc/92/45/67/1054924567.db2.gz SATCQCOOHUPLHM-SFHVURJKSA-N 2 1 321.415 4.237 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc3c4ccccc4sc32)CCC[NH2+]1 ZINC001236095804 1054939845 /nfs/dbraw/zinc/93/98/45/1054939845.db2.gz ZBROXBUEADONDV-AWEZNQCLSA-N 2 1 310.466 4.238 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)CCC[NH2+]1 ZINC001236094376 1054940816 /nfs/dbraw/zinc/94/08/16/1054940816.db2.gz CSISYNDZLIZYQR-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C[C@@H](N)c1ccccc1 ZINC001236108155 1054951983 /nfs/dbraw/zinc/95/19/83/1054951983.db2.gz JHYHYOIHXKMGNU-MSOLQXFVSA-N 2 1 312.482 4.245 20 0 DIADMP CSc1ccccc1[C@@H]1CCCN1C[C@@H]([NH3+])c1ccccc1 ZINC001236108155 1054951991 /nfs/dbraw/zinc/95/19/91/1054951991.db2.gz JHYHYOIHXKMGNU-MSOLQXFVSA-N 2 1 312.482 4.245 20 0 DIADMP CCC[N@@H+](Cc1cccc(-c2ccccc2)c1)C1CC[NH2+]CC1 ZINC001236182558 1054981470 /nfs/dbraw/zinc/98/14/70/1054981470.db2.gz REEJIPSNEYMEHS-UHFFFAOYSA-N 2 1 308.469 4.318 20 0 DIADMP C[N@@H+](Cc1ccc2c(c1)C[NH2+]C2)Cc1ccc2ccccc2c1 ZINC001236183782 1054983500 /nfs/dbraw/zinc/98/35/00/1054983500.db2.gz ILSQUCHLIHAUMD-UHFFFAOYSA-N 2 1 302.421 4.075 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)Cc1cccc(C[NH3+])c1 ZINC001236190283 1054988855 /nfs/dbraw/zinc/98/88/55/1054988855.db2.gz SIVSKJVZNAVZAU-MRXNPFEDSA-N 2 1 304.437 4.492 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1Cc1cccc2c[nH+]cn21 ZINC001236192183 1054989636 /nfs/dbraw/zinc/98/96/36/1054989636.db2.gz GFEHSQXFHFWRBW-FQEVSTJZSA-N 2 1 316.408 4.153 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@@H+]1Cc1cccc2c[nH+]cn21 ZINC001236192183 1054989643 /nfs/dbraw/zinc/98/96/43/1054989643.db2.gz GFEHSQXFHFWRBW-FQEVSTJZSA-N 2 1 316.408 4.153 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3oc21)[C@@]1(C)CCC[NH2+]C1 ZINC001236207192 1054999386 /nfs/dbraw/zinc/99/93/86/1054999386.db2.gz NBKIZOLHMFSTSB-FQEVSTJZSA-N 2 1 308.425 4.160 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)[C@@]1(C)CCC[NH2+]C1 ZINC001236207192 1054999393 /nfs/dbraw/zinc/99/93/93/1054999393.db2.gz NBKIZOLHMFSTSB-FQEVSTJZSA-N 2 1 308.425 4.160 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001236214400 1055000873 /nfs/dbraw/zinc/00/08/73/1055000873.db2.gz DDGWYGUHRNNSCL-UHFFFAOYSA-N 2 1 322.496 4.240 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1cccs1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236216622 1055006889 /nfs/dbraw/zinc/00/68/89/1055006889.db2.gz KVQVCEBLKSODAJ-SJORKVTESA-N 2 1 300.471 4.117 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(Cl)cc(C)cc2Cl)CC1 ZINC001236215520 1055007377 /nfs/dbraw/zinc/00/73/77/1055007377.db2.gz OMUPRRXMSYDPNG-UHFFFAOYSA-N 2 1 315.288 4.264 20 0 DIADMP Cc1c(C[N@@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219384 1055009556 /nfs/dbraw/zinc/00/95/56/1055009556.db2.gz VOEHMPRZTZGJKZ-LEWJYISDSA-N 2 1 308.469 4.364 20 0 DIADMP Cc1c(C[N@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219384 1055009566 /nfs/dbraw/zinc/00/95/66/1055009566.db2.gz VOEHMPRZTZGJKZ-LEWJYISDSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222828 1055011783 /nfs/dbraw/zinc/01/17/83/1055011783.db2.gz LUOKZATWZRDJMN-MXVIHJGJSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236221820 1055013410 /nfs/dbraw/zinc/01/34/10/1055013410.db2.gz GQFOJZVMGXMKDA-WKILWMFISA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224663 1055014086 /nfs/dbraw/zinc/01/40/86/1055014086.db2.gz WHSXRIMEODUQTI-JOCQHMNTSA-N 2 1 318.408 4.000 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@@H+](C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236224941 1055015329 /nfs/dbraw/zinc/01/53/29/1055015329.db2.gz YZJNZWJPHJXCNQ-VDGAXYAQSA-N 2 1 302.506 4.190 20 0 DIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236224902 1055015738 /nfs/dbraw/zinc/01/57/38/1055015738.db2.gz YHUGDDWJEBFWOE-WGSAOQKQSA-N 2 1 324.468 4.064 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@@H+](C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236224938 1055015857 /nfs/dbraw/zinc/01/58/57/1055015857.db2.gz YZJNZWJPHJXCNQ-NSISKUIASA-N 2 1 302.506 4.190 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)C1(C)CC[NH2+]CC1 ZINC001236225708 1055016293 /nfs/dbraw/zinc/01/62/93/1055016293.db2.gz CTLMJMPOQWUKJB-UHFFFAOYSA-N 2 1 308.425 4.160 20 0 DIADMP C[N@@H+](Cc1ccc(C2CCCCC2)cc1)C1(C)CC[NH2+]CC1 ZINC001236228061 1055019586 /nfs/dbraw/zinc/01/95/86/1055019586.db2.gz PGSSCWNTBZZHDO-UHFFFAOYSA-N 2 1 300.490 4.308 20 0 DIADMP Cc1cc(C[N@H+](C)C2(C)CC[NH2+]CC2)ccc1Oc1ccccc1 ZINC001236228701 1055020304 /nfs/dbraw/zinc/02/03/04/1055020304.db2.gz XZZHJCZNWHXJTF-UHFFFAOYSA-N 2 1 324.468 4.361 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001236246090 1055029809 /nfs/dbraw/zinc/02/98/09/1055029809.db2.gz XRYSQJQDYLJEER-CQSZACIVSA-N 2 1 314.860 4.179 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(s1)C[NH2+]CC2 ZINC001236244504 1055029920 /nfs/dbraw/zinc/02/99/20/1055029920.db2.gz LIKGDYPLDHLMQM-LBPRGKRZSA-N 2 1 320.889 4.240 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(s1)C[NH2+]CC2 ZINC001236244504 1055029932 /nfs/dbraw/zinc/02/99/32/1055029932.db2.gz LIKGDYPLDHLMQM-LBPRGKRZSA-N 2 1 320.889 4.240 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1 ZINC001236285197 1055048354 /nfs/dbraw/zinc/04/83/54/1055048354.db2.gz CFEPJMRCDNLBOO-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP c1ccc(C[N@@H+](Cc2ccccc2C2CC2)C2CC[NH2+]CC2)cc1 ZINC001236300597 1055049069 /nfs/dbraw/zinc/04/90/69/1055049069.db2.gz UTDAIMXZLQYJBN-UHFFFAOYSA-N 2 1 320.480 4.318 20 0 DIADMP c1ccc(C[N@@H+](Cc2ccc(C3CC3)cc2)C2CC[NH2+]CC2)cc1 ZINC001236300445 1055049264 /nfs/dbraw/zinc/04/92/64/1055049264.db2.gz CFTCIBZPUKRIFT-UHFFFAOYSA-N 2 1 320.480 4.318 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCCC[NH2+]1)Cc1cccc(C(F)(F)F)c1 ZINC001236288448 1055049451 /nfs/dbraw/zinc/04/94/51/1055049451.db2.gz ZKOBSAAOUGVWGU-INIZCTEOSA-N 2 1 314.395 4.060 20 0 DIADMP Clc1ccc(C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1 ZINC001236286501 1055049529 /nfs/dbraw/zinc/04/95/29/1055049529.db2.gz LNXQZUZJBUIJQE-UHFFFAOYSA-N 2 1 314.860 4.094 20 0 DIADMP Clc1ccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1 ZINC001236286501 1055049542 /nfs/dbraw/zinc/04/95/42/1055049542.db2.gz LNXQZUZJBUIJQE-UHFFFAOYSA-N 2 1 314.860 4.094 20 0 DIADMP CC[N@@H+](CC[C@H]1CCCC[NH2+]1)Cc1cccc(C(F)(F)F)c1 ZINC001236288450 1055049734 /nfs/dbraw/zinc/04/97/34/1055049734.db2.gz ZKOBSAAOUGVWGU-MRXNPFEDSA-N 2 1 314.395 4.060 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1C ZINC001236287320 1055049805 /nfs/dbraw/zinc/04/98/05/1055049805.db2.gz RCGGJNYKEIUHHB-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236299635 1055050276 /nfs/dbraw/zinc/05/02/76/1055050276.db2.gz HHJGXOQRYFCWHN-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP C[C@H](C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1)c1ccccc1 ZINC001236288198 1055051078 /nfs/dbraw/zinc/05/10/78/1055051078.db2.gz XNDJXPYDWGPJBV-GOSISDBHSA-N 2 1 308.469 4.044 20 0 DIADMP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc2ccccc2n1 ZINC000183953045 1055061860 /nfs/dbraw/zinc/06/18/60/1055061860.db2.gz ZWZAAMAHLZGZPS-MRXNPFEDSA-N 2 1 311.473 4.007 20 0 DIADMP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1cnc2ccsc2c1 ZINC000183948878 1055063129 /nfs/dbraw/zinc/06/31/29/1055063129.db2.gz PIWAOJKMFYMBJM-CQSZACIVSA-N 2 1 317.502 4.069 20 0 DIADMP CC/C=C\CCCCCC[N@@H+]1CC[C@@H]([NH3+])[C@@H](C(F)(F)F)C1 ZINC001236361746 1055072549 /nfs/dbraw/zinc/07/25/49/1055072549.db2.gz SJIJRBTUVRXRMA-VUBDOFJKSA-N 2 1 306.416 4.115 20 0 DIADMP CC/C=C\CCCCCC[N@H+]1CC[C@@H]([NH3+])[C@@H](C(F)(F)F)C1 ZINC001236361746 1055072561 /nfs/dbraw/zinc/07/25/61/1055072561.db2.gz SJIJRBTUVRXRMA-VUBDOFJKSA-N 2 1 306.416 4.115 20 0 DIADMP CC/C=C\CCCCCC[N@@H+]1CC[C@H]([NH3+])[C@@H](C(F)(F)F)C1 ZINC001236361733 1055072812 /nfs/dbraw/zinc/07/28/12/1055072812.db2.gz SJIJRBTUVRXRMA-CGXNLCPXSA-N 2 1 306.416 4.115 20 0 DIADMP CC/C=C\CCCCCC[N@H+]1CC[C@H]([NH3+])[C@@H](C(F)(F)F)C1 ZINC001236361733 1055072825 /nfs/dbraw/zinc/07/28/25/1055072825.db2.gz SJIJRBTUVRXRMA-CGXNLCPXSA-N 2 1 306.416 4.115 20 0 DIADMP CC/C=C\CCC[N@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001236368980 1055076440 /nfs/dbraw/zinc/07/64/40/1055076440.db2.gz XEVXRSDYFCPNJS-ARJAWSKDSA-N 2 1 304.453 4.126 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001236368980 1055076452 /nfs/dbraw/zinc/07/64/52/1055076452.db2.gz XEVXRSDYFCPNJS-ARJAWSKDSA-N 2 1 304.453 4.126 20 0 DIADMP Cc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(C)s1 ZINC001236373695 1055078698 /nfs/dbraw/zinc/07/86/98/1055078698.db2.gz JLKXPHJNVHVMTJ-MRXNPFEDSA-N 2 1 306.519 4.109 20 0 DIADMP FC1(F)CCC(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)CC1 ZINC001236371268 1055079839 /nfs/dbraw/zinc/07/98/39/1055079839.db2.gz JJTWLEBZGGNTSI-MRXNPFEDSA-N 2 1 314.464 4.056 20 0 DIADMP Cc1c(F)cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1F ZINC001236375376 1055083181 /nfs/dbraw/zinc/08/31/81/1055083181.db2.gz JTQJOISHDNMZNI-OAHLLOKOSA-N 2 1 322.443 4.017 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1Cl ZINC001236375850 1055083457 /nfs/dbraw/zinc/08/34/57/1055083457.db2.gz MTOGSWJAXGJWTA-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1ccc(Cl)cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374861 1055083864 /nfs/dbraw/zinc/08/38/64/1055083864.db2.gz FWMLOPAQHWWQQO-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP Fc1ccc(C[N@@H+](CCC2CCCC2)CC2CC[NH2+]CC2)cc1 ZINC001236381836 1055087187 /nfs/dbraw/zinc/08/71/87/1055087187.db2.gz NIRCUICNYNSHEO-UHFFFAOYSA-N 2 1 318.480 4.208 20 0 DIADMP CC(C)CSCCC[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185672770 1055095959 /nfs/dbraw/zinc/09/59/59/1055095959.db2.gz AZDJCKJOBYUJRC-DLBZAZTESA-N 2 1 312.567 4.008 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccc(C)cc2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236408034 1055098857 /nfs/dbraw/zinc/09/88/57/1055098857.db2.gz KCKATPMZNIDTQO-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@H]1CC[NH2+]C1 ZINC001236408838 1055100641 /nfs/dbraw/zinc/10/06/41/1055100641.db2.gz OXMIHWONVUWEDR-INIZCTEOSA-N 2 1 308.425 4.017 20 0 DIADMP CC[N@H+](Cc1ccc(C2CCCCC2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236412107 1055102543 /nfs/dbraw/zinc/10/25/43/1055102543.db2.gz QVKLFHZNWFOZDZ-SFHVURJKSA-N 2 1 300.490 4.166 20 0 DIADMP C[NH+](C)Cc1cccc(-c2ccc3[nH]c4cc[nH+]cc4c3c2)c1 ZINC001236425841 1055109143 /nfs/dbraw/zinc/10/91/43/1055109143.db2.gz JKJJSDYYFBDYBA-UHFFFAOYSA-N 2 1 301.393 4.445 20 0 DIADMP CCOC(=[NH2+])c1cccc(-c2ccc(C[NH2+]CC(C)C)cc2)c1 ZINC001236437418 1055113367 /nfs/dbraw/zinc/11/33/67/1055113367.db2.gz YKQYJWUOHGDCEU-UHFFFAOYSA-N 2 1 310.441 4.461 20 0 DIADMP CC/C=C\CCCCC[N@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001236446595 1055118157 /nfs/dbraw/zinc/11/81/57/1055118157.db2.gz CSDYMAIRIURHAP-ARJAWSKDSA-N 2 1 315.505 4.162 20 0 DIADMP CC/C=C\CCCCC[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001236446595 1055118163 /nfs/dbraw/zinc/11/81/63/1055118163.db2.gz CSDYMAIRIURHAP-ARJAWSKDSA-N 2 1 315.505 4.162 20 0 DIADMP Clc1ccccc1C[N@@H+](CC1CCCC1)C1CC[NH2+]CC1 ZINC001236450213 1055119492 /nfs/dbraw/zinc/11/94/92/1055119492.db2.gz FDWLNPDWDQEGLW-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(F)c(Cl)c1)C1CC[NH2+]CC1 ZINC001236457029 1055124042 /nfs/dbraw/zinc/12/40/42/1055124042.db2.gz JCFBUEGAVONADV-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236457734 1055125519 /nfs/dbraw/zinc/12/55/19/1055125519.db2.gz PVLXHDRAVYYYPI-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc2occc2c1)C1CC[NH2+]CC1 ZINC001236458219 1055127512 /nfs/dbraw/zinc/12/75/12/1055127512.db2.gz TUOUPEGJMFHKOT-UHFFFAOYSA-N 2 1 300.446 4.033 20 0 DIADMP CC(C)[N@H+](Cc1cccc(-c2ccsc2)c1)[C@@H]1CCC[NH2+]C1 ZINC001236469291 1055129655 /nfs/dbraw/zinc/12/96/55/1055129655.db2.gz WEKMEIJLXCBFBT-LJQANCHMSA-N 2 1 314.498 4.378 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(-c2ccsc2)c1)[C@@H]1CCC[NH2+]C1 ZINC001236469291 1055129663 /nfs/dbraw/zinc/12/96/63/1055129663.db2.gz WEKMEIJLXCBFBT-LJQANCHMSA-N 2 1 314.498 4.378 20 0 DIADMP C[NH2+]Cc1ccc(C2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001236474537 1055133838 /nfs/dbraw/zinc/13/38/38/1055133838.db2.gz KVKRWXHRTGGGQA-YADHBBJMSA-N 2 1 318.464 4.226 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380898078 1055134105 /nfs/dbraw/zinc/13/41/05/1055134105.db2.gz DNPLEMLHKAULLZ-MOPGFXCFSA-N 2 1 300.490 4.067 20 0 DIADMP COc1ccc(C[N@H+](CC(C)C)[C@@H]2CCC[NH2+]C2)cc1C(C)C ZINC001236477787 1055136851 /nfs/dbraw/zinc/13/68/51/1055136851.db2.gz MTIGTZZGJGZUBD-GOSISDBHSA-N 2 1 318.505 4.029 20 0 DIADMP COc1ccc(C[N@@H+](CC(C)C)[C@@H]2CCC[NH2+]C2)cc1C(C)C ZINC001236477787 1055136854 /nfs/dbraw/zinc/13/68/54/1055136854.db2.gz MTIGTZZGJGZUBD-GOSISDBHSA-N 2 1 318.505 4.029 20 0 DIADMP Fc1ccc(C[N@H+](CC2CCCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236505616 1055151110 /nfs/dbraw/zinc/15/11/10/1055151110.db2.gz VXAXZRFKKQKENF-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP Fc1ccc(C[N@@H+](CC2CCCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236505616 1055151119 /nfs/dbraw/zinc/15/11/19/1055151119.db2.gz VXAXZRFKKQKENF-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1F ZINC001236541907 1055170313 /nfs/dbraw/zinc/17/03/13/1055170313.db2.gz OKIMYARSTZIZIC-IYARVYRRSA-N 2 1 304.453 4.006 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3ccccc3n2)CC2CCC2)CC1 ZINC001236541939 1055170407 /nfs/dbraw/zinc/17/04/07/1055170407.db2.gz QECMUGXSHUOTHT-KESTWPANSA-N 2 1 323.484 4.107 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236542099 1055170805 /nfs/dbraw/zinc/17/08/05/1055170805.db2.gz WYRCUQLDXIZGMJ-QAQDUYKDSA-N 2 1 322.443 4.145 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Cl)c(F)c2)CC2CCC2)CC1 ZINC001236540753 1055171016 /nfs/dbraw/zinc/17/10/16/1055171016.db2.gz AWINNMKTLAUHRB-WKILWMFISA-N 2 1 324.871 4.351 20 0 DIADMP CSc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236541630 1055171194 /nfs/dbraw/zinc/17/11/94/1055171194.db2.gz NSZNSFXFPUWIPA-IYARVYRRSA-N 2 1 318.530 4.281 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236542574 1055172457 /nfs/dbraw/zinc/17/24/57/1055172457.db2.gz YSCMMWOSXGSXSG-SNRMKQJTSA-N 2 1 318.505 4.454 20 0 DIADMP Cc1ccc([C@H](C)CC[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236542572 1055173327 /nfs/dbraw/zinc/17/33/27/1055173327.db2.gz YSCMMWOSXGSXSG-ATZDWAIDSA-N 2 1 318.505 4.454 20 0 DIADMP CC(C)C[N@@H+](Cc1cc2ccccc2o1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550822 1055178233 /nfs/dbraw/zinc/17/82/33/1055178233.db2.gz MZVZECMCZYIDRO-QAQDUYKDSA-N 2 1 300.446 4.161 20 0 DIADMP CSc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236550669 1055178255 /nfs/dbraw/zinc/17/82/55/1055178255.db2.gz LPNCCHHEMOCKMS-QAQDUYKDSA-N 2 1 306.519 4.136 20 0 DIADMP CC(C)C[N@@H+](Cc1cc(F)ccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551607 1055179276 /nfs/dbraw/zinc/17/92/76/1055179276.db2.gz RWGFUKKRJPQLGR-WKILWMFISA-N 2 1 312.860 4.207 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc(O)cc3ccccc32)CC2CC2)CC1 ZINC001236552153 1055179328 /nfs/dbraw/zinc/17/93/28/1055179328.db2.gz RZYUSNFVYCGXID-WGSAOQKQSA-N 2 1 324.468 4.027 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3ccccc3c2)CC2CC2)CC1 ZINC001236552188 1055179379 /nfs/dbraw/zinc/17/93/79/1055179379.db2.gz ODUMYUUVHHBAND-MEMLXQNLSA-N 2 1 308.469 4.322 20 0 DIADMP CC(C)C[N@@H+](Cc1cccc2ncsc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552619 1055179423 /nfs/dbraw/zinc/17/94/23/1055179423.db2.gz UBTDLFXDEHSCKR-WKILWMFISA-N 2 1 317.502 4.024 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(C(F)F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551880 1055179845 /nfs/dbraw/zinc/17/98/45/1055179845.db2.gz NIIDJBVPKJAMOS-QAQDUYKDSA-N 2 1 310.432 4.352 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)c1 ZINC001236552075 1055180291 /nfs/dbraw/zinc/18/02/91/1055180291.db2.gz GDMRIBJJKUWYRW-QAQDUYKDSA-N 2 1 306.881 4.130 20 0 DIADMP Cc1cccc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236554689 1055181046 /nfs/dbraw/zinc/18/10/46/1055181046.db2.gz QLHLRKRFGLTTFX-QAQDUYKDSA-N 2 1 308.897 4.376 20 0 DIADMP Cc1cccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236553402 1055181119 /nfs/dbraw/zinc/18/11/19/1055181119.db2.gz ZPIFLFZGLSVVOQ-QAQDUYKDSA-N 2 1 306.881 4.130 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554548 1055181594 /nfs/dbraw/zinc/18/15/94/1055181594.db2.gz KKRDSSGMSOIFAC-QAQDUYKDSA-N 2 1 308.897 4.376 20 0 DIADMP Cc1cc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)nc1C ZINC001236554795 1055181661 /nfs/dbraw/zinc/18/16/61/1055181661.db2.gz VZOLRDFBWYQHPV-QAQDUYKDSA-N 2 1 323.912 4.080 20 0 DIADMP Cc1ccnc2cccc(C[N@@H+](CC3CC3)[C@H]3CC[C@H]([NH3+])CC3)c12 ZINC001236553096 1055181862 /nfs/dbraw/zinc/18/18/62/1055181862.db2.gz WVAQYVJLBCSWKD-WGSAOQKQSA-N 2 1 323.484 4.025 20 0 DIADMP CC(C)C[N@@H+](Cc1c2ccoc2ccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554546 1055182077 /nfs/dbraw/zinc/18/20/77/1055182077.db2.gz KDQGKWRCXJRQTQ-SHTZXODSSA-N 2 1 318.436 4.300 20 0 DIADMP COc1ccccc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236565493 1055185970 /nfs/dbraw/zinc/18/59/70/1055185970.db2.gz IBHBRJISNLQHDP-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236566142 1055186298 /nfs/dbraw/zinc/18/62/98/1055186298.db2.gz CUHVWFWMZMNUSN-KESTWPANSA-N 2 1 300.490 4.318 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)s1 ZINC001236566151 1055186441 /nfs/dbraw/zinc/18/64/41/1055186441.db2.gz CVAPBUOTVMNOIR-SAABIXHNSA-N 2 1 306.519 4.379 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3ncccc3c2)C2CCCC2)CC1 ZINC001236567760 1055188100 /nfs/dbraw/zinc/18/81/00/1055188100.db2.gz ZRYKYZKIQSTZGG-KESTWPANSA-N 2 1 323.484 4.249 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(Cl)n2)C2CCCCC2)CC1 ZINC001236568003 1055188204 /nfs/dbraw/zinc/18/82/04/1055188204.db2.gz UGRHOYGNFQGUHV-CZIWCDLHSA-N 2 1 321.896 4.140 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)s2)C2CCCC2)CC1 ZINC001236566499 1055188374 /nfs/dbraw/zinc/18/83/74/1055188374.db2.gz JIFVIHCPSWEUBN-MQMHXKEQSA-N 2 1 312.910 4.416 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(Cl)ccn2)C2CCCCC2)CC1 ZINC001236567492 1055188532 /nfs/dbraw/zinc/18/85/32/1055188532.db2.gz NLCXOLCQFHGDRB-RZDIXWSQSA-N 2 1 321.896 4.140 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cnc3ccccc3c2)C2CCCC2)CC1 ZINC001236566525 1055188544 /nfs/dbraw/zinc/18/85/44/1055188544.db2.gz KCDOOHCRZXFXST-KESTWPANSA-N 2 1 323.484 4.249 20 0 DIADMP CCc1ccccc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572141 1055192880 /nfs/dbraw/zinc/19/28/80/1055192880.db2.gz SYBRAQVLKXWJSG-KESTWPANSA-N 2 1 300.490 4.264 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(F)cc(Cl)c2)C2CCC2)CC1 ZINC001236572527 1055193191 /nfs/dbraw/zinc/19/31/91/1055193191.db2.gz OEEZVWRXZRQYDO-JCNLHEQBSA-N 2 1 310.844 4.104 20 0 DIADMP Cc1cccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236571708 1055193318 /nfs/dbraw/zinc/19/33/18/1055193318.db2.gz AOUXVZGBYWFIPD-JCNLHEQBSA-N 2 1 306.881 4.273 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236572399 1055193532 /nfs/dbraw/zinc/19/35/32/1055193532.db2.gz XIGYZKVQNQBSCE-JCNLHEQBSA-N 2 1 322.443 4.288 20 0 DIADMP Cc1cccc(F)c1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571839 1055193595 /nfs/dbraw/zinc/19/35/95/1055193595.db2.gz LHODMYLTAULVDF-JCNLHEQBSA-N 2 1 304.453 4.149 20 0 DIADMP CSc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236571908 1055193708 /nfs/dbraw/zinc/19/37/08/1055193708.db2.gz JQIKZXCQBKMHFV-JCNLHEQBSA-N 2 1 304.503 4.033 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236572610 1055195265 /nfs/dbraw/zinc/19/52/65/1055195265.db2.gz TXCSTYKFQKTYID-ZVZYQTTQSA-N 2 1 304.478 4.206 20 0 DIADMP Cc1cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc(C)c1F ZINC001236573471 1055195325 /nfs/dbraw/zinc/19/53/25/1055195325.db2.gz YIJOMNVODCDYCM-SAABIXHNSA-N 2 1 304.453 4.067 20 0 DIADMP CC(C)(C)c1cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)ccn1 ZINC001236572986 1055195362 /nfs/dbraw/zinc/19/53/62/1055195362.db2.gz RYAOJVVLKISKPR-SAABIXHNSA-N 2 1 315.505 4.004 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccc(Cl)cc2)C2CCC2)CC1 ZINC001236572945 1055195545 /nfs/dbraw/zinc/19/55/45/1055195545.db2.gz XKCWDVZLVNWIIE-SAABIXHNSA-N 2 1 306.881 4.007 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)n1 ZINC001236574374 1055195652 /nfs/dbraw/zinc/19/56/52/1055195652.db2.gz OCJZEPDIGBZNTG-RZDIXWSQSA-N 2 1 321.896 4.058 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)c(C3CC3)c2)C2CCC2)CC1 ZINC001236577700 1055197127 /nfs/dbraw/zinc/19/71/27/1055197127.db2.gz ZJBYJYXMADYTFZ-SAABIXHNSA-N 2 1 316.464 4.328 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236599574 1055201534 /nfs/dbraw/zinc/20/15/34/1055201534.db2.gz STEYTFRPLXGKAU-OAHLLOKOSA-N 2 1 314.498 4.174 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001236603681 1055204824 /nfs/dbraw/zinc/20/48/24/1055204824.db2.gz CHTOGMQSMJGDBW-IBGZPJMESA-N 2 1 314.860 4.178 20 0 DIADMP CC[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccsc1 ZINC000382192136 1055206076 /nfs/dbraw/zinc/20/60/76/1055206076.db2.gz ZDCFSWKHAOIYMS-SFHVURJKSA-N 2 1 302.487 4.311 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001236636609 1055208431 /nfs/dbraw/zinc/20/84/31/1055208431.db2.gz GETDBOVRGPKXTI-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP c1cc2c(cccc2C[N@@H+](C2CCC2)C2CC[NH2+]CC2)s1 ZINC001236637523 1055209814 /nfs/dbraw/zinc/20/98/14/1055209814.db2.gz RAYFJMJNENTHPL-UHFFFAOYSA-N 2 1 300.471 4.008 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236681124 1055227161 /nfs/dbraw/zinc/22/71/61/1055227161.db2.gz BLVYFNWAAOHOJO-MEMLXQNLSA-N 2 1 308.469 4.267 20 0 DIADMP Cc1ccsc1C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236681127 1055228715 /nfs/dbraw/zinc/22/87/15/1055228715.db2.gz BPIPDJRPRWLXKG-IYARVYRRSA-N 2 1 314.498 4.329 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236701339 1055231769 /nfs/dbraw/zinc/23/17/69/1055231769.db2.gz QNKRHXJEGUKGEB-OJTDBYKOSA-N 2 1 316.489 4.123 20 0 DIADMP CS[C@H](C)CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236714240 1055236361 /nfs/dbraw/zinc/23/63/61/1055236361.db2.gz KYIUHJQLGHKCIQ-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236741731 1055248416 /nfs/dbraw/zinc/24/84/16/1055248416.db2.gz JEXMQSUGRQUNDN-SNRMKQJTSA-N 2 1 306.469 4.334 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)C[C@@H]2CC=CCC2)CC1 ZINC001236755856 1055250834 /nfs/dbraw/zinc/25/08/34/1055250834.db2.gz RIXFIWNBVIUQQV-MISYRCLQSA-N 2 1 304.522 4.495 20 0 DIADMP CC(C)(C)C[N@@H+](CC1Cc2ccccc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767433 1055251012 /nfs/dbraw/zinc/25/10/12/1055251012.db2.gz IILZLQZLBMIGGA-MXVIHJGJSA-N 2 1 314.517 4.019 20 0 DIADMP Cc1cc(O)cc(C)c1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767560 1055251414 /nfs/dbraw/zinc/25/14/14/1055251414.db2.gz NSQMLYCJBQGWQQ-QAQDUYKDSA-N 2 1 318.505 4.127 20 0 DIADMP Cc1scnc1C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236758878 1055252003 /nfs/dbraw/zinc/25/20/03/1055252003.db2.gz NMYANQBZZZIEDM-QAQDUYKDSA-N 2 1 321.534 4.104 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cccs2)CC2CCCCC2)CC1 ZINC001236755224 1055252095 /nfs/dbraw/zinc/25/20/95/1055252095.db2.gz MJDUNBQSSHNWHL-IYARVYRRSA-N 2 1 320.546 4.443 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(O)c2)CC2CCCCC2)CC1 ZINC001236755165 1055252733 /nfs/dbraw/zinc/25/27/33/1055252733.db2.gz LBQOKZWHSIWMCP-WGSAOQKQSA-N 2 1 316.489 4.044 20 0 DIADMP Cc1cccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1C ZINC001236765853 1055252820 /nfs/dbraw/zinc/25/28/20/1055252820.db2.gz BIDAFJCRQBESEB-WGSAOQKQSA-N 2 1 302.506 4.421 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768870 1055253853 /nfs/dbraw/zinc/25/38/53/1055253853.db2.gz YGKRVBFBKCNBSQ-IYARVYRRSA-N 2 1 302.506 4.421 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(C)c(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781175 1055255591 /nfs/dbraw/zinc/25/55/91/1055255591.db2.gz BOOMVXBIWCWIQD-SAABIXHNSA-N 2 1 306.469 4.395 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1 ZINC001236768989 1055255882 /nfs/dbraw/zinc/25/58/82/1055255882.db2.gz YXQUXVLPONFMEP-QAQDUYKDSA-N 2 1 306.469 4.252 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2OC=CC2=S)CC2CCCCC2)CC1 ZINC001236768356 1055256011 /nfs/dbraw/zinc/25/60/11/1055256011.db2.gz NDNFQDRXMOBFJY-WKILWMFISA-N 2 1 322.518 4.221 20 0 DIADMP CCC(CC)[N@@H+](CCC[NH2+]C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782921 1055257452 /nfs/dbraw/zinc/25/74/52/1055257452.db2.gz MNXARGIIFQSGSE-IRJFHVNHSA-N 3 1 323.569 4.059 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc2c1CCC2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783342 1055257872 /nfs/dbraw/zinc/25/78/72/1055257872.db2.gz SSUNGLHNBXXTMG-WGSAOQKQSA-N 2 1 314.517 4.293 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(COC)s1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782094 1055259102 /nfs/dbraw/zinc/25/91/02/1055259102.db2.gz MHJBVHIDHUKCTR-KOMQPUFPSA-N 2 1 324.534 4.155 20 0 DIADMP CCC(CC)[N@@H+](Cc1c(C)cccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236791695 1055261253 /nfs/dbraw/zinc/26/12/53/1055261253.db2.gz ZLBJAKQHWKBHAU-SAABIXHNSA-N 2 1 318.505 4.264 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)c2ccccc21 ZINC000383287357 1055262876 /nfs/dbraw/zinc/26/28/76/1055262876.db2.gz MGYUYAQOQFQTQF-HTAPYJJXSA-N 2 1 320.480 4.489 20 0 DIADMP CCC(CC)[N@@H+](Cc1cncc(C2CC2)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236798322 1055267133 /nfs/dbraw/zinc/26/71/33/1055267133.db2.gz KGHREUBUNAQNBF-KESTWPANSA-N 2 1 315.505 4.220 20 0 DIADMP CCC[N@H+](Cc1ccccc1Oc1ccccc1)C[C@H]1CC[NH2+]C1 ZINC001236835683 1055283421 /nfs/dbraw/zinc/28/34/21/1055283421.db2.gz OWXQBAXTXNPLHY-SFHVURJKSA-N 2 1 324.468 4.300 20 0 DIADMP CCC[N@@H+](C[C@@H](C)c1cccc2ccccc21)C[C@H]1CC[NH2+]C1 ZINC001236832303 1055283893 /nfs/dbraw/zinc/28/38/93/1055283893.db2.gz UEKSPROTILDXRL-MSOLQXFVSA-N 2 1 310.485 4.265 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](CCC)C[C@@H]2CC[NH2+]C2)cc1 ZINC001236834922 1055284373 /nfs/dbraw/zinc/28/43/73/1055284373.db2.gz KPUKDLVFZDWHNH-LJQANCHMSA-N 2 1 318.505 4.077 20 0 DIADMP CCC[N@@H+](C[C@H](C)c1cccc2ccccc21)C[C@@H]1CC[NH2+]C1 ZINC001236832306 1055284770 /nfs/dbraw/zinc/28/47/70/1055284770.db2.gz UEKSPROTILDXRL-ZWKOTPCHSA-N 2 1 310.485 4.265 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236902867 1055306716 /nfs/dbraw/zinc/30/67/16/1055306716.db2.gz JPQUIOMWNBRASJ-OKILXGFUSA-N 2 1 303.837 4.289 20 0 DIADMP CC[C@H]1CCCC[N@H+]1Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236911236 1055311553 /nfs/dbraw/zinc/31/15/53/1055311553.db2.gz WDHCHRSQZFJXAJ-HNNXBMFYSA-N 2 1 303.837 4.290 20 0 DIADMP Clc1cc(C[N@H+]2CCCCC23CC3)ccc1-n1ccnc1 ZINC001236911084 1055312232 /nfs/dbraw/zinc/31/22/32/1055312232.db2.gz IAJXVCWJSKCEBB-UHFFFAOYSA-N 2 1 301.821 4.044 20 0 DIADMP c1ccc(CC[C@@H]2CCC[N@@H+](Cc3ccc4c(c3)C[NH2+]C4)C2)cc1 ZINC001236948437 1055316730 /nfs/dbraw/zinc/31/67/30/1055316730.db2.gz DZJDKYVAYJNBCI-IBGZPJMESA-N 2 1 320.480 4.135 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001237059205 1055354087 /nfs/dbraw/zinc/35/40/87/1055354087.db2.gz RQMCIHPCMXVEED-HXUWFJFHSA-N 2 1 312.432 4.054 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001237057390 1055355277 /nfs/dbraw/zinc/35/52/77/1055355277.db2.gz LUSRIRBSHJACOC-GOSISDBHSA-N 2 1 318.848 4.161 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001237082290 1055363105 /nfs/dbraw/zinc/36/31/05/1055363105.db2.gz OSWGOQLYKQLDAN-HXUWFJFHSA-N 2 1 312.432 4.054 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1-c1ccccc1 ZINC001237081545 1055363937 /nfs/dbraw/zinc/36/39/37/1055363937.db2.gz KJTNTXSGKNFVIQ-XGSMCBPESA-N 2 1 306.453 4.055 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccsc1 ZINC000765451663 1055395551 /nfs/dbraw/zinc/39/55/51/1055395551.db2.gz CVTCUYGNJPZMFD-OAHLLOKOSA-N 2 1 306.519 4.443 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237388190 1055444104 /nfs/dbraw/zinc/44/41/04/1055444104.db2.gz CMFUIFCNOVLZDV-XLIONFOSSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237388190 1055444113 /nfs/dbraw/zinc/44/41/13/1055444113.db2.gz CMFUIFCNOVLZDV-XLIONFOSSA-N 2 1 322.452 4.053 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@H]2[NH2+]CCC[C@H]2C1)c1cccc2ccccc21 ZINC001237380726 1055444498 /nfs/dbraw/zinc/44/44/98/1055444498.db2.gz HCVANNYESFRZEB-MMOPVJDHSA-N 2 1 308.469 4.017 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)s2)c1 ZINC001237389373 1055446145 /nfs/dbraw/zinc/44/61/45/1055446145.db2.gz FZUJQXGAQAWRLD-DZGCQCFKSA-N 2 1 318.511 4.051 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)s2)c1 ZINC001237389373 1055446149 /nfs/dbraw/zinc/44/61/49/1055446149.db2.gz FZUJQXGAQAWRLD-DZGCQCFKSA-N 2 1 318.511 4.051 20 0 DIADMP c1cc(-c2csc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)c2)cs1 ZINC001237410692 1055450523 /nfs/dbraw/zinc/45/05/23/1055450523.db2.gz CTTVDRYXLDHBTA-SUMWQHHRSA-N 2 1 318.511 4.051 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)c2)cs1 ZINC001237410692 1055450527 /nfs/dbraw/zinc/45/05/27/1055450527.db2.gz CTTVDRYXLDHBTA-SUMWQHHRSA-N 2 1 318.511 4.051 20 0 DIADMP Cc1c(C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)cccc1-c1ccccc1 ZINC001237585959 1055480871 /nfs/dbraw/zinc/48/08/71/1055480871.db2.gz SNMZUVQTZSQMDM-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP CSCc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC001620868434 1055496553 /nfs/dbraw/zinc/49/65/53/1055496553.db2.gz CPJYDPXBPXBVTJ-IBGZPJMESA-N 2 1 320.546 4.007 20 0 DIADMP CCc1cccc2cc(C[NH2+]CC3(C[NH+](C)C)CCCC3)oc21 ZINC001620896300 1055522065 /nfs/dbraw/zinc/52/20/65/1055522065.db2.gz HYKDSGUJLWYCPO-UHFFFAOYSA-N 2 1 314.473 4.207 20 0 DIADMP C[C@@H]1C[N@H+](CCC[NH2+][C@H]2CCC[C@@H](C(C)(C)C)CC2)CCCO1 ZINC001620899761 1055525373 /nfs/dbraw/zinc/52/53/73/1055525373.db2.gz NJIDZIJYFSMHSN-QRVBRYPASA-N 2 1 324.553 4.072 20 0 DIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@H]2CCC[C@@H](C(C)(C)C)CC2)CCCO1 ZINC001620899761 1055525390 /nfs/dbraw/zinc/52/53/90/1055525390.db2.gz NJIDZIJYFSMHSN-QRVBRYPASA-N 2 1 324.553 4.072 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+](C)Cc3ccccc3)cc21 ZINC001237880623 1055548365 /nfs/dbraw/zinc/54/83/65/1055548365.db2.gz HPIBAFZGXJEYNR-UHFFFAOYSA-N 2 1 306.453 4.320 20 0 DIADMP CC[N@@H+](Cc1ccncc1)Cc1ccc2c(c1)C(C(C)C)=[NH+]CC2 ZINC001237881902 1055549602 /nfs/dbraw/zinc/54/96/02/1055549602.db2.gz ZSTKBSWFJBHNEG-UHFFFAOYSA-N 2 1 321.468 4.105 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CC[C@@H](C(F)(F)F)C3)cc21 ZINC001237885563 1055551343 /nfs/dbraw/zinc/55/13/43/1055551343.db2.gz IIRGSOMVWGOKGG-OAHLLOKOSA-N 2 1 324.390 4.072 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CC[C@@H](C(F)(F)F)C3)cc21 ZINC001237885563 1055551355 /nfs/dbraw/zinc/55/13/55/1055551355.db2.gz IIRGSOMVWGOKGG-OAHLLOKOSA-N 2 1 324.390 4.072 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CC3=CCCCC3)CC23CC3)cc1 ZINC001620953182 1055572328 /nfs/dbraw/zinc/57/23/28/1055572328.db2.gz AGOTYHYAIIIEKM-FQEVSTJZSA-N 2 1 310.485 4.274 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CC3=CCCCC3)CC23CC3)cc1 ZINC001620953182 1055572343 /nfs/dbraw/zinc/57/23/43/1055572343.db2.gz AGOTYHYAIIIEKM-FQEVSTJZSA-N 2 1 310.485 4.274 20 0 DIADMP CC[C@H]1CC[C@H](C)[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001168569628 1055652736 /nfs/dbraw/zinc/65/27/36/1055652736.db2.gz HIGKSLWAJZFRHZ-PXNSSMCTSA-N 2 1 300.490 4.435 20 0 DIADMP CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001168569633 1055652894 /nfs/dbraw/zinc/65/28/94/1055652894.db2.gz HIGKSLWAJZFRHZ-YLJYHZDGSA-N 2 1 300.490 4.435 20 0 DIADMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547973 1055683309 /nfs/dbraw/zinc/68/33/09/1055683309.db2.gz GJDRKLRFTCPTMD-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547973 1055683315 /nfs/dbraw/zinc/68/33/15/1055683315.db2.gz GJDRKLRFTCPTMD-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547973 1055683317 /nfs/dbraw/zinc/68/33/17/1055683317.db2.gz GJDRKLRFTCPTMD-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547973 1055683320 /nfs/dbraw/zinc/68/33/20/1055683320.db2.gz GJDRKLRFTCPTMD-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCCC2(CC[NH+](CCOC)CC2)C1 ZINC001278273065 1055737168 /nfs/dbraw/zinc/73/71/68/1055737168.db2.gz SQMJUIUAXPOKDV-LJQANCHMSA-N 2 1 324.553 4.027 20 0 DIADMP C[C@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1)CC(F)F ZINC001620982845 1055933887 /nfs/dbraw/zinc/93/38/87/1055933887.db2.gz HYKIXLBIZYHQJV-HNNXBMFYSA-N 2 1 312.448 4.026 20 0 DIADMP Cc1occc1C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000671743639 1055936997 /nfs/dbraw/zinc/93/69/97/1055936997.db2.gz DRSXIICMSXBZMW-UHFFFAOYSA-N 2 1 312.457 4.121 20 0 DIADMP FC1(F)CCC([NH2+]C[C@H]2CCC[N@H+]2CC2CCCCC2)CC1 ZINC001620770557 1055939631 /nfs/dbraw/zinc/93/96/31/1055939631.db2.gz VRFQGAFDNMILDX-QGZVFWFLSA-N 2 1 314.464 4.199 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC001620791154 1055967698 /nfs/dbraw/zinc/96/76/98/1055967698.db2.gz AHKSNKSBHLHXEB-HOJAQTOUSA-N 2 1 314.517 4.280 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC001620791154 1055967705 /nfs/dbraw/zinc/96/77/05/1055967705.db2.gz AHKSNKSBHLHXEB-HOJAQTOUSA-N 2 1 314.517 4.280 20 0 DIADMP COCCC1(C[NH2+]C[C@@H](C2CCCCC2)[NH+](C)C)CCCCC1 ZINC001620724171 1055986687 /nfs/dbraw/zinc/98/66/87/1055986687.db2.gz LKCCLSIWTPZXMI-IBGZPJMESA-N 2 1 324.553 4.074 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)CSC(C)(C)C)c1 ZINC000765775042 1055994147 /nfs/dbraw/zinc/99/41/47/1055994147.db2.gz JKJPYYSFMQYMLL-HNNXBMFYSA-N 2 1 308.535 4.148 20 0 DIADMP Cc1[nH+]c2ccc(N[C@H]3CCCC[C@@H]3[NH+](C)C)cc2n1C(C)C ZINC001168601544 1056019429 /nfs/dbraw/zinc/01/94/29/1056019429.db2.gz UBKKFOXCIWIUFF-WMZOPIPTSA-N 2 1 314.477 4.210 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)C1 ZINC001116288077 1056197512 /nfs/dbraw/zinc/19/75/12/1056197512.db2.gz BZSAMJHBICTFRA-UKRRQHHQSA-N 2 1 323.550 4.132 20 0 DIADMP CCC[C@@H](C[NH2+][C@H]1CC[N@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821216 1056208646 /nfs/dbraw/zinc/20/86/46/1056208646.db2.gz OJTNDPICRRAMOV-SFTDATJTSA-N 2 1 314.517 4.424 20 0 DIADMP CCC[C@@H](C[NH2+][C@H]1CC[N@@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821216 1056208662 /nfs/dbraw/zinc/20/86/62/1056208662.db2.gz OJTNDPICRRAMOV-SFTDATJTSA-N 2 1 314.517 4.424 20 0 DIADMP CCC[C@H](C[NH2+][C@H]1CC[N@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821215 1056208947 /nfs/dbraw/zinc/20/89/47/1056208947.db2.gz OJTNDPICRRAMOV-RTWAWAEBSA-N 2 1 314.517 4.424 20 0 DIADMP CCC[C@H](C[NH2+][C@H]1CC[N@@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821215 1056208960 /nfs/dbraw/zinc/20/89/60/1056208960.db2.gz OJTNDPICRRAMOV-RTWAWAEBSA-N 2 1 314.517 4.424 20 0 DIADMP C[N@H+]1CC[C@@H](c2ccc(-c3ccc(C[NH+]4CCCC4)cc3)cc2)C1 ZINC001240062381 1056297468 /nfs/dbraw/zinc/29/74/68/1056297468.db2.gz ULXLMFMAATVIFE-JOCHJYFZSA-N 2 1 320.480 4.369 20 0 DIADMP CC[C@@H](C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)[NH+]1CCCC1 ZINC000474473829 1056317236 /nfs/dbraw/zinc/31/72/36/1056317236.db2.gz GNYFNKPVQAFBQQ-LBDPXKHJSA-N 2 1 320.443 4.208 20 0 DIADMP CC(C)[NH+](CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)C(C)C ZINC000474473460 1056318437 /nfs/dbraw/zinc/31/84/37/1056318437.db2.gz PUAFUXKDKZHCFU-QQFBHYJXSA-N 2 1 322.459 4.452 20 0 DIADMP Nc1cc[nH+]c2cc(C3=CCC[N@@H+](Cc4ccccc4)C3)ccc12 ZINC001240386783 1056469032 /nfs/dbraw/zinc/46/90/32/1056469032.db2.gz JSPHQAKMEXBYGS-UHFFFAOYSA-N 2 1 315.420 4.106 20 0 DIADMP c1ccc(C[N@H+]2CCC=C(c3ccc([C@H]4CC[NH2+]C4)cc3)C2)cc1 ZINC001240388393 1056471019 /nfs/dbraw/zinc/47/10/19/1056471019.db2.gz BTLJLMNBMNEQQK-NRFANRHFSA-N 2 1 318.464 4.053 20 0 DIADMP c1ccc(C[N@H+]2CCC=C(c3ccc([C@H]4CCC[NH2+]4)cc3)C2)cc1 ZINC001240388151 1056471099 /nfs/dbraw/zinc/47/10/99/1056471099.db2.gz CSXWXMYZRPCSNZ-JOCHJYFZSA-N 2 1 318.464 4.400 20 0 DIADMP Cc1cccc(C[N@H+](CCC[NH+]2CCCCC2)CC(C)C)c1 ZINC001615285515 1056487481 /nfs/dbraw/zinc/48/74/81/1056487481.db2.gz GROJALGLLOCACX-UHFFFAOYSA-N 2 1 302.506 4.329 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cccc(C(C)(C)C)c2)CC1 ZINC001615384197 1056502737 /nfs/dbraw/zinc/50/27/37/1056502737.db2.gz VCNZLKMLUHPYTD-UHFFFAOYSA-N 2 1 302.506 4.289 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC001615539903 1056528455 /nfs/dbraw/zinc/52/84/55/1056528455.db2.gz MDQKQPYKGCKDRU-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615539903 1056528469 /nfs/dbraw/zinc/52/84/69/1056528469.db2.gz MDQKQPYKGCKDRU-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615539903 1056528483 /nfs/dbraw/zinc/52/84/83/1056528483.db2.gz MDQKQPYKGCKDRU-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC001615539902 1056529026 /nfs/dbraw/zinc/52/90/26/1056529026.db2.gz MDQKQPYKGCKDRU-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615539902 1056529040 /nfs/dbraw/zinc/52/90/40/1056529040.db2.gz MDQKQPYKGCKDRU-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615539902 1056529055 /nfs/dbraw/zinc/52/90/55/1056529055.db2.gz MDQKQPYKGCKDRU-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC001615557915 1056534768 /nfs/dbraw/zinc/53/47/68/1056534768.db2.gz AJUOUEASMPVSSR-IBGZPJMESA-N 2 1 300.490 4.118 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001615577904 1056541296 /nfs/dbraw/zinc/54/12/96/1056541296.db2.gz MLDWYXXQKXTASY-MRXNPFEDSA-N 2 1 306.881 4.099 20 0 DIADMP Cc1cccc(Cl)c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001615577904 1056541310 /nfs/dbraw/zinc/54/13/10/1056541310.db2.gz MLDWYXXQKXTASY-MRXNPFEDSA-N 2 1 306.881 4.099 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2c(C)ccc3ccccc32)CC1 ZINC001615789169 1056574642 /nfs/dbraw/zinc/57/46/42/1056574642.db2.gz JUDVFUWKWCPLKQ-UHFFFAOYSA-N 2 1 310.485 4.454 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1C ZINC001615791574 1056576493 /nfs/dbraw/zinc/57/64/93/1056576493.db2.gz JFCSUTMFWCBZJX-ORAYPTAESA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1C ZINC001615791574 1056576499 /nfs/dbraw/zinc/57/64/99/1056576499.db2.gz JFCSUTMFWCBZJX-ORAYPTAESA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)c(C)c1C ZINC001615791574 1056576513 /nfs/dbraw/zinc/57/65/13/1056576513.db2.gz JFCSUTMFWCBZJX-ORAYPTAESA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)c(C)c1C ZINC001615791574 1056576524 /nfs/dbraw/zinc/57/65/24/1056576524.db2.gz JFCSUTMFWCBZJX-ORAYPTAESA-N 2 1 302.506 4.143 20 0 DIADMP CCCCCc1ccc(-c2ccc3c(C4C[NH2+]C4)[nH+]cn3c2)cc1 ZINC001241033824 1056832635 /nfs/dbraw/zinc/83/26/35/1056832635.db2.gz NHYCRMGIISHGNZ-UHFFFAOYSA-N 2 1 319.452 4.421 20 0 DIADMP CCCCc1ccc(-c2ccc3c(C4C[NH2+]C4)[nH+]cn3c2)cc1 ZINC001241053367 1056848165 /nfs/dbraw/zinc/84/81/65/1056848165.db2.gz XQWHFVFINBGACN-UHFFFAOYSA-N 2 1 305.425 4.031 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682076056 1056886612 /nfs/dbraw/zinc/88/66/12/1056886612.db2.gz SOYZUPSFKDHYIW-ZWKOTPCHSA-N 2 1 318.505 4.037 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(-c2cnc(N(C)C)cc2C)nc1 ZINC001241239771 1056975383 /nfs/dbraw/zinc/97/53/83/1056975383.db2.gz CVNFBYVHDIHQDV-IBGZPJMESA-N 2 1 324.472 4.065 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2-c2cc(Cl)ccc2F)CC1 ZINC001241331555 1057017495 /nfs/dbraw/zinc/01/74/95/1057017495.db2.gz FVPCSGGTPOJDGV-UHFFFAOYSA-N 2 1 318.823 4.069 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000360028640 1057017875 /nfs/dbraw/zinc/01/78/75/1057017875.db2.gz GSTQAXMKGGWZJO-WWGRRREGSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000360028640 1057017880 /nfs/dbraw/zinc/01/78/80/1057017880.db2.gz GSTQAXMKGGWZJO-WWGRRREGSA-N 2 1 322.905 4.093 20 0 DIADMP C[C@H](C[NH2+][C@H]1CCSc2c(Cl)cccc21)C[NH+]1CCCC1 ZINC000360440984 1057022689 /nfs/dbraw/zinc/02/26/89/1057022689.db2.gz DOTBTBTWEHDDNR-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)C(C)(C)C(F)F ZINC000657836681 1057023989 /nfs/dbraw/zinc/02/39/89/1057023989.db2.gz VFUKQCNGYYIQAS-CQSZACIVSA-N 2 1 312.448 4.296 20 0 DIADMP Cc1cc(-c2ccc(C[NH+]3CCCCC3)cc2)cn2cc[nH+]c12 ZINC001241389696 1057035356 /nfs/dbraw/zinc/03/53/56/1057035356.db2.gz WTBGRSWDNBSRGV-UHFFFAOYSA-N 2 1 305.425 4.296 20 0 DIADMP C[N@H+]1CCc2ccc(-c3ccc(C[NH+]4CCCCC4)cc3)cc2C1 ZINC001241390433 1057036363 /nfs/dbraw/zinc/03/63/63/1057036363.db2.gz ZPWJTRRICLHBDM-UHFFFAOYSA-N 2 1 320.480 4.327 20 0 DIADMP Cc1cc2[nH]ccc2c(C2=CC[N@@H+](Cc3ccccc3)CC2)[nH+]1 ZINC001241502495 1057071701 /nfs/dbraw/zinc/07/17/01/1057071701.db2.gz YSQGOVSKXHWMDH-UHFFFAOYSA-N 2 1 303.409 4.161 20 0 DIADMP CCOC(=[NH2+])c1cccc(C2=CC[N@H+](Cc3ccccc3)CC2)c1 ZINC001241505165 1057075692 /nfs/dbraw/zinc/07/56/92/1057075692.db2.gz OVRGQAZAWGPECY-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP CCOC(=[NH2+])c1cccc(C2=CC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001241505165 1057075698 /nfs/dbraw/zinc/07/56/98/1057075698.db2.gz OVRGQAZAWGPECY-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP [NH3+]C1(c2cccc(C3=CC[N@@H+](Cc4ccccc4)CC3)c2)CCC1 ZINC001241506622 1057077194 /nfs/dbraw/zinc/07/71/94/1057077194.db2.gz INRAMCACUBHHBC-UHFFFAOYSA-N 2 1 318.464 4.314 20 0 DIADMP CCOC(=[NH2+])c1ccc(C2=CC[N@H+](Cc3ccccc3)CC2)cc1 ZINC001241507509 1057078911 /nfs/dbraw/zinc/07/89/11/1057078911.db2.gz WLGPVUAQMDVYHQ-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP CCOC(=[NH2+])c1ccc(C2=CC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001241507509 1057078914 /nfs/dbraw/zinc/07/89/14/1057078914.db2.gz WLGPVUAQMDVYHQ-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000483708614 1057137528 /nfs/dbraw/zinc/13/75/28/1057137528.db2.gz DDYCCZIEQCDPAF-QMMLZNLJSA-N 2 1 314.517 4.250 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000483708614 1057137530 /nfs/dbraw/zinc/13/75/30/1057137530.db2.gz DDYCCZIEQCDPAF-QMMLZNLJSA-N 2 1 314.517 4.250 20 0 DIADMP [NH3+]Cc1ccc(-c2ccc3c(c2)C[N@H+](Cc2ccccc2)C3)cc1 ZINC001241917183 1057210877 /nfs/dbraw/zinc/21/08/77/1057210877.db2.gz FZNUJXHQQKPTTL-UHFFFAOYSA-N 2 1 314.432 4.328 20 0 DIADMP Cc1cc(N)[nH+]cc1-c1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2 ZINC001242095929 1057263000 /nfs/dbraw/zinc/26/30/00/1057263000.db2.gz SYRWZIJDNDFIGR-UHFFFAOYSA-N 2 1 315.420 4.155 20 0 DIADMP Cc1cc(N)[nH+]cc1-c1ccc2c(c1)C[N@H+](Cc1ccccc1)C2 ZINC001242095929 1057263004 /nfs/dbraw/zinc/26/30/04/1057263004.db2.gz SYRWZIJDNDFIGR-UHFFFAOYSA-N 2 1 315.420 4.155 20 0 DIADMP C[N@H+]1CCc2c(F)cc(-c3cccc(C[NH+]4CCCC4)c3)cc2C1 ZINC001242119967 1057268753 /nfs/dbraw/zinc/26/87/53/1057268753.db2.gz NVEBCVFGMLPKCX-UHFFFAOYSA-N 2 1 324.443 4.076 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319471 1057369466 /nfs/dbraw/zinc/36/94/66/1057369466.db2.gz BYUDITMRDQNNNM-FXAWDEMLSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319471 1057369473 /nfs/dbraw/zinc/36/94/73/1057369473.db2.gz BYUDITMRDQNNNM-FXAWDEMLSA-N 2 1 324.468 4.233 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000675752419 1057407103 /nfs/dbraw/zinc/40/71/03/1057407103.db2.gz SGWNKSIGJIFGTR-HBFSDRIKSA-N 2 1 300.490 4.299 20 0 DIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)C(C)(C)C ZINC000675747062 1057408692 /nfs/dbraw/zinc/40/86/92/1057408692.db2.gz DWANLEPPEYSKKM-OALUTQOASA-N 2 1 324.553 4.070 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000675777250 1057412564 /nfs/dbraw/zinc/41/25/64/1057412564.db2.gz PPVFQQPBTOYTMR-HMFYCAOWSA-N 2 1 322.496 4.357 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000675777250 1057412566 /nfs/dbraw/zinc/41/25/66/1057412566.db2.gz PPVFQQPBTOYTMR-HMFYCAOWSA-N 2 1 322.496 4.357 20 0 DIADMP C[N@H+]1CC[C@@H](c2ccc(C3=CC[C@@H]([NH+]4CCCC4)CC3)cc2)C1 ZINC001242697522 1057451863 /nfs/dbraw/zinc/45/18/63/1057451863.db2.gz SQMWZKGYOHHROE-NHCUHLMSSA-N 2 1 310.485 4.137 20 0 DIADMP C[N@H+]1CC[C@H](c2ccc(C3=CC[C@@H]([NH+]4CCCC4)CC3)cc2)C1 ZINC001242697521 1057452074 /nfs/dbraw/zinc/45/20/74/1057452074.db2.gz SQMWZKGYOHHROE-LEWJYISDSA-N 2 1 310.485 4.137 20 0 DIADMP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2nc(C)sc2C)c1 ZINC000676489789 1057479165 /nfs/dbraw/zinc/47/91/65/1057479165.db2.gz LEQCNRPETRYYBN-CYBMUJFWSA-N 2 1 317.502 4.062 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2nc(C)sc2C)c1 ZINC000676489789 1057479170 /nfs/dbraw/zinc/47/91/70/1057479170.db2.gz LEQCNRPETRYYBN-CYBMUJFWSA-N 2 1 317.502 4.062 20 0 DIADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc(C[NH2+]C)cc2)nc1 ZINC001242991767 1057539444 /nfs/dbraw/zinc/53/94/44/1057539444.db2.gz VTUZSIYZPHQBFB-OAQYLSRUSA-N 2 1 323.484 4.405 20 0 DIADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(-c2cccc(C[NH2+]C)c2)nc1 ZINC001242996280 1057539958 /nfs/dbraw/zinc/53/99/58/1057539958.db2.gz DFSYNRJNEIXNTC-OAQYLSRUSA-N 2 1 323.484 4.405 20 0 DIADMP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1scnc1C1CC1 ZINC000487269943 1057571965 /nfs/dbraw/zinc/57/19/65/1057571965.db2.gz IYWWITIWCNAOSL-HZPDHXFCSA-N 2 1 321.534 4.011 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)CCCCCCC[NH3+] ZINC000842476349 1057608783 /nfs/dbraw/zinc/60/87/83/1057608783.db2.gz MKPWVZUDADUNDV-HNNXBMFYSA-N 2 1 311.539 4.477 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166840903 1057677426 /nfs/dbraw/zinc/67/74/26/1057677426.db2.gz CTDUJNHRLRDCEJ-DAYGRLMNSA-N 2 1 308.416 4.022 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166840903 1057677428 /nfs/dbraw/zinc/67/74/28/1057677428.db2.gz CTDUJNHRLRDCEJ-DAYGRLMNSA-N 2 1 308.416 4.022 20 0 DIADMP Cc1ccc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1F ZINC000731450199 1057744039 /nfs/dbraw/zinc/74/40/39/1057744039.db2.gz PEZZSBCARPFVQW-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP C[NH+]1CCC(c2ccc(-c3ccc4c(c3)C[N@H+](C)CC4)cc2)CC1 ZINC001243656011 1057745639 /nfs/dbraw/zinc/74/56/39/1057745639.db2.gz ADKLWPIZGORTHZ-UHFFFAOYSA-N 2 1 320.480 4.151 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001548928492 1058276335 /nfs/dbraw/zinc/27/63/35/1058276335.db2.gz NMWGINZDYYBLST-BCKAPOECSA-N 2 1 324.443 4.155 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001550520143 1058341245 /nfs/dbraw/zinc/34/12/45/1058341245.db2.gz IKCXNYUWLDZMNZ-GPQLOAJWSA-N 2 1 301.478 4.005 20 0 DIADMP Cc1cccc(C2([NH2+][C@@H]3CC[C@H](c4[nH+]ccn4C)C3)CCC2)c1 ZINC001550512050 1058341691 /nfs/dbraw/zinc/34/16/91/1058341691.db2.gz QCDOCKFRVZAXSU-FUHWJXTLSA-N 2 1 309.457 4.034 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+][C@@H](C2CCC2)C2CCCC2)C1 ZINC001550511504 1058343730 /nfs/dbraw/zinc/34/37/30/1058343730.db2.gz FIJDIZREENZWBG-FGTMMUONSA-N 2 1 301.478 4.005 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001552080676 1058426164 /nfs/dbraw/zinc/42/61/64/1058426164.db2.gz AHQJXAFFNJMXTN-ZKNLVJASSA-N 2 1 320.480 4.324 20 0 DIADMP Fc1ccccc1C1CC([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001552080691 1058427303 /nfs/dbraw/zinc/42/73/03/1058427303.db2.gz HWJYIHOQJRMMTB-HTZGDQIUSA-N 2 1 324.443 4.155 20 0 DIADMP Fc1ccccc1C1CC([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001552080693 1058427615 /nfs/dbraw/zinc/42/76/15/1058427615.db2.gz HWJYIHOQJRMMTB-WYESBNJKSA-N 2 1 324.443 4.155 20 0 DIADMP c1ccc([C@H]2CC[C@@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001552219492 1058430861 /nfs/dbraw/zinc/43/08/61/1058430861.db2.gz QINIKEMZXAPTOE-CGXNFDGLSA-N 2 1 306.453 4.016 20 0 DIADMP C[C@@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1ccc(Cl)cc1Cl ZINC001246074970 1058667639 /nfs/dbraw/zinc/66/76/39/1058667639.db2.gz HNNVQOJNLSNCBI-GMTAPVOTSA-N 2 1 301.261 4.173 20 0 DIADMP Cc1ccccc1C[NH2+][C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246073449 1058662390 /nfs/dbraw/zinc/66/23/90/1058662390.db2.gz YFJBUQDCUNSJTB-QUCCMNQESA-N 2 1 312.432 4.025 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)cc1 ZINC001246073493 1058663212 /nfs/dbraw/zinc/66/32/12/1058663212.db2.gz ZISXJXQZPKZISZ-QUCCMNQESA-N 2 1 312.432 4.025 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1Cl ZINC001246076915 1058666338 /nfs/dbraw/zinc/66/63/38/1058666338.db2.gz QDIRPWFSZVULHQ-DEQVHRJGSA-N 2 1 313.272 4.317 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1CC[C@H](C)[NH2+]C1 ZINC001246078009 1058667675 /nfs/dbraw/zinc/66/76/75/1058667675.db2.gz APGDPCYQLWLGLZ-UEXGIBASSA-N 2 1 322.496 4.327 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(Cl)c2F)C[C@H](CC)[NH2+]1 ZINC001246107728 1058680966 /nfs/dbraw/zinc/68/09/66/1058680966.db2.gz UMLAZFXKQMBNJA-YIYPIFLZSA-N 2 1 312.860 4.439 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]C34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246178558 1058724684 /nfs/dbraw/zinc/72/46/84/1058724684.db2.gz IYFUPGLSLJEMII-FNKBMKOHSA-N 2 1 310.485 4.038 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246179778 1058728417 /nfs/dbraw/zinc/72/84/17/1058728417.db2.gz RRWXPZVBKIYNPQ-HSALFYBXSA-N 2 1 312.432 4.360 20 0 DIADMP C[C@@H]1CC([NH2+]Cc2ccccc2Oc2ccccc2)C[C@@H](C)[NH2+]1 ZINC001246189716 1058730913 /nfs/dbraw/zinc/73/09/13/1058730913.db2.gz DVMIUNLKUVIDSL-HZPDHXFCSA-N 2 1 310.441 4.098 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@]1(C)CCC[NH2+]C1 ZINC001246190763 1058734873 /nfs/dbraw/zinc/73/48/73/1058734873.db2.gz SEWUUSPNKPRLEO-XMSQKQJNSA-N 2 1 322.496 4.329 20 0 DIADMP CC[C@@H]1CC([NH2+]Cc2ccc(Cl)c(Cl)c2)C[C@@H](CC)[NH2+]1 ZINC001246196205 1058738093 /nfs/dbraw/zinc/73/80/93/1058738093.db2.gz RMDDIWDTCIGZKG-CHWSQXEVSA-N 2 1 315.288 4.392 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1Cl ZINC001246195801 1058738559 /nfs/dbraw/zinc/73/85/59/1058738559.db2.gz PVVUWWBQMTWTQM-MJGOQNOKSA-N 2 1 314.860 4.231 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246196897 1058739400 /nfs/dbraw/zinc/73/94/00/1058739400.db2.gz WUNSSYANLHCODU-KGLIPLIRSA-N 2 1 315.288 4.394 20 0 DIADMP C[C@]1(C[NH2+][C@H]2CCCC3(CCCCC3)C2)CC[NH2+]CC1(F)F ZINC001246224099 1058751283 /nfs/dbraw/zinc/75/12/83/1058751283.db2.gz ZDFOTVAFSPADQP-JKSUJKDBSA-N 2 1 314.464 4.104 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246229890 1058754326 /nfs/dbraw/zinc/75/43/26/1058754326.db2.gz MUBVEESJBGITSV-IQLMPHEPSA-N 2 1 316.464 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CCC2=CCCCC2)CC[NH2+]1 ZINC001246231245 1058754921 /nfs/dbraw/zinc/75/49/21/1058754921.db2.gz CZCSCXAALQWEJX-QUCCMNQESA-N 2 1 316.464 4.407 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246229887 1058755164 /nfs/dbraw/zinc/75/51/64/1058755164.db2.gz MUBVEESJBGITSV-HWUFZWQCSA-N 2 1 316.464 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CCCC2CCCC2)CC[NH2+]1 ZINC001246237919 1058762766 /nfs/dbraw/zinc/76/27/66/1058762766.db2.gz JYBIZJLXWROTBT-ICSRJNTNSA-N 2 1 318.480 4.487 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246253439 1058770543 /nfs/dbraw/zinc/77/05/43/1058770543.db2.gz MAOLCMVSYQDLMG-COLVAYQJSA-N 2 1 301.261 4.175 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccccc1F ZINC001246270294 1058784975 /nfs/dbraw/zinc/78/49/75/1058784975.db2.gz AHFXIDCIBYTLJQ-OLMNPRSZSA-N 2 1 306.469 4.279 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1F ZINC001246267614 1058785082 /nfs/dbraw/zinc/78/50/82/1058785082.db2.gz UWLWYQCBUOQLTA-QAPCUYQASA-N 2 1 304.453 4.321 20 0 DIADMP C[C@H]1CC([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)C[C@H](C)[NH2+]1 ZINC001246271633 1058785381 /nfs/dbraw/zinc/78/53/81/1058785381.db2.gz NXVGFVHAERFUCO-QWRGUYRKSA-N 2 1 315.288 4.347 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]C(C)(C)c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246275585 1058790787 /nfs/dbraw/zinc/79/07/87/1058790787.db2.gz AQICQYRSGGEXOF-BJWYYQGGSA-N 2 1 310.432 4.099 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)c(F)c1 ZINC001246281892 1058800501 /nfs/dbraw/zinc/80/05/01/1058800501.db2.gz ADPBCZQMZACVQD-ACWOFJMJSA-N 2 1 316.395 4.109 20 0 DIADMP CCCC[C@H]1CC[C@H](C2CCC(N[C@@H]([NH3+])CCC[NH3+])CC2)CC1 ZINC001246299327 1058812595 /nfs/dbraw/zinc/81/25/95/1058812595.db2.gz HIGXCLGZMBQFQS-MQPDGSBLSA-N 2 1 323.569 4.155 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246308382 1058816549 /nfs/dbraw/zinc/81/65/49/1058816549.db2.gz QTBQMXYUXBETKO-PASDCYSWSA-N 2 1 304.453 4.176 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H](CC)[NH2+][C@@H](CC)C1)c1ccccc1OC ZINC001246316574 1058824318 /nfs/dbraw/zinc/82/43/18/1058824318.db2.gz JNGPNMLMUKONLI-MPGHIAIKSA-N 2 1 304.478 4.045 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]C(C)(C)c2ccccc2Cl)C[C@H](CC)[NH2+]1 ZINC001246314262 1058826493 /nfs/dbraw/zinc/82/64/93/1058826493.db2.gz XCKZLUOUGCNMAA-FICVDOATSA-N 2 1 308.897 4.474 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+][C@@H]1C[NH2+]CCC1(C)C ZINC001246324788 1058835519 /nfs/dbraw/zinc/83/55/19/1058835519.db2.gz GKLKUECVLRALBR-GDBMZVCRSA-N 2 1 324.534 4.048 20 0 DIADMP CC(C)C1CCC([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246332590 1058841020 /nfs/dbraw/zinc/84/10/20/1058841020.db2.gz FXMOFYDFHNSKBF-HFPIOELMSA-N 2 1 300.490 4.284 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1C[NH2+]CC[C@@H]1C ZINC001246334068 1058842407 /nfs/dbraw/zinc/84/24/07/1058842407.db2.gz XYBUIWYEHOGWSK-SPEDKVCISA-N 2 1 322.496 4.185 20 0 DIADMP CCCC1CCC([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246331779 1058844803 /nfs/dbraw/zinc/84/48/03/1058844803.db2.gz CGNVCSBBGWSWLK-PEVDHWGLSA-N 2 1 300.490 4.428 20 0 DIADMP Cc1ccc(C[C@H]([NH2+][C@H]2CC[C@H](C)NC2)c2ccccc2)cc1 ZINC001246338910 1058847319 /nfs/dbraw/zinc/84/73/19/1058847319.db2.gz NFWYEJSSSIINCJ-YYWHXJBOSA-N 2 1 308.469 4.009 20 0 DIADMP FC(F)(F)[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001246343021 1058852298 /nfs/dbraw/zinc/85/22/98/1058852298.db2.gz ULBQFYPIVKGFHN-ZNMIVQPWSA-N 2 1 318.427 4.010 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246345100 1058856021 /nfs/dbraw/zinc/85/60/21/1058856021.db2.gz UJMQSOCQNGVURP-FCHUYYIVSA-N 2 1 322.496 4.435 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246351176 1058861005 /nfs/dbraw/zinc/86/10/05/1058861005.db2.gz SDMHOFXYABEVGS-NUJGCVRESA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360845 1058867754 /nfs/dbraw/zinc/86/77/54/1058867754.db2.gz IQKJTZLDAZLSCM-YOEHRIQHSA-N 2 1 320.908 4.476 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360310 1058868139 /nfs/dbraw/zinc/86/81/39/1058868139.db2.gz FFIXGEIEJPPTFP-RHSMWYFYSA-N 2 1 306.881 4.085 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360841 1058871187 /nfs/dbraw/zinc/87/11/87/1058871187.db2.gz IQKJTZLDAZLSCM-RHSMWYFYSA-N 2 1 320.908 4.476 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C[C@H]1C ZINC001246378887 1058885113 /nfs/dbraw/zinc/88/51/13/1058885113.db2.gz VEWZDUMVMZRVMI-OAGGEKHMSA-N 2 1 320.908 4.333 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246386106 1058894648 /nfs/dbraw/zinc/89/46/48/1058894648.db2.gz DQUFZMXQIDKVQA-WMZOPIPTSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCCCC2(C)C)CC[NH2+]1 ZINC001246392441 1058895688 /nfs/dbraw/zinc/89/56/88/1058895688.db2.gz DFQCIJAIKDPFRJ-NZSAHSFTSA-N 2 1 318.480 4.486 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](c2ccncc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246391771 1058896867 /nfs/dbraw/zinc/89/68/67/1058896867.db2.gz GUXGMHUEFVHTRM-KRXQYRFLSA-N 2 1 321.896 4.085 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246390612 1058898429 /nfs/dbraw/zinc/89/84/29/1058898429.db2.gz FASJHVOIOAKNOZ-IPELMVKDSA-N 2 1 318.480 4.423 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C2CC2)c1 ZINC001246399168 1058901929 /nfs/dbraw/zinc/90/19/29/1058901929.db2.gz GGOXSOXUGMTYQS-PWRODBHTSA-N 2 1 324.443 4.360 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)CC[NH2+]1 ZINC001246403483 1058904546 /nfs/dbraw/zinc/90/45/46/1058904546.db2.gz MUHBWKIHDRHXQW-QGZVKYPTSA-N 3 1 323.569 4.058 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246406678 1058906694 /nfs/dbraw/zinc/90/66/94/1058906694.db2.gz RGJPTULNZAYMQP-GJYPPUQNSA-N 2 1 304.453 4.177 20 0 DIADMP Cc1cccc(C2([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CCC2)c1 ZINC001246415016 1058918181 /nfs/dbraw/zinc/91/81/81/1058918181.db2.gz WZEPSVIKDJIOSY-RTWAWAEBSA-N 2 1 320.480 4.457 20 0 DIADMP CC1(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246427289 1058922220 /nfs/dbraw/zinc/92/22/20/1058922220.db2.gz KEBDLXVNSFZNMY-SJORKVTESA-N 2 1 322.443 4.285 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246437849 1058928979 /nfs/dbraw/zinc/92/89/79/1058928979.db2.gz WFDVKGNMUQVNKZ-IEZWGBDMSA-N 2 1 318.480 4.343 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C1(c2ccccc2F)CC[NH2+]CC1 ZINC001246439546 1058935004 /nfs/dbraw/zinc/93/50/04/1058935004.db2.gz YVYQNKLKCPVFHM-INIZCTEOSA-N 2 1 304.453 4.129 20 0 DIADMP Cc1ccccc1C1([NH2+][C@@H]2CCCC[NH2+]C2)CCC(F)(F)CC1 ZINC001246454147 1058939779 /nfs/dbraw/zinc/93/97/79/1058939779.db2.gz DCXTUWCAPOPJMM-MRXNPFEDSA-N 2 1 322.443 4.131 20 0 DIADMP C[C@H]([NH2+]C1C[C@H](C)[NH2+][C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC001246482653 1058963035 /nfs/dbraw/zinc/96/30/35/1058963035.db2.gz HNNVQOJNLSNCBI-DCAQKATOSA-N 2 1 301.261 4.173 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1C ZINC001246469368 1058956538 /nfs/dbraw/zinc/95/65/38/1058956538.db2.gz CRZZYNGGJCWJLW-QFUCXCTJSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246491021 1058968148 /nfs/dbraw/zinc/96/81/48/1058968148.db2.gz RLYWEBNSIMGIQY-SESVDKBCSA-N 2 1 306.453 4.065 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c3ccccc3)C1)CCC2 ZINC001246496891 1058970356 /nfs/dbraw/zinc/97/03/56/1058970356.db2.gz DCWQEPCNJBICCW-KSEOMHKRSA-N 2 1 320.480 4.455 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C(c2cccs2)c2cccs2)CC[NH2+]1 ZINC001246507429 1058978783 /nfs/dbraw/zinc/97/87/83/1058978783.db2.gz BOWIWXCRALEOIT-KBPBESRZSA-N 2 1 320.527 4.265 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2[C@@H](C)CCC[C@@H]2C)CC[NH2+]1 ZINC001246518548 1058981141 /nfs/dbraw/zinc/98/11/41/1058981141.db2.gz HGFMNOUAHQWNQN-BVYOLEPJSA-N 2 1 304.453 4.190 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246519401 1058981459 /nfs/dbraw/zinc/98/14/59/1058981459.db2.gz NEZNPJSPNDQVLX-AZUAARDMSA-N 2 1 300.490 4.209 20 0 DIADMP C1CCC2(CC1)CCC[C@@H]([N@H+]1CCCC3(CC[NH2+]CC3)C1)C2 ZINC001246523076 1058981830 /nfs/dbraw/zinc/98/18/30/1058981830.db2.gz LYSFLTRAAYREKO-GOSISDBHSA-N 2 1 304.522 4.345 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246518200 1058981867 /nfs/dbraw/zinc/98/18/67/1058981867.db2.gz FLYYQQIJBPEZJU-GOSISDBHSA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)[N@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246520242 1058982600 /nfs/dbraw/zinc/98/26/00/1058982600.db2.gz SFBFGERDJWGOJE-SFTDATJTSA-N 2 1 308.469 4.390 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246520242 1058982620 /nfs/dbraw/zinc/98/26/20/1058982620.db2.gz SFBFGERDJWGOJE-SFTDATJTSA-N 2 1 308.469 4.390 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530064 1058985356 /nfs/dbraw/zinc/98/53/56/1058985356.db2.gz NMFWZHVBTDIFHZ-SFTDATJTSA-N 2 1 322.496 4.484 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530058 1058986515 /nfs/dbraw/zinc/98/65/15/1058986515.db2.gz NMFWZHVBTDIFHZ-NHCUHLMSSA-N 2 1 322.496 4.484 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](C(C)(C)C)C2)c1 ZINC001246536448 1058990429 /nfs/dbraw/zinc/99/04/29/1058990429.db2.gz FNWJYVWOHAYTLA-FHWLQOOXSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@@H](C(C)(C)C)C2)c1 ZINC001246536447 1058990766 /nfs/dbraw/zinc/99/07/66/1058990766.db2.gz FNWJYVWOHAYTLA-CEXWTWQISA-N 2 1 300.490 4.299 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001246547329 1058999590 /nfs/dbraw/zinc/99/95/90/1058999590.db2.gz CKVQAABPRCCTQN-MAUKXSAKSA-N 2 1 324.534 4.273 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246556256 1059001380 /nfs/dbraw/zinc/00/13/80/1059001380.db2.gz BSFXGALQGXZCBN-UHFFFAOYSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246558252 1059001547 /nfs/dbraw/zinc/00/15/47/1059001547.db2.gz KCAFCWUOKZVUBY-LJQANCHMSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1CC[N@H+](C2CCC(Cc3ccccc3)CC2)CC[C@@H]1C[NH3+] ZINC001246561430 1059002373 /nfs/dbraw/zinc/00/23/73/1059002373.db2.gz SNPRLJSNRPUSEK-MAKTXDPSSA-N 2 1 314.517 4.095 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246565037 1059007531 /nfs/dbraw/zinc/00/75/31/1059007531.db2.gz ZZEDGMQKQAEKGU-YDZRNGNQSA-N 2 1 304.453 4.272 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001246583263 1059011082 /nfs/dbraw/zinc/01/10/82/1059011082.db2.gz QGPNOKOOGZOTDN-DMKPSLHHSA-N 2 1 320.908 4.427 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001246586198 1059011943 /nfs/dbraw/zinc/01/19/43/1059011943.db2.gz RNUWTWZPCWQCPF-HSALFYBXSA-N 2 1 300.490 4.164 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC[NH2+]1 ZINC001246593165 1059017423 /nfs/dbraw/zinc/01/74/23/1059017423.db2.gz ANBSTMMBMDYRJV-AZUAARDMSA-N 2 1 300.490 4.352 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CCc2c(Cl)cccc2C1)[C@H]1CCC[NH2+]CC1 ZINC001246593427 1059019122 /nfs/dbraw/zinc/01/91/22/1059019122.db2.gz MZJMOLHYMAEEOU-DLBZAZTESA-N 2 1 320.908 4.050 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246589422 1059020196 /nfs/dbraw/zinc/02/01/96/1059020196.db2.gz DZTDEQNLCQOXTJ-SSSCAMEASA-N 2 1 320.908 4.425 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CCc2cccc(Cl)c2C1)[C@@H]1CCC[NH2+]CC1 ZINC001246597941 1059021152 /nfs/dbraw/zinc/02/11/52/1059021152.db2.gz YYHJKUCYZAUMNO-IAGOWNOFSA-N 2 1 320.908 4.050 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CC[C@]34CCC[NH2+]C4)CC2)cc1 ZINC001246607160 1059022226 /nfs/dbraw/zinc/02/22/26/1059022226.db2.gz SHQWLRHCNDEFJJ-KVZIAJEVSA-N 2 1 318.892 4.194 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@]34CCC[NH2+]C4)CC2)cc1 ZINC001246607160 1059022242 /nfs/dbraw/zinc/02/22/42/1059022242.db2.gz SHQWLRHCNDEFJJ-KVZIAJEVSA-N 2 1 318.892 4.194 20 0 DIADMP c1ccc(C2CCC([N@@H+]3CCC[C@@]34CCC[NH2+]CC4)CC2)cc1 ZINC001246604079 1059022475 /nfs/dbraw/zinc/02/24/75/1059022475.db2.gz GTMGFCDPBHKFIT-XVAXZDLZSA-N 2 1 312.501 4.321 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246609805 1059025202 /nfs/dbraw/zinc/02/52/02/1059025202.db2.gz NVSSYCWQCNDHAU-AEFFLSMTSA-N 2 1 312.567 4.152 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609742 1059026142 /nfs/dbraw/zinc/02/61/42/1059026142.db2.gz MZOYVXZIVFOBGE-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@@H+]2CCC[C@@]23CCC[NH2+]C3)CC1 ZINC001246611484 1059029618 /nfs/dbraw/zinc/02/96/18/1059029618.db2.gz UCIKALQCPYVABH-KITAHSCOSA-N 2 1 324.512 4.031 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CC[C@@]2(CC[NH2+]2)C1 ZINC001246633007 1059036818 /nfs/dbraw/zinc/03/68/18/1059036818.db2.gz BJTUQFYBFOSONN-AVRDEDQJSA-N 2 1 320.480 4.035 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@@]2(CC[NH2+]2)C1 ZINC001246633007 1059036838 /nfs/dbraw/zinc/03/68/38/1059036838.db2.gz BJTUQFYBFOSONN-AVRDEDQJSA-N 2 1 320.480 4.035 20 0 DIADMP c1ccc(CC2CCC([NH+]3CCC4(CCC[NH2+]4)CC3)CC2)cc1 ZINC001246627005 1059038339 /nfs/dbraw/zinc/03/83/39/1059038339.db2.gz WEHZNHUGZJKZNM-UHFFFAOYSA-N 2 1 312.501 4.006 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CC[C@@H]4CC[NH2+][C@@H]4C3)CC2)cc1 ZINC001246633081 1059038652 /nfs/dbraw/zinc/03/86/52/1059038652.db2.gz DIVKSOWBNDDBTF-DHRZBBNESA-N 2 1 318.892 4.050 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@@H]4CC[NH2+][C@@H]4C3)CC2)cc1 ZINC001246633081 1059038671 /nfs/dbraw/zinc/03/86/71/1059038671.db2.gz DIVKSOWBNDDBTF-DHRZBBNESA-N 2 1 318.892 4.050 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246629977 1059039102 /nfs/dbraw/zinc/03/91/02/1059039102.db2.gz GUJFOWAYWRGHSM-NHCUHLMSSA-N 2 1 314.517 4.252 20 0 DIADMP C1C[NH2+][C@]2(C1)CCC[N@@H+]([C@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633778 1059039147 /nfs/dbraw/zinc/03/91/47/1059039147.db2.gz MMCQPAGVDJPMOW-AZUAARDMSA-N 2 1 304.522 4.488 20 0 DIADMP C1C[NH2+][C@]2(C1)CCC[N@H+]([C@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633778 1059039171 /nfs/dbraw/zinc/03/91/71/1059039171.db2.gz MMCQPAGVDJPMOW-AZUAARDMSA-N 2 1 304.522 4.488 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246633868 1059040562 /nfs/dbraw/zinc/04/05/62/1059040562.db2.gz MZQJXOKEEGHACU-KBXCAEBGSA-N 2 1 324.871 4.018 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246633868 1059040583 /nfs/dbraw/zinc/04/05/83/1059040583.db2.gz MZQJXOKEEGHACU-KBXCAEBGSA-N 2 1 324.871 4.018 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CCCC[C@@]34CC[NH2+]C4)CC2)cc1 ZINC001246643098 1059047816 /nfs/dbraw/zinc/04/78/16/1059047816.db2.gz LXVLZVRJGNLHFS-CBNMVNINSA-N 2 1 312.501 4.006 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246642925 1059048443 /nfs/dbraw/zinc/04/84/43/1059048443.db2.gz FQODWZSOKNQIOW-SFTDATJTSA-N 2 1 314.517 4.252 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001246645434 1059048727 /nfs/dbraw/zinc/04/87/27/1059048727.db2.gz AKOJMUPDFJCSFH-HXUWFJFHSA-N 2 1 314.517 4.396 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246646185 1059051258 /nfs/dbraw/zinc/05/12/58/1059051258.db2.gz OVZYGTZFJDJCDB-HNAYVOBHSA-N 2 1 320.908 4.125 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)CC2)cc1 ZINC001246655819 1059055391 /nfs/dbraw/zinc/05/53/91/1059055391.db2.gz ATAWCUXZERWCKD-JGJLBUBWSA-N 2 1 318.892 4.050 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)CC2)cc1 ZINC001246655819 1059055417 /nfs/dbraw/zinc/05/54/17/1059055417.db2.gz ATAWCUXZERWCKD-JGJLBUBWSA-N 2 1 318.892 4.050 20 0 DIADMP CC(C)CC[C@H](C)[N@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246675156 1059056844 /nfs/dbraw/zinc/05/68/44/1059056844.db2.gz WHBXALSBHSFGON-JBACZVJFSA-N 2 1 314.517 4.064 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CCC[N@H+]3C2CCCCCCC2)cc1 ZINC001246674940 1059057858 /nfs/dbraw/zinc/05/78/58/1059057858.db2.gz PDJJIFZNWLCVOP-NHCUHLMSSA-N 2 1 312.501 4.321 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246675896 1059059519 /nfs/dbraw/zinc/05/95/19/1059059519.db2.gz BFVVJMSICHZGQR-MVWVFHAYSA-N 2 1 320.480 4.248 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C[C@H]1C ZINC001246676825 1059061080 /nfs/dbraw/zinc/06/10/80/1059061080.db2.gz SXGBOFIYXYLPDP-JBYOPCTKSA-N 2 1 312.501 4.033 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2C)C[C@H](CC)[NH2+]1 ZINC001246682568 1059061558 /nfs/dbraw/zinc/06/15/58/1059061558.db2.gz WDOBBRCLISVURK-AJYBTWMASA-N 2 1 300.490 4.441 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)CC1CC[NH2+]CC1 ZINC001246682510 1059065347 /nfs/dbraw/zinc/06/53/47/1059065347.db2.gz VFQMDPXFXKPEEI-OAHLLOKOSA-N 2 1 324.534 4.001 20 0 DIADMP CC(C)=CCC[C@H](C)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246686332 1059069837 /nfs/dbraw/zinc/06/98/37/1059069837.db2.gz RNKHLAAKZBDGDO-TYPHKJRUSA-N 2 1 312.501 4.200 20 0 DIADMP CCC1CCC([N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001246687877 1059070430 /nfs/dbraw/zinc/07/04/30/1059070430.db2.gz XZNQHUSNGREMNP-HXJFWZBSSA-N 2 1 312.501 4.034 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246770304 1059072327 /nfs/dbraw/zinc/07/23/27/1059072327.db2.gz PZCQFWUFALXODB-IBGZPJMESA-N 2 1 300.490 4.211 20 0 DIADMP CCCC[N@H+](CCC)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246774803 1059072999 /nfs/dbraw/zinc/07/29/99/1059072999.db2.gz GUHHHUKLSHLCQK-PKOBYXMFSA-N 2 1 306.469 4.439 20 0 DIADMP CCCC[N@@H+](CCC)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246774803 1059073023 /nfs/dbraw/zinc/07/30/23/1059073023.db2.gz GUHHHUKLSHLCQK-PKOBYXMFSA-N 2 1 306.469 4.439 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246773357 1059076503 /nfs/dbraw/zinc/07/65/03/1059076503.db2.gz BKVQKBWLCZPXQP-IBGZPJMESA-N 2 1 308.469 4.194 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246778545 1059080218 /nfs/dbraw/zinc/08/02/18/1059080218.db2.gz QKKPNRCXFVWAJV-FPOVZHCZSA-N 2 1 308.469 4.194 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(C)cc2)C[C@H](CC)[NH2+]1 ZINC001246780996 1059080254 /nfs/dbraw/zinc/08/02/54/1059080254.db2.gz MPWSRLMATHRPMD-NMLBUPMWSA-N 2 1 300.490 4.441 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H](C[NH3+])C1 ZINC001246779443 1059082348 /nfs/dbraw/zinc/08/23/48/1059082348.db2.gz GYAWZHONPAFBCA-RBUKOAKNSA-N 2 1 322.496 4.268 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246787349 1059088320 /nfs/dbraw/zinc/08/83/20/1059088320.db2.gz PHLWNOQIEWWJRU-LPHOPBHVSA-N 2 1 316.464 4.275 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)cc1 ZINC001246783576 1059088543 /nfs/dbraw/zinc/08/85/43/1059088543.db2.gz CHMZLIGMSWTXQD-XBMUEBEBSA-N 2 1 318.892 4.399 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246787346 1059088582 /nfs/dbraw/zinc/08/85/82/1059088582.db2.gz PHLWNOQIEWWJRU-APWZRJJASA-N 2 1 316.464 4.275 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246791906 1059093535 /nfs/dbraw/zinc/09/35/35/1059093535.db2.gz PQSADZBDCTWFTO-QAPCUYQASA-N 2 1 318.892 4.399 20 0 DIADMP Fc1ccc(F)c([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246792212 1059094062 /nfs/dbraw/zinc/09/40/62/1059094062.db2.gz OMLOESRTDQSSKW-MNEFBYGVSA-N 2 1 320.427 4.024 20 0 DIADMP Clc1ccc(CCC2CC[NH+]([C@@H]3CCCC[NH2+]C3)CC2)cc1 ZINC001246792388 1059094155 /nfs/dbraw/zinc/09/41/55/1059094155.db2.gz VIUGMSUDYMQWHT-LJQANCHMSA-N 2 1 320.908 4.127 20 0 DIADMP Fc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246796038 1059095035 /nfs/dbraw/zinc/09/50/35/1059095035.db2.gz KMZXGMUDALFIOX-QFBILLFUSA-N 2 1 316.464 4.418 20 0 DIADMP Fc1ccccc1[C@H]1CCC[N@H+]1C1CCC2(CCC[NH2+]C2)CC1 ZINC001246793828 1059096164 /nfs/dbraw/zinc/09/61/64/1059096164.db2.gz FBLGEZJXRLZTLA-NQKNOSNGSA-N 2 1 316.464 4.275 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246793089 1059096927 /nfs/dbraw/zinc/09/69/27/1059096927.db2.gz CZXHNJUJWBJAJH-YDZRNGNQSA-N 2 1 304.453 4.272 20 0 DIADMP Fc1ccc(F)c([C@@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246792216 1059097454 /nfs/dbraw/zinc/09/74/54/1059097454.db2.gz OMLOESRTDQSSKW-SNRMKQJTSA-N 2 1 320.427 4.024 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2ccccc2OC)C[C@@H](CC)[NH2+]1 ZINC001246792524 1059097676 /nfs/dbraw/zinc/09/76/76/1059097676.db2.gz QLXBIEUVPPTQFA-GPMSIDNRSA-N 2 1 316.489 4.141 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)[C@H]1CCC[C@H](c2ccccc2)C1 ZINC001246795953 1059099299 /nfs/dbraw/zinc/09/92/99/1059099299.db2.gz JQZOHQQGELBZEZ-PMACEKPBSA-N 2 1 300.490 4.034 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001246807736 1059100613 /nfs/dbraw/zinc/10/06/13/1059100613.db2.gz QUBGTKRHNLEREN-DBXWQHBBSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001246807736 1059100620 /nfs/dbraw/zinc/10/06/20/1059100620.db2.gz QUBGTKRHNLEREN-DBXWQHBBSA-N 2 1 324.443 4.108 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246799365 1059101131 /nfs/dbraw/zinc/10/11/31/1059101131.db2.gz UARXZNXWFDIAQR-KRWDZBQOSA-N 2 1 306.881 4.227 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246801188 1059101155 /nfs/dbraw/zinc/10/11/55/1059101155.db2.gz RYWNWEGPHVZHCC-NJYVYQBISA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246801188 1059101158 /nfs/dbraw/zinc/10/11/58/1059101158.db2.gz RYWNWEGPHVZHCC-NJYVYQBISA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246801185 1059101632 /nfs/dbraw/zinc/10/16/32/1059101632.db2.gz RYWNWEGPHVZHCC-HBMCJLEFSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246801185 1059101638 /nfs/dbraw/zinc/10/16/38/1059101638.db2.gz RYWNWEGPHVZHCC-HBMCJLEFSA-N 2 1 324.443 4.456 20 0 DIADMP C[NH2+]C1CCC([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001246806413 1059101817 /nfs/dbraw/zinc/10/18/17/1059101817.db2.gz MZBDFHJYUSUREL-AOMIVXANSA-N 2 1 320.480 4.165 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246803503 1059102754 /nfs/dbraw/zinc/10/27/54/1059102754.db2.gz YRXSZDQTDMQAHA-BZSNNMDCSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)C[C@H](C)[NH2+]1 ZINC001246807598 1059103058 /nfs/dbraw/zinc/10/30/58/1059103058.db2.gz SLJQWJOHIJVMRZ-AXRVMRSRSA-N 2 1 320.480 4.163 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2CCCCCCC2)CC[NH2+]1 ZINC001246815267 1059107686 /nfs/dbraw/zinc/10/76/86/1059107686.db2.gz WVDUCIPTCSPAQV-IEBWSBKVSA-N 2 1 304.453 4.193 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821012 1059111816 /nfs/dbraw/zinc/11/18/16/1059111816.db2.gz HPIUYGROLAEZEM-OLZOCXBDSA-N 2 1 310.894 4.213 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821012 1059111821 /nfs/dbraw/zinc/11/18/21/1059111821.db2.gz HPIUYGROLAEZEM-OLZOCXBDSA-N 2 1 310.894 4.213 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821824 1059111884 /nfs/dbraw/zinc/11/18/84/1059111884.db2.gz JMXYHCTWXKPTPS-DGAVXFQQSA-N 2 1 310.894 4.212 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821824 1059111894 /nfs/dbraw/zinc/11/18/94/1059111894.db2.gz JMXYHCTWXKPTPS-DGAVXFQQSA-N 2 1 310.894 4.212 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H]3CCC[C@H]32)CCN1 ZINC001246818220 1059111973 /nfs/dbraw/zinc/11/19/73/1059111973.db2.gz AOSNHAPNNDLTNZ-MFHCWRBVSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]3CCC[C@H]32)CC[NH2+]1 ZINC001246818220 1059111982 /nfs/dbraw/zinc/11/19/82/1059111982.db2.gz AOSNHAPNNDLTNZ-MFHCWRBVSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H]3CCC[C@H]32)CC[NH2+]1 ZINC001246818220 1059111994 /nfs/dbraw/zinc/11/19/94/1059111994.db2.gz AOSNHAPNNDLTNZ-MFHCWRBVSA-N 2 1 316.464 4.192 20 0 DIADMP [NH3+][C@H]1C[C@@H](C(F)(F)F)C[N@@H+]([C@H]2CCCC3(CCCCC3)C2)C1 ZINC001246826812 1059114511 /nfs/dbraw/zinc/11/45/11/1059114511.db2.gz FDBZEPMYRNNDDB-ILXRZTDVSA-N 2 1 318.427 4.091 20 0 DIADMP [NH3+][C@H]1C[C@@H](C(F)(F)F)C[N@H+]([C@H]2CCCC3(CCCCC3)C2)C1 ZINC001246826812 1059114525 /nfs/dbraw/zinc/11/45/25/1059114525.db2.gz FDBZEPMYRNNDDB-ILXRZTDVSA-N 2 1 318.427 4.091 20 0 DIADMP CC(C)c1nc(C[N@@H+](C)C2CCC3(CC[NH2+]CC3)CC2)cs1 ZINC001246835628 1059115078 /nfs/dbraw/zinc/11/50/78/1059115078.db2.gz KOONIXUVRAXXBV-UHFFFAOYSA-N 2 1 321.534 4.011 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246842244 1059118825 /nfs/dbraw/zinc/11/88/25/1059118825.db2.gz XQLKYKPRBDWNFP-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC[NH2+]1 ZINC001246838895 1059120536 /nfs/dbraw/zinc/12/05/36/1059120536.db2.gz KDIGYYMCLXMUHC-FCHUYYIVSA-N 2 1 322.496 4.262 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)cc1 ZINC001246844483 1059122885 /nfs/dbraw/zinc/12/28/85/1059122885.db2.gz JHESIGMZLVPPNS-FCHUYYIVSA-N 2 1 322.496 4.044 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246844914 1059123024 /nfs/dbraw/zinc/12/30/24/1059123024.db2.gz DJNFCDSBGJWGHU-WMLDXEAASA-N 2 1 306.881 4.255 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2CCC(C(C)C)CC2)CC[NH2+]1 ZINC001246845519 1059124188 /nfs/dbraw/zinc/12/41/88/1059124188.db2.gz KOEZSURQURJVEG-UYAOXDASSA-N 2 1 318.480 4.295 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246844916 1059124377 /nfs/dbraw/zinc/12/43/77/1059124377.db2.gz DJNFCDSBGJWGHU-YOEHRIQHSA-N 2 1 306.881 4.255 20 0 DIADMP Fc1ccc([C@@H]2CC[N@@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246846405 1059125308 /nfs/dbraw/zinc/12/53/08/1059125308.db2.gz GWBXFOXKAYNJNY-HMXCVIKNSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccc([C@@H]2CC[N@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246846405 1059125330 /nfs/dbraw/zinc/12/53/30/1059125330.db2.gz GWBXFOXKAYNJNY-HMXCVIKNSA-N 2 1 324.443 4.108 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846705 1059126963 /nfs/dbraw/zinc/12/69/63/1059126963.db2.gz PZVRTOGCHPNVPB-UYAOXDASSA-N 2 1 318.480 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846705 1059126973 /nfs/dbraw/zinc/12/69/73/1059126973.db2.gz PZVRTOGCHPNVPB-UYAOXDASSA-N 2 1 318.480 4.439 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246850175 1059127301 /nfs/dbraw/zinc/12/73/01/1059127301.db2.gz HNMVXIOUPNKNAQ-GOSISDBHSA-N 2 1 322.452 4.053 20 0 DIADMP C1C[N@H+]([C@H]2CC[NH2+]C3(CCCCC3)C2)C[C@@H]1C1CCCCC1 ZINC001246847677 1059128798 /nfs/dbraw/zinc/12/87/98/1059128798.db2.gz KZFSYGSEJUGTSW-MOPGFXCFSA-N 2 1 304.522 4.344 20 0 DIADMP Fc1ccc([C@@H]2CC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246848191 1059128873 /nfs/dbraw/zinc/12/88/73/1059128873.db2.gz MOWIVDNPIKGPMC-MJGOQNOKSA-N 2 1 316.464 4.070 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001246849559 1059129250 /nfs/dbraw/zinc/12/92/50/1059129250.db2.gz GCINBLAEYAXVJU-GOSISDBHSA-N 2 1 310.441 4.053 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846704 1059129436 /nfs/dbraw/zinc/12/94/36/1059129436.db2.gz PZVRTOGCHPNVPB-QUCCMNQESA-N 2 1 318.480 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846704 1059129447 /nfs/dbraw/zinc/12/94/47/1059129447.db2.gz PZVRTOGCHPNVPB-QUCCMNQESA-N 2 1 318.480 4.439 20 0 DIADMP C[C@@H]1CC([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)C[C@@H](C)[NH2+]1 ZINC001246849513 1059130067 /nfs/dbraw/zinc/13/00/67/1059130067.db2.gz FOKLXLPUWUKJGV-IAGOWNOFSA-N 2 1 324.468 4.440 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)[C@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246853638 1059131188 /nfs/dbraw/zinc/13/11/88/1059131188.db2.gz RWXWVKJISNFBDZ-WMZOPIPTSA-N 2 1 316.489 4.143 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+]([C@@H]3CCC[C@]4(CC[NH2+]C4)C3)C2)cc1 ZINC001246852953 1059132923 /nfs/dbraw/zinc/13/29/23/1059132923.db2.gz PCMOFKNKXSCRTQ-QRQLOZEOSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+]([C@H]3CCC[C@@]4(CC[NH2+]C4)C3)C2)cc1 ZINC001246852952 1059133122 /nfs/dbraw/zinc/13/31/22/1059133122.db2.gz PCMOFKNKXSCRTQ-NZSAHSFTSA-N 2 1 318.892 4.052 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852138 1059133793 /nfs/dbraw/zinc/13/37/93/1059133793.db2.gz MVXCMQBINYJGBB-SZMVWBNQSA-N 2 1 320.908 4.296 20 0 DIADMP F[C@@H]1CCC2(C1)CC[NH+]([C@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246850643 1059134057 /nfs/dbraw/zinc/13/40/57/1059134057.db2.gz CGCTUQVVGDMDTL-SJORKVTESA-N 2 1 308.485 4.046 20 0 DIADMP CC[C@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246863800 1059135662 /nfs/dbraw/zinc/13/56/62/1059135662.db2.gz GIUMMILGSHYJNG-QUCCMNQESA-N 2 1 312.501 4.451 20 0 DIADMP CC[C@H]1c2ccccc2CC[N@H+]1C1CCC2(CCC[NH2+]C2)CC1 ZINC001246866305 1059136257 /nfs/dbraw/zinc/13/62/57/1059136257.db2.gz JEVTWFFJUDAKGK-CKHPTIKVSA-N 2 1 312.501 4.308 20 0 DIADMP C[NH2+]C[C@H]1CC[N@H+]([C@@H](C)CC(c2ccccc2)c2ccccc2)C1 ZINC001246861670 1059137752 /nfs/dbraw/zinc/13/77/52/1059137752.db2.gz CUUNZTXTCXKBFW-RBUKOAKNSA-N 2 1 322.496 4.138 20 0 DIADMP CC1(C)CCC([N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)CC1 ZINC001246862279 1059138506 /nfs/dbraw/zinc/13/85/06/1059138506.db2.gz QNYCGVYCCJCXPM-UHFFFAOYSA-N 2 1 312.501 4.092 20 0 DIADMP c1ccc(C2=CC[N@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)cc1 ZINC001246859337 1059138595 /nfs/dbraw/zinc/13/85/95/1059138595.db2.gz NQVIIWIEQYGNJA-VXKWHMMOSA-N 2 1 318.464 4.269 20 0 DIADMP c1ccc(C2=CC[N@@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)cc1 ZINC001246859337 1059138603 /nfs/dbraw/zinc/13/86/03/1059138603.db2.gz NQVIIWIEQYGNJA-VXKWHMMOSA-N 2 1 318.464 4.269 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2CC3(C2)CCCCC3)CC[NH2+]1 ZINC001246861051 1059138632 /nfs/dbraw/zinc/13/86/32/1059138632.db2.gz PXPKGMZNLGTRSG-HKUYNNGSSA-N 2 1 316.464 4.193 20 0 DIADMP C1C[C@@H](C2CCCCC2)[N@H+]([C@@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246867481 1059142262 /nfs/dbraw/zinc/14/22/62/1059142262.db2.gz XYQGUUWGYUOTOR-MOPGFXCFSA-N 2 1 304.522 4.486 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246870580 1059143032 /nfs/dbraw/zinc/14/30/32/1059143032.db2.gz YMLKQOMQWFKXGE-QRQLOZEOSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCc3cccc(Cl)c3C2)C[C@H](CC)[NH2+]1 ZINC001246876114 1059146615 /nfs/dbraw/zinc/14/66/15/1059146615.db2.gz YQOACUSXYZXVGW-ZSHCYNCHSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCc3cccc(Cl)c3C2)C[C@H](CC)[NH2+]1 ZINC001246876114 1059146618 /nfs/dbraw/zinc/14/66/18/1059146618.db2.gz YQOACUSXYZXVGW-ZSHCYNCHSA-N 2 1 306.881 4.007 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@@H+](C)CCC(c1ccccc1)c1ccccc1 ZINC001246881843 1059148770 /nfs/dbraw/zinc/14/87/70/1059148770.db2.gz KEFYWBGPBMQZDA-GOSISDBHSA-N 2 1 310.485 4.138 20 0 DIADMP C[NH2+]CC[C@H](C)[N@@H+](C)CCC(c1ccccc1)c1ccccc1 ZINC001246881844 1059149126 /nfs/dbraw/zinc/14/91/26/1059149126.db2.gz KEFYWBGPBMQZDA-SFHVURJKSA-N 2 1 310.485 4.138 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2C(C)C)CCN1 ZINC001246885266 1059150108 /nfs/dbraw/zinc/15/01/08/1059150108.db2.gz DFXUFUCCJMOMJN-YTQUADARSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2C(C)C)CC[NH2+]1 ZINC001246885266 1059150117 /nfs/dbraw/zinc/15/01/17/1059150117.db2.gz DFXUFUCCJMOMJN-YTQUADARSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2C(C)C)CC[NH2+]1 ZINC001246885266 1059150122 /nfs/dbraw/zinc/15/01/22/1059150122.db2.gz DFXUFUCCJMOMJN-YTQUADARSA-N 2 1 304.453 4.048 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CCN2)cc1 ZINC001246886569 1059151158 /nfs/dbraw/zinc/15/11/58/1059151158.db2.gz HLZWCSBKVYLNAQ-LMVRJCEZSA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886569 1059151168 /nfs/dbraw/zinc/15/11/68/1059151168.db2.gz HLZWCSBKVYLNAQ-LMVRJCEZSA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886569 1059151185 /nfs/dbraw/zinc/15/11/85/1059151185.db2.gz HLZWCSBKVYLNAQ-LMVRJCEZSA-N 2 1 318.464 4.066 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C1CCC2(C[NH2+]C2)CC1 ZINC001246889517 1059153408 /nfs/dbraw/zinc/15/34/08/1059153408.db2.gz QQRMYLIJLPQXRL-QGZVFWFLSA-N 2 1 316.514 4.078 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)c1 ZINC001246888028 1059153594 /nfs/dbraw/zinc/15/35/94/1059153594.db2.gz QFQDCSWGSFEUDW-VSZNYVQBSA-N 2 1 304.865 4.150 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1 ZINC001246889636 1059154297 /nfs/dbraw/zinc/15/42/97/1059154297.db2.gz RJEGRFJFJZFKKR-JYYAWHABSA-N 2 1 304.503 4.074 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1C[C@@H](C)[NH2+][C@H](C)C1 ZINC001246889632 1059156782 /nfs/dbraw/zinc/15/67/82/1059156782.db2.gz RJEGRFJFJZFKKR-CPUCHLNUSA-N 2 1 304.503 4.074 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+](C)C(C)(C)Cc2ccccc2)CC[NH2+]1 ZINC001246894422 1059158340 /nfs/dbraw/zinc/15/83/40/1059158340.db2.gz TYEUWUFXSCETNB-MOPGFXCFSA-N 2 1 302.506 4.250 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246900379 1059158667 /nfs/dbraw/zinc/15/86/67/1059158667.db2.gz IFALTAXKBUEWOS-CZAAIQMYSA-N 2 1 323.484 4.227 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246893110 1059160258 /nfs/dbraw/zinc/16/02/58/1059160258.db2.gz HNNLYHMXCKQRBI-VQTJNVASSA-N 2 1 310.485 4.438 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899741 1059160583 /nfs/dbraw/zinc/16/05/83/1059160583.db2.gz FYWITXUYHOGEEH-KRXQYRFLSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899741 1059160587 /nfs/dbraw/zinc/16/05/87/1059160587.db2.gz FYWITXUYHOGEEH-KRXQYRFLSA-N 2 1 322.443 4.411 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[NH2+]1 ZINC001246896008 1059160763 /nfs/dbraw/zinc/16/07/63/1059160763.db2.gz RSYWSAIAWIDVRJ-ZTTFOMCMSA-N 2 1 316.464 4.049 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+](CC)Cc2cccc(Cl)c2)CC[NH2+]1 ZINC001246903883 1059163785 /nfs/dbraw/zinc/16/37/85/1059163785.db2.gz LVBZTCHKEMPHQY-QZTJIDSGSA-N 2 1 308.897 4.473 20 0 DIADMP CC[N@H+](Cc1ccc(C)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246906756 1059166859 /nfs/dbraw/zinc/16/68/59/1059166859.db2.gz GNEIWRHTTYJZOP-SFTDATJTSA-N 2 1 308.469 4.310 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246906756 1059166878 /nfs/dbraw/zinc/16/68/78/1059166878.db2.gz GNEIWRHTTYJZOP-SFTDATJTSA-N 2 1 308.469 4.310 20 0 DIADMP CC[N@H+](Cc1ccc(C)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246906755 1059166952 /nfs/dbraw/zinc/16/69/52/1059166952.db2.gz GNEIWRHTTYJZOP-RTWAWAEBSA-N 2 1 308.469 4.310 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246906755 1059166957 /nfs/dbraw/zinc/16/69/57/1059166957.db2.gz GNEIWRHTTYJZOP-RTWAWAEBSA-N 2 1 308.469 4.310 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC001246907829 1059167745 /nfs/dbraw/zinc/16/77/45/1059167745.db2.gz JVBDWSMBKMGIBX-NHCUHLMSSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC001246907829 1059167752 /nfs/dbraw/zinc/16/77/52/1059167752.db2.gz JVBDWSMBKMGIBX-NHCUHLMSSA-N 2 1 308.469 4.229 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](CC)Cc2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC001246906983 1059168312 /nfs/dbraw/zinc/16/83/12/1059168312.db2.gz SZLFAFVZKBAVBP-HOTGVXAUSA-N 2 1 314.395 4.058 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1 ZINC001246909067 1059171501 /nfs/dbraw/zinc/17/15/01/1059171501.db2.gz ZDHXOBHPEUSVDD-YWVIFJGQSA-N 2 1 314.395 4.056 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)C2CCC(Cc3ccccc3)CC2)CC1 ZINC001246921720 1059174280 /nfs/dbraw/zinc/17/42/80/1059174280.db2.gz RDAYSLKUBOGJJC-UHFFFAOYSA-N 2 1 314.517 4.250 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@@H]1C[NH3+] ZINC001246918865 1059176363 /nfs/dbraw/zinc/17/63/63/1059176363.db2.gz XXPSRFBMCHXQLC-YLJYHZDGSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H]1C[NH3+] ZINC001246918865 1059176368 /nfs/dbraw/zinc/17/63/68/1059176368.db2.gz XXPSRFBMCHXQLC-YLJYHZDGSA-N 2 1 308.469 4.020 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246916914 1059176449 /nfs/dbraw/zinc/17/64/49/1059176449.db2.gz UMXWCJOFBJVZIO-PKOBYXMFSA-N 2 1 302.506 4.455 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932435 1059180836 /nfs/dbraw/zinc/18/08/36/1059180836.db2.gz AKKYKMWFULBBIK-HKUYNNGSSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932435 1059180845 /nfs/dbraw/zinc/18/08/45/1059180845.db2.gz AKKYKMWFULBBIK-HKUYNNGSSA-N 2 1 316.464 4.193 20 0 DIADMP CC[N@@H+](C[C@@H]1CC[NH2+]C1)[C@@H](C)CC(C)(C)SCc1ccco1 ZINC001246934363 1059183479 /nfs/dbraw/zinc/18/34/79/1059183479.db2.gz CPSBWNRPZGVDKD-JKSUJKDBSA-N 2 1 324.534 4.001 20 0 DIADMP CCCCCC1CCC([N@H+]2CC[C@@H]([NH3+])[C@H](C(F)(F)F)C2)CC1 ZINC001246933819 1059184399 /nfs/dbraw/zinc/18/43/99/1059184399.db2.gz JCNNCELZYMGECG-QDIHITRGSA-N 2 1 320.443 4.337 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246938313 1059184487 /nfs/dbraw/zinc/18/44/87/1059184487.db2.gz OZUQMIQQNNSEHT-PMACEKPBSA-N 2 1 314.517 4.252 20 0 DIADMP Cc1ccc(C[C@H](C)[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001246934031 1059184942 /nfs/dbraw/zinc/18/49/42/1059184942.db2.gz NBPZSKRREPPGAM-ICSRJNTNSA-N 2 1 314.517 4.170 20 0 DIADMP Fc1cccc(C[N@H+](C2CCC3(CC3)CC2)[C@H]2CCC[NH2+]C2)c1 ZINC001246939234 1059185091 /nfs/dbraw/zinc/18/50/91/1059185091.db2.gz UHLZUDQHFPRLKF-IBGZPJMESA-N 2 1 316.464 4.103 20 0 DIADMP Fc1cccc(C[N@@H+](C2CCC3(CC3)CC2)[C@H]2CCC[NH2+]C2)c1 ZINC001246939234 1059185103 /nfs/dbraw/zinc/18/51/03/1059185103.db2.gz UHLZUDQHFPRLKF-IBGZPJMESA-N 2 1 316.464 4.103 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@H]([NH3+])[C@@H](C(F)(F)F)C2)CC1 ZINC001246943003 1059187857 /nfs/dbraw/zinc/18/78/57/1059187857.db2.gz YSCZDMGRRDYHAS-WUCCLRPBSA-N 2 1 320.443 4.193 20 0 DIADMP CC(C)CC[C@H](C)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246944845 1059188273 /nfs/dbraw/zinc/18/82/73/1059188273.db2.gz VTJLBHRUOBRQCH-INIZCTEOSA-N 2 1 306.469 4.204 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC001246944756 1059189117 /nfs/dbraw/zinc/18/91/17/1059189117.db2.gz VIJKYGCAJIGFID-IGOJGBNBSA-N 2 1 318.480 4.204 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246946119 1059189817 /nfs/dbraw/zinc/18/98/17/1059189817.db2.gz FZDWEXXHQOYJOE-OTWHNJEPSA-N 2 1 318.892 4.399 20 0 DIADMP Fc1ccc(F)c([C@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246947976 1059196287 /nfs/dbraw/zinc/19/62/87/1059196287.db2.gz OMLOESRTDQSSKW-IPELMVKDSA-N 2 1 320.427 4.024 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CCCCC2)C2CC[NH2+]CC2)c1 ZINC001246951701 1059196408 /nfs/dbraw/zinc/19/64/08/1059196408.db2.gz NMFWDDAODKHHMJ-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP Cc1ccc(C[N@@H+](C2CC[NH2+]CC2)[C@H]2CCC[C@H](C)C2)c(F)c1 ZINC001246955646 1059199377 /nfs/dbraw/zinc/19/93/77/1059199377.db2.gz MRBDNVNJAATLRC-KXBFYZLASA-N 2 1 318.480 4.267 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246956814 1059203462 /nfs/dbraw/zinc/20/34/62/1059203462.db2.gz VOZRNXAHJKQUQS-MRXNPFEDSA-N 2 1 324.459 4.344 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956828 1059205699 /nfs/dbraw/zinc/20/56/99/1059205699.db2.gz WAYMSGBJTBBSAX-PBHICJAKSA-N 2 1 322.443 4.098 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001246962221 1059206980 /nfs/dbraw/zinc/20/69/80/1059206980.db2.gz IXVSEVVHZDLYCI-GOSISDBHSA-N 2 1 306.469 4.267 20 0 DIADMP CC[C@@H]1CC([N@@H+](Cc2ccccc2)C2CCC2)C[C@@H](CC)[NH2+]1 ZINC001246959211 1059208801 /nfs/dbraw/zinc/20/88/01/1059208801.db2.gz FRROBWJPQQFZGJ-QZTJIDSGSA-N 2 1 300.490 4.350 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2CC[NH2+][C@H](C(C)(C)C)C2)c1C ZINC001246970199 1059210531 /nfs/dbraw/zinc/21/05/31/1059210531.db2.gz XYUWFIRFHYMXGK-PMACEKPBSA-N 2 1 314.517 4.435 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246966490 1059212155 /nfs/dbraw/zinc/21/21/55/1059212155.db2.gz UQNFRYJQOXRNLD-FHWLQOOXSA-N 2 1 318.505 4.346 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001246969189 1059212614 /nfs/dbraw/zinc/21/26/14/1059212614.db2.gz VCNTYASWHPZIFV-VJFUWPCTSA-N 2 1 306.881 4.037 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1C ZINC001246965299 1059214128 /nfs/dbraw/zinc/21/41/28/1059214128.db2.gz HAMHQLPIFUAPKU-LEWJYISDSA-N 2 1 312.501 4.190 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246975276 1059215553 /nfs/dbraw/zinc/21/55/53/1059215553.db2.gz BNSDPRXJMGOJIA-SXLOBPIMSA-N 2 1 302.506 4.250 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](CCC)C[C@H]1CC[NH2+]C1 ZINC001246974640 1059216884 /nfs/dbraw/zinc/21/68/84/1059216884.db2.gz LDUKRKOZLPTEQS-VQTJNVASSA-N 2 1 302.506 4.109 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](CCC)C[C@@H]1CC[NH2+]C1 ZINC001246974642 1059217236 /nfs/dbraw/zinc/21/72/36/1059217236.db2.gz LDUKRKOZLPTEQS-WOJBJXKFSA-N 2 1 302.506 4.109 20 0 DIADMP C1CC([N@@H+](C2CC[NH2+]CC2)[C@@H]2CCCC3(CCCCC3)C2)C1 ZINC001246973681 1059217522 /nfs/dbraw/zinc/21/75/22/1059217522.db2.gz HUINAVRSOMLGSA-LJQANCHMSA-N 2 1 304.522 4.486 20 0 DIADMP CCCCCC[C@@H](CCCC)[N@H+]1CC[C@@H](N2CCC([NH3+])CC2)C1 ZINC001246974915 1059218437 /nfs/dbraw/zinc/21/84/37/1059218437.db2.gz KSADHNCMCMOXIA-WOJBJXKFSA-N 2 1 323.569 4.013 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@@H+](C[C@@H]3CCC[NH2+]C3)C3CC3)C2)cc1 ZINC001246973548 1059219311 /nfs/dbraw/zinc/21/93/11/1059219311.db2.gz ODFMVARDZCVOJF-YFVAEKQCSA-N 2 1 312.501 4.177 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)C1 ZINC001246999944 1059227964 /nfs/dbraw/zinc/22/79/64/1059227964.db2.gz CSNPPJWEMCMDDP-SFHVURJKSA-N 2 1 312.501 4.092 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001246999301 1059228356 /nfs/dbraw/zinc/22/83/56/1059228356.db2.gz ASXBYEZVECENTR-MJGOQNOKSA-N 2 1 314.517 4.338 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246987656 1059229369 /nfs/dbraw/zinc/22/93/69/1059229369.db2.gz NOOZVKHLXARQGD-HNNXBMFYSA-N 2 1 313.272 4.100 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246987656 1059229390 /nfs/dbraw/zinc/22/93/90/1059229390.db2.gz NOOZVKHLXARQGD-HNNXBMFYSA-N 2 1 313.272 4.100 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004583 1059231031 /nfs/dbraw/zinc/23/10/31/1059231031.db2.gz RWHDLLSHABLOMY-RCCFBDPRSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004583 1059231053 /nfs/dbraw/zinc/23/10/53/1059231053.db2.gz RWHDLLSHABLOMY-RCCFBDPRSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004558 1059231486 /nfs/dbraw/zinc/23/14/86/1059231486.db2.gz RWHDLLSHABLOMY-KSZLIROESA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004558 1059231506 /nfs/dbraw/zinc/23/15/06/1059231506.db2.gz RWHDLLSHABLOMY-KSZLIROESA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@](C)(C[NH3+])C1 ZINC001247001812 1059232557 /nfs/dbraw/zinc/23/25/57/1059232557.db2.gz LLQNPJHRTVRNGP-CRAIPNDOSA-N 2 1 324.534 4.131 20 0 DIADMP Fc1cc(F)cc([C@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001247003728 1059232474 /nfs/dbraw/zinc/23/24/74/1059232474.db2.gz PTNGZQJROPNKIG-QZTJIDSGSA-N 2 1 320.427 4.024 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001782 1059233230 /nfs/dbraw/zinc/23/32/30/1059233230.db2.gz LEYAHJZYZJDYEF-GUDVDZBRSA-N 2 1 322.443 4.413 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001782 1059233250 /nfs/dbraw/zinc/23/32/50/1059233250.db2.gz LEYAHJZYZJDYEF-GUDVDZBRSA-N 2 1 322.443 4.413 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006106 1059234311 /nfs/dbraw/zinc/23/43/11/1059234311.db2.gz WRRQLNHKFVGAIX-RNVRALISSA-N 2 1 318.480 4.438 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006106 1059234325 /nfs/dbraw/zinc/23/43/25/1059234325.db2.gz WRRQLNHKFVGAIX-RNVRALISSA-N 2 1 318.480 4.438 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001247007683 1059236076 /nfs/dbraw/zinc/23/60/76/1059236076.db2.gz GPYGQXILNDRBRI-OAHLLOKOSA-N 2 1 318.530 4.001 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2Cc3ccccc3C23CC[NH2+]CC3)CC(C)(C)C1 ZINC001247013548 1059245036 /nfs/dbraw/zinc/24/50/36/1059245036.db2.gz ZUOWRJWDUXOQRA-SJLPKXTDSA-N 2 1 312.501 4.296 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC(C)(C)C1 ZINC001247016347 1059247069 /nfs/dbraw/zinc/24/70/69/1059247069.db2.gz UBYNXCGUWQAMRL-AEFFLSMTSA-N 2 1 312.501 4.296 20 0 DIADMP CCCC[C@H](CCC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247016206 1059247106 /nfs/dbraw/zinc/24/71/06/1059247106.db2.gz SPQDMDBBJFSPDR-SFHVURJKSA-N 2 1 300.490 4.440 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H](OC)C2CCCCC2)CC1 ZINC001559489580 1059266040 /nfs/dbraw/zinc/26/60/40/1059266040.db2.gz XJXXPWKCYBXMQS-FQEVSTJZSA-N 2 1 324.553 4.026 20 0 DIADMP CC(C)(C)CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594635 1059426988 /nfs/dbraw/zinc/42/69/88/1059426988.db2.gz RXQOYLCICASASE-VQTJNVASSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594635 1059427006 /nfs/dbraw/zinc/42/70/06/1059427006.db2.gz RXQOYLCICASASE-VQTJNVASSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594635 1059427013 /nfs/dbraw/zinc/42/70/13/1059427013.db2.gz RXQOYLCICASASE-VQTJNVASSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)[C@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001559595788 1059429403 /nfs/dbraw/zinc/42/94/03/1059429403.db2.gz GXDMJRMGOUTICJ-FQEVSTJZSA-N 2 1 300.490 4.150 20 0 DIADMP CC(C)[NH2+][C@H]1CCC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559634399 1059460428 /nfs/dbraw/zinc/46/04/28/1059460428.db2.gz NQYZRMJAEGUMSF-RLLQIKCJSA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)[NH2+][C@H]1CCC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559634399 1059460439 /nfs/dbraw/zinc/46/04/39/1059460439.db2.gz NQYZRMJAEGUMSF-RLLQIKCJSA-N 2 1 300.490 4.033 20 0 DIADMP Cc1c2ccccc2sc1[C@@H](C)[NH2+]CCCc1c[nH+]cn1C ZINC001559729804 1059561925 /nfs/dbraw/zinc/56/19/25/1059561925.db2.gz LJMFZHZWNRQYJN-CQSZACIVSA-N 2 1 313.470 4.227 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737195 1059570022 /nfs/dbraw/zinc/57/00/22/1059570022.db2.gz GGUGCAGRLYZEHF-HZPDHXFCSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737195 1059570048 /nfs/dbraw/zinc/57/00/48/1059570048.db2.gz GGUGCAGRLYZEHF-HZPDHXFCSA-N 2 1 320.908 4.391 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](CCCCc2cccc(Cl)c2)CC1 ZINC001559749065 1059583019 /nfs/dbraw/zinc/58/30/19/1059583019.db2.gz DWUOXBHBQLTWEV-SFHVURJKSA-N 2 1 308.897 4.079 20 0 DIADMP Cc1ccoc1C[N@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001559862590 1059682636 /nfs/dbraw/zinc/68/26/36/1059682636.db2.gz VIJMXEOLTIZFPU-UHFFFAOYSA-N 2 1 312.457 4.206 20 0 DIADMP Cc1c(C)c(C)c(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c(C)c1C ZINC001559864279 1059685775 /nfs/dbraw/zinc/68/57/75/1059685775.db2.gz ZNRZQFHWQJBSJI-OAQYLSRUSA-N 2 1 314.517 4.146 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c(C)c1C ZINC001559864279 1059685781 /nfs/dbraw/zinc/68/57/81/1059685781.db2.gz ZNRZQFHWQJBSJI-OAQYLSRUSA-N 2 1 314.517 4.146 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c(C)c1C ZINC001559864279 1059685790 /nfs/dbraw/zinc/68/57/90/1059685790.db2.gz ZNRZQFHWQJBSJI-OAQYLSRUSA-N 2 1 314.517 4.146 20 0 DIADMP CCCC[N@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001560036766 1059850032 /nfs/dbraw/zinc/85/00/32/1059850032.db2.gz MHXRCGQQRVOSBZ-HXUWFJFHSA-N 2 1 314.517 4.409 20 0 DIADMP CCCC[N@@H+](CC1CC(F)(F)C1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001560035823 1059852843 /nfs/dbraw/zinc/85/28/43/1059852843.db2.gz IPLOBSQELRVSFK-UHFFFAOYSA-N 2 1 316.480 4.443 20 0 DIADMP C[NH+]1C[C@@]2(C)C[NH+](Cc3ccc(C4CCCC4)cc3)C[C@]2(C)C1 ZINC001560044083 1059855528 /nfs/dbraw/zinc/85/55/28/1059855528.db2.gz SZFHEEZEIJAQGI-SFTDATJTSA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+]1C[C@@]2(C)C[NH+](CCCc3cccc4ccccc43)C[C@]2(C)C1 ZINC001560043730 1059855757 /nfs/dbraw/zinc/85/57/57/1059855757.db2.gz ITHCTGIESHLESU-VXKWHMMOSA-N 2 1 322.496 4.046 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001560068675 1059881142 /nfs/dbraw/zinc/88/11/42/1059881142.db2.gz FUOVLNGUHFHKGC-FXAWDEMLSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001560068675 1059881169 /nfs/dbraw/zinc/88/11/69/1059881169.db2.gz FUOVLNGUHFHKGC-FXAWDEMLSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC001560077685 1059891218 /nfs/dbraw/zinc/89/12/18/1059891218.db2.gz UJIJPZDKVNCVAP-SZVBFZGTSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@H]2[C@H](CC[N@@H+]2C)C1 ZINC001560077685 1059891242 /nfs/dbraw/zinc/89/12/42/1059891242.db2.gz UJIJPZDKVNCVAP-SZVBFZGTSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC001560077685 1059891267 /nfs/dbraw/zinc/89/12/67/1059891267.db2.gz UJIJPZDKVNCVAP-SZVBFZGTSA-N 2 1 300.490 4.071 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](Cc2ccc(CF)cc2)CC1 ZINC001560107658 1059915811 /nfs/dbraw/zinc/91/58/11/1059915811.db2.gz YIHIRFLODMOIKF-UHFFFAOYSA-N 2 1 318.480 4.387 20 0 DIADMP Cc1[nH]c(C2CC[NH+](C[C@H]3CCCCC3(C)C)CC2)[nH+]c1C ZINC001560149795 1059948277 /nfs/dbraw/zinc/94/82/77/1059948277.db2.gz WVRWGNIDEHAXLH-QGZVFWFLSA-N 2 1 303.494 4.422 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1[C@H](C)c1ccccc1 ZINC001560162777 1059956446 /nfs/dbraw/zinc/95/64/46/1059956446.db2.gz ALIKTNJMIYUTHG-YLJYHZDGSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1[C@H](C)c1ccccc1 ZINC001560162777 1059956465 /nfs/dbraw/zinc/95/64/65/1059956465.db2.gz ALIKTNJMIYUTHG-YLJYHZDGSA-N 2 1 311.473 4.240 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1ccc2oc3ccccc3c2c1 ZINC001560263194 1060029948 /nfs/dbraw/zinc/02/99/48/1060029948.db2.gz SSWWRAJPUBUFQE-UHFFFAOYSA-N 2 1 310.441 4.406 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc2oc3ccccc3c2c1 ZINC001560263194 1060029967 /nfs/dbraw/zinc/02/99/67/1060029967.db2.gz SSWWRAJPUBUFQE-UHFFFAOYSA-N 2 1 310.441 4.406 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560270054 1060040532 /nfs/dbraw/zinc/04/05/32/1060040532.db2.gz DETZMODYUIXZGI-GASCZTMLSA-N 2 1 308.897 4.106 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC001560270980 1060044312 /nfs/dbraw/zinc/04/43/12/1060044312.db2.gz QCCUHRGIKDEKPP-MRXNPFEDSA-N 2 1 314.473 4.343 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(Cl)c1F ZINC001560270627 1060044686 /nfs/dbraw/zinc/04/46/86/1060044686.db2.gz BYOQMMZCGBFAIZ-CQSZACIVSA-N 2 1 312.860 4.223 20 0 DIADMP c1csc(-c2ccc(CN[C@@H]3CC[N@H+]4CCCC[C@@H]34)cc2)c1 ZINC001560271556 1060045686 /nfs/dbraw/zinc/04/56/86/1060045686.db2.gz PHHYBHKDZUUYOK-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CCN4CCCC[C@@H]34)cc2)c1 ZINC001560271556 1060045708 /nfs/dbraw/zinc/04/57/08/1060045708.db2.gz PHHYBHKDZUUYOK-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@@H]34)cc2)c1 ZINC001560271556 1060045729 /nfs/dbraw/zinc/04/57/29/1060045729.db2.gz PHHYBHKDZUUYOK-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@@H]34)cc2)c1 ZINC001560271556 1060045749 /nfs/dbraw/zinc/04/57/49/1060045749.db2.gz PHHYBHKDZUUYOK-MSOLQXFVSA-N 2 1 312.482 4.132 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1ccc(F)cc1 ZINC001560271182 1060045785 /nfs/dbraw/zinc/04/57/85/1060045785.db2.gz YHIACGXYXBIHLB-QLBOMPFWSA-N 2 1 304.453 4.083 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[NH2+]CC(C)(C)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560292650 1060074213 /nfs/dbraw/zinc/07/42/13/1060074213.db2.gz RLLHLGJCPCCOFQ-NBMJBFSESA-N 2 1 306.538 4.325 20 0 DIADMP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1 ZINC001560301568 1060085934 /nfs/dbraw/zinc/08/59/34/1060085934.db2.gz YMMPONRMIQBVJH-HNNXBMFYSA-N 2 1 316.420 4.048 20 0 DIADMP CC[N@H+](CC[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1)C(C)C ZINC001560306314 1060092450 /nfs/dbraw/zinc/09/24/50/1060092450.db2.gz BFIHVDLMPMITNW-VQTJNVASSA-N 2 1 302.506 4.423 20 0 DIADMP CC[N@@H+](CC[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1)C(C)C ZINC001560306314 1060092474 /nfs/dbraw/zinc/09/24/74/1060092474.db2.gz BFIHVDLMPMITNW-VQTJNVASSA-N 2 1 302.506 4.423 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+]CC1(CCOC)CCCCC1 ZINC001560320648 1060106676 /nfs/dbraw/zinc/10/66/76/1060106676.db2.gz IFLOJWOYPVRDON-IBGZPJMESA-N 2 1 324.553 4.218 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+]CC1(CCOC)CCCCC1 ZINC001560320648 1060106685 /nfs/dbraw/zinc/10/66/85/1060106685.db2.gz IFLOJWOYPVRDON-IBGZPJMESA-N 2 1 324.553 4.218 20 0 DIADMP CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@H+](CC3CCCC3)C2)C1 ZINC001560360238 1060146669 /nfs/dbraw/zinc/14/66/69/1060146669.db2.gz GVLXFCJKSKTTBI-RLLQIKCJSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@@H+](CC3CCCC3)C2)C1 ZINC001560360238 1060146676 /nfs/dbraw/zinc/14/66/76/1060146676.db2.gz GVLXFCJKSKTTBI-RLLQIKCJSA-N 2 1 306.538 4.445 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)s1 ZINC001560362314 1060149188 /nfs/dbraw/zinc/14/91/88/1060149188.db2.gz DXSIGDYLJXJVNW-UHFFFAOYSA-N 2 1 306.519 4.252 20 0 DIADMP CCc1cccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001560418391 1060201745 /nfs/dbraw/zinc/20/17/45/1060201745.db2.gz LLWWTACPDANILN-GCJKJVERSA-N 2 1 322.496 4.249 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001560435568 1060223634 /nfs/dbraw/zinc/22/36/34/1060223634.db2.gz TYGHDVKKVGCCMR-RBUKOAKNSA-N 2 1 314.517 4.354 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H]3CCC[C@H]3C3CC3)CC2)cc1 ZINC001560503477 1060298809 /nfs/dbraw/zinc/29/88/09/1060298809.db2.gz OAXAKHSFNHVYNT-CTNGQTDRSA-N 2 1 312.501 4.067 20 0 DIADMP CCC(C)(C)[C@@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001560531133 1060332044 /nfs/dbraw/zinc/33/20/44/1060332044.db2.gz VFYFUGSQIPWMQL-MRXNPFEDSA-N 2 1 320.496 4.247 20 0 DIADMP c1cnc2cccc(C[NH2+]C[C@H]3CC[N@@H+]3C3CCCCCC3)c2c1 ZINC001560562102 1060372984 /nfs/dbraw/zinc/37/29/84/1060372984.db2.gz KEHNXQSCNKMEAZ-LJQANCHMSA-N 2 1 323.484 4.122 20 0 DIADMP c1cnc2cccc(C[NH2+]C[C@H]3CC[N@H+]3C3CCCCCC3)c2c1 ZINC001560562102 1060372998 /nfs/dbraw/zinc/37/29/98/1060372998.db2.gz KEHNXQSCNKMEAZ-LJQANCHMSA-N 2 1 323.484 4.122 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC[C@@H]2C=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001560576909 1060389938 /nfs/dbraw/zinc/38/99/38/1060389938.db2.gz UDOWUAJMFBPSAC-SBHAEUEKSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC[C@@H]2C=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001560576909 1060389954 /nfs/dbraw/zinc/38/99/54/1060389954.db2.gz UDOWUAJMFBPSAC-SBHAEUEKSA-N 2 1 312.501 4.376 20 0 DIADMP Cc1occc1C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001560629626 1060442136 /nfs/dbraw/zinc/44/21/36/1060442136.db2.gz XXKGPUIDSQQHRK-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1occc1C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001560629626 1060442144 /nfs/dbraw/zinc/44/21/44/1060442144.db2.gz XXKGPUIDSQQHRK-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1occc1C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001560629626 1060442152 /nfs/dbraw/zinc/44/21/52/1060442152.db2.gz XXKGPUIDSQQHRK-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1occc1C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001560629626 1060442161 /nfs/dbraw/zinc/44/21/61/1060442161.db2.gz XXKGPUIDSQQHRK-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCc2ccc(C(C)(C)C)cc2)C1 ZINC001560661413 1060487228 /nfs/dbraw/zinc/48/72/28/1060487228.db2.gz CFSYYEMTHOGECN-LJQANCHMSA-N 2 1 316.533 4.190 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560668786 1060496147 /nfs/dbraw/zinc/49/61/47/1060496147.db2.gz UWVIYICFVKVLBU-NJYVYQBISA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560668786 1060496154 /nfs/dbraw/zinc/49/61/54/1060496154.db2.gz UWVIYICFVKVLBU-NJYVYQBISA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560668786 1060496158 /nfs/dbraw/zinc/49/61/58/1060496158.db2.gz UWVIYICFVKVLBU-NJYVYQBISA-N 2 1 314.517 4.303 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC001560681003 1060521040 /nfs/dbraw/zinc/52/10/40/1060521040.db2.gz RVIYDHBXUWTFHX-SFTDATJTSA-N 2 1 314.517 4.303 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC001560681003 1060521059 /nfs/dbraw/zinc/52/10/59/1060521059.db2.gz RVIYDHBXUWTFHX-SFTDATJTSA-N 2 1 314.517 4.303 20 0 DIADMP CCc1cccc(Cl)c1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC001560680879 1060523239 /nfs/dbraw/zinc/52/32/39/1060523239.db2.gz QQHKJUXFMAHMQD-UHFFFAOYSA-N 2 1 322.924 4.455 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001560704054 1060560537 /nfs/dbraw/zinc/56/05/37/1060560537.db2.gz WFPCYNMBBPOMEU-LELZANKISA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)c1ccc(C[C@H]2CC[N@@H+](CC3CC[NH+](C)CC3)C2)cc1 ZINC001560731977 1060601137 /nfs/dbraw/zinc/60/11/37/1060601137.db2.gz AFBJLMNWAPWKEI-HXUWFJFHSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)CS1 ZINC001560792043 1060651755 /nfs/dbraw/zinc/65/17/55/1060651755.db2.gz XMNPWRWBSCTOTK-NJAFHUGGSA-N 2 1 324.578 4.293 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)CS1 ZINC001560792043 1060651763 /nfs/dbraw/zinc/65/17/63/1060651763.db2.gz XMNPWRWBSCTOTK-NJAFHUGGSA-N 2 1 324.578 4.293 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@@H]1Cc1ccc(Cl)cc1 ZINC001560803613 1060663279 /nfs/dbraw/zinc/66/32/79/1060663279.db2.gz BBVUXKAHZUTXLL-SUMDDJOVSA-N 2 1 322.924 4.371 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001560803872 1060664174 /nfs/dbraw/zinc/66/41/74/1060664174.db2.gz IJZNOPBXZRHLSC-QWHCGFSZSA-N 2 1 302.915 4.043 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001560804275 1060666719 /nfs/dbraw/zinc/66/67/19/1060666719.db2.gz XYXSYVOMLHFUSE-OLMNPRSZSA-N 2 1 308.897 4.296 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)CCc1ccc(F)cc1Cl ZINC001560811231 1060671287 /nfs/dbraw/zinc/67/12/87/1060671287.db2.gz CHOKTIFKTJDLOK-UHFFFAOYSA-N 2 1 314.876 4.075 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC001560844819 1060700686 /nfs/dbraw/zinc/70/06/86/1060700686.db2.gz BUIWDGXNXDLKCH-ACRUOGEOSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560869400 1060729873 /nfs/dbraw/zinc/72/98/73/1060729873.db2.gz GRVOWEKUOVMRFB-DFQSSKMNSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560869400 1060729889 /nfs/dbraw/zinc/72/98/89/1060729889.db2.gz GRVOWEKUOVMRFB-DFQSSKMNSA-N 2 1 302.506 4.207 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1 ZINC001560870971 1060733075 /nfs/dbraw/zinc/73/30/75/1060733075.db2.gz VATCJBREMJCXQM-HOJAQTOUSA-N 2 1 302.506 4.421 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1 ZINC001560870971 1060733081 /nfs/dbraw/zinc/73/30/81/1060733081.db2.gz VATCJBREMJCXQM-HOJAQTOUSA-N 2 1 302.506 4.421 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC001560877990 1060739286 /nfs/dbraw/zinc/73/92/86/1060739286.db2.gz JFZOWEZGLDTVPM-OBXNSHGQSA-N 2 1 314.517 4.282 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)C1 ZINC001560877892 1060739505 /nfs/dbraw/zinc/73/95/05/1060739505.db2.gz GMLBTQDZMJOFDB-YZGWKJHDSA-N 2 1 300.490 4.034 20 0 DIADMP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC[N@@H+]1CCCC1(C)C ZINC001560882416 1060742896 /nfs/dbraw/zinc/74/28/96/1060742896.db2.gz KOKRJNCMVIRFJD-KRWDZBQOSA-N 2 1 308.897 4.125 20 0 DIADMP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC[N@H+]1CCCC1(C)C ZINC001560882416 1060742915 /nfs/dbraw/zinc/74/29/15/1060742915.db2.gz KOKRJNCMVIRFJD-KRWDZBQOSA-N 2 1 308.897 4.125 20 0 DIADMP C[C@@H]1CCC(C)(C)C[C@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901256 1060763777 /nfs/dbraw/zinc/76/37/77/1060763777.db2.gz OMTRDJHCEPGJRW-RSPOEFSDSA-N 2 1 314.517 4.136 20 0 DIADMP CC[C@@H]1CCCC[C@H]1C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901146 1060764461 /nfs/dbraw/zinc/76/44/61/1060764461.db2.gz MEVDVEMKMNWOFD-PMXSJFBMSA-N 2 1 314.517 4.138 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938198 1060802422 /nfs/dbraw/zinc/80/24/22/1060802422.db2.gz YBIUIGIQNUKQSC-ZBFHGGJFSA-N 2 1 314.464 4.197 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938198 1060802436 /nfs/dbraw/zinc/80/24/36/1060802436.db2.gz YBIUIGIQNUKQSC-ZBFHGGJFSA-N 2 1 314.464 4.197 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001560950859 1060816365 /nfs/dbraw/zinc/81/63/65/1060816365.db2.gz PTKGSQUZQNKKMA-SFTDATJTSA-N 2 1 314.517 4.028 20 0 DIADMP CC1(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@]3(C)C2)CCCC1 ZINC001560998689 1060859091 /nfs/dbraw/zinc/85/90/91/1060859091.db2.gz DPUAOGZOQRMYBZ-CTNGQTDRSA-N 2 1 312.501 4.021 20 0 DIADMP CC1(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@]3(C)C2)CCCC1 ZINC001560998689 1060859100 /nfs/dbraw/zinc/85/91/00/1060859100.db2.gz DPUAOGZOQRMYBZ-CTNGQTDRSA-N 2 1 312.501 4.021 20 0 DIADMP CC1(C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@@]3(C)C2)CCCC1 ZINC001560998689 1060859112 /nfs/dbraw/zinc/85/91/12/1060859112.db2.gz DPUAOGZOQRMYBZ-CTNGQTDRSA-N 2 1 312.501 4.021 20 0 DIADMP CC1(C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@@]3(C)C2)CCCC1 ZINC001560998689 1060859118 /nfs/dbraw/zinc/85/91/18/1060859118.db2.gz DPUAOGZOQRMYBZ-CTNGQTDRSA-N 2 1 312.501 4.021 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)[C@H]1CCCc2ccc(F)cc21 ZINC001473191003 1060944157 /nfs/dbraw/zinc/94/41/57/1060944157.db2.gz CYWKTMRBVXNBPW-HKUYNNGSSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)[C@H]1CCCc2ccc(F)cc21 ZINC001473191003 1060944178 /nfs/dbraw/zinc/94/41/78/1060944178.db2.gz CYWKTMRBVXNBPW-HKUYNNGSSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)[C@H]1CCCc2ccc(F)cc21 ZINC001473191003 1060944198 /nfs/dbraw/zinc/94/41/98/1060944198.db2.gz CYWKTMRBVXNBPW-HKUYNNGSSA-N 2 1 304.453 4.009 20 0 DIADMP C[N@@H+](C/C=C/c1ccc(Cl)cc1)CC[C@@H]1CCCC[NH+]1C ZINC001473191498 1060948421 /nfs/dbraw/zinc/94/84/21/1060948421.db2.gz GULRAUCVGNDIND-QWNKOJSDSA-N 2 1 306.881 4.159 20 0 DIADMP C[N@H+](C/C=C/c1ccc(Cl)cc1)CC[C@@H]1CCCC[NH+]1C ZINC001473191498 1060948443 /nfs/dbraw/zinc/94/84/43/1060948443.db2.gz GULRAUCVGNDIND-QWNKOJSDSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C/c1ccc(Cl)cc1)CC[C@@H]1CCCC[N@@H+]1C ZINC001473191498 1060948462 /nfs/dbraw/zinc/94/84/62/1060948462.db2.gz GULRAUCVGNDIND-QWNKOJSDSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C/c1ccc(Cl)cc1)CC[C@@H]1CCCC[N@H+]1C ZINC001473191498 1060948482 /nfs/dbraw/zinc/94/84/82/1060948482.db2.gz GULRAUCVGNDIND-QWNKOJSDSA-N 2 1 306.881 4.159 20 0 DIADMP CC[NH+]1CCC([N@H+](C)CC2CCC(c3ccccc3)CC2)CC1 ZINC001473208561 1060976366 /nfs/dbraw/zinc/97/63/66/1060976366.db2.gz FQTXSARNCDIMKA-UHFFFAOYSA-N 2 1 314.517 4.377 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)CC2CCC(c3ccccc3)CC2)CC1 ZINC001473208561 1060976391 /nfs/dbraw/zinc/97/63/91/1060976391.db2.gz FQTXSARNCDIMKA-UHFFFAOYSA-N 2 1 314.517 4.377 20 0 DIADMP CC(C)=CCC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219767 1060994362 /nfs/dbraw/zinc/99/43/62/1060994362.db2.gz MUXJAXSHZUVXBY-SFTDATJTSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219767 1060994376 /nfs/dbraw/zinc/99/43/76/1060994376.db2.gz MUXJAXSHZUVXBY-SFTDATJTSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219767 1060994389 /nfs/dbraw/zinc/99/43/89/1060994389.db2.gz MUXJAXSHZUVXBY-SFTDATJTSA-N 2 1 312.501 4.329 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC001473220525 1060998506 /nfs/dbraw/zinc/99/85/06/1060998506.db2.gz WTAYHURTRGRBMN-AZUAARDMSA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC001473220525 1060998516 /nfs/dbraw/zinc/99/85/16/1060998516.db2.gz WTAYHURTRGRBMN-AZUAARDMSA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC001473220525 1060998529 /nfs/dbraw/zinc/99/85/29/1060998529.db2.gz WTAYHURTRGRBMN-AZUAARDMSA-N 2 1 314.517 4.290 20 0 DIADMP CC(C)=CCC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219765 1060999020 /nfs/dbraw/zinc/99/90/20/1060999020.db2.gz MUXJAXSHZUVXBY-RTWAWAEBSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219765 1060999043 /nfs/dbraw/zinc/99/90/43/1060999043.db2.gz MUXJAXSHZUVXBY-RTWAWAEBSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219765 1060999065 /nfs/dbraw/zinc/99/90/65/1060999065.db2.gz MUXJAXSHZUVXBY-RTWAWAEBSA-N 2 1 312.501 4.329 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001462183226 1061001540 /nfs/dbraw/zinc/00/15/40/1061001540.db2.gz YHRGSJVIEBBWLO-IGGJEDBVSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001462183226 1061001558 /nfs/dbraw/zinc/00/15/58/1061001558.db2.gz YHRGSJVIEBBWLO-IGGJEDBVSA-N 2 1 312.501 4.380 20 0 DIADMP CSCC[C@@H](C)[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001473241082 1061018418 /nfs/dbraw/zinc/01/84/18/1061018418.db2.gz XZUKTYFLBKUZSE-QGZVFWFLSA-N 2 1 320.546 4.246 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1c(C)cc(Cl)cc1C ZINC001462196820 1061021992 /nfs/dbraw/zinc/02/19/92/1061021992.db2.gz FUGMZOSXQOOIPR-UHFFFAOYSA-N 2 1 308.897 4.265 20 0 DIADMP CC[C@@H]1CCC[C@@H](C[N@@H+](C)CCCN(C)Cc2ccco2)C1 ZINC001462218951 1061034405 /nfs/dbraw/zinc/03/44/05/1061034405.db2.gz MHVZPMHUQGGKBH-QZTJIDSGSA-N 2 1 306.494 4.250 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC001473262429 1061036420 /nfs/dbraw/zinc/03/64/20/1061036420.db2.gz JZIHMOORBUKALP-FQEVSTJZSA-N 2 1 313.489 4.427 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC001473262429 1061036440 /nfs/dbraw/zinc/03/64/40/1061036440.db2.gz JZIHMOORBUKALP-FQEVSTJZSA-N 2 1 313.489 4.427 20 0 DIADMP CC[C@H]1CCC[C@H](C[N@@H+](C)CCCN(C)Cc2ccco2)C1 ZINC001462218953 1061036752 /nfs/dbraw/zinc/03/67/52/1061036752.db2.gz MHVZPMHUQGGKBH-ROUUACIJSA-N 2 1 306.494 4.250 20 0 DIADMP CC(C)SCC[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462222868 1061037453 /nfs/dbraw/zinc/03/74/53/1061037453.db2.gz XJMWQQQFTJYUAN-HKUYNNGSSA-N 2 1 318.530 4.086 20 0 DIADMP CC(C)SCC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462222868 1061037464 /nfs/dbraw/zinc/03/74/64/1061037464.db2.gz XJMWQQQFTJYUAN-HKUYNNGSSA-N 2 1 318.530 4.086 20 0 DIADMP CC(C)SCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462222881 1061037940 /nfs/dbraw/zinc/03/79/40/1061037940.db2.gz XJMWQQQFTJYUAN-MJGOQNOKSA-N 2 1 318.530 4.086 20 0 DIADMP CC(C)SCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462222881 1061037954 /nfs/dbraw/zinc/03/79/54/1061037954.db2.gz XJMWQQQFTJYUAN-MJGOQNOKSA-N 2 1 318.530 4.086 20 0 DIADMP CC(C)[C@H](C[NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC001462222075 1061039595 /nfs/dbraw/zinc/03/95/95/1061039595.db2.gz MRRCKDZITSCLIL-IBGZPJMESA-N 2 1 320.908 4.296 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC001462265909 1061062417 /nfs/dbraw/zinc/06/24/17/1061062417.db2.gz MPRVVBMDYQAZDI-RDJZCZTQSA-N 2 1 316.480 4.301 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280359 1061073307 /nfs/dbraw/zinc/07/33/07/1061073307.db2.gz ROHZOOIHXXQFOZ-LXZKKBNFSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280359 1061073321 /nfs/dbraw/zinc/07/33/21/1061073321.db2.gz ROHZOOIHXXQFOZ-LXZKKBNFSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c2ccsc2S1 ZINC001462280359 1061073340 /nfs/dbraw/zinc/07/33/40/1061073340.db2.gz ROHZOOIHXXQFOZ-LXZKKBNFSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c2ccsc2S1 ZINC001462280359 1061073358 /nfs/dbraw/zinc/07/33/58/1061073358.db2.gz ROHZOOIHXXQFOZ-LXZKKBNFSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001473368833 1061116804 /nfs/dbraw/zinc/11/68/04/1061116804.db2.gz BMFFTTGEAASQGE-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP CC[C@@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)[C@@H]1C ZINC001473403188 1061139736 /nfs/dbraw/zinc/13/97/36/1061139736.db2.gz SBVHMIWWFKIAJA-YLJYHZDGSA-N 2 1 300.490 4.293 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H]1C[C@H](OC(C)C)C1(C)C)C1CCCCC1 ZINC001462408114 1061154570 /nfs/dbraw/zinc/15/45/70/1061154570.db2.gz MHAXTOCVKUHMMM-MOPGFXCFSA-N 2 1 324.553 4.213 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001462439102 1061173795 /nfs/dbraw/zinc/17/37/95/1061173795.db2.gz KWVUVPCYXNEXGL-MOPGFXCFSA-N 2 1 300.490 4.004 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001462439102 1061173801 /nfs/dbraw/zinc/17/38/01/1061173801.db2.gz KWVUVPCYXNEXGL-MOPGFXCFSA-N 2 1 300.490 4.004 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001462451955 1061181412 /nfs/dbraw/zinc/18/14/12/1061181412.db2.gz JDYOMRMRHVECLO-UYAOXDASSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001462451955 1061181425 /nfs/dbraw/zinc/18/14/25/1061181425.db2.gz JDYOMRMRHVECLO-UYAOXDASSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001462451952 1061181831 /nfs/dbraw/zinc/18/18/31/1061181831.db2.gz JDYOMRMRHVECLO-AZUAARDMSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001462451952 1061181836 /nfs/dbraw/zinc/18/18/36/1061181836.db2.gz JDYOMRMRHVECLO-AZUAARDMSA-N 2 1 302.506 4.207 20 0 DIADMP c1ccc([C@@H]2[N@H+](CCC[NH+]3CCCCC3)CC23CCCC3)cc1 ZINC001473529995 1061225009 /nfs/dbraw/zinc/22/50/09/1061225009.db2.gz ZAPUTNYRJMGSFT-FQEVSTJZSA-N 2 1 312.501 4.480 20 0 DIADMP c1ccc([C@@H]2[N@@H+](CCC[NH+]3CCCCC3)CC23CCCC3)cc1 ZINC001473529995 1061225031 /nfs/dbraw/zinc/22/50/31/1061225031.db2.gz ZAPUTNYRJMGSFT-FQEVSTJZSA-N 2 1 312.501 4.480 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)cc1 ZINC001462520451 1061230385 /nfs/dbraw/zinc/23/03/85/1061230385.db2.gz WCNXAGSAMVCIDP-GHTZIAJQSA-N 2 1 314.517 4.485 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)cc1 ZINC001462520451 1061230403 /nfs/dbraw/zinc/23/04/03/1061230403.db2.gz WCNXAGSAMVCIDP-GHTZIAJQSA-N 2 1 314.517 4.485 20 0 DIADMP C[N@H+](C/C=C/c1ccc(F)cc1)CCCC[NH+]1CCCCC1 ZINC001462538320 1061246038 /nfs/dbraw/zinc/24/60/38/1061246038.db2.gz WZPNVETYHKUBLA-BQYQJAHWSA-N 2 1 304.453 4.037 20 0 DIADMP CCc1ccc(C[N@@H+](CC[C@@H]2CCC[NH+]2C)CC(C)C)cc1 ZINC001473577377 1061266008 /nfs/dbraw/zinc/26/60/08/1061266008.db2.gz GEBXMLKWMQPWRA-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CCc1ccc(C[NH+](CC[C@@H]2CCC[N@@H+]2C)CC(C)C)cc1 ZINC001473577377 1061266026 /nfs/dbraw/zinc/26/60/26/1061266026.db2.gz GEBXMLKWMQPWRA-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CCc1ccc(C[NH+](CC[C@@H]2CCC[N@H+]2C)CC(C)C)cc1 ZINC001473577377 1061266048 /nfs/dbraw/zinc/26/60/48/1061266048.db2.gz GEBXMLKWMQPWRA-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001462627431 1061307202 /nfs/dbraw/zinc/30/72/02/1061307202.db2.gz JSQBUQDJSNOJJL-QUCCMNQESA-N 2 1 312.501 4.380 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001462627431 1061307216 /nfs/dbraw/zinc/30/72/16/1061307216.db2.gz JSQBUQDJSNOJJL-QUCCMNQESA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462654821 1061319010 /nfs/dbraw/zinc/31/90/10/1061319010.db2.gz MUCSSAFRTZUWAR-PLWAMTLXSA-N 2 1 310.485 4.299 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462654821 1061319025 /nfs/dbraw/zinc/31/90/25/1061319025.db2.gz MUCSSAFRTZUWAR-PLWAMTLXSA-N 2 1 310.485 4.299 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001462667161 1061327966 /nfs/dbraw/zinc/32/79/66/1061327966.db2.gz NHEKYBIKWUWMFW-UHFFFAOYSA-N 2 1 306.494 4.238 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001462667161 1061327989 /nfs/dbraw/zinc/32/79/89/1061327989.db2.gz NHEKYBIKWUWMFW-UHFFFAOYSA-N 2 1 306.494 4.238 20 0 DIADMP CCc1cccc2cc(C[NH+]3CCC(c4c[nH+]cn4C)CC3)oc21 ZINC001462667809 1061328240 /nfs/dbraw/zinc/32/82/40/1061328240.db2.gz MHNCLUNCVYIYIE-UHFFFAOYSA-N 2 1 323.440 4.108 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@@H](C)[C@@H]1CC1(F)F)c1ccccc1 ZINC001462673064 1061330538 /nfs/dbraw/zinc/33/05/38/1061330538.db2.gz HTLQQRWDCHUDSD-XIRDDKMYSA-N 2 1 310.432 4.093 20 0 DIADMP CCc1cccc(C[NH+]2CCC(CC)([NH+]3CCCC3)CC2)c1 ZINC001473697458 1061352997 /nfs/dbraw/zinc/35/29/97/1061352997.db2.gz DHDHPGYYIGCGCJ-UHFFFAOYSA-N 2 1 300.490 4.089 20 0 DIADMP CC(C)C[N@@H+](CCSc1ccccc1)CC1CC[NH+](C)CC1 ZINC001473739184 1061382364 /nfs/dbraw/zinc/38/23/64/1061382364.db2.gz LGEWMCAMSRMGLX-UHFFFAOYSA-N 2 1 320.546 4.079 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CCc3ccccc3Cl)CC2)[nH+]c1C ZINC001473802706 1061413649 /nfs/dbraw/zinc/41/36/49/1061413649.db2.gz RLXOGBHHYNYJDZ-UHFFFAOYSA-N 2 1 317.864 4.102 20 0 DIADMP Cc1cccc(C2=CC[N@H+](CCC[NH+]3CCCCC3)CC2)c1C ZINC001473873098 1061444308 /nfs/dbraw/zinc/44/43/08/1061444308.db2.gz WXGBTBVCZMSGAM-UHFFFAOYSA-N 2 1 312.501 4.269 20 0 DIADMP Cc1cccc(C2=CC[N@@H+](CCC[NH+]3CCCCC3)CC2)c1C ZINC001473873098 1061444314 /nfs/dbraw/zinc/44/43/14/1061444314.db2.gz WXGBTBVCZMSGAM-UHFFFAOYSA-N 2 1 312.501 4.269 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001473933540 1061479328 /nfs/dbraw/zinc/47/93/28/1061479328.db2.gz KJIVOBWJWCMOOV-BMQTXXJKSA-N 2 1 314.517 4.443 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001473933546 1061480116 /nfs/dbraw/zinc/48/01/16/1061480116.db2.gz KJIVOBWJWCMOOV-TWFHAPMSSA-N 2 1 314.517 4.443 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(Cl)ccc2F)C1 ZINC001473937092 1061482161 /nfs/dbraw/zinc/48/21/61/1061482161.db2.gz KVRUGJXYJGHJAY-CQSZACIVSA-N 2 1 312.860 4.081 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(Cl)ccc1F ZINC001473937076 1061482397 /nfs/dbraw/zinc/48/23/97/1061482397.db2.gz KNGNVOGNKNOBKG-CQSZACIVSA-N 2 1 312.860 4.223 20 0 DIADMP COc1cc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)ccc1Cl ZINC001473937049 1061483014 /nfs/dbraw/zinc/48/30/14/1061483014.db2.gz JYGUXAMTISONOB-OAHLLOKOSA-N 2 1 324.896 4.093 20 0 DIADMP C[C@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001473957434 1061499686 /nfs/dbraw/zinc/49/96/86/1061499686.db2.gz PAZPZHQCEXTVAH-PXNSSMCTSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001473957434 1061499700 /nfs/dbraw/zinc/49/97/00/1061499700.db2.gz PAZPZHQCEXTVAH-PXNSSMCTSA-N 2 1 314.517 4.034 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Cl)c(C)c2Cl)C1 ZINC001473965080 1061506721 /nfs/dbraw/zinc/50/67/21/1061506721.db2.gz UPHXTEIFOHMMQE-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Cl)c(C)c2Cl)C1 ZINC001473965080 1061506738 /nfs/dbraw/zinc/50/67/38/1061506738.db2.gz UPHXTEIFOHMMQE-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)CC1(C)C ZINC001473969401 1061513199 /nfs/dbraw/zinc/51/31/99/1061513199.db2.gz UGLOLDCEBBMIKT-SJORKVTESA-N 2 1 306.469 4.375 20 0 DIADMP CS[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@H+]2CC2CCCCC2)C1 ZINC001473980697 1061523288 /nfs/dbraw/zinc/52/32/88/1061523288.db2.gz YQFORXNCYSADNN-CEXWTWQISA-N 2 1 324.578 4.295 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1CC[NH2+]C[C@H](C)CCc1ccccc1 ZINC001473994699 1061536774 /nfs/dbraw/zinc/53/67/74/1061536774.db2.gz BHESBNWBQDEGQA-QUCCMNQESA-N 2 1 302.506 4.109 20 0 DIADMP CC[C@H]1CCCC[N@H+]1CC[NH2+]C[C@H](C)CCc1ccccc1 ZINC001473994699 1061536783 /nfs/dbraw/zinc/53/67/83/1061536783.db2.gz BHESBNWBQDEGQA-QUCCMNQESA-N 2 1 302.506 4.109 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cccc(Cl)c1Cl ZINC001474019896 1061559440 /nfs/dbraw/zinc/55/94/40/1061559440.db2.gz ITRDNYAKWVYIPU-UHFFFAOYSA-N 2 1 312.244 4.068 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(C)(C)C)cc2)C1 ZINC001474078492 1061624809 /nfs/dbraw/zinc/62/48/09/1061624809.db2.gz LTUPQWCMJGEEBZ-LJQANCHMSA-N 2 1 316.533 4.442 20 0 DIADMP Cc1ccc(-c2ccccc2C[NH2+]CCC[NH+]2CCC2)c(C)c1 ZINC001474100443 1061647417 /nfs/dbraw/zinc/64/74/17/1061647417.db2.gz YNKVZJAJWLGKPP-UHFFFAOYSA-N 2 1 308.469 4.156 20 0 DIADMP C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1)C[NH+](C)C ZINC001474161749 1061703593 /nfs/dbraw/zinc/70/35/93/1061703593.db2.gz DRYWPXJUMZPHMT-HNNXBMFYSA-N 2 1 316.876 4.294 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cccc2[nH]ccc21)C1CCCCC1 ZINC001474200595 1061750235 /nfs/dbraw/zinc/75/02/35/1061750235.db2.gz QDOUOQJYXZWUOT-UHFFFAOYSA-N 2 1 313.489 4.302 20 0 DIADMP C[C@@H](CC[NH2+]Cc1cccc(Oc2ccc(F)cc2)c1)[NH+](C)C ZINC001474223659 1061782885 /nfs/dbraw/zinc/78/28/85/1061782885.db2.gz QNZIRXOZTWRPQW-HNNXBMFYSA-N 2 1 316.420 4.048 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC001253094564 1061801254 /nfs/dbraw/zinc/80/12/54/1061801254.db2.gz FFYSAOGFGTVYCW-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001474294753 1061863409 /nfs/dbraw/zinc/86/34/09/1061863409.db2.gz TUIVMICQMKRBAB-MISYRCLQSA-N 2 1 310.485 4.128 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001474294753 1061863421 /nfs/dbraw/zinc/86/34/21/1061863421.db2.gz TUIVMICQMKRBAB-MISYRCLQSA-N 2 1 310.485 4.128 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2cccc(C)c2C)CC1 ZINC001474317472 1061893087 /nfs/dbraw/zinc/89/30/87/1061893087.db2.gz GVRKJJADQBNYBS-FQEVSTJZSA-N 2 1 300.490 4.172 20 0 DIADMP CCCC[N@H+](Cc1ccccc1F)CC1CC[NH+](CC)CC1 ZINC001474342845 1061938686 /nfs/dbraw/zinc/93/86/86/1061938686.db2.gz FUEPJXPGPDACQB-UHFFFAOYSA-N 2 1 306.469 4.160 20 0 DIADMP CC(C)CCCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001474380859 1062027760 /nfs/dbraw/zinc/02/77/60/1062027760.db2.gz DUZXGGGTACAXFA-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP CC(C)CCCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001474380859 1062027782 /nfs/dbraw/zinc/02/77/82/1062027782.db2.gz DUZXGGGTACAXFA-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP CC(C)CCCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474380859 1062027804 /nfs/dbraw/zinc/02/78/04/1062027804.db2.gz DUZXGGGTACAXFA-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CC2CCC3(CC3)CC2)CC1 ZINC001459317427 1062084423 /nfs/dbraw/zinc/08/44/23/1062084423.db2.gz KFXHZFXOYATTRR-UHFFFAOYSA-N 2 1 306.538 4.401 20 0 DIADMP C[C@H](c1nccc2ccccc21)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001474413753 1062086159 /nfs/dbraw/zinc/08/61/59/1062086159.db2.gz WVDMDXPBXPRTHE-QGZVFWFLSA-N 2 1 323.484 4.246 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001474418390 1062088307 /nfs/dbraw/zinc/08/83/07/1062088307.db2.gz DHXJEMNIYZUOCP-PZJWPPBQSA-N 2 1 312.501 4.163 20 0 DIADMP C(C1CC1)[N@H+]1CCCC12CC[NH+](C1CCC3(CC3)CC1)CC2 ZINC001254443347 1062105505 /nfs/dbraw/zinc/10/55/05/1062105505.db2.gz WVXXSWUVDMNVLC-UHFFFAOYSA-N 2 1 302.506 4.050 20 0 DIADMP Cc1ccc(C[N@@H+]2C[C@@H]3C[NH+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254442826 1062106784 /nfs/dbraw/zinc/10/67/84/1062106784.db2.gz OOFSJTUDUJZWAB-BGYRXZFFSA-N 2 1 324.512 4.081 20 0 DIADMP Cc1ccc(C[NH+]2C[C@@H]3C[N@H+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254442826 1062106793 /nfs/dbraw/zinc/10/67/93/1062106793.db2.gz OOFSJTUDUJZWAB-BGYRXZFFSA-N 2 1 324.512 4.081 20 0 DIADMP Cc1ccc(C[NH+]2C[C@@H]3C[N@@H+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254442826 1062106805 /nfs/dbraw/zinc/10/68/05/1062106805.db2.gz OOFSJTUDUJZWAB-BGYRXZFFSA-N 2 1 324.512 4.081 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001474435990 1062112121 /nfs/dbraw/zinc/11/21/21/1062112121.db2.gz RYDLXPLHYIOHRV-RDGPPVDQSA-N 2 1 306.538 4.444 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC001254453563 1062113204 /nfs/dbraw/zinc/11/32/04/1062113204.db2.gz JGVQARQXASTNSV-UHFFFAOYSA-N 2 1 323.484 4.056 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001474440000 1062116741 /nfs/dbraw/zinc/11/67/41/1062116741.db2.gz DAYMVCAGMHGVIJ-PKOBYXMFSA-N 2 1 300.490 4.380 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001474440000 1062116754 /nfs/dbraw/zinc/11/67/54/1062116754.db2.gz DAYMVCAGMHGVIJ-PKOBYXMFSA-N 2 1 300.490 4.380 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001254497521 1062138309 /nfs/dbraw/zinc/13/83/09/1062138309.db2.gz DBKICWBMHBWBON-OAQYLSRUSA-N 2 1 314.517 4.347 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+](C)C1CC[NH+](CC)CC1 ZINC001254494103 1062138498 /nfs/dbraw/zinc/13/84/98/1062138498.db2.gz IRGHIAQVGOIBMO-IBGZPJMESA-N 2 1 302.506 4.204 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](C)C1CC[NH+](CC)CC1 ZINC001254494103 1062138504 /nfs/dbraw/zinc/13/85/04/1062138504.db2.gz IRGHIAQVGOIBMO-IBGZPJMESA-N 2 1 302.506 4.204 20 0 DIADMP FC1(F)CC[C@@H](C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC001459437238 1062145453 /nfs/dbraw/zinc/14/54/53/1062145453.db2.gz JESZKPGMSIZHER-IAGOWNOFSA-N 2 1 314.464 4.010 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001254509965 1062148414 /nfs/dbraw/zinc/14/84/14/1062148414.db2.gz KSVWVYLXWFYKJX-MOPGFXCFSA-N 2 1 304.453 4.131 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001254510816 1062150113 /nfs/dbraw/zinc/15/01/13/1062150113.db2.gz QSYFGXSIXFTKBF-RBUKOAKNSA-N 2 1 304.453 4.131 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC1 ZINC001254507452 1062151352 /nfs/dbraw/zinc/15/13/52/1062151352.db2.gz CELUBNWCUGPNEY-QFBILLFUSA-N 2 1 304.453 4.131 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C2(CC3CCC3)CCC(F)(F)CC2)CC1 ZINC001254511894 1062152892 /nfs/dbraw/zinc/15/28/92/1062152892.db2.gz HALVADAYAGPKIT-INIZCTEOSA-N 2 1 314.464 4.199 20 0 DIADMP CC(C)CCCC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC001474479310 1062158372 /nfs/dbraw/zinc/15/83/72/1062158372.db2.gz NUQBEEROLJJPEO-UHFFFAOYSA-N 2 1 303.494 4.225 20 0 DIADMP CCCSC[C@@H](C)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001474483871 1062164061 /nfs/dbraw/zinc/16/40/61/1062164061.db2.gz NGOPRGWPIHBGFZ-IEBWSBKVSA-N 2 1 320.546 4.020 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCc2ccccc21 ZINC001474500303 1062181258 /nfs/dbraw/zinc/18/12/58/1062181258.db2.gz HUZCZFWNSZAOFS-OAQYLSRUSA-N 2 1 322.496 4.300 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)CCc1ccc(C(C)(C)C)cc1 ZINC001474502707 1062183569 /nfs/dbraw/zinc/18/35/69/1062183569.db2.gz BEBSSLFSAAWQHA-UHFFFAOYSA-N 2 1 304.522 4.190 20 0 DIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC001459527053 1062185251 /nfs/dbraw/zinc/18/52/51/1062185251.db2.gz RFBKYNCQWFWMFL-LEWJYISDSA-N 2 1 312.501 4.437 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505051 1062188261 /nfs/dbraw/zinc/18/82/61/1062188261.db2.gz NZBMABCXVFTUMB-QUCCMNQESA-N 2 1 314.517 4.409 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505051 1062188268 /nfs/dbraw/zinc/18/82/68/1062188268.db2.gz NZBMABCXVFTUMB-QUCCMNQESA-N 2 1 314.517 4.409 20 0 DIADMP C[N@@H+](CCCc1cccc2ccccc21)C[C@@H]1CCC[NH+](C)C1 ZINC001459537147 1062190851 /nfs/dbraw/zinc/19/08/51/1062190851.db2.gz DBOCTUUZPVCDPZ-GOSISDBHSA-N 2 1 310.485 4.046 20 0 DIADMP C[NH+](CCCc1cccc2ccccc21)C[C@@H]1CCC[N@H+](C)C1 ZINC001459537147 1062190858 /nfs/dbraw/zinc/19/08/58/1062190858.db2.gz DBOCTUUZPVCDPZ-GOSISDBHSA-N 2 1 310.485 4.046 20 0 DIADMP C[NH+](CCCc1cccc2ccccc21)C[C@@H]1CCC[N@@H+](C)C1 ZINC001459537147 1062190885 /nfs/dbraw/zinc/19/08/85/1062190885.db2.gz DBOCTUUZPVCDPZ-GOSISDBHSA-N 2 1 310.485 4.046 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@@H+]2CCCc2c[nH+]cn2C)o1 ZINC001459537192 1062193737 /nfs/dbraw/zinc/19/37/37/1062193737.db2.gz UXNJVPKBLZZIDE-SFHVURJKSA-N 2 1 315.461 4.125 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@H+]2CCCc2c[nH+]cn2C)o1 ZINC001459537192 1062193750 /nfs/dbraw/zinc/19/37/50/1062193750.db2.gz UXNJVPKBLZZIDE-SFHVURJKSA-N 2 1 315.461 4.125 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CCC[NH+](CC)CC)o1 ZINC001459567009 1062216483 /nfs/dbraw/zinc/21/64/83/1062216483.db2.gz AODWFLPFMQQHNJ-AEFFLSMTSA-N 2 1 306.494 4.347 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CCC[NH+](CC)CC)o1 ZINC001459567009 1062216503 /nfs/dbraw/zinc/21/65/03/1062216503.db2.gz AODWFLPFMQQHNJ-AEFFLSMTSA-N 2 1 306.494 4.347 20 0 DIADMP CC(C)=CCC[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603186 1062236697 /nfs/dbraw/zinc/23/66/97/1062236697.db2.gz BVIHUFTZAAGAQV-ICSRJNTNSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603186 1062236717 /nfs/dbraw/zinc/23/67/17/1062236717.db2.gz BVIHUFTZAAGAQV-ICSRJNTNSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603186 1062236732 /nfs/dbraw/zinc/23/67/32/1062236732.db2.gz BVIHUFTZAAGAQV-ICSRJNTNSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603186 1062236749 /nfs/dbraw/zinc/23/67/49/1062236749.db2.gz BVIHUFTZAAGAQV-ICSRJNTNSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001459603189 1062237940 /nfs/dbraw/zinc/23/79/40/1062237940.db2.gz BVIHUFTZAAGAQV-UYAOXDASSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001459603189 1062237955 /nfs/dbraw/zinc/23/79/55/1062237955.db2.gz BVIHUFTZAAGAQV-UYAOXDASSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001459603189 1062237973 /nfs/dbraw/zinc/23/79/73/1062237973.db2.gz BVIHUFTZAAGAQV-UYAOXDASSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001459603189 1062237992 /nfs/dbraw/zinc/23/79/92/1062237992.db2.gz BVIHUFTZAAGAQV-UYAOXDASSA-N 2 1 300.490 4.328 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(C)ccc3ccccc32)C[C@H]1C ZINC001459614623 1062247100 /nfs/dbraw/zinc/24/71/00/1062247100.db2.gz QLYQVRJDTPEIIB-IEBWSBKVSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(C)ccc3ccccc32)C[C@H]1C ZINC001459614623 1062247122 /nfs/dbraw/zinc/24/71/22/1062247122.db2.gz QLYQVRJDTPEIIB-IEBWSBKVSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(C)ccc3ccccc32)C[C@H]1C ZINC001459614623 1062247142 /nfs/dbraw/zinc/24/71/42/1062247142.db2.gz QLYQVRJDTPEIIB-IEBWSBKVSA-N 2 1 310.485 4.453 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001474559330 1062262193 /nfs/dbraw/zinc/26/21/93/1062262193.db2.gz ATGQHYCTUYBIDJ-PGYGNJIDSA-N 2 1 302.506 4.279 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001474559330 1062262212 /nfs/dbraw/zinc/26/22/12/1062262212.db2.gz ATGQHYCTUYBIDJ-PGYGNJIDSA-N 2 1 302.506 4.279 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001474558144 1062262812 /nfs/dbraw/zinc/26/28/12/1062262812.db2.gz NRBKAWGRDVGTCJ-DFQSSKMNSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001474558144 1062262831 /nfs/dbraw/zinc/26/28/31/1062262831.db2.gz NRBKAWGRDVGTCJ-DFQSSKMNSA-N 2 1 302.506 4.207 20 0 DIADMP FC1CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255122216 1062322983 /nfs/dbraw/zinc/32/29/83/1062322983.db2.gz MWYMWCVOXLVURE-ZYUSWAADSA-N 2 1 316.464 4.052 20 0 DIADMP F[C@@H]1CCCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137742 1062324771 /nfs/dbraw/zinc/32/47/71/1062324771.db2.gz WRVICBPYVIVBRS-ZRNYENFQSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137742 1062324794 /nfs/dbraw/zinc/32/47/94/1062324794.db2.gz WRVICBPYVIVBRS-ZRNYENFQSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137742 1062324809 /nfs/dbraw/zinc/32/48/09/1062324809.db2.gz WRVICBPYVIVBRS-ZRNYENFQSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137742 1062324829 /nfs/dbraw/zinc/32/48/29/1062324829.db2.gz WRVICBPYVIVBRS-ZRNYENFQSA-N 2 1 316.464 4.006 20 0 DIADMP CCCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255137624 1062328653 /nfs/dbraw/zinc/32/86/53/1062328653.db2.gz ZGBZIHWIUMIMBD-AFYVEPGGSA-N 2 1 300.490 4.350 20 0 DIADMP F[C@H]1CCCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137740 1062329461 /nfs/dbraw/zinc/32/94/61/1062329461.db2.gz WRVICBPYVIVBRS-VNTMZGSJSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137740 1062329481 /nfs/dbraw/zinc/32/94/81/1062329481.db2.gz WRVICBPYVIVBRS-VNTMZGSJSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137740 1062329503 /nfs/dbraw/zinc/32/95/03/1062329503.db2.gz WRVICBPYVIVBRS-VNTMZGSJSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137740 1062329524 /nfs/dbraw/zinc/32/95/24/1062329524.db2.gz WRVICBPYVIVBRS-VNTMZGSJSA-N 2 1 316.464 4.006 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2C[C@@H]4CCCC[C@H]4C2)C3)cc1 ZINC001255147478 1062335042 /nfs/dbraw/zinc/33/50/42/1062335042.db2.gz AEULEPCFIPSFTJ-KGWSWXIGSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC4CCC(CC4)C2)C3)cc1 ZINC001255147093 1062335715 /nfs/dbraw/zinc/33/57/15/1062335715.db2.gz LTTNFLBXWONGCE-NGCWXFERSA-N 2 1 324.512 4.304 20 0 DIADMP C[C@@H]1CCCCC[N@@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145123 1062339040 /nfs/dbraw/zinc/33/90/40/1062339040.db2.gz ZDTKULIPKRFBRK-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145123 1062339062 /nfs/dbraw/zinc/33/90/62/1062339062.db2.gz ZDTKULIPKRFBRK-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145123 1062339088 /nfs/dbraw/zinc/33/90/88/1062339088.db2.gz ZDTKULIPKRFBRK-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145123 1062339110 /nfs/dbraw/zinc/33/91/10/1062339110.db2.gz ZDTKULIPKRFBRK-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145325 1062341460 /nfs/dbraw/zinc/34/14/60/1062341460.db2.gz AXDTXEZYJOFRPM-BQJUDKOJSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145325 1062341483 /nfs/dbraw/zinc/34/14/83/1062341483.db2.gz AXDTXEZYJOFRPM-BQJUDKOJSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145325 1062341505 /nfs/dbraw/zinc/34/15/05/1062341505.db2.gz AXDTXEZYJOFRPM-BQJUDKOJSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145325 1062341522 /nfs/dbraw/zinc/34/15/22/1062341522.db2.gz AXDTXEZYJOFRPM-BQJUDKOJSA-N 2 1 312.501 4.302 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC001459751355 1062361084 /nfs/dbraw/zinc/36/10/84/1062361084.db2.gz ZXAONUGSAUCGRY-NHCUHLMSSA-N 2 1 308.469 4.044 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C[C@H]1C ZINC001459762670 1062369243 /nfs/dbraw/zinc/36/92/43/1062369243.db2.gz IIXQCWGWEDNJFD-QZTJIDSGSA-N 2 1 300.490 4.150 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255319296 1062394143 /nfs/dbraw/zinc/39/41/43/1062394143.db2.gz HPGBSULFZTWZFA-WDSOQIARSA-N 2 1 318.505 4.346 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255319010 1062395022 /nfs/dbraw/zinc/39/50/22/1062395022.db2.gz DUVJKFCRODVJBO-ATZDWAIDSA-N 2 1 306.469 4.476 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255319294 1062395268 /nfs/dbraw/zinc/39/52/68/1062395268.db2.gz HPGBSULFZTWZFA-BHIYHBOVSA-N 2 1 318.505 4.346 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671692 1062401943 /nfs/dbraw/zinc/40/19/43/1062401943.db2.gz XQMQVXAPCJHVIW-PXNSSMCTSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671692 1062401960 /nfs/dbraw/zinc/40/19/60/1062401960.db2.gz XQMQVXAPCJHVIW-PXNSSMCTSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671693 1062402926 /nfs/dbraw/zinc/40/29/26/1062402926.db2.gz XQMQVXAPCJHVIW-XLIONFOSSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671693 1062402941 /nfs/dbraw/zinc/40/29/41/1062402941.db2.gz XQMQVXAPCJHVIW-XLIONFOSSA-N 2 1 300.490 4.177 20 0 DIADMP CCCC[C@H](C)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001255329033 1062404572 /nfs/dbraw/zinc/40/45/72/1062404572.db2.gz HCTQNIIJOAODSP-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001255329033 1062404587 /nfs/dbraw/zinc/40/45/87/1062404587.db2.gz HCTQNIIJOAODSP-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001255329033 1062404604 /nfs/dbraw/zinc/40/46/04/1062404604.db2.gz HCTQNIIJOAODSP-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001255329702 1062407106 /nfs/dbraw/zinc/40/71/06/1062407106.db2.gz UZPAMUSIBQZQJP-QGZVFWFLSA-N 2 1 304.478 4.146 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCC(C)(C)C[C@@H]2c2ccccc2)CC1 ZINC001474680840 1062413316 /nfs/dbraw/zinc/41/33/16/1062413316.db2.gz WSCOFFKIPMJUDJ-MOPGFXCFSA-N 2 1 300.490 4.033 20 0 DIADMP Cc1ccc(C)c(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255381963 1062423291 /nfs/dbraw/zinc/42/32/91/1062423291.db2.gz ADUQGZYLRCMKSC-QFIPXVFZSA-N 2 1 322.496 4.448 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccs1 ZINC001255376934 1062423806 /nfs/dbraw/zinc/42/38/06/1062423806.db2.gz CZHZXSHNAVKSOX-AEFFLSMTSA-N 2 1 314.498 4.453 20 0 DIADMP Cc1ccnc([C@H](C)[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255384287 1062423914 /nfs/dbraw/zinc/42/39/14/1062423914.db2.gz XJPJIHFDNCNYGI-AZUAARDMSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccnc([C@H](C)[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255384287 1062423920 /nfs/dbraw/zinc/42/39/20/1062423920.db2.gz XJPJIHFDNCNYGI-AZUAARDMSA-N 2 1 323.484 4.095 20 0 DIADMP CC1([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCCCC1 ZINC001255380361 1062425418 /nfs/dbraw/zinc/42/54/18/1062425418.db2.gz JNEVNRLCWMZJOL-IBGZPJMESA-N 2 1 300.490 4.354 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)nc1 ZINC001255393241 1062427818 /nfs/dbraw/zinc/42/78/18/1062427818.db2.gz MSUHUVPHQQRIMP-QUCCMNQESA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)nc1 ZINC001255393241 1062427827 /nfs/dbraw/zinc/42/78/27/1062427827.db2.gz MSUHUVPHQQRIMP-QUCCMNQESA-N 2 1 323.484 4.095 20 0 DIADMP CCCC1([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCC1 ZINC001255392875 1062428296 /nfs/dbraw/zinc/42/82/96/1062428296.db2.gz MLUCTAPUTCEYFU-LJQANCHMSA-N 2 1 300.490 4.354 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccnc1 ZINC001255394543 1062428779 /nfs/dbraw/zinc/42/87/79/1062428779.db2.gz VUWQYJPSQXGAMP-NHCUHLMSSA-N 2 1 323.484 4.177 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@@H]3CCCC34CCC4)CC2)cc1 ZINC001255395757 1062432277 /nfs/dbraw/zinc/43/22/77/1062432277.db2.gz CQEDNFDYXZGYFJ-WOJBJXKFSA-N 2 1 312.501 4.354 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400040 1062432352 /nfs/dbraw/zinc/43/23/52/1062432352.db2.gz DCPSMGCIIXEOBV-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400040 1062432363 /nfs/dbraw/zinc/43/23/63/1062432363.db2.gz DCPSMGCIIXEOBV-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400040 1062432379 /nfs/dbraw/zinc/43/23/79/1062432379.db2.gz DCPSMGCIIXEOBV-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400040 1062432391 /nfs/dbraw/zinc/43/23/91/1062432391.db2.gz DCPSMGCIIXEOBV-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255397070 1062432642 /nfs/dbraw/zinc/43/26/42/1062432642.db2.gz DPUMOJVSMCRGFY-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255397070 1062432655 /nfs/dbraw/zinc/43/26/55/1062432655.db2.gz DPUMOJVSMCRGFY-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255397070 1062432666 /nfs/dbraw/zinc/43/26/66/1062432666.db2.gz DPUMOJVSMCRGFY-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255395793 1062432937 /nfs/dbraw/zinc/43/29/37/1062432937.db2.gz DMAXBFNRNOSQBK-KVPLUYHFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@]1(F)CCCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398954 1062433133 /nfs/dbraw/zinc/43/31/33/1062433133.db2.gz NJNGCEWDNQDVFJ-PMACEKPBSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398954 1062433140 /nfs/dbraw/zinc/43/31/40/1062433140.db2.gz NJNGCEWDNQDVFJ-PMACEKPBSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398954 1062433148 /nfs/dbraw/zinc/43/31/48/1062433148.db2.gz NJNGCEWDNQDVFJ-PMACEKPBSA-N 2 1 318.480 4.255 20 0 DIADMP FC1(F)CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255397889 1062435784 /nfs/dbraw/zinc/43/57/84/1062435784.db2.gz IDHPDUKENWYKRA-GOSISDBHSA-N 2 1 322.443 4.162 20 0 DIADMP FC1(F)CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255397889 1062435790 /nfs/dbraw/zinc/43/57/90/1062435790.db2.gz IDHPDUKENWYKRA-GOSISDBHSA-N 2 1 322.443 4.162 20 0 DIADMP FC1(F)CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255397889 1062435804 /nfs/dbraw/zinc/43/58/04/1062435804.db2.gz IDHPDUKENWYKRA-GOSISDBHSA-N 2 1 322.443 4.162 20 0 DIADMP CC1(C)CC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255403101 1062438479 /nfs/dbraw/zinc/43/84/79/1062438479.db2.gz NXHDDQHQTWBXSR-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](CC1CCCC1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408966 1062438525 /nfs/dbraw/zinc/43/85/25/1062438525.db2.gz QZDLGULDJLZODU-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](CC1CCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408966 1062438537 /nfs/dbraw/zinc/43/85/37/1062438537.db2.gz QZDLGULDJLZODU-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](CC1CCCC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408966 1062438551 /nfs/dbraw/zinc/43/85/51/1062438551.db2.gz QZDLGULDJLZODU-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP CC1(C)CC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255403099 1062440448 /nfs/dbraw/zinc/44/04/48/1062440448.db2.gz NXHDDQHQTWBXSR-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408382 1062440485 /nfs/dbraw/zinc/44/04/85/1062440485.db2.gz KWFCAWFGQMZBPR-WOJBJXKFSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408382 1062440492 /nfs/dbraw/zinc/44/04/92/1062440492.db2.gz KWFCAWFGQMZBPR-WOJBJXKFSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408382 1062440508 /nfs/dbraw/zinc/44/05/08/1062440508.db2.gz KWFCAWFGQMZBPR-WOJBJXKFSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC001255408241 1062441745 /nfs/dbraw/zinc/44/17/45/1062441745.db2.gz IUISIWQDXBJHMV-FGZHOGPDSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@@H+]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC001255408241 1062441750 /nfs/dbraw/zinc/44/17/50/1062441750.db2.gz IUISIWQDXBJHMV-FGZHOGPDSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@H+]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC001255408241 1062441759 /nfs/dbraw/zinc/44/17/59/1062441759.db2.gz IUISIWQDXBJHMV-FGZHOGPDSA-N 2 1 320.480 4.488 20 0 DIADMP C[N@@H+](C[C@@H]1CC1(C)C)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408384 1062443095 /nfs/dbraw/zinc/44/30/95/1062443095.db2.gz KWQBYIXTLPBUMP-OALUTQOASA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408384 1062443104 /nfs/dbraw/zinc/44/31/04/1062443104.db2.gz KWQBYIXTLPBUMP-OALUTQOASA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408384 1062443119 /nfs/dbraw/zinc/44/31/19/1062443119.db2.gz KWQBYIXTLPBUMP-OALUTQOASA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CC4CCC(CC4)C3)CC2)cc1 ZINC001255409530 1062446284 /nfs/dbraw/zinc/44/62/84/1062446284.db2.gz ZSVONQZJRVUFEI-XVAXZDLZSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CC4CCC(CC4)C3)CC2)cc1 ZINC001255409530 1062446288 /nfs/dbraw/zinc/44/62/88/1062446288.db2.gz ZSVONQZJRVUFEI-XVAXZDLZSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001459871915 1062460652 /nfs/dbraw/zinc/46/06/52/1062460652.db2.gz CILHUUMPNIWOQK-KRWDZBQOSA-N 2 1 322.496 4.430 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925810 1062501027 /nfs/dbraw/zinc/50/10/27/1062501027.db2.gz SXJPUGXUPJGFBK-WBVHZDCISA-N 2 1 320.908 4.391 20 0 DIADMP C[C@H]([NH2+]Cc1cc(Cl)ccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001459925701 1062501517 /nfs/dbraw/zinc/50/15/17/1062501517.db2.gz SPIIIRJSUOTVOW-UONOGXRCSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cc(Cl)ccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925701 1062501537 /nfs/dbraw/zinc/50/15/37/1062501537.db2.gz SPIIIRJSUOTVOW-UONOGXRCSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255681516 1062513754 /nfs/dbraw/zinc/51/37/54/1062513754.db2.gz WAOIOAKTFPBMCQ-DTWYCDNDSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255681516 1062513772 /nfs/dbraw/zinc/51/37/72/1062513772.db2.gz WAOIOAKTFPBMCQ-DTWYCDNDSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255681516 1062513791 /nfs/dbraw/zinc/51/37/91/1062513791.db2.gz WAOIOAKTFPBMCQ-DTWYCDNDSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255681516 1062513810 /nfs/dbraw/zinc/51/38/10/1062513810.db2.gz WAOIOAKTFPBMCQ-DTWYCDNDSA-N 2 1 306.881 4.348 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255701294 1062526019 /nfs/dbraw/zinc/52/60/19/1062526019.db2.gz UHUUZATWMHFEPB-ZQDZILKHSA-N 2 1 306.416 4.088 20 0 DIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255703026 1062528075 /nfs/dbraw/zinc/52/80/75/1062528075.db2.gz ZKNHMPVLBADYBL-VGWMRTNUSA-N 2 1 320.443 4.335 20 0 DIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255703025 1062528334 /nfs/dbraw/zinc/52/83/34/1062528334.db2.gz ZKNHMPVLBADYBL-KLHDSHLOSA-N 2 1 320.443 4.335 20 0 DIADMP C[C@@H](CSc1ccc(F)cc1)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC001255727854 1062546131 /nfs/dbraw/zinc/54/61/31/1062546131.db2.gz IFRBEKVDQYYIAO-JKSUJKDBSA-N 2 1 324.509 4.160 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001255759448 1062582342 /nfs/dbraw/zinc/58/23/42/1062582342.db2.gz WCOWLBCXKWVEOK-FJIDUMEYSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001255759448 1062582360 /nfs/dbraw/zinc/58/23/60/1062582360.db2.gz WCOWLBCXKWVEOK-FJIDUMEYSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCCC[C@@H](CCC[NH3+])C2)cc1 ZINC001255759691 1062583451 /nfs/dbraw/zinc/58/34/51/1062583451.db2.gz AWUYHLOTKDFGQM-MSOLQXFVSA-N 2 1 320.546 4.317 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+](CCC4CCCC4)C3)C2)cc1 ZINC001460100351 1062636238 /nfs/dbraw/zinc/63/62/38/1062636238.db2.gz OVGKTVMRAYETHF-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+](CCC4CCCC4)C3)C2)cc1 ZINC001460100351 1062636249 /nfs/dbraw/zinc/63/62/49/1062636249.db2.gz OVGKTVMRAYETHF-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](CCC4CCCC4)C3)C2)cc1 ZINC001460100351 1062636260 /nfs/dbraw/zinc/63/62/60/1062636260.db2.gz OVGKTVMRAYETHF-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001255872367 1062647513 /nfs/dbraw/zinc/64/75/13/1062647513.db2.gz IIQJPGWVBFTBGY-FXAWDEMLSA-N 2 1 318.480 4.097 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(CC[NH+](C4CCCCCC4)C3)C2)cc1 ZINC001255892103 1062659753 /nfs/dbraw/zinc/65/97/53/1062659753.db2.gz CTLLOVSUEUYDOE-OAQYLSRUSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](C4CCCCCC4)C3)C2)cc1 ZINC001255892103 1062659762 /nfs/dbraw/zinc/65/97/62/1062659762.db2.gz CTLLOVSUEUYDOE-OAQYLSRUSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@H+](C4CCCCCC4)C3)C2)cc1 ZINC001255892103 1062659765 /nfs/dbraw/zinc/65/97/65/1062659765.db2.gz CTLLOVSUEUYDOE-OAQYLSRUSA-N 2 1 312.501 4.307 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(F)cc1C(F)(F)F ZINC001255943644 1062665481 /nfs/dbraw/zinc/66/54/81/1062665481.db2.gz PIQPPMOODVKZNO-GFCCVEGCSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(C)c(C(F)(F)F)c1 ZINC001255946862 1062665844 /nfs/dbraw/zinc/66/58/44/1062665844.db2.gz KCPDRKWCFCSOFM-CQSZACIVSA-N 2 1 316.411 4.224 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](c1ccccc1F)C1CCC1 ZINC001255948655 1062669022 /nfs/dbraw/zinc/66/90/22/1062669022.db2.gz PLBLZWAQUNQRLW-BEFAXECRSA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CCCC[C@@H]1c1cccc(OC)c1 ZINC001255964758 1062673337 /nfs/dbraw/zinc/67/33/37/1062673337.db2.gz SOLQCBPAVDGASC-FXAWDEMLSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CCCC[C@@H]1c1cccc(OC)c1 ZINC001255964758 1062673347 /nfs/dbraw/zinc/67/33/47/1062673347.db2.gz SOLQCBPAVDGASC-FXAWDEMLSA-N 2 1 318.505 4.343 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2[C@H](C)CC[NH+](CC)CC)cc1 ZINC001255963374 1062673599 /nfs/dbraw/zinc/67/35/99/1062673599.db2.gz HBYIPSMAZXIIAE-XLIONFOSSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+](C)Cc1ccccc1C(F)(F)F ZINC001255965129 1062674548 /nfs/dbraw/zinc/67/45/48/1062674548.db2.gz XYQJICUWOVGPAQ-AWEZNQCLSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC001255965129 1062674551 /nfs/dbraw/zinc/67/45/51/1062674551.db2.gz XYQJICUWOVGPAQ-AWEZNQCLSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC001255968415 1062674809 /nfs/dbraw/zinc/67/48/09/1062674809.db2.gz YFARUVWHAYVKJN-AWEZNQCLSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC001255968415 1062674816 /nfs/dbraw/zinc/67/48/16/1062674816.db2.gz YFARUVWHAYVKJN-AWEZNQCLSA-N 2 1 316.411 4.258 20 0 DIADMP OCCCCCCCCCCCC[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001256069852 1062694185 /nfs/dbraw/zinc/69/41/85/1062694185.db2.gz NJIAVYNQSLKKPP-UHFFFAOYSA-N 2 1 324.553 4.096 20 0 DIADMP Fc1cccc([C@H](CC2CCC2)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC001256071907 1062694494 /nfs/dbraw/zinc/69/44/94/1062694494.db2.gz STCYGOBHDSKACO-FQEVSTJZSA-N 2 1 316.464 4.273 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001256108399 1062707911 /nfs/dbraw/zinc/70/79/11/1062707911.db2.gz AXSQBOFKUXUCPN-UQVNRYHBSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001256108399 1062707927 /nfs/dbraw/zinc/70/79/27/1062707927.db2.gz AXSQBOFKUXUCPN-UQVNRYHBSA-N 2 1 312.501 4.318 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001256109022 1062709653 /nfs/dbraw/zinc/70/96/53/1062709653.db2.gz RWWGHSMMCPISLI-YRPNKDGESA-N 2 1 300.490 4.175 20 0 DIADMP c1ccc([C@H]2CCC[C@H]([NH+]3CC4(C3)CC[N@@H+](CC3CC3)C4)C2)cc1 ZINC001256114501 1062716007 /nfs/dbraw/zinc/71/60/07/1062716007.db2.gz DYFJSDUGGDXDRO-SFTDATJTSA-N 2 1 324.512 4.131 20 0 DIADMP c1ccc([C@H]2CCC[C@H]([NH+]3CC4(C3)CC[N@H+](CC3CC3)C4)C2)cc1 ZINC001256114501 1062716025 /nfs/dbraw/zinc/71/60/25/1062716025.db2.gz DYFJSDUGGDXDRO-SFTDATJTSA-N 2 1 324.512 4.131 20 0 DIADMP CC[N@@H+](C)C1CC[NH+]([C@@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256121555 1062720380 /nfs/dbraw/zinc/72/03/80/1062720380.db2.gz VSPSDQJMUJQOTA-AZUAARDMSA-N 2 1 300.490 4.129 20 0 DIADMP CC1(C)[C@H](c2ccccc2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC001460257812 1062734792 /nfs/dbraw/zinc/73/47/92/1062734792.db2.gz MPUCKBMYVQNFNJ-IBGZPJMESA-N 2 1 300.490 4.131 20 0 DIADMP C[NH+]1CCC([NH+]2CCC(CCc3ccc(Cl)cc3)CC2)CC1 ZINC001256207455 1062749024 /nfs/dbraw/zinc/74/90/24/1062749024.db2.gz KLMOEXVQUQHYCJ-UHFFFAOYSA-N 2 1 320.908 4.079 20 0 DIADMP CC(C)CC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001256367970 1062791385 /nfs/dbraw/zinc/79/13/85/1062791385.db2.gz KQGNZMPNQNISLF-SFHVURJKSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CC[C@@H](C)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001256371588 1062793394 /nfs/dbraw/zinc/79/33/94/1062793394.db2.gz RCXIBOOPZITCBA-QUCCMNQESA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@@H](C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001256371588 1062793415 /nfs/dbraw/zinc/79/34/15/1062793415.db2.gz RCXIBOOPZITCBA-QUCCMNQESA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@@H](C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001256371588 1062793435 /nfs/dbraw/zinc/79/34/35/1062793435.db2.gz RCXIBOOPZITCBA-QUCCMNQESA-N 2 1 302.506 4.265 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[N@@H+]1Cc1ccccc1 ZINC001256528213 1062847050 /nfs/dbraw/zinc/84/70/50/1062847050.db2.gz CMHKPILGQYXBEX-KVPLUYHFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[N@H+]1Cc1ccccc1 ZINC001256528213 1062847073 /nfs/dbraw/zinc/84/70/73/1062847073.db2.gz CMHKPILGQYXBEX-KVPLUYHFSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC001256526618 1062847200 /nfs/dbraw/zinc/84/72/00/1062847200.db2.gz NUACHYCTNJQEOX-UIFIKXQLSA-N 2 1 323.484 4.175 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC001256526618 1062847212 /nfs/dbraw/zinc/84/72/12/1062847212.db2.gz NUACHYCTNJQEOX-UIFIKXQLSA-N 2 1 323.484 4.175 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001256526620 1062847814 /nfs/dbraw/zinc/84/78/14/1062847814.db2.gz NUACHYCTNJQEOX-YYWHXJBOSA-N 2 1 323.484 4.175 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001256526620 1062847838 /nfs/dbraw/zinc/84/78/38/1062847838.db2.gz NUACHYCTNJQEOX-YYWHXJBOSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256528211 1062849183 /nfs/dbraw/zinc/84/91/83/1062849183.db2.gz CMHKPILGQYXBEX-HNBVOPMISA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256528211 1062849202 /nfs/dbraw/zinc/84/92/02/1062849202.db2.gz CMHKPILGQYXBEX-HNBVOPMISA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@H]3CCC[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535863 1062853247 /nfs/dbraw/zinc/85/32/47/1062853247.db2.gz BBDIMPUGBYAADB-AYWYSENESA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CC[C@H]3CCC[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535863 1062853276 /nfs/dbraw/zinc/85/32/76/1062853276.db2.gz BBDIMPUGBYAADB-AYWYSENESA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CC[C@H]3CCC[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535863 1062853302 /nfs/dbraw/zinc/85/33/02/1062853302.db2.gz BBDIMPUGBYAADB-AYWYSENESA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256539870 1062858571 /nfs/dbraw/zinc/85/85/71/1062858571.db2.gz YNNIAIQDAFXWKQ-UTKZUKDTSA-N 2 1 306.453 4.055 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256539870 1062858603 /nfs/dbraw/zinc/85/86/03/1062858603.db2.gz YNNIAIQDAFXWKQ-UTKZUKDTSA-N 2 1 306.453 4.055 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256540518 1062861631 /nfs/dbraw/zinc/86/16/31/1062861631.db2.gz IQPPZNZCIJCXHX-AEFFLSMTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256540518 1062861664 /nfs/dbraw/zinc/86/16/64/1062861664.db2.gz IQPPZNZCIJCXHX-AEFFLSMTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540518 1062861682 /nfs/dbraw/zinc/86/16/82/1062861682.db2.gz IQPPZNZCIJCXHX-AEFFLSMTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540518 1062861699 /nfs/dbraw/zinc/86/16/99/1062861699.db2.gz IQPPZNZCIJCXHX-AEFFLSMTSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(F)(F)[C@@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256541169 1062862400 /nfs/dbraw/zinc/86/24/00/1062862400.db2.gz LEQYZYFHBWFZHQ-LZLYRXPVSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(F)(F)[C@@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256541169 1062862432 /nfs/dbraw/zinc/86/24/32/1062862432.db2.gz LEQYZYFHBWFZHQ-LZLYRXPVSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC(F)(F)[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541169 1062862455 /nfs/dbraw/zinc/86/24/55/1062862455.db2.gz LEQYZYFHBWFZHQ-LZLYRXPVSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC(F)(F)[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541169 1062862478 /nfs/dbraw/zinc/86/24/78/1062862478.db2.gz LEQYZYFHBWFZHQ-LZLYRXPVSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256538283 1062862586 /nfs/dbraw/zinc/86/25/86/1062862586.db2.gz SSYGNVZSZSNRMH-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256538283 1062862613 /nfs/dbraw/zinc/86/26/13/1062862613.db2.gz SSYGNVZSZSNRMH-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2C[C@H]3CCCC[C@@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540547 1062862900 /nfs/dbraw/zinc/86/29/00/1062862900.db2.gz IVQSMSCRENJNHO-CWJKEVGVSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2C[C@H]3CCCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256540547 1062862919 /nfs/dbraw/zinc/86/29/19/1062862919.db2.gz IVQSMSCRENJNHO-CWJKEVGVSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@@H](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256543948 1062867347 /nfs/dbraw/zinc/86/73/47/1062867347.db2.gz WAPBXEWJLSDUHC-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@@H](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256543948 1062867363 /nfs/dbraw/zinc/86/73/63/1062867363.db2.gz WAPBXEWJLSDUHC-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543948 1062867388 /nfs/dbraw/zinc/86/73/88/1062867388.db2.gz WAPBXEWJLSDUHC-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543948 1062867405 /nfs/dbraw/zinc/86/74/05/1062867405.db2.gz WAPBXEWJLSDUHC-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@H]2CC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001256553924 1062876641 /nfs/dbraw/zinc/87/66/41/1062876641.db2.gz MIIJAQDSOCUGLH-QRQLOZEOSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@H]2CC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001256553924 1062876660 /nfs/dbraw/zinc/87/66/60/1062876660.db2.gz MIIJAQDSOCUGLH-QRQLOZEOSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C[C@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553924 1062876684 /nfs/dbraw/zinc/87/66/84/1062876684.db2.gz MIIJAQDSOCUGLH-QRQLOZEOSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C[C@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553924 1062876690 /nfs/dbraw/zinc/87/66/90/1062876690.db2.gz MIIJAQDSOCUGLH-QRQLOZEOSA-N 2 1 300.490 4.017 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552487 1062877273 /nfs/dbraw/zinc/87/72/73/1062877273.db2.gz BECPXIWIMKIQMP-IHPCNDPISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552487 1062877287 /nfs/dbraw/zinc/87/72/87/1062877287.db2.gz BECPXIWIMKIQMP-IHPCNDPISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552487 1062877302 /nfs/dbraw/zinc/87/73/02/1062877302.db2.gz BECPXIWIMKIQMP-IHPCNDPISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552487 1062877314 /nfs/dbraw/zinc/87/73/14/1062877314.db2.gz BECPXIWIMKIQMP-IHPCNDPISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CC3CCC(CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256560895 1062883103 /nfs/dbraw/zinc/88/31/03/1062883103.db2.gz UJVMXQPXZWZNHH-RLHVNXBHSA-N 2 1 312.501 4.162 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)CC1 ZINC001256567561 1062888441 /nfs/dbraw/zinc/88/84/41/1062888441.db2.gz WEDDNMPHMAJGBA-GOSISDBHSA-N 2 1 322.443 4.195 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccccc1F ZINC001256563908 1062890670 /nfs/dbraw/zinc/89/06/70/1062890670.db2.gz JCHDQFCGIHBKHY-GOSISDBHSA-N 2 1 306.469 4.375 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]C(C)(C)c2cc(F)cc(F)c2)CC1 ZINC001256563520 1062891079 /nfs/dbraw/zinc/89/10/79/1062891079.db2.gz DCGBPHCUJHKNKU-UHFFFAOYSA-N 2 1 310.432 4.052 20 0 DIADMP C[N@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C[C@@H]1CC1(C)C ZINC001460520858 1062895142 /nfs/dbraw/zinc/89/51/42/1062895142.db2.gz WFYIBYRPKGZNRP-IBGZPJMESA-N 2 1 300.490 4.150 20 0 DIADMP CC(C)(CC1CCC1)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001256602294 1062911785 /nfs/dbraw/zinc/91/17/85/1062911785.db2.gz SMZBVYFFFWQNMI-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CCC4(C3)CCCCC4)CC2)cc1 ZINC001256611981 1062917630 /nfs/dbraw/zinc/91/76/30/1062917630.db2.gz AXOMVGZIUUGJQM-UHFFFAOYSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CCC4(C3)CCCCC4)CC2)cc1 ZINC001256611981 1062917649 /nfs/dbraw/zinc/91/76/49/1062917649.db2.gz AXOMVGZIUUGJQM-UHFFFAOYSA-N 2 1 312.501 4.307 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001256616930 1062918605 /nfs/dbraw/zinc/91/86/05/1062918605.db2.gz DNEIPIBBZSVGQS-XVLXNVKGSA-N 2 1 304.453 4.128 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[NH+](CC[C@@H]2CCC[N@H+]2C)CC1 ZINC001460578549 1062923203 /nfs/dbraw/zinc/92/32/03/1062923203.db2.gz DRTAJOYXUIOUIR-SFHVURJKSA-N 2 1 318.892 4.222 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[NH+](CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC001460578549 1062923228 /nfs/dbraw/zinc/92/32/28/1062923228.db2.gz DRTAJOYXUIOUIR-SFHVURJKSA-N 2 1 318.892 4.222 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[N@H+](CC[C@@H]2CCC[NH+]2C)CC1 ZINC001460578549 1062923255 /nfs/dbraw/zinc/92/32/55/1062923255.db2.gz DRTAJOYXUIOUIR-SFHVURJKSA-N 2 1 318.892 4.222 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[N@@H+](CC[C@@H]2CCC[NH+]2C)CC1 ZINC001460578549 1062923272 /nfs/dbraw/zinc/92/32/72/1062923272.db2.gz DRTAJOYXUIOUIR-SFHVURJKSA-N 2 1 318.892 4.222 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2CCC(C)(C)C2CC2)CC1 ZINC001460628433 1062945279 /nfs/dbraw/zinc/94/52/79/1062945279.db2.gz VPXBPTCKGYJMTM-LJQANCHMSA-N 2 1 306.538 4.399 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)c(C)c1 ZINC001460669422 1062976009 /nfs/dbraw/zinc/97/60/09/1062976009.db2.gz ABLUZVLUHVUPMP-UHFFFAOYSA-N 2 1 302.506 4.103 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2)CCN1c1cc[nH+]cc1 ZINC001460704623 1062997999 /nfs/dbraw/zinc/99/79/99/1062997999.db2.gz FESPOWDXEVCTGD-KRWDZBQOSA-N 2 1 323.484 4.090 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC001460710483 1063003766 /nfs/dbraw/zinc/00/37/66/1063003766.db2.gz RQFKXQVTHSUHMC-GOSISDBHSA-N 2 1 322.537 4.065 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256895325 1063029417 /nfs/dbraw/zinc/02/94/17/1063029417.db2.gz AVBYZWNXSPMTIV-MJGOQNOKSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256895325 1063029440 /nfs/dbraw/zinc/02/94/40/1063029440.db2.gz AVBYZWNXSPMTIV-MJGOQNOKSA-N 2 1 300.490 4.004 20 0 DIADMP Clc1cccc(CCC[NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)c1 ZINC001256901932 1063035370 /nfs/dbraw/zinc/03/53/70/1063035370.db2.gz MHYMYGVAESPJQE-GOSISDBHSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1cccc(CCC[NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)c1 ZINC001256901932 1063035391 /nfs/dbraw/zinc/03/53/91/1063035391.db2.gz MHYMYGVAESPJQE-GOSISDBHSA-N 2 1 320.908 4.269 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)CC1 ZINC001256906564 1063039471 /nfs/dbraw/zinc/03/94/71/1063039471.db2.gz CQRRAMYOSVJCBN-INIZCTEOSA-N 2 1 314.464 4.199 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)CC1 ZINC001256906564 1063039492 /nfs/dbraw/zinc/03/94/92/1063039492.db2.gz CQRRAMYOSVJCBN-INIZCTEOSA-N 2 1 314.464 4.199 20 0 DIADMP [NH2+]=C(N[C@H]1CCC[N@H+](C2CCCC2)C1)c1cccc2ccccc21 ZINC001256908292 1063040438 /nfs/dbraw/zinc/04/04/38/1063040438.db2.gz MDMVBVSPMMEBBZ-KRWDZBQOSA-N 2 1 321.468 4.162 20 0 DIADMP CC(C)(Cc1cccc(F)c1)[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256904839 1063041469 /nfs/dbraw/zinc/04/14/69/1063041469.db2.gz KWSRIYPUUQVSBP-SFHVURJKSA-N 2 1 318.480 4.143 20 0 DIADMP CC(C)(Cc1cccc(F)c1)[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256904839 1063041493 /nfs/dbraw/zinc/04/14/93/1063041493.db2.gz KWSRIYPUUQVSBP-SFHVURJKSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256905834 1063041820 /nfs/dbraw/zinc/04/18/20/1063041820.db2.gz UQASDKSLZPDIKX-MAUKXSAKSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256905834 1063041844 /nfs/dbraw/zinc/04/18/44/1063041844.db2.gz UQASDKSLZPDIKX-MAUKXSAKSA-N 2 1 320.908 4.268 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)CC1 ZINC001256906566 1063043083 /nfs/dbraw/zinc/04/30/83/1063043083.db2.gz CQRRAMYOSVJCBN-MRXNPFEDSA-N 2 1 314.464 4.199 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)CC1 ZINC001256906566 1063043100 /nfs/dbraw/zinc/04/31/00/1063043100.db2.gz CQRRAMYOSVJCBN-MRXNPFEDSA-N 2 1 314.464 4.199 20 0 DIADMP C[C@@H]([NH3+])c1cn([C@H]2CCC[N@H+](C3CCCC3)C2)c2ccccc12 ZINC001256909961 1063049038 /nfs/dbraw/zinc/04/90/38/1063049038.db2.gz VIYXEGLFCHWXBR-WBVHZDCISA-N 2 1 311.473 4.241 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+]([C@@H]2CCCc3ccc(F)cc32)CC1 ZINC001460794535 1063063726 /nfs/dbraw/zinc/06/37/26/1063063726.db2.gz NJXZGELAXVGLPB-LJQANCHMSA-N 2 1 316.464 4.153 20 0 DIADMP C[C@@H]1CC([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@@H](C)O1 ZINC001257079681 1063105443 /nfs/dbraw/zinc/10/54/43/1063105443.db2.gz GMDFXYLXSPIGTB-PSBWJHGTSA-N 2 1 322.537 4.095 20 0 DIADMP CC(C)[NH+]1CCC([NH+]2CCC(c3ccccc3Cl)CC2)CC1 ZINC001257221906 1063148255 /nfs/dbraw/zinc/14/82/55/1063148255.db2.gz KBWHAUWLRAQBFR-UHFFFAOYSA-N 2 1 320.908 4.392 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1[NH3+] ZINC001257250399 1063160337 /nfs/dbraw/zinc/16/03/37/1063160337.db2.gz MWAUQDWQPICEMM-DGXAPEILSA-N 2 1 320.480 4.142 20 0 DIADMP CCC[C@@H](CC)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001257255157 1063163547 /nfs/dbraw/zinc/16/35/47/1063163547.db2.gz YTXZMQXVTVMENU-YZGWKJHDSA-N 2 1 302.506 4.313 20 0 DIADMP CCC[C@H](CC)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257264627 1063170727 /nfs/dbraw/zinc/17/07/27/1063170727.db2.gz PLJSQKFVANYKKV-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC001257292892 1063183229 /nfs/dbraw/zinc/18/32/29/1063183229.db2.gz XRBSBRDGQGUJCM-QZTJIDSGSA-N 2 1 318.505 4.248 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001257301509 1063190628 /nfs/dbraw/zinc/19/06/28/1063190628.db2.gz HVEJDROKYVRCMI-OALUTQOASA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257301509 1063190638 /nfs/dbraw/zinc/19/06/38/1063190638.db2.gz HVEJDROKYVRCMI-OALUTQOASA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257301509 1063190653 /nfs/dbraw/zinc/19/06/53/1063190653.db2.gz HVEJDROKYVRCMI-OALUTQOASA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001257301508 1063191230 /nfs/dbraw/zinc/19/12/30/1063191230.db2.gz HVEJDROKYVRCMI-MOPGFXCFSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257301508 1063191241 /nfs/dbraw/zinc/19/12/41/1063191241.db2.gz HVEJDROKYVRCMI-MOPGFXCFSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257301508 1063191248 /nfs/dbraw/zinc/19/12/48/1063191248.db2.gz HVEJDROKYVRCMI-MOPGFXCFSA-N 2 1 300.490 4.019 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@@H](C(C)C)[NH+]1CCCC1 ZINC001461030038 1063199509 /nfs/dbraw/zinc/19/95/09/1063199509.db2.gz LHUKXPQERYIHQD-BAILOTOSSA-N 2 1 320.908 4.453 20 0 DIADMP CCc1cccc2cc(C[NH2+]C3CC[NH+](CC(C)C)CC3)oc21 ZINC001461032418 1063202351 /nfs/dbraw/zinc/20/23/51/1063202351.db2.gz QJAXDUOAPSVZFP-UHFFFAOYSA-N 2 1 314.473 4.205 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257328682 1063209139 /nfs/dbraw/zinc/20/91/39/1063209139.db2.gz SPSZWCFZHCAHFF-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257328682 1063209156 /nfs/dbraw/zinc/20/91/56/1063209156.db2.gz SPSZWCFZHCAHFF-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257328682 1063209175 /nfs/dbraw/zinc/20/91/75/1063209175.db2.gz SPSZWCFZHCAHFF-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccc(C[NH2+]CC3(C)CCC3)cc2)C1 ZINC001461043812 1063211901 /nfs/dbraw/zinc/21/19/01/1063211901.db2.gz IVWFLXOMCTZMGI-QGZVFWFLSA-N 2 1 300.490 4.198 20 0 DIADMP CCCC(CCC)N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001257337557 1063217730 /nfs/dbraw/zinc/21/77/30/1063217730.db2.gz YJWMRNZZBAEJAK-INIZCTEOSA-N 2 1 320.525 4.069 20 0 DIADMP CCCCCC[C@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257359275 1063227059 /nfs/dbraw/zinc/22/70/59/1063227059.db2.gz NQNNKYAYTCNDPD-BZSNNMDCSA-N 2 1 310.526 4.096 20 0 DIADMP CCCCCC[C@@H](C)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001257366266 1063234918 /nfs/dbraw/zinc/23/49/18/1063234918.db2.gz SWHWXAJQKZPEBZ-MRXNPFEDSA-N 2 1 303.494 4.288 20 0 DIADMP CCCCCC[C@H](C)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001257365340 1063236340 /nfs/dbraw/zinc/23/63/40/1063236340.db2.gz KSXXOGSXCLVZIU-ROUUACIJSA-N 2 1 324.553 4.357 20 0 DIADMP CCCCCC[C@@H](C)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001257374023 1063241314 /nfs/dbraw/zinc/24/13/14/1063241314.db2.gz YFJVZEXCEBIPQC-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)c2ccc(Cl)cc2)CC1(C)C ZINC001461087040 1063245469 /nfs/dbraw/zinc/24/54/69/1063245469.db2.gz XLHCVIVZZRMJTH-MRXNPFEDSA-N 2 1 308.897 4.080 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCC[C@H](C)CC2)cc1F ZINC001461097034 1063252267 /nfs/dbraw/zinc/25/22/67/1063252267.db2.gz ADKFSPFNSPRHCM-WMLDXEAASA-N 2 1 315.436 4.378 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257414920 1063262615 /nfs/dbraw/zinc/26/26/15/1063262615.db2.gz TXZNZEIFPLWNIP-FHWLQOOXSA-N 2 1 303.494 4.122 20 0 DIADMP CC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1c1ccccc1 ZINC001257433782 1063279170 /nfs/dbraw/zinc/27/91/70/1063279170.db2.gz KFAZVHUOZRQHAV-NYVOZVTQSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](C)[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001257445718 1063281559 /nfs/dbraw/zinc/28/15/59/1063281559.db2.gz CXZPHXGBRPCCEL-SFHVURJKSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)CC[C@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001257481333 1063306347 /nfs/dbraw/zinc/30/63/47/1063306347.db2.gz JXBHBONQGFZTQL-ROUUACIJSA-N 2 1 324.553 4.167 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001461173093 1063308824 /nfs/dbraw/zinc/30/88/24/1063308824.db2.gz WBZCMQSLPTWCGB-SFTDATJTSA-N 2 1 314.517 4.178 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001461173093 1063308846 /nfs/dbraw/zinc/30/88/46/1063308846.db2.gz WBZCMQSLPTWCGB-SFTDATJTSA-N 2 1 314.517 4.178 20 0 DIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1cnc(C2CCCC2)s1)C(C)(C)C ZINC001461192976 1063323725 /nfs/dbraw/zinc/32/37/25/1063323725.db2.gz NGOVHVGDDPTJMO-MRXNPFEDSA-N 2 1 323.550 4.257 20 0 DIADMP CCCCC[C@H](C)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257517692 1063325735 /nfs/dbraw/zinc/32/57/35/1063325735.db2.gz ZGLUAUDWBFXSHS-ICSRJNTNSA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@H](C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257517692 1063325751 /nfs/dbraw/zinc/32/57/51/1063325751.db2.gz ZGLUAUDWBFXSHS-ICSRJNTNSA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@H](C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257517692 1063325768 /nfs/dbraw/zinc/32/57/68/1063325768.db2.gz ZGLUAUDWBFXSHS-ICSRJNTNSA-N 2 1 302.506 4.409 20 0 DIADMP CCC(CC)C[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001461356261 1063441052 /nfs/dbraw/zinc/44/10/52/1063441052.db2.gz FZEYKRHQVKWBLH-YLJYHZDGSA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C[C@H](c2ccccc2)C(C)C)C1 ZINC001461373845 1063454513 /nfs/dbraw/zinc/45/45/13/1063454513.db2.gz VAHZPFVFOFFCBI-FPOVZHCZSA-N 2 1 316.533 4.384 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC(C)C)CC1 ZINC001258016905 1063466009 /nfs/dbraw/zinc/46/60/09/1063466009.db2.gz NPUNCZDZMBEWFF-UHFFFAOYSA-N 2 1 308.897 4.282 20 0 DIADMP Cc1ccc([C@H]2CCC[N@@H+]2C2CC[NH+](CC(C)C)CC2)cc1 ZINC001258014690 1063466391 /nfs/dbraw/zinc/46/63/91/1063466391.db2.gz QHPDHRACALBWCR-HXUWFJFHSA-N 2 1 300.490 4.252 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC001258017225 1063467615 /nfs/dbraw/zinc/46/76/15/1063467615.db2.gz XFIDAYJWXGESKR-KRWDZBQOSA-N 2 1 320.908 4.250 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC001473176346 1063481850 /nfs/dbraw/zinc/48/18/50/1063481850.db2.gz VEMWRYPOTVKSFT-FQEVSTJZSA-N 2 1 300.490 4.260 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@H](C)[C@H]1c1ccc(C)cc1 ZINC001473184174 1063493188 /nfs/dbraw/zinc/49/31/88/1063493188.db2.gz CMTYFINQFGJTBC-ICSRJNTNSA-N 2 1 302.506 4.500 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 ZINC001473184175 1063494413 /nfs/dbraw/zinc/49/44/13/1063494413.db2.gz CMTYFINQFGJTBC-QUCCMNQESA-N 2 1 302.506 4.500 20 0 DIADMP CCC(CC)[N@H+](CC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258146852 1063532810 /nfs/dbraw/zinc/53/28/10/1063532810.db2.gz APYYJYZQIZFODZ-UHFFFAOYSA-N 2 1 302.506 4.204 20 0 DIADMP CCC(CC)[N@@H+](CC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258146852 1063532823 /nfs/dbraw/zinc/53/28/23/1063532823.db2.gz APYYJYZQIZFODZ-UHFFFAOYSA-N 2 1 302.506 4.204 20 0 DIADMP C[C@H]1CC([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C[C@H](C)C1 ZINC001258158325 1063534747 /nfs/dbraw/zinc/53/47/47/1063534747.db2.gz CFMCIAMQWNUVDN-IAGOWNOFSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C[C@@H](C)C1 ZINC001258155360 1063536096 /nfs/dbraw/zinc/53/60/96/1063536096.db2.gz DEJYECZJKONQDX-HWWDLCQESA-N 2 1 320.908 4.415 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C[C@@H](C)C1 ZINC001258158324 1063536639 /nfs/dbraw/zinc/53/66/39/1063536639.db2.gz CFMCIAMQWNUVDN-DZFIZOCASA-N 2 1 304.522 4.152 20 0 DIADMP c1csc(C[NH+]2C[C@@H]3C[NH+](C4CCCCCCC4)C[C@H]3C2)c1 ZINC001258237412 1063577137 /nfs/dbraw/zinc/57/71/37/1063577137.db2.gz JTAZFUQBSAOVJA-IAGOWNOFSA-N 2 1 318.530 4.225 20 0 DIADMP CC1(C)CCC[C@@H]([N@@H+](Cc2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258281630 1063584712 /nfs/dbraw/zinc/58/47/12/1063584712.db2.gz NDANIQOWNFFBJE-BHIYHBOVSA-N 2 1 315.505 4.122 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C1CCCC1 ZINC001461567473 1063585227 /nfs/dbraw/zinc/58/52/27/1063585227.db2.gz FVXARTOHKMAMJC-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C1CCCC1 ZINC001461567473 1063585235 /nfs/dbraw/zinc/58/52/35/1063585235.db2.gz FVXARTOHKMAMJC-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C1 ZINC001258284195 1063587571 /nfs/dbraw/zinc/58/75/71/1063587571.db2.gz APQNEIIQIYGKCI-SFHVURJKSA-N 2 1 304.522 4.296 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCCC(C)(C)C1 ZINC001258288599 1063590063 /nfs/dbraw/zinc/59/00/63/1063590063.db2.gz HGRWOUIRXNYXDZ-WOJBJXKFSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCCC(C)(C)C1 ZINC001258288599 1063590077 /nfs/dbraw/zinc/59/00/77/1063590077.db2.gz HGRWOUIRXNYXDZ-WOJBJXKFSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCCC(C)(C)C1 ZINC001258288599 1063590090 /nfs/dbraw/zinc/59/00/90/1063590090.db2.gz HGRWOUIRXNYXDZ-WOJBJXKFSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001258303688 1063600556 /nfs/dbraw/zinc/60/05/56/1063600556.db2.gz WKABKDHSMNCXQO-CVEARBPZSA-N 2 1 324.534 4.144 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258315148 1063605195 /nfs/dbraw/zinc/60/51/95/1063605195.db2.gz KANYZYPSOKIUBF-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP C[N@H+]1CC[C@H](NCc2ccc(-c3cccs3)cc2)CC1(C)C ZINC001461622779 1063619662 /nfs/dbraw/zinc/61/96/62/1063619662.db2.gz SAWHQIFOCSBAKW-KRWDZBQOSA-N 2 1 314.498 4.378 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(-c3cccs3)cc2)CC1(C)C ZINC001461622779 1063619674 /nfs/dbraw/zinc/61/96/74/1063619674.db2.gz SAWHQIFOCSBAKW-KRWDZBQOSA-N 2 1 314.498 4.378 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1ccc2c(c1)CCC2)C1CCCCC1 ZINC001461624127 1063620819 /nfs/dbraw/zinc/62/08/19/1063620819.db2.gz QUCBNVRCVCUKKK-UHFFFAOYSA-N 2 1 314.517 4.310 20 0 DIADMP C([NH2+]C1CCC2(CCCC2)CC1)[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461664384 1063644410 /nfs/dbraw/zinc/64/44/10/1063644410.db2.gz QKBVMJKOMPXZTF-GOSISDBHSA-N 2 1 304.522 4.201 20 0 DIADMP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1-c1ccccc1 ZINC001279097154 1063645576 /nfs/dbraw/zinc/64/55/76/1063645576.db2.gz GSSCBPYGXRWSET-IHWFROFDSA-N 2 1 306.453 4.068 20 0 DIADMP CCCCC[C@H](CC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258433530 1063650649 /nfs/dbraw/zinc/65/06/49/1063650649.db2.gz GQQFZRCJNDHVLF-BZSNNMDCSA-N 2 1 310.526 4.096 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001258460631 1063663032 /nfs/dbraw/zinc/66/30/32/1063663032.db2.gz JPJLMKUVJOUAQI-LPHOPBHVSA-N 2 1 316.489 4.145 20 0 DIADMP Cc1ccccc1C[N@H+]([C@@H](C)CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258457600 1063663391 /nfs/dbraw/zinc/66/33/91/1063663391.db2.gz ZRQQEAPCMZDASS-VDGAXYAQSA-N 2 1 300.490 4.256 20 0 DIADMP C[C@@H](CC1CC1)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001258461748 1063666036 /nfs/dbraw/zinc/66/60/36/1063666036.db2.gz FTNPTYPDWIVZCQ-SFHVURJKSA-N 2 1 312.501 4.163 20 0 DIADMP CCCC1CCC([N@@H+](C2CCOCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001258531111 1063684456 /nfs/dbraw/zinc/68/44/56/1063684456.db2.gz VIAOKMKZYZMZNA-ASUHFHQRSA-N 2 1 322.537 4.096 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001461752786 1063697576 /nfs/dbraw/zinc/69/75/76/1063697576.db2.gz HXKRAUMVNARHEX-RTBURBONSA-N 2 1 308.469 4.119 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCC(C)(C)C1 ZINC001258607908 1063709019 /nfs/dbraw/zinc/70/90/19/1063709019.db2.gz UJIRQFPROGTXPC-RTBURBONSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258653322 1063725982 /nfs/dbraw/zinc/72/59/82/1063725982.db2.gz OUZDXRINQKPCSF-NJDAHSKKSA-N 2 1 314.517 4.380 20 0 DIADMP CCCCC[C@@H](CCC)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001258666316 1063732721 /nfs/dbraw/zinc/73/27/21/1063732721.db2.gz GMPRZEUOCBKLQI-QGZVFWFLSA-N 3 1 313.574 4.211 20 0 DIADMP CCCCC[C@@H](CCC)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001258673614 1063742727 /nfs/dbraw/zinc/74/27/27/1063742727.db2.gz MQCWFGRDGDXNJN-HXUWFJFHSA-N 2 1 324.553 4.311 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001461863435 1063757318 /nfs/dbraw/zinc/75/73/18/1063757318.db2.gz OOQNOJMLTNHWKD-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001461863435 1063757326 /nfs/dbraw/zinc/75/73/26/1063757326.db2.gz OOQNOJMLTNHWKD-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001461863435 1063757333 /nfs/dbraw/zinc/75/73/33/1063757333.db2.gz OOQNOJMLTNHWKD-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001461863435 1063757343 /nfs/dbraw/zinc/75/73/43/1063757343.db2.gz OOQNOJMLTNHWKD-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP C[NH+]1CCC(C[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)CC1 ZINC001461861524 1063757991 /nfs/dbraw/zinc/75/79/91/1063757991.db2.gz KNEUPHIZBSFOOB-JOCHJYFZSA-N 2 1 320.480 4.128 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001258710804 1063767919 /nfs/dbraw/zinc/76/79/19/1063767919.db2.gz WGRRWPACVXXJTM-TYPHKJRUSA-N 2 1 316.533 4.496 20 0 DIADMP CC[C@@H]1C[N@@H+](CC2CC[NH+](CC)CC2)CC[C@H]1c1ccccc1 ZINC001461880567 1063768708 /nfs/dbraw/zinc/76/87/08/1063768708.db2.gz JVQGKPGJZXIHDX-TZIWHRDSSA-N 2 1 314.517 4.234 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001258710801 1063769472 /nfs/dbraw/zinc/76/94/72/1063769472.db2.gz WGRRWPACVXXJTM-CEWLAPEOSA-N 2 1 316.533 4.496 20 0 DIADMP C[N@@H+](CC1CCC2(CCCCC2)CC1)C[C@H]1CCC[NH+](C)C1 ZINC001461886150 1063776262 /nfs/dbraw/zinc/77/62/62/1063776262.db2.gz CMZHTXMIBFFLMY-IBGZPJMESA-N 2 1 306.538 4.401 20 0 DIADMP C[NH+](CC1CCC2(CCCCC2)CC1)C[C@H]1CCC[N@H+](C)C1 ZINC001461886150 1063776276 /nfs/dbraw/zinc/77/62/76/1063776276.db2.gz CMZHTXMIBFFLMY-IBGZPJMESA-N 2 1 306.538 4.401 20 0 DIADMP C[NH+](CC1CCC2(CCCCC2)CC1)C[C@H]1CCC[N@@H+](C)C1 ZINC001461886150 1063776288 /nfs/dbraw/zinc/77/62/88/1063776288.db2.gz CMZHTXMIBFFLMY-IBGZPJMESA-N 2 1 306.538 4.401 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001258745025 1063795216 /nfs/dbraw/zinc/79/52/16/1063795216.db2.gz XJAUCHXRZWFRQS-JKSUJKDBSA-N 2 1 308.897 4.112 20 0 DIADMP CC(C)C[N@@H+]([C@H](C)Cc1cccc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258744938 1063795291 /nfs/dbraw/zinc/79/52/91/1063795291.db2.gz WITCKUWOATVBCL-ATZDWAIDSA-N 2 1 322.924 4.499 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H](C)Cc2cccc(Cl)c2)CC1 ZINC001258753576 1063799910 /nfs/dbraw/zinc/79/99/10/1063799910.db2.gz MIVNWPFUUKNPHG-MRXNPFEDSA-N 2 1 322.924 4.467 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC001461921732 1063803869 /nfs/dbraw/zinc/80/38/69/1063803869.db2.gz WILMHERMGQXIHG-KRWDZBQOSA-N 2 1 318.505 4.049 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC001461921732 1063803878 /nfs/dbraw/zinc/80/38/78/1063803878.db2.gz WILMHERMGQXIHG-KRWDZBQOSA-N 2 1 318.505 4.049 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001461921732 1063803887 /nfs/dbraw/zinc/80/38/87/1063803887.db2.gz WILMHERMGQXIHG-KRWDZBQOSA-N 2 1 318.505 4.049 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001461921732 1063803908 /nfs/dbraw/zinc/80/39/08/1063803908.db2.gz WILMHERMGQXIHG-KRWDZBQOSA-N 2 1 318.505 4.049 20 0 DIADMP CCCC[C@H](CCC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258759638 1063805192 /nfs/dbraw/zinc/80/51/92/1063805192.db2.gz WRCBMWKRDKZOKJ-BZSNNMDCSA-N 2 1 310.526 4.096 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2-c2ccccc2C)C1 ZINC001461920639 1063805397 /nfs/dbraw/zinc/80/53/97/1063805397.db2.gz RIQJDUDKJKXJJD-IBGZPJMESA-N 2 1 322.496 4.436 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2-c2ccccc2C)C1 ZINC001461920639 1063805408 /nfs/dbraw/zinc/80/54/08/1063805408.db2.gz RIQJDUDKJKXJJD-IBGZPJMESA-N 2 1 322.496 4.436 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2C)C1 ZINC001461920639 1063805420 /nfs/dbraw/zinc/80/54/20/1063805420.db2.gz RIQJDUDKJKXJJD-IBGZPJMESA-N 2 1 322.496 4.436 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2-c2ccccc2C)C1 ZINC001461920645 1063806247 /nfs/dbraw/zinc/80/62/47/1063806247.db2.gz RIQJDUDKJKXJJD-LJQANCHMSA-N 2 1 322.496 4.436 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2-c2ccccc2C)C1 ZINC001461920645 1063806262 /nfs/dbraw/zinc/80/62/62/1063806262.db2.gz RIQJDUDKJKXJJD-LJQANCHMSA-N 2 1 322.496 4.436 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2C)C1 ZINC001461920645 1063806278 /nfs/dbraw/zinc/80/62/78/1063806278.db2.gz RIQJDUDKJKXJJD-LJQANCHMSA-N 2 1 322.496 4.436 20 0 DIADMP CCCC[C@@H](CCC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258762039 1063806729 /nfs/dbraw/zinc/80/67/29/1063806729.db2.gz SJHSUUQJTSJMGA-QGZVFWFLSA-N 2 1 303.494 4.288 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C\c2ccc(F)cc2)CC1 ZINC001461926944 1063812067 /nfs/dbraw/zinc/81/20/67/1063812067.db2.gz LKGUMUXIQQXIJM-WAYWQWQTSA-N 2 1 318.480 4.283 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](CC2CC2)c2ccccc2F)CC1 ZINC001258770540 1063813003 /nfs/dbraw/zinc/81/30/03/1063813003.db2.gz LPYLIYGPXNVLHA-LJQANCHMSA-N 2 1 304.453 4.131 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001258775157 1063816781 /nfs/dbraw/zinc/81/67/81/1063816781.db2.gz CECNZEXLXGAUSF-INIZCTEOSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001258775157 1063816796 /nfs/dbraw/zinc/81/67/96/1063816796.db2.gz CECNZEXLXGAUSF-INIZCTEOSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001258774579 1063817665 /nfs/dbraw/zinc/81/76/65/1063817665.db2.gz SKKNBYQDGVDNLD-IBGZPJMESA-N 2 1 304.453 4.227 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001258774579 1063817673 /nfs/dbraw/zinc/81/76/73/1063817673.db2.gz SKKNBYQDGVDNLD-IBGZPJMESA-N 2 1 304.453 4.227 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001258781811 1063818616 /nfs/dbraw/zinc/81/86/16/1063818616.db2.gz FWRFSGHBBXKETO-UYAOXDASSA-N 2 1 316.533 4.498 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258782278 1063818924 /nfs/dbraw/zinc/81/89/24/1063818924.db2.gz NRYPCOKCEWFCST-DOTOQJQBSA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258785116 1063821294 /nfs/dbraw/zinc/82/12/94/1063821294.db2.gz DTZVLPROYSFBIM-DLBZAZTESA-N 2 1 318.505 4.160 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258786154 1063824163 /nfs/dbraw/zinc/82/41/63/1063824163.db2.gz KTTWKYSVBFZGOM-HOTGVXAUSA-N 2 1 306.469 4.290 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814419 1063844980 /nfs/dbraw/zinc/84/49/80/1063844980.db2.gz OUTWLISENFFLHT-HUYLIWGRSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001258825519 1063850732 /nfs/dbraw/zinc/85/07/32/1063850732.db2.gz WWHWATZONGHQFL-HKUYNNGSSA-N 2 1 316.489 4.146 20 0 DIADMP CSCCCCCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000378927863 1063981812 /nfs/dbraw/zinc/98/18/12/1063981812.db2.gz VLMZHOCFXFDWEU-UHFFFAOYSA-N 2 1 320.546 4.164 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1C ZINC000379621915 1063984288 /nfs/dbraw/zinc/98/42/88/1063984288.db2.gz GBZYUWOCJHAGJQ-FJWRRNOESA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1C ZINC000379621915 1063984291 /nfs/dbraw/zinc/98/42/91/1063984291.db2.gz GBZYUWOCJHAGJQ-FJWRRNOESA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(O)cc1 ZINC000379632711 1063984554 /nfs/dbraw/zinc/98/45/54/1063984554.db2.gz NXWSTYVOOKDHRQ-ABSDTBQOSA-N 2 1 324.468 4.096 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(O)cc1 ZINC000379632711 1063984560 /nfs/dbraw/zinc/98/45/60/1063984560.db2.gz NXWSTYVOOKDHRQ-ABSDTBQOSA-N 2 1 324.468 4.096 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379632656 1063984898 /nfs/dbraw/zinc/98/48/98/1063984898.db2.gz NUODOBAHRSWFBC-UGKGYDQZSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379632656 1063984907 /nfs/dbraw/zinc/98/49/07/1063984907.db2.gz NUODOBAHRSWFBC-UGKGYDQZSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC000379654966 1063987782 /nfs/dbraw/zinc/98/77/82/1063987782.db2.gz KKZFJMZLDJOABJ-UGKGYDQZSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1C ZINC000379654966 1063987790 /nfs/dbraw/zinc/98/77/90/1063987790.db2.gz KKZFJMZLDJOABJ-UGKGYDQZSA-N 2 1 322.496 4.446 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658817 1063988206 /nfs/dbraw/zinc/98/82/06/1063988206.db2.gz XLIPMQFQJNZBOI-ZHALLVOQSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658817 1063988210 /nfs/dbraw/zinc/98/82/10/1063988210.db2.gz XLIPMQFQJNZBOI-ZHALLVOQSA-N 2 1 302.506 4.454 20 0 DIADMP CCCC(CCC)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381799712 1063992731 /nfs/dbraw/zinc/99/27/31/1063992731.db2.gz RVLUHPQEERTVRK-HKUYNNGSSA-N 2 1 302.506 4.455 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382073444 1063997347 /nfs/dbraw/zinc/99/73/47/1063997347.db2.gz SWSHGJQDTHRKOC-CMKODMSKSA-N 2 1 302.506 4.169 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CCCC1 ZINC000382773148 1064000290 /nfs/dbraw/zinc/00/02/90/1064000290.db2.gz ALCKZGRNXNQINP-NRFANRHFSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660906 1064166488 /nfs/dbraw/zinc/16/64/88/1064166488.db2.gz PRUIYQBLHFQQSW-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660906 1064166489 /nfs/dbraw/zinc/16/64/89/1064166489.db2.gz PRUIYQBLHFQQSW-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP CC(C)(C)CC(C)(C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000390801854 1064170316 /nfs/dbraw/zinc/17/03/16/1064170316.db2.gz ZYFLIUARPPKVOV-UHFFFAOYSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C[C@@H](C)C1 ZINC000393624580 1064291788 /nfs/dbraw/zinc/29/17/88/1064291788.db2.gz HRUXRZDJNDXZDY-YXYSEUPNSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000393946123 1064311979 /nfs/dbraw/zinc/31/19/79/1064311979.db2.gz FYLLLRXBIDTOMQ-NSHGMRRFSA-N 2 1 302.506 4.313 20 0 DIADMP C[N@H+]1CCCC2(CC[NH+](CCCc3ccc(Cl)cc3)CC2)C1 ZINC001279633242 1064362063 /nfs/dbraw/zinc/36/20/63/1064362063.db2.gz ZTQAQVZBUCLTSI-UHFFFAOYSA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+]1CCC[C@]2(CCC[NH+](CCCc3ccc(Cl)cc3)C2)C1 ZINC001279631856 1064362403 /nfs/dbraw/zinc/36/24/03/1064362403.db2.gz GEMFMEGFUXRGCG-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CCC[N@H+](CCCc3ccc(Cl)cc3)C2)C1 ZINC001279631856 1064362417 /nfs/dbraw/zinc/36/24/17/1064362417.db2.gz GEMFMEGFUXRGCG-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CCC[N@@H+](CCCc3ccc(Cl)cc3)C2)C1 ZINC001279631856 1064362428 /nfs/dbraw/zinc/36/24/28/1064362428.db2.gz GEMFMEGFUXRGCG-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC2(C1)CCC[N@@H+](CCOC(C)C)C2 ZINC001280081505 1064380376 /nfs/dbraw/zinc/38/03/76/1064380376.db2.gz SKKNNTFINURTPH-LJQANCHMSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCOCC)C2 ZINC001280151316 1064381896 /nfs/dbraw/zinc/38/18/96/1064381896.db2.gz HVZABZYEPVLKMS-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCOCC)C2 ZINC001280151316 1064381911 /nfs/dbraw/zinc/38/19/11/1064381911.db2.gz HVZABZYEPVLKMS-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCOCC)C2 ZINC001280151316 1064381916 /nfs/dbraw/zinc/38/19/16/1064381916.db2.gz HVZABZYEPVLKMS-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP Fc1cccc(C2([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CCC2)c1 ZINC000647802326 1064414814 /nfs/dbraw/zinc/41/48/14/1064414814.db2.gz JCQPTIPZJYUCTM-UXHICEINSA-N 2 1 324.443 4.288 20 0 DIADMP Fc1ccc(F)c(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC001307413567 1065374655 /nfs/dbraw/zinc/37/46/55/1065374655.db2.gz XDAANESMMUCMEE-UHFFFAOYSA-N 2 1 322.443 4.053 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC2CCCCC2)CC1 ZINC001307452031 1065408554 /nfs/dbraw/zinc/40/85/54/1065408554.db2.gz HJKIYWVOQFVLNK-UHFFFAOYSA-N 2 1 314.517 4.411 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477721 1065423288 /nfs/dbraw/zinc/42/32/88/1065423288.db2.gz NJFAUHLMXASUTG-BWPNAZKDSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477721 1065423294 /nfs/dbraw/zinc/42/32/94/1065423294.db2.gz NJFAUHLMXASUTG-BWPNAZKDSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477721 1065423298 /nfs/dbraw/zinc/42/32/98/1065423298.db2.gz NJFAUHLMXASUTG-BWPNAZKDSA-N 2 1 304.522 4.009 20 0 DIADMP CC1CC(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC001307523668 1065461486 /nfs/dbraw/zinc/46/14/86/1065461486.db2.gz BCPNKJFTSNWWQY-HXJFWZBSSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC001307523668 1065461494 /nfs/dbraw/zinc/46/14/94/1065461494.db2.gz BCPNKJFTSNWWQY-HXJFWZBSSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC001307523668 1065461500 /nfs/dbraw/zinc/46/15/00/1065461500.db2.gz BCPNKJFTSNWWQY-HXJFWZBSSA-N 2 1 312.501 4.019 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(C)c1 ZINC001307524793 1065462880 /nfs/dbraw/zinc/46/28/80/1065462880.db2.gz ZUJFNALSTLCEBI-IPMKNSEASA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001307524793 1065462883 /nfs/dbraw/zinc/46/28/83/1065462883.db2.gz ZUJFNALSTLCEBI-IPMKNSEASA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c(C)c1 ZINC001307524793 1065462889 /nfs/dbraw/zinc/46/28/89/1065462889.db2.gz ZUJFNALSTLCEBI-IPMKNSEASA-N 2 1 300.490 4.089 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC001307628305 1065526780 /nfs/dbraw/zinc/52/67/80/1065526780.db2.gz HERCSQBENOXXCE-MSOLQXFVSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C1CCCCC1 ZINC001307670003 1065554055 /nfs/dbraw/zinc/55/40/55/1065554055.db2.gz OXQMRPXTUVULGV-AOIWGVFYSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001307764742 1065611074 /nfs/dbraw/zinc/61/10/74/1065611074.db2.gz ZGUGKUFYRNINAG-SIKLNZKXSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001307764742 1065611077 /nfs/dbraw/zinc/61/10/77/1065611077.db2.gz ZGUGKUFYRNINAG-SIKLNZKXSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001307764742 1065611080 /nfs/dbraw/zinc/61/10/80/1065611080.db2.gz ZGUGKUFYRNINAG-SIKLNZKXSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001307764740 1065611400 /nfs/dbraw/zinc/61/14/00/1065611400.db2.gz ZGUGKUFYRNINAG-DENIHFKCSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001307764740 1065611403 /nfs/dbraw/zinc/61/14/03/1065611403.db2.gz ZGUGKUFYRNINAG-DENIHFKCSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001307764740 1065611406 /nfs/dbraw/zinc/61/14/06/1065611406.db2.gz ZGUGKUFYRNINAG-DENIHFKCSA-N 2 1 320.480 4.346 20 0 DIADMP Cc1cccc(C)c1[C@H]1CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001307921388 1065681690 /nfs/dbraw/zinc/68/16/90/1065681690.db2.gz WVJOPDSXZGSOPF-LJQANCHMSA-N 2 1 300.490 4.316 20 0 DIADMP CCC[N@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001307968672 1065704708 /nfs/dbraw/zinc/70/47/08/1065704708.db2.gz NYJWHALZSMHGFR-LJQANCHMSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009100 1065723242 /nfs/dbraw/zinc/72/32/42/1065723242.db2.gz PLLGXGSLDSYBRK-QIJZPMMNSA-N 2 1 314.517 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(c2ccccc2)c2ccccc2)CC1(C)C ZINC001308179076 1065791131 /nfs/dbraw/zinc/79/11/31/1065791131.db2.gz HZMLUVUJTKKRTG-FQEVSTJZSA-N 2 1 322.496 4.281 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)CC1 ZINC001308180458 1065791395 /nfs/dbraw/zinc/79/13/95/1065791395.db2.gz IHBYERDQERCGDZ-UYAOXDASSA-N 2 1 300.490 4.177 20 0 DIADMP CC1(C)CCC[C@@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001308182039 1065794129 /nfs/dbraw/zinc/79/41/29/1065794129.db2.gz LJGLFDJKMJIQEJ-LJQANCHMSA-N 2 1 314.517 4.457 20 0 DIADMP CCOc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(C)c1 ZINC001308202214 1065809687 /nfs/dbraw/zinc/80/96/87/1065809687.db2.gz DZQURJWLBVGJEC-SFHVURJKSA-N 2 1 318.505 4.138 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC001308200022 1065810037 /nfs/dbraw/zinc/81/00/37/1065810037.db2.gz RSACAFIUDPNPDR-HLIPFELVSA-N 2 1 300.490 4.197 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cn1 ZINC001308203237 1065813226 /nfs/dbraw/zinc/81/32/26/1065813226.db2.gz MUYXAVCXZMUBJQ-SFHVURJKSA-N 2 1 317.521 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C/C=C\c1cc(C)c(C)cc1C ZINC001308283022 1065880285 /nfs/dbraw/zinc/88/02/85/1065880285.db2.gz QZFOWADPNARUKZ-FPLPWBNLSA-N 2 1 311.473 4.200 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc2occc2c1)[N@@H+](C)Cc1ccccc1 ZINC001308302280 1065896494 /nfs/dbraw/zinc/89/64/94/1065896494.db2.gz YMGFALWUIDQLDD-QGZVFWFLSA-N 2 1 322.452 4.433 20 0 DIADMP CC(C)CC[C@@H]1CC[C@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC001308302970 1065898492 /nfs/dbraw/zinc/89/84/92/1065898492.db2.gz BRXQKMGVWRQAPT-QUCCMNQESA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)CC[C@H]1CC[C@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC001308302969 1065898592 /nfs/dbraw/zinc/89/85/92/1065898592.db2.gz BRXQKMGVWRQAPT-ICSRJNTNSA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccccc2C2CC2)C1 ZINC001308338634 1065922718 /nfs/dbraw/zinc/92/27/18/1065922718.db2.gz BFMRQZKQAWJQCV-QGZVFWFLSA-N 2 1 300.490 4.022 20 0 DIADMP Cc1scc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC001308367319 1065945573 /nfs/dbraw/zinc/94/55/73/1065945573.db2.gz DVSPLPMBMHZURO-ZBFHGGJFSA-N 2 1 306.519 4.108 20 0 DIADMP CC(C)C(C)(C)C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001308374372 1065948835 /nfs/dbraw/zinc/94/88/35/1065948835.db2.gz JTMKYURKCWNODS-UHFFFAOYSA-N 2 1 304.522 4.416 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)c1 ZINC001308465576 1066006561 /nfs/dbraw/zinc/00/65/61/1066006561.db2.gz QWOJDAMDSYWEAI-HXUWFJFHSA-N 2 1 322.496 4.484 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001308469698 1066009364 /nfs/dbraw/zinc/00/93/64/1066009364.db2.gz RVDZWQYYKWFNHH-AZUAARDMSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001308469698 1066009380 /nfs/dbraw/zinc/00/93/80/1066009380.db2.gz RVDZWQYYKWFNHH-AZUAARDMSA-N 2 1 314.517 4.252 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001308589573 1066103906 /nfs/dbraw/zinc/10/39/06/1066103906.db2.gz HBCCEMCRJPGIPU-PWRODBHTSA-N 2 1 318.549 4.423 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@H](C)c2sc(C(C)C)nc2C)CC1 ZINC001308621401 1066123175 /nfs/dbraw/zinc/12/31/75/1066123175.db2.gz KJLRQNCVLVIJEQ-OAHLLOKOSA-N 2 1 323.550 4.300 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001308634203 1066129257 /nfs/dbraw/zinc/12/92/57/1066129257.db2.gz GDEAACGREIMYDS-QYRPDUKASA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2CC=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001308633619 1066129310 /nfs/dbraw/zinc/12/93/10/1066129310.db2.gz KNFVWRYWXOSCKJ-SBHAEUEKSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2CC=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001308633619 1066129313 /nfs/dbraw/zinc/12/93/13/1066129313.db2.gz KNFVWRYWXOSCKJ-SBHAEUEKSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C[C@@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633619 1066129316 /nfs/dbraw/zinc/12/93/16/1066129316.db2.gz KNFVWRYWXOSCKJ-SBHAEUEKSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C[C@@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633619 1066129317 /nfs/dbraw/zinc/12/93/17/1066129317.db2.gz KNFVWRYWXOSCKJ-SBHAEUEKSA-N 2 1 312.501 4.328 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C4CCCCC4)[C@@H]3C2)cc1 ZINC001308636365 1066131511 /nfs/dbraw/zinc/13/15/11/1066131511.db2.gz ZRLGMWZMVCKNMO-TYPHKJRUSA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)CC1 ZINC001308721170 1066198770 /nfs/dbraw/zinc/19/87/70/1066198770.db2.gz QBVAOIIYTRKOLD-UHFFFAOYSA-N 2 1 306.538 4.257 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001308721525 1066199121 /nfs/dbraw/zinc/19/91/21/1066199121.db2.gz CNGHBYNENJHQAV-WIYYLYMNSA-N 2 1 314.517 4.485 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001308729127 1066204543 /nfs/dbraw/zinc/20/45/43/1066204543.db2.gz DMSDWTFDZFJYRL-TZIWHRDSSA-N 2 1 322.496 4.210 20 0 DIADMP C[C@]1(C[NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@@H+](Cc2ccccc2)C1 ZINC001308729011 1066205289 /nfs/dbraw/zinc/20/52/89/1066205289.db2.gz VIOSBGWZLGZARF-XSDIEEQYSA-N 2 1 312.501 4.067 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1ccc(C)c(C)c1 ZINC001308743227 1066215530 /nfs/dbraw/zinc/21/55/30/1066215530.db2.gz CZKTXXCDOSCZJC-UHFFFAOYSA-N 2 1 313.489 4.017 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1ccc(C)c(C)c1 ZINC001308743227 1066215540 /nfs/dbraw/zinc/21/55/40/1066215540.db2.gz CZKTXXCDOSCZJC-UHFFFAOYSA-N 2 1 313.489 4.017 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(Cl)c1C ZINC001308744838 1066218513 /nfs/dbraw/zinc/21/85/13/1066218513.db2.gz ZQROFZWVJRBHJE-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(Cl)c1C ZINC001308744838 1066218526 /nfs/dbraw/zinc/21/85/26/1066218526.db2.gz ZQROFZWVJRBHJE-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)C[C@@H](C)c1cc(F)cc(F)c1 ZINC001308745188 1066220120 /nfs/dbraw/zinc/22/01/20/1066220120.db2.gz RDHTXKHATPXFLO-OAHLLOKOSA-N 2 1 312.448 4.122 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001308751539 1066226138 /nfs/dbraw/zinc/22/61/38/1066226138.db2.gz UEFVQYFKIKWPSO-KBPBESRZSA-N 2 1 314.926 4.187 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001308751539 1066226157 /nfs/dbraw/zinc/22/61/57/1066226157.db2.gz UEFVQYFKIKWPSO-KBPBESRZSA-N 2 1 314.926 4.187 20 0 DIADMP CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308772731 1066245994 /nfs/dbraw/zinc/24/59/94/1066245994.db2.gz WIHQRASXJFHRSS-OYNPSCLESA-N 2 1 314.517 4.313 20 0 DIADMP CC/C=C\C[NH2+]C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001308782449 1066254663 /nfs/dbraw/zinc/25/46/63/1066254663.db2.gz NYQMHSHHLIXBOZ-PNWMKBJFSA-N 2 1 314.517 4.481 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC001308863992 1066343269 /nfs/dbraw/zinc/34/32/69/1066343269.db2.gz OPQUYGDXAZVQLL-ATZDWAIDSA-N 2 1 320.908 4.298 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)C1 ZINC001308863905 1066345342 /nfs/dbraw/zinc/34/53/42/1066345342.db2.gz ODCOYFDWBVPELX-YZGWKJHDSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H](CC1CCCCC1)C[N@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC001308920107 1066400268 /nfs/dbraw/zinc/40/02/68/1066400268.db2.gz ZJXDFJGOBGTCMB-ZWKOTPCHSA-N 2 1 315.505 4.199 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@@H+](C)CC1CCC(c2ccccc2)CC1 ZINC001308969711 1066426764 /nfs/dbraw/zinc/42/67/64/1066426764.db2.gz UNNYXBCRPAWURY-UHFFFAOYSA-N 2 1 316.533 4.480 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccs1 ZINC000019914602 182164343 /nfs/dbraw/zinc/16/43/43/182164343.db2.gz NGVLADSJUZQCPC-OAHLLOKOSA-N 2 1 300.471 4.063 20 0 DIADMP C[C@@H](N[C@@H](C)c1cccnc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272635151 130048703 /nfs/dbraw/zinc/04/87/03/130048703.db2.gz BOBPLZXAOYYMED-ILXRZTDVSA-N 2 1 321.896 4.039 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)c1 ZINC000274823419 130264864 /nfs/dbraw/zinc/26/48/64/130264864.db2.gz BWASKJCPGIJFJP-AWEZNQCLSA-N 2 1 317.864 4.038 20 0 DIADMP CSCCCCC[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274817211 130265175 /nfs/dbraw/zinc/26/51/75/130265175.db2.gz XEKDAWCAUYQSFM-MJGOQNOKSA-N 2 1 320.546 4.020 20 0 DIADMP CSCCCCC[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000274817209 130265829 /nfs/dbraw/zinc/26/58/29/130265829.db2.gz XEKDAWCAUYQSFM-IEBWSBKVSA-N 2 1 320.546 4.020 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)c1 ZINC000284133189 131052412 /nfs/dbraw/zinc/05/24/12/131052412.db2.gz OHXYDCNDRRUELU-NRFANRHFSA-N 2 1 324.468 4.011 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(-c2cccnc2)cc1 ZINC000297799249 132034898 /nfs/dbraw/zinc/03/48/98/132034898.db2.gz XGRGBOJFYWLMNG-MRXNPFEDSA-N 2 1 321.468 4.026 20 0 DIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770621 332142265 /nfs/dbraw/zinc/14/22/65/332142265.db2.gz MKKUAAYLEOPROP-INIZCTEOSA-N 2 1 314.498 4.189 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770621 332142266 /nfs/dbraw/zinc/14/22/66/332142266.db2.gz MKKUAAYLEOPROP-INIZCTEOSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770621 332142267 /nfs/dbraw/zinc/14/22/67/332142267.db2.gz MKKUAAYLEOPROP-INIZCTEOSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770621 332142268 /nfs/dbraw/zinc/14/22/68/332142268.db2.gz MKKUAAYLEOPROP-INIZCTEOSA-N 2 1 314.498 4.189 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000559740475 332278144 /nfs/dbraw/zinc/27/81/44/332278144.db2.gz FXDXYYDPTCHRPU-YADHBBJMSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000559740475 332278145 /nfs/dbraw/zinc/27/81/45/332278145.db2.gz FXDXYYDPTCHRPU-YADHBBJMSA-N 2 1 322.496 4.271 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000559741918 332278209 /nfs/dbraw/zinc/27/82/09/332278209.db2.gz XFGWEKVAYVWWEO-LRQRDZAKSA-N 2 1 324.468 4.181 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000559741918 332278211 /nfs/dbraw/zinc/27/82/11/332278211.db2.gz XFGWEKVAYVWWEO-LRQRDZAKSA-N 2 1 324.468 4.181 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000559735761 332278767 /nfs/dbraw/zinc/27/87/67/332278767.db2.gz NDGZVKYROJPFBV-UIFIKXQLSA-N 2 1 308.469 4.215 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000559735761 332278769 /nfs/dbraw/zinc/27/87/69/332278769.db2.gz NDGZVKYROJPFBV-UIFIKXQLSA-N 2 1 308.469 4.215 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000559767084 332280309 /nfs/dbraw/zinc/28/03/09/332280309.db2.gz PBECISNODSINGW-OKYOBFRVSA-N 2 1 318.530 4.086 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000559767084 332280310 /nfs/dbraw/zinc/28/03/10/332280310.db2.gz PBECISNODSINGW-OKYOBFRVSA-N 2 1 318.530 4.086 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000109786219 332283948 /nfs/dbraw/zinc/28/39/48/332283948.db2.gz WHSMRKRMEYJPAO-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000109786219 332283950 /nfs/dbraw/zinc/28/39/50/332283950.db2.gz WHSMRKRMEYJPAO-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP CC(C)Oc1cccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000518765687 333029700 /nfs/dbraw/zinc/02/97/00/333029700.db2.gz XIRKQTCWYOVPGP-SFHVURJKSA-N 2 1 318.505 4.218 20 0 DIADMP CC1(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CCCCC1 ZINC000394548126 333075247 /nfs/dbraw/zinc/07/52/47/333075247.db2.gz GQMFTCWODWOCGF-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP c1cc(C2CCCC2)ccc1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000462915869 333131409 /nfs/dbraw/zinc/13/14/09/333131409.db2.gz XFIPWRACTRMVBL-UHFFFAOYSA-N 2 1 312.501 4.451 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccs2)c1 ZINC000177977268 333133750 /nfs/dbraw/zinc/13/37/50/333133750.db2.gz HCURGTQTJVSQNL-HNNXBMFYSA-N 2 1 302.487 4.439 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccsc1 ZINC000178012684 333134419 /nfs/dbraw/zinc/13/44/19/333134419.db2.gz DMUVPTYNDPHVOM-HNNXBMFYSA-N 2 1 302.487 4.439 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+]C2c3ccccc3-c3ccccc32)CC1 ZINC000497809070 333295235 /nfs/dbraw/zinc/29/52/35/333295235.db2.gz SJSGJPWIOUPZMF-UHFFFAOYSA-N 2 1 320.480 4.466 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCC3)[C@@H]1c1cccs1 ZINC000502465322 333298187 /nfs/dbraw/zinc/29/81/87/333298187.db2.gz VBICHGKDLHZANO-DJIMGWMZSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCC3)[C@@H]1c1cccs1 ZINC000502465322 333298189 /nfs/dbraw/zinc/29/81/89/333298189.db2.gz VBICHGKDLHZANO-DJIMGWMZSA-N 2 1 304.503 4.053 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000497850381 333301126 /nfs/dbraw/zinc/30/11/26/333301126.db2.gz ZDQDBMKTIKRGCS-LPHOPBHVSA-N 2 1 321.484 4.162 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccsc1 ZINC000390698654 333315847 /nfs/dbraw/zinc/31/58/47/333315847.db2.gz SIYSQVLPRRDOCZ-GOSISDBHSA-N 2 1 314.498 4.138 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccsc1 ZINC000390698654 333315848 /nfs/dbraw/zinc/31/58/48/333315848.db2.gz SIYSQVLPRRDOCZ-GOSISDBHSA-N 2 1 314.498 4.138 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000020549202 333322177 /nfs/dbraw/zinc/32/21/77/333322177.db2.gz SOQDIKNATSWSSO-CYBMUJFWSA-N 2 1 302.384 4.088 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000020556181 333323088 /nfs/dbraw/zinc/32/30/88/333323088.db2.gz XYWQFSOCWFFUQH-CYBMUJFWSA-N 2 1 302.384 4.088 20 0 DIADMP CCn1cncc1C[N@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC000417769829 335134068 /nfs/dbraw/zinc/13/40/68/335134068.db2.gz BLFKRHNFDJLMTE-UHFFFAOYSA-N 2 1 323.440 4.049 20 0 DIADMP CCn1cncc1C[N@@H+](CCc1ccc(C)cc1)Cc1ccco1 ZINC000417769829 335134070 /nfs/dbraw/zinc/13/40/70/335134070.db2.gz BLFKRHNFDJLMTE-UHFFFAOYSA-N 2 1 323.440 4.049 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000221922390 333379916 /nfs/dbraw/zinc/37/99/16/333379916.db2.gz OXIBRFGTOTTWRZ-CYBMUJFWSA-N 2 1 311.539 4.130 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C ZINC000221922390 333379915 /nfs/dbraw/zinc/37/99/15/333379915.db2.gz OXIBRFGTOTTWRZ-CYBMUJFWSA-N 2 1 311.539 4.130 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)NCCC[N@H+](C)C(C)C ZINC000221922390 333379914 /nfs/dbraw/zinc/37/99/14/333379914.db2.gz OXIBRFGTOTTWRZ-CYBMUJFWSA-N 2 1 311.539 4.130 20 0 DIADMP C1=C(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000563121001 333392909 /nfs/dbraw/zinc/39/29/09/333392909.db2.gz WAODBHPJIMQHSU-FQEVSTJZSA-N 2 1 310.485 4.274 20 0 DIADMP C1=C(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000563121001 333392911 /nfs/dbraw/zinc/39/29/11/333392911.db2.gz WAODBHPJIMQHSU-FQEVSTJZSA-N 2 1 310.485 4.274 20 0 DIADMP C[C@H]([NH2+]CC1CCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390800890 333394335 /nfs/dbraw/zinc/39/43/35/333394335.db2.gz ORZBQRLSFPUEOF-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP CCC(CC)[C@H]([NH2+]CCCc1c[nH+]cn1C)c1cccs1 ZINC000563355836 333595395 /nfs/dbraw/zinc/59/53/95/333595395.db2.gz WMMXPXWJXURUIB-KRWDZBQOSA-N 2 1 305.491 4.181 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000392003957 335149940 /nfs/dbraw/zinc/14/99/40/335149940.db2.gz RGMMSTLUDPSMOY-KTIPNOMGSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414668480 334062951 /nfs/dbraw/zinc/06/29/51/334062951.db2.gz AAWFGEVARXPRED-MCIONIFRSA-N 2 1 314.395 4.086 20 0 DIADMP [NH3+]C1(C[NH2+]Cc2cnc(-c3ccsc3)s2)CCCCCC1 ZINC000414858936 334131321 /nfs/dbraw/zinc/13/13/21/334131321.db2.gz LPSIOCHGIKWYOH-UHFFFAOYSA-N 2 1 321.515 4.013 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]C2CC(c3ccc(F)c(Cl)c3)C2)[C@H](C)C1 ZINC000467434323 334147264 /nfs/dbraw/zinc/14/72/64/334147264.db2.gz UTPIDUNBYXEZLU-UZFJHYNOSA-N 2 1 324.871 4.045 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccccc1)c1cccc(Cl)c1)[C@H]1CC[NH2+]C1 ZINC000415082669 334272023 /nfs/dbraw/zinc/27/20/23/334272023.db2.gz DOVDTWFLFAGDQY-UCLAIMLFSA-N 2 1 314.860 4.017 20 0 DIADMP Clc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC000415088097 334276523 /nfs/dbraw/zinc/27/65/23/334276523.db2.gz UQWNSOHJASOFAL-ZBFHGGJFSA-N 2 1 320.889 4.027 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@H+](C(C)C)C1 ZINC000582149471 334273577 /nfs/dbraw/zinc/27/35/77/334273577.db2.gz NAVVYHVBBJFKSU-UXHICEINSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@H+](C(C)C)C1 ZINC000582149472 334273661 /nfs/dbraw/zinc/27/36/61/334273661.db2.gz NAVVYHVBBJFKSU-VQTJNVASSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)C(C)(C)c1ccccc1 ZINC000415086029 334274790 /nfs/dbraw/zinc/27/47/90/334274790.db2.gz RDVKBQLSJOODOO-YYWHXJBOSA-N 2 1 322.496 4.436 20 0 DIADMP Cc1ccccc1C(C)(C)C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415092648 334280427 /nfs/dbraw/zinc/28/04/27/334280427.db2.gz UBLXOLLSZXPFLR-FPOVZHCZSA-N 2 1 322.496 4.356 20 0 DIADMP Cc1ccccc1C(C)(C)C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415092650 334280457 /nfs/dbraw/zinc/28/04/57/334280457.db2.gz UBLXOLLSZXPFLR-TZIWHRDSSA-N 2 1 322.496 4.356 20 0 DIADMP Clc1cccc([C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000415094089 334280532 /nfs/dbraw/zinc/28/05/32/334280532.db2.gz WNKRBHOCIJVBBC-KXBFYZLASA-N 2 1 314.860 4.019 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415095229 334281015 /nfs/dbraw/zinc/28/10/15/334281015.db2.gz YZBXZZXJXHLRAI-DPDLHNOKSA-N 2 1 306.453 4.003 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415095230 334281067 /nfs/dbraw/zinc/28/10/67/334281067.db2.gz YZBXZZXJXHLRAI-NSGGIEJNSA-N 2 1 306.453 4.003 20 0 DIADMP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415113193 334282165 /nfs/dbraw/zinc/28/21/65/334282165.db2.gz BOSVDSFMXWEKSV-RDGPPVDQSA-N 2 1 300.490 4.284 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117070 334284000 /nfs/dbraw/zinc/28/40/00/334284000.db2.gz FWALRRLGILVVJB-NIKGAXFTSA-N 2 1 314.860 4.484 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCC1 ZINC000531962012 334312589 /nfs/dbraw/zinc/31/25/89/334312589.db2.gz GNWDZAOZKUBCTA-VKJFTORMSA-N 2 1 320.908 4.080 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC000531957758 334313931 /nfs/dbraw/zinc/31/39/31/334313931.db2.gz FDXDLQVMZOMESF-UYAOXDASSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1ccc(C(F)F)cc1)Cc1ccccc1 ZINC000303431552 334319828 /nfs/dbraw/zinc/31/98/28/334319828.db2.gz VMRKJLOBVPDZHK-UHFFFAOYSA-N 2 1 318.411 4.236 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC000531967587 334326470 /nfs/dbraw/zinc/32/64/70/334326470.db2.gz GTLUSFQTDBFSRC-HTAPYJJXSA-N 2 1 320.480 4.489 20 0 DIADMP COc1ccc([C@@H](CCC(C)C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972454 334336733 /nfs/dbraw/zinc/33/67/33/334336733.db2.gz YYSCOLBQWBYDOV-FXAWDEMLSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000531988793 334364023 /nfs/dbraw/zinc/36/40/23/334364023.db2.gz SBKARNGXJPKJEH-BLIXFSHQSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000531988793 334364024 /nfs/dbraw/zinc/36/40/24/334364024.db2.gz SBKARNGXJPKJEH-BLIXFSHQSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000531988793 334364025 /nfs/dbraw/zinc/36/40/25/334364025.db2.gz SBKARNGXJPKJEH-BLIXFSHQSA-N 2 1 308.469 4.317 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc3ccccc3c2)CC1 ZINC000535082896 334366510 /nfs/dbraw/zinc/36/65/10/334366510.db2.gz FJTHEFIHLGDDKY-UHFFFAOYSA-N 2 1 310.485 4.392 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000345283792 335313629 /nfs/dbraw/zinc/31/36/29/335313629.db2.gz BLCZVFVILVNPOV-XWIAVFTESA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000345283792 335313631 /nfs/dbraw/zinc/31/36/31/335313631.db2.gz BLCZVFVILVNPOV-XWIAVFTESA-N 2 1 306.881 4.254 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000345286923 335314007 /nfs/dbraw/zinc/31/40/07/335314007.db2.gz FOGGYSSSTMOHHQ-SFHVURJKSA-N 2 1 304.865 4.033 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000346319404 335399744 /nfs/dbraw/zinc/39/97/44/335399744.db2.gz XXSZHYZTDJIKAT-GOSISDBHSA-N 2 1 319.452 4.455 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000346319404 335399746 /nfs/dbraw/zinc/39/97/46/335399746.db2.gz XXSZHYZTDJIKAT-GOSISDBHSA-N 2 1 319.452 4.455 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCCCS2)cc1 ZINC000346809556 335442465 /nfs/dbraw/zinc/44/24/65/335442465.db2.gz QATJVZSWJDKOQZ-KSSFIOAISA-N 2 1 315.486 4.117 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCCCS2)cc1 ZINC000346809551 335442630 /nfs/dbraw/zinc/44/26/30/335442630.db2.gz QATJVZSWJDKOQZ-KBXCAEBGSA-N 2 1 315.486 4.117 20 0 DIADMP C[C@H](CC[NH2+][C@H]1CCSc2ccccc21)[NH+]1CCCCC1 ZINC000346869184 335451484 /nfs/dbraw/zinc/45/14/84/335451484.db2.gz TXATZRSFSFQVSY-WBVHZDCISA-N 2 1 304.503 4.078 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000352090930 336194442 /nfs/dbraw/zinc/19/44/42/336194442.db2.gz FUPBYTXZASCGKJ-IUDNXUCKSA-N 2 1 317.864 4.017 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000532393496 336245234 /nfs/dbraw/zinc/24/52/34/336245234.db2.gz JXQDATFSTRFGSN-RDJZCZTQSA-N 2 1 321.534 4.011 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)o1 ZINC000532457515 336248327 /nfs/dbraw/zinc/24/83/27/336248327.db2.gz ZATHSUIQHVXPKH-KRWDZBQOSA-N 2 1 312.457 4.425 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1Cl ZINC000532462196 336248960 /nfs/dbraw/zinc/24/89/60/336248960.db2.gz FGAOILBWRCBWLS-CYBMUJFWSA-N 2 1 322.880 4.016 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000532494011 336250817 /nfs/dbraw/zinc/25/08/17/336250817.db2.gz BJPZZFYPQPGSEK-LZLYRXPVSA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000532494011 336250818 /nfs/dbraw/zinc/25/08/18/336250818.db2.gz BJPZZFYPQPGSEK-LZLYRXPVSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000532504733 336252475 /nfs/dbraw/zinc/25/24/75/336252475.db2.gz MDNBKLNZMVLKJL-FAEYYBQFSA-N 2 1 314.517 4.279 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cc1 ZINC000532505378 336252779 /nfs/dbraw/zinc/25/27/79/336252779.db2.gz IDQXNACWUYELNY-MSOLQXFVSA-N 2 1 324.468 4.471 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000532525380 336254272 /nfs/dbraw/zinc/25/42/72/336254272.db2.gz UWYIAOOHBSFJRQ-QIJUGHKUSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000532525380 336254273 /nfs/dbraw/zinc/25/42/73/336254273.db2.gz UWYIAOOHBSFJRQ-QIJUGHKUSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cscc1C(F)(F)F ZINC000352833200 336270546 /nfs/dbraw/zinc/27/05/46/336270546.db2.gz GZSWHXUOQSXCMA-GFCCVEGCSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1cscc1C(F)(F)F ZINC000352833200 336270547 /nfs/dbraw/zinc/27/05/47/336270547.db2.gz GZSWHXUOQSXCMA-GFCCVEGCSA-N 2 1 320.424 4.121 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526983745 336278069 /nfs/dbraw/zinc/27/80/69/336278069.db2.gz FKVSZTSWFJXQNE-INIZCTEOSA-N 2 1 310.432 4.082 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CCC(c4[nH]cc[nH+]4)CC3)o2)cc1 ZINC000352855024 336280761 /nfs/dbraw/zinc/28/07/61/336280761.db2.gz VPGLVNXQBXFKOU-UHFFFAOYSA-N 2 1 321.424 4.358 20 0 DIADMP Clc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000192917843 336284359 /nfs/dbraw/zinc/28/43/59/336284359.db2.gz PGRAGIKLYSKGTL-OAHLLOKOSA-N 2 1 320.889 4.013 20 0 DIADMP Clc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000192917843 336284360 /nfs/dbraw/zinc/28/43/60/336284360.db2.gz PGRAGIKLYSKGTL-OAHLLOKOSA-N 2 1 320.889 4.013 20 0 DIADMP Clc1csc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000192928137 336284487 /nfs/dbraw/zinc/28/44/87/336284487.db2.gz GLBLFODAOVQNJX-HNNXBMFYSA-N 2 1 320.889 4.013 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC(Nc2cc[nH+]cc2Cl)CC1 ZINC000301541068 336313434 /nfs/dbraw/zinc/31/34/34/336313434.db2.gz VKURWMAKKJXECO-CQSZACIVSA-N 2 1 315.848 4.373 20 0 DIADMP CCC[N@@H+]1CC[C@@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000302002192 336342465 /nfs/dbraw/zinc/34/24/65/336342465.db2.gz XBEXGOUWDNZZBT-ZDUSSCGKSA-N 2 1 303.837 4.032 20 0 DIADMP CCC[N@H+]1CC[C@@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000302002192 336342466 /nfs/dbraw/zinc/34/24/66/336342466.db2.gz XBEXGOUWDNZZBT-ZDUSSCGKSA-N 2 1 303.837 4.032 20 0 DIADMP CC(C)Cc1cccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC000514106298 336361003 /nfs/dbraw/zinc/36/10/03/336361003.db2.gz XJGACCFOJGZWCA-MRXNPFEDSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610542 336386210 /nfs/dbraw/zinc/38/62/10/336386210.db2.gz ZRXPORAFUSPHFY-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610542 336386211 /nfs/dbraw/zinc/38/62/11/336386211.db2.gz ZRXPORAFUSPHFY-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610542 336386212 /nfs/dbraw/zinc/38/62/12/336386212.db2.gz ZRXPORAFUSPHFY-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610542 336386213 /nfs/dbraw/zinc/38/62/13/336386213.db2.gz ZRXPORAFUSPHFY-XJKSGUPXSA-N 2 1 318.848 4.002 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000152470419 336388923 /nfs/dbraw/zinc/38/89/23/336388923.db2.gz DXKRVUNSZGRYCG-NWDGAFQWSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)c1cccc(Cl)c1Cl ZINC000565159214 336400737 /nfs/dbraw/zinc/40/07/37/336400737.db2.gz WNAYGJSWALCAII-NSHDSACASA-N 2 1 312.244 4.010 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cnccc2C)cc1 ZINC000356700875 336558605 /nfs/dbraw/zinc/55/86/05/336558605.db2.gz ROCPMVWOBKGOSH-HZPDHXFCSA-N 2 1 320.440 4.296 20 0 DIADMP c1sc2ccccc2c1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000376020571 337025483 /nfs/dbraw/zinc/02/54/83/337025483.db2.gz GRSWDLFDFOYRJT-UHFFFAOYSA-N 2 1 300.471 4.008 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035886 337084113 /nfs/dbraw/zinc/08/41/13/337084113.db2.gz LIYWXSSPEPKRPN-RYQLBKOJSA-N 2 1 310.441 4.224 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035886 337084114 /nfs/dbraw/zinc/08/41/14/337084114.db2.gz LIYWXSSPEPKRPN-RYQLBKOJSA-N 2 1 310.441 4.224 20 0 DIADMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1 ZINC000173386272 337134948 /nfs/dbraw/zinc/13/49/48/337134948.db2.gz AGIDINBZUUYJHU-GUYCJALGSA-N 2 1 305.853 4.222 20 0 DIADMP Cc1nc(C)c([C@@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000183190894 337190271 /nfs/dbraw/zinc/19/02/71/337190271.db2.gz LIQDORYVKOIOSF-XJKCOSOUSA-N 2 1 321.534 4.064 20 0 DIADMP CC1(C)CC([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000395176860 337209104 /nfs/dbraw/zinc/20/91/04/337209104.db2.gz KLFZDWHHHLEMFS-GOSISDBHSA-N 2 1 300.490 4.067 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCC2(C)CC2)CC1 ZINC000583135415 337243227 /nfs/dbraw/zinc/24/32/27/337243227.db2.gz UHIVHNWTNWXXRQ-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1cccc(Cl)c1F ZINC000187309706 337264087 /nfs/dbraw/zinc/26/40/87/337264087.db2.gz ZKMSIYYLAPXWQM-GFCCVEGCSA-N 2 1 309.816 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1cccc(Cl)c1F ZINC000187309706 337264088 /nfs/dbraw/zinc/26/40/88/337264088.db2.gz ZKMSIYYLAPXWQM-GFCCVEGCSA-N 2 1 309.816 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1cccc(Cl)c1F ZINC000187309683 337264094 /nfs/dbraw/zinc/26/40/94/337264094.db2.gz ZKMSIYYLAPXWQM-LBPRGKRZSA-N 2 1 309.816 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1cccc(Cl)c1F ZINC000187309683 337264095 /nfs/dbraw/zinc/26/40/95/337264095.db2.gz ZKMSIYYLAPXWQM-LBPRGKRZSA-N 2 1 309.816 4.067 20 0 DIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398020092 337304575 /nfs/dbraw/zinc/30/45/75/337304575.db2.gz JPKFGJFMNGBCPS-HNAYVOBHSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCC1CCCC1 ZINC000398181623 337309231 /nfs/dbraw/zinc/30/92/31/337309231.db2.gz XDCNRFRWVDBHIW-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCC1CCCC1 ZINC000398181623 337309232 /nfs/dbraw/zinc/30/92/32/337309232.db2.gz XDCNRFRWVDBHIW-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2cccc(F)c2)CC1 ZINC000520791673 337390939 /nfs/dbraw/zinc/39/09/39/337390939.db2.gz WEYQMEARWYEWKJ-INIZCTEOSA-N 2 1 306.469 4.331 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)[C@@H]1CCC[NH2+]C1 ZINC000422770343 337685812 /nfs/dbraw/zinc/68/58/12/337685812.db2.gz WFASQVIHRIAXGV-GRYCIOLGSA-N 2 1 301.261 4.032 20 0 DIADMP CCCCOc1cccc(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000422886980 337689995 /nfs/dbraw/zinc/68/99/95/337689995.db2.gz AHFIUFRDJVJOBG-VQTJNVASSA-N 2 1 310.441 4.100 20 0 DIADMP C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc2ccccc21)C1C[NH2+]C1 ZINC000422911268 337690897 /nfs/dbraw/zinc/69/08/97/337690897.db2.gz SNJRWPIAHINXOS-ZHRRBRCNSA-N 2 1 316.448 4.127 20 0 DIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](c1cc2ccccc2o1)c1ccccc1 ZINC000422930437 337692047 /nfs/dbraw/zinc/69/20/47/337692047.db2.gz UKFUPWPZQPZJDH-AVYPCKFXSA-N 2 1 308.425 4.238 20 0 DIADMP C[C@H](C[C@H](C)[NH3+])[NH2+]C1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423082201 337698643 /nfs/dbraw/zinc/69/86/43/337698643.db2.gz WMHDAJYYIVUASK-VHSXEESVSA-N 2 1 320.786 4.063 20 0 DIADMP CC(F)(F)c1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000423134489 337701050 /nfs/dbraw/zinc/70/10/50/337701050.db2.gz MEKGEGFDTYJKHD-SJORKVTESA-N 2 1 302.368 4.033 20 0 DIADMP CC(C)C[C@H](C[NH3+])[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423260186 337707841 /nfs/dbraw/zinc/70/78/41/337707841.db2.gz GUOIXPVQIILCCF-JKSUJKDBSA-N 2 1 315.505 4.187 20 0 DIADMP CC(C)C[C@H](C[NH3+])[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423260185 337707911 /nfs/dbraw/zinc/70/79/11/337707911.db2.gz GUOIXPVQIILCCF-HZPDHXFCSA-N 2 1 315.505 4.187 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423336358 337712658 /nfs/dbraw/zinc/71/26/58/337712658.db2.gz SKDBTOVMKQJAAA-ABAIWWIYSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000423395368 337718782 /nfs/dbraw/zinc/71/87/82/337718782.db2.gz SPPHMRSWYSXWJH-ZIFCJYIRSA-N 2 1 324.468 4.057 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000315505928 337988303 /nfs/dbraw/zinc/98/83/03/337988303.db2.gz HKUYJFKVLMWYSZ-HOCLYGCPSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+][C@@H]3CCC[C@H]([NH+](C)C)C3)oc2c1 ZINC000426032181 338019776 /nfs/dbraw/zinc/01/97/76/338019776.db2.gz XDKOEZBLHHYGLP-UAGQMJEPSA-N 2 1 300.446 4.265 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc2ccc(C)cc2o1 ZINC000426032364 338019856 /nfs/dbraw/zinc/01/98/56/338019856.db2.gz XXGXPXGSSOZEHG-LSDHHAIUSA-N 2 1 311.429 4.233 20 0 DIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CCCc2sc(Cl)cc21 ZINC000426303126 338025822 /nfs/dbraw/zinc/02/58/22/338025822.db2.gz LJIGHHPMFOCYHJ-OXHZDVMGSA-N 2 1 312.910 4.097 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CCCc2sc(Cl)cc21 ZINC000426303126 338025823 /nfs/dbraw/zinc/02/58/23/338025823.db2.gz LJIGHHPMFOCYHJ-OXHZDVMGSA-N 2 1 312.910 4.097 20 0 DIADMP Cc1nc(C(C)C)oc1CN[C@H](C)c1cccc(-n2ccnc2)c1 ZINC000428366596 338049035 /nfs/dbraw/zinc/04/90/35/338049035.db2.gz XPUMBXQWJJCYIH-CQSZACIVSA-N 2 1 324.428 4.143 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000428856737 338062705 /nfs/dbraw/zinc/06/27/05/338062705.db2.gz NPWTWXHYPWVACM-LBPRGKRZSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000428856737 338062706 /nfs/dbraw/zinc/06/27/06/338062706.db2.gz NPWTWXHYPWVACM-LBPRGKRZSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000428994322 338068254 /nfs/dbraw/zinc/06/82/54/338068254.db2.gz BJQXRVDHKWXREZ-UZLBHIALSA-N 2 1 300.490 4.073 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)Cc1ccccc1SC ZINC000429246390 338074542 /nfs/dbraw/zinc/07/45/42/338074542.db2.gz OFSRGUQCPYVNNP-UHFFFAOYSA-N 2 1 317.502 4.080 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccccc1SC ZINC000429246390 338074544 /nfs/dbraw/zinc/07/45/44/338074544.db2.gz OFSRGUQCPYVNNP-UHFFFAOYSA-N 2 1 317.502 4.080 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@H](C)CCSc2ccccc2)C1 ZINC000431606569 338134571 /nfs/dbraw/zinc/13/45/71/338134571.db2.gz FNMNEBOERJVBRP-QZTJIDSGSA-N 2 1 320.546 4.221 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@H](C)CCSc2ccccc2)C1 ZINC000431606568 338134630 /nfs/dbraw/zinc/13/46/30/338134630.db2.gz FNMNEBOERJVBRP-MSOLQXFVSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431609978 338134677 /nfs/dbraw/zinc/13/46/77/338134677.db2.gz PGJUNPAIDJMSQL-ROUUACIJSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431609978 338134678 /nfs/dbraw/zinc/13/46/78/338134678.db2.gz PGJUNPAIDJMSQL-ROUUACIJSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431609978 338134679 /nfs/dbraw/zinc/13/46/79/338134679.db2.gz PGJUNPAIDJMSQL-ROUUACIJSA-N 2 1 320.546 4.221 20 0 DIADMP CCc1ccc([C@H]2CC[N@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000433069819 338180173 /nfs/dbraw/zinc/18/01/73/338180173.db2.gz WELRVGDZPBOYGI-FQEVSTJZSA-N 2 1 311.473 4.024 20 0 DIADMP CCc1ccc([C@H]2CC[N@@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000433069819 338180174 /nfs/dbraw/zinc/18/01/74/338180174.db2.gz WELRVGDZPBOYGI-FQEVSTJZSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)CCC2)cc1C ZINC000433084995 338180879 /nfs/dbraw/zinc/18/08/79/338180879.db2.gz UXYJDIDONAHFAN-QWFCFKBJSA-N 2 1 314.517 4.043 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]C2CC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000433300951 338190381 /nfs/dbraw/zinc/19/03/81/338190381.db2.gz UPEYWXXCCYHGAI-AEFFLSMTSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434611998 338220969 /nfs/dbraw/zinc/22/09/69/338220969.db2.gz MYTFZCIFAQBMAX-LJQANCHMSA-N 2 1 317.452 4.440 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434611998 338220970 /nfs/dbraw/zinc/22/09/70/338220970.db2.gz MYTFZCIFAQBMAX-LJQANCHMSA-N 2 1 317.452 4.440 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)C1 ZINC000434672139 338223034 /nfs/dbraw/zinc/22/30/34/338223034.db2.gz XUMZAEHVHSZTGR-SJORKVTESA-N 2 1 315.505 4.225 20 0 DIADMP c1[nH+]c(C2CC[NH+](CCCc3ccccc3)CC2)n2c1CCCC2 ZINC000434682535 338223318 /nfs/dbraw/zinc/22/33/18/338223318.db2.gz APRGXGFSOUNNHX-UHFFFAOYSA-N 2 1 323.484 4.032 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434691978 338223603 /nfs/dbraw/zinc/22/36/03/338223603.db2.gz VDWHFSBKRDTTPD-UHFFFAOYSA-N 2 1 323.484 4.216 20 0 DIADMP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000434752290 338224813 /nfs/dbraw/zinc/22/48/13/338224813.db2.gz AUEPRKMYTAFBCA-PXNSSMCTSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435056230 338231331 /nfs/dbraw/zinc/23/13/31/338231331.db2.gz FMUNKCKVPNMCIE-SJLPKXTDSA-N 2 1 315.505 4.225 20 0 DIADMP COCCC1(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)CCCCC1 ZINC000436267103 338264489 /nfs/dbraw/zinc/26/44/89/338264489.db2.gz BUQPBWYADMHNPE-IBGZPJMESA-N 2 1 324.553 4.075 20 0 DIADMP CC1(C)CCc2ccccc2[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C1 ZINC000436307935 338268236 /nfs/dbraw/zinc/26/82/36/338268236.db2.gz OTVQBBKUBNIBOY-NLWGTHIKSA-N 2 1 312.501 4.307 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437593462 338315529 /nfs/dbraw/zinc/31/55/29/338315529.db2.gz NXHBUJXHKVDYHX-NHCUHLMSSA-N 2 1 314.517 4.301 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000437593462 338315530 /nfs/dbraw/zinc/31/55/30/338315530.db2.gz NXHBUJXHKVDYHX-NHCUHLMSSA-N 2 1 314.517 4.301 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCCCOc2ccccc2)C[C@@H]1C ZINC000438092859 338330944 /nfs/dbraw/zinc/33/09/44/338330944.db2.gz BIFQPSVXJWYLDY-RBUKOAKNSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCCCOc2ccccc2)C[C@@H]1C ZINC000438092859 338330945 /nfs/dbraw/zinc/33/09/45/338330945.db2.gz BIFQPSVXJWYLDY-RBUKOAKNSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCCCOc2ccccc2)C[C@@H]1C ZINC000438092859 338330946 /nfs/dbraw/zinc/33/09/46/338330946.db2.gz BIFQPSVXJWYLDY-RBUKOAKNSA-N 2 1 318.505 4.040 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCCCOc2ccccc2)C[C@H]1C ZINC000438092860 338331006 /nfs/dbraw/zinc/33/10/06/338331006.db2.gz BIFQPSVXJWYLDY-RTBURBONSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCCCOc2ccccc2)C[C@H]1C ZINC000438092860 338331007 /nfs/dbraw/zinc/33/10/07/338331007.db2.gz BIFQPSVXJWYLDY-RTBURBONSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCCCOc2ccccc2)C[C@H]1C ZINC000438092860 338331008 /nfs/dbraw/zinc/33/10/08/338331008.db2.gz BIFQPSVXJWYLDY-RTBURBONSA-N 2 1 318.505 4.040 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438109472 338332179 /nfs/dbraw/zinc/33/21/79/338332179.db2.gz OILQFDJLBUDPRC-CEWLAPEOSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438109472 338332180 /nfs/dbraw/zinc/33/21/80/338332180.db2.gz OILQFDJLBUDPRC-CEWLAPEOSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438109472 338332181 /nfs/dbraw/zinc/33/21/81/338332181.db2.gz OILQFDJLBUDPRC-CEWLAPEOSA-N 2 1 314.517 4.161 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CCN1C ZINC000438847058 338353707 /nfs/dbraw/zinc/35/37/07/338353707.db2.gz CZMRMZQWNWYFQL-NQIIRXRSSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000438847058 338353708 /nfs/dbraw/zinc/35/37/08/338353708.db2.gz CZMRMZQWNWYFQL-NQIIRXRSSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000438847058 338353709 /nfs/dbraw/zinc/35/37/09/338353709.db2.gz CZMRMZQWNWYFQL-NQIIRXRSSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847058 338353710 /nfs/dbraw/zinc/35/37/10/338353710.db2.gz CZMRMZQWNWYFQL-NQIIRXRSSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847058 338353711 /nfs/dbraw/zinc/35/37/11/338353711.db2.gz CZMRMZQWNWYFQL-NQIIRXRSSA-N 2 1 322.496 4.233 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449060700 338589319 /nfs/dbraw/zinc/58/93/19/338589319.db2.gz DTEBLTGZGCEIPC-GOSISDBHSA-N 2 1 318.892 4.350 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H]3CCCC34CCC4)CC2)cc1 ZINC000449072840 338590860 /nfs/dbraw/zinc/59/08/60/338590860.db2.gz LSOOLRFXENGXEF-FQEVSTJZSA-N 2 1 312.501 4.006 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)ccn1 ZINC000449405666 338621581 /nfs/dbraw/zinc/62/15/81/338621581.db2.gz ZNQFLVXFXXZDAH-UHFFFAOYSA-N 2 1 317.521 4.159 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CC[C@@H](C)c2ccsc21 ZINC000453106338 338794469 /nfs/dbraw/zinc/79/44/69/338794469.db2.gz ISQFXMGQVAELPH-IOASZLSFSA-N 2 1 303.475 4.117 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cs1 ZINC000453130789 338797556 /nfs/dbraw/zinc/79/75/56/338797556.db2.gz SVEKZRXPFSDGDM-HNNXBMFYSA-N 2 1 315.486 4.080 20 0 DIADMP CCCC[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(OC)cc1 ZINC000459397364 339026807 /nfs/dbraw/zinc/02/68/07/339026807.db2.gz DFIIMKPMFXECRJ-FQEVSTJZSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@H]([NH2+]CCc1cccc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000459454134 339030209 /nfs/dbraw/zinc/03/02/09/339030209.db2.gz BOPMMIMBTHGXDA-RDJZCZTQSA-N 2 1 320.908 4.125 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C2CC(OC(C)C)C2)CC1)CC(C)C ZINC000459478564 339031766 /nfs/dbraw/zinc/03/17/66/339031766.db2.gz TVUOTUREQVONRS-UHFFFAOYSA-N 2 1 324.553 4.022 20 0 DIADMP Clc1cccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)c1 ZINC000459563489 339035993 /nfs/dbraw/zinc/03/59/93/339035993.db2.gz QOOSEDLORGQCBZ-CRAIPNDOSA-N 2 1 318.892 4.193 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000459721006 339044231 /nfs/dbraw/zinc/04/42/31/339044231.db2.gz ABYPUDLZTHIBJX-OXJNMPFZSA-N 2 1 316.464 4.083 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1C(F)(F)F ZINC000459736630 339045240 /nfs/dbraw/zinc/04/52/40/339045240.db2.gz QCDWSLJCGQSORF-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(Cl)c2ccccc21 ZINC000462449246 339079168 /nfs/dbraw/zinc/07/91/68/339079168.db2.gz UUZHMSDJJXCHEC-ZDUSSCGKSA-N 2 1 313.832 4.349 20 0 DIADMP CC(C)(C)CCCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000462772509 339087864 /nfs/dbraw/zinc/08/78/64/339087864.db2.gz IKONJHMLBRLSED-UHFFFAOYSA-N 2 1 302.506 4.457 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801019 339089713 /nfs/dbraw/zinc/08/97/13/339089713.db2.gz BAXYSZQEZUGDFL-IPELMVKDSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801019 339089714 /nfs/dbraw/zinc/08/97/14/339089714.db2.gz BAXYSZQEZUGDFL-IPELMVKDSA-N 2 1 316.489 4.141 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000462842929 339093921 /nfs/dbraw/zinc/09/39/21/339093921.db2.gz SXNITHCLPISKIW-VNYTWHDVSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000463075785 339104497 /nfs/dbraw/zinc/10/44/97/339104497.db2.gz RFUGNUBPBBIAQR-JXFKEZNVSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C1CCCC1 ZINC000463129168 339106620 /nfs/dbraw/zinc/10/66/20/339106620.db2.gz HLXMACWTTXJCSM-MRXNPFEDSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463138266 339106871 /nfs/dbraw/zinc/10/68/71/339106871.db2.gz CJULGSASRRCINL-UZLBHIALSA-N 2 1 318.480 4.001 20 0 DIADMP CC(C)CC[C@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463140008 339107000 /nfs/dbraw/zinc/10/70/00/339107000.db2.gz FSXWQLKYQOMPJL-KRWDZBQOSA-N 2 1 320.496 4.247 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463146133 339107129 /nfs/dbraw/zinc/10/71/29/339107129.db2.gz FBDVJWMAZBOWSF-HNBVOPMISA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463146133 339107130 /nfs/dbraw/zinc/10/71/30/339107130.db2.gz FBDVJWMAZBOWSF-HNBVOPMISA-N 2 1 300.490 4.208 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207752 339109530 /nfs/dbraw/zinc/10/95/30/339109530.db2.gz UHDJJAQYKFYJSQ-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207752 339109531 /nfs/dbraw/zinc/10/95/31/339109531.db2.gz UHDJJAQYKFYJSQ-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463249086 339112081 /nfs/dbraw/zinc/11/20/81/339112081.db2.gz YDURHIZOBWIRLA-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463249086 339112082 /nfs/dbraw/zinc/11/20/82/339112082.db2.gz YDURHIZOBWIRLA-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[NH+]1CCCC1 ZINC000466353127 339200380 /nfs/dbraw/zinc/20/03/80/339200380.db2.gz QHHOZDXTGLOWMB-UYSNPLJNSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCCC[C@@H]1C ZINC000466357955 339200493 /nfs/dbraw/zinc/20/04/93/339200493.db2.gz ZYZWYJVONFGCRQ-QRNKSROTSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCCC[C@@H]1C ZINC000466357955 339200494 /nfs/dbraw/zinc/20/04/94/339200494.db2.gz ZYZWYJVONFGCRQ-QRNKSROTSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000466459482 339205916 /nfs/dbraw/zinc/20/59/16/339205916.db2.gz YRFUQDIWOFTXNY-QVOMUQBLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000466459482 339205917 /nfs/dbraw/zinc/20/59/17/339205917.db2.gz YRFUQDIWOFTXNY-QVOMUQBLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000467454660 339239756 /nfs/dbraw/zinc/23/97/56/339239756.db2.gz QAOJUVGHLWLXHC-PPQDBTBKSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1csc(Cl)c1 ZINC000468848017 339272638 /nfs/dbraw/zinc/27/26/38/339272638.db2.gz GJLQRLMFVQSEGS-LBPRGKRZSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000469867349 339303240 /nfs/dbraw/zinc/30/32/40/339303240.db2.gz VIYFXMVVXFPBES-QWHCGFSZSA-N 2 1 320.889 4.238 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccccc2)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000469995342 339307533 /nfs/dbraw/zinc/30/75/33/339307533.db2.gz ZDDLDXSCUYHLHY-WCRBZPEASA-N 2 1 306.453 4.068 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000470014546 339308615 /nfs/dbraw/zinc/30/86/15/339308615.db2.gz BPRKBCFPNQUROJ-UHFFFAOYSA-N 2 1 320.889 4.252 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C[C@H](C)c2cccc(Cl)c2)C1 ZINC000470354695 339317988 /nfs/dbraw/zinc/31/79/88/339317988.db2.gz RPJQRCXVTQGIHS-JKSUJKDBSA-N 2 1 308.897 4.154 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C2c3ccccc3-c3ccccc32)C1 ZINC000471024745 339334786 /nfs/dbraw/zinc/33/47/86/339334786.db2.gz DBROTVVJUVITHF-KRWDZBQOSA-N 2 1 320.480 4.420 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000471024745 339334787 /nfs/dbraw/zinc/33/47/87/339334787.db2.gz DBROTVVJUVITHF-KRWDZBQOSA-N 2 1 320.480 4.420 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000471024745 339334788 /nfs/dbraw/zinc/33/47/88/339334788.db2.gz DBROTVVJUVITHF-KRWDZBQOSA-N 2 1 320.480 4.420 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000471245662 339341043 /nfs/dbraw/zinc/34/10/43/339341043.db2.gz VVKSNQGXFIRFGF-LAUBAEHRSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000471245662 339341044 /nfs/dbraw/zinc/34/10/44/339341044.db2.gz VVKSNQGXFIRFGF-LAUBAEHRSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCc2ccc3ccccc3c2)[C@@H](C)C1 ZINC000471245662 339341045 /nfs/dbraw/zinc/34/10/45/339341045.db2.gz VVKSNQGXFIRFGF-LAUBAEHRSA-N 2 1 310.485 4.044 20 0 DIADMP CCSc1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000473133561 339381856 /nfs/dbraw/zinc/38/18/56/339381856.db2.gz SCPFDAWRABZQBH-SFHVURJKSA-N 2 1 318.530 4.249 20 0 DIADMP CCSc1cccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000473133561 339381857 /nfs/dbraw/zinc/38/18/57/339381857.db2.gz SCPFDAWRABZQBH-SFHVURJKSA-N 2 1 318.530 4.249 20 0 DIADMP Cc1ccc2[nH]c(C[N@@H+](C)C3CC[NH+](C(C)C)CC3)cc2c1C ZINC000473143391 339382574 /nfs/dbraw/zinc/38/25/74/339382574.db2.gz XNQRYHRPFQOXSZ-UHFFFAOYSA-N 2 1 313.489 4.089 20 0 DIADMP Cc1ccc2[nH]c(C[N@H+](C)C3CC[NH+](C(C)C)CC3)cc2c1C ZINC000473143391 339382575 /nfs/dbraw/zinc/38/25/75/339382575.db2.gz XNQRYHRPFQOXSZ-UHFFFAOYSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149863 339383122 /nfs/dbraw/zinc/38/31/22/339383122.db2.gz YJWOYDZULYEXMK-QAPCUYQASA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149863 339383123 /nfs/dbraw/zinc/38/31/23/339383123.db2.gz YJWOYDZULYEXMK-QAPCUYQASA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149863 339383124 /nfs/dbraw/zinc/38/31/24/339383124.db2.gz YJWOYDZULYEXMK-QAPCUYQASA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149863 339383125 /nfs/dbraw/zinc/38/31/25/339383125.db2.gz YJWOYDZULYEXMK-QAPCUYQASA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474462508 339415546 /nfs/dbraw/zinc/41/55/46/339415546.db2.gz SPGQQWLAVLUERT-YIYPIFLZSA-N 2 1 314.926 4.213 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cnc2ccsc2c1 ZINC000477920179 339504573 /nfs/dbraw/zinc/50/45/73/339504573.db2.gz FJJSJDUFORDUFO-AWEZNQCLSA-N 2 1 317.502 4.069 20 0 DIADMP C[C@@H](c1cccc(Cl)c1F)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000480497371 339574953 /nfs/dbraw/zinc/57/49/53/339574953.db2.gz FXMJJBNPVBDTIW-AWEZNQCLSA-N 2 1 324.871 4.348 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1ccc2ccccc2n1)C(C)C ZINC000483690601 339671762 /nfs/dbraw/zinc/67/17/62/339671762.db2.gz XFEDLFGEHKQKKT-QGZVFWFLSA-N 2 1 313.489 4.394 20 0 DIADMP CC(C)C1CC([NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)C1 ZINC000488432130 339781900 /nfs/dbraw/zinc/78/19/00/339781900.db2.gz LOWFNWWIXUCPBI-PPDQVPDSSA-N 2 1 300.490 4.236 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCc3ccccc3)C2)CC1 ZINC000498818369 340023933 /nfs/dbraw/zinc/02/39/33/340023933.db2.gz PEPNQRJRNRQEDV-NRFANRHFSA-N 2 1 314.517 4.063 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c(C)s1 ZINC000498909342 340025428 /nfs/dbraw/zinc/02/54/28/340025428.db2.gz HRLRUDFETYYNMX-SFHVURJKSA-N 2 1 320.546 4.309 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c(C)s1 ZINC000498909342 340025429 /nfs/dbraw/zinc/02/54/29/340025429.db2.gz HRLRUDFETYYNMX-SFHVURJKSA-N 2 1 320.546 4.309 20 0 DIADMP Cc1cccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000499151293 340031211 /nfs/dbraw/zinc/03/12/11/340031211.db2.gz XXFSRJFCWIDSEQ-DKUWSORSSA-N 2 1 320.480 4.280 20 0 DIADMP C[N@@H+](CCCC(C)(C)C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000499597602 340040322 /nfs/dbraw/zinc/04/03/22/340040322.db2.gz CLEIESJDBCDUKT-UHFFFAOYSA-N 2 1 303.494 4.056 20 0 DIADMP CC(C)C[C@@H](C)C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000499757124 340044105 /nfs/dbraw/zinc/04/41/05/340044105.db2.gz NJJHIKPSKLZJOY-MRXNPFEDSA-N 2 1 303.494 4.081 20 0 DIADMP C(C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)SC1CCCCC1 ZINC000500130234 340050963 /nfs/dbraw/zinc/05/09/63/340050963.db2.gz RHHDWOXTJWEIFF-QGZVFWFLSA-N 2 1 310.551 4.003 20 0 DIADMP CCC[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccccn1 ZINC000500615469 340063710 /nfs/dbraw/zinc/06/37/10/340063710.db2.gz BTLIMWQZGFAFOW-GOSISDBHSA-N 2 1 303.494 4.167 20 0 DIADMP CCC[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccccn1 ZINC000500615469 340063711 /nfs/dbraw/zinc/06/37/11/340063711.db2.gz BTLIMWQZGFAFOW-GOSISDBHSA-N 2 1 303.494 4.167 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1)[NH+](C)C ZINC000501470769 340081820 /nfs/dbraw/zinc/08/18/20/340081820.db2.gz YZTHASIQVYYYMG-RLLQIKCJSA-N 2 1 317.521 4.064 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502458313 340104521 /nfs/dbraw/zinc/10/45/21/340104521.db2.gz CLXYJJRXZCEOBP-VQIMIIECSA-N 2 1 312.457 4.069 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502458313 340104522 /nfs/dbraw/zinc/10/45/22/340104522.db2.gz CLXYJJRXZCEOBP-VQIMIIECSA-N 2 1 312.457 4.069 20 0 DIADMP CCc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C(C)C)cc1 ZINC000506127769 340186479 /nfs/dbraw/zinc/18/64/79/340186479.db2.gz TYVNRGSLTHIOIL-SLFFLAALSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)C/C=C\c2ccc(Cl)cc2)CC1 ZINC000506327847 340192469 /nfs/dbraw/zinc/19/24/69/340192469.db2.gz VBBSDHXAPKAICR-PLNGDYQASA-N 2 1 306.881 4.158 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)C/C=C\c2ccc(Cl)cc2)CC1 ZINC000506327847 340192470 /nfs/dbraw/zinc/19/24/70/340192470.db2.gz VBBSDHXAPKAICR-PLNGDYQASA-N 2 1 306.881 4.158 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473440 340195141 /nfs/dbraw/zinc/19/51/41/340195141.db2.gz IXSADCWJCYKNJW-QAPCUYQASA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473440 340195142 /nfs/dbraw/zinc/19/51/42/340195142.db2.gz IXSADCWJCYKNJW-QAPCUYQASA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473440 340195143 /nfs/dbraw/zinc/19/51/43/340195143.db2.gz IXSADCWJCYKNJW-QAPCUYQASA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473440 340195144 /nfs/dbraw/zinc/19/51/44/340195144.db2.gz IXSADCWJCYKNJW-QAPCUYQASA-N 2 1 320.546 4.451 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000507834632 340233654 /nfs/dbraw/zinc/23/36/54/340233654.db2.gz VBUGLMGXTGMPLV-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000507834632 340233655 /nfs/dbraw/zinc/23/36/55/340233655.db2.gz VBUGLMGXTGMPLV-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000507834632 340233656 /nfs/dbraw/zinc/23/36/56/340233656.db2.gz VBUGLMGXTGMPLV-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000507834632 340233657 /nfs/dbraw/zinc/23/36/57/340233657.db2.gz VBUGLMGXTGMPLV-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP C[N@@H+](CC(c1ccccc1)c1ccccc1)CC1CC[NH+](C)CC1 ZINC000508217028 340240909 /nfs/dbraw/zinc/24/09/09/340240909.db2.gz UNRKWVFQPOAGGH-UHFFFAOYSA-N 2 1 322.496 4.092 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[N@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000508543800 340246249 /nfs/dbraw/zinc/24/62/49/340246249.db2.gz JTWMGMAGMHGQPA-CYBMUJFWSA-N 2 1 322.905 4.247 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000508543800 340246250 /nfs/dbraw/zinc/24/62/50/340246250.db2.gz JTWMGMAGMHGQPA-CYBMUJFWSA-N 2 1 322.905 4.247 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(F)c(F)c1 ZINC000508666475 340250163 /nfs/dbraw/zinc/25/01/63/340250163.db2.gz ZJUXGUFVNDHRKC-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508830656 340253897 /nfs/dbraw/zinc/25/38/97/340253897.db2.gz XOJSACJBSMHAKC-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508830656 340253898 /nfs/dbraw/zinc/25/38/98/340253898.db2.gz XOJSACJBSMHAKC-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508830656 340253899 /nfs/dbraw/zinc/25/38/99/340253899.db2.gz XOJSACJBSMHAKC-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665833 340276239 /nfs/dbraw/zinc/27/62/39/340276239.db2.gz LXVANEPNBMVMMU-DZGCQCFKSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665833 340276240 /nfs/dbraw/zinc/27/62/40/340276240.db2.gz LXVANEPNBMVMMU-DZGCQCFKSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665833 340276241 /nfs/dbraw/zinc/27/62/41/340276241.db2.gz LXVANEPNBMVMMU-DZGCQCFKSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2C(F)(F)F)C[C@@H]1C ZINC000509665833 340276242 /nfs/dbraw/zinc/27/62/42/340276242.db2.gz LXVANEPNBMVMMU-DZGCQCFKSA-N 2 1 314.395 4.010 20 0 DIADMP CC[C@@H](C[NH2+]C1CC(c2ccccc2Cl)C1)[NH+]1CCCC1 ZINC000509845967 340281511 /nfs/dbraw/zinc/28/15/11/340281511.db2.gz JIFQSTWGMPHQHG-GPANFISMSA-N 2 1 306.881 4.050 20 0 DIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@H](C[NH+]3CCCCC3)C1)CCC2 ZINC000510359440 340296847 /nfs/dbraw/zinc/29/68/47/340296847.db2.gz SUMPBCONNFGMNI-OXQOHEQNSA-N 2 1 316.464 4.011 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H]2C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000510680280 340306323 /nfs/dbraw/zinc/30/63/23/340306323.db2.gz HVGJNZYZEAPEIA-DBOLQNLKSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H]2C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000510680280 340306324 /nfs/dbraw/zinc/30/63/24/340306324.db2.gz HVGJNZYZEAPEIA-DBOLQNLKSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000510755198 340309817 /nfs/dbraw/zinc/30/98/17/340309817.db2.gz VTXZYSJXQHMRMM-SEVLPDGMSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000510755198 340309818 /nfs/dbraw/zinc/30/98/18/340309818.db2.gz VTXZYSJXQHMRMM-SEVLPDGMSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000510755196 340309890 /nfs/dbraw/zinc/30/98/90/340309890.db2.gz VTXZYSJXQHMRMM-MBPVOVBZSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000510755196 340309891 /nfs/dbraw/zinc/30/98/91/340309891.db2.gz VTXZYSJXQHMRMM-MBPVOVBZSA-N 2 1 312.501 4.065 20 0 DIADMP Cc1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303224777 340313984 /nfs/dbraw/zinc/31/39/84/340313984.db2.gz WKYGDQCGEFVUIM-IBGZPJMESA-N 2 1 300.490 4.083 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000510931768 340315367 /nfs/dbraw/zinc/31/53/67/340315367.db2.gz JXVMRYMEXQGBGX-ROUUACIJSA-N 2 1 317.864 4.161 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]CCCn1cc[nH+]c1C ZINC000511021015 340318613 /nfs/dbraw/zinc/31/86/13/340318613.db2.gz ZQQPGSCEFYBHEG-CQSZACIVSA-N 2 1 311.429 4.241 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000511132131 340321817 /nfs/dbraw/zinc/32/18/17/340321817.db2.gz RNGJWGYWNQLQEX-VQIMIIECSA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000511132131 340321818 /nfs/dbraw/zinc/32/18/18/340321818.db2.gz RNGJWGYWNQLQEX-VQIMIIECSA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000511132131 340321819 /nfs/dbraw/zinc/32/18/19/340321819.db2.gz RNGJWGYWNQLQEX-VQIMIIECSA-N 2 1 320.546 4.349 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303557425 340333402 /nfs/dbraw/zinc/33/34/02/340333402.db2.gz HTLDVTCKISGURE-GUDVDZBRSA-N 2 1 300.490 4.334 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303557425 340333403 /nfs/dbraw/zinc/33/34/03/340333403.db2.gz HTLDVTCKISGURE-GUDVDZBRSA-N 2 1 300.490 4.334 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000303557425 340333404 /nfs/dbraw/zinc/33/34/04/340333404.db2.gz HTLDVTCKISGURE-GUDVDZBRSA-N 2 1 300.490 4.334 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+]C(C)(C)CC2CCCCCC2)s1 ZINC000511903970 340342504 /nfs/dbraw/zinc/34/25/04/340342504.db2.gz BCTGDSHZAMIMKU-UHFFFAOYSA-N 2 1 323.550 4.433 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+][C@H]2CCC[C@@H](C(C)(C)C)CC2)s1 ZINC000511907954 340342669 /nfs/dbraw/zinc/34/26/69/340342669.db2.gz MSMJGTDSIVEVBP-CABCVRRESA-N 2 1 323.550 4.289 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512313503 340356629 /nfs/dbraw/zinc/35/66/29/340356629.db2.gz JSLBNMJFEKYFDP-JYJNAYRXSA-N 2 1 306.519 4.360 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512334076 340357548 /nfs/dbraw/zinc/35/75/48/340357548.db2.gz ZIGZWMDTWRRKES-MDOVXXIYSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2)o1)C[NH+]1CCCCC1 ZINC000513642591 340416749 /nfs/dbraw/zinc/41/67/49/340416749.db2.gz IZGVRTOUJHXALG-KRWDZBQOSA-N 2 1 312.457 4.158 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000236967416 340666865 /nfs/dbraw/zinc/66/68/65/340666865.db2.gz PBXCWLLQMDHFLY-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000236963063 340666905 /nfs/dbraw/zinc/66/69/05/340666905.db2.gz PBXCWLLQMDHFLY-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCCCC1 ZINC000237410110 340670749 /nfs/dbraw/zinc/67/07/49/340670749.db2.gz OYASPRIKAHLSOJ-QGZVFWFLSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000237696188 340673218 /nfs/dbraw/zinc/67/32/18/340673218.db2.gz LZAPXWNFDABRAV-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(F)cc1)C1CCC1 ZINC000128291559 340865701 /nfs/dbraw/zinc/86/57/01/340865701.db2.gz AKDJNNPHEOJUKB-IBGZPJMESA-N 2 1 315.436 4.242 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000539079079 340871145 /nfs/dbraw/zinc/87/11/45/340871145.db2.gz RQIUYQGLWZUYCW-RDTXWAMCSA-N 2 1 317.502 4.410 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1Cl ZINC000542488264 341009873 /nfs/dbraw/zinc/00/98/73/341009873.db2.gz GNIFFKYZVDJCCV-GJZGRUSLSA-N 2 1 324.896 4.264 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668568 341016486 /nfs/dbraw/zinc/01/64/86/341016486.db2.gz MSXBMWMUWJGUOZ-LPHOPBHVSA-N 2 1 304.478 4.139 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668568 341016487 /nfs/dbraw/zinc/01/64/87/341016487.db2.gz MSXBMWMUWJGUOZ-LPHOPBHVSA-N 2 1 304.478 4.139 20 0 DIADMP C[C@H](CCc1cccc(F)c1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000543080903 341031005 /nfs/dbraw/zinc/03/10/05/341031005.db2.gz JUXQARNHGNKHDI-YLJYHZDGSA-N 2 1 318.480 4.097 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707155 341054531 /nfs/dbraw/zinc/05/45/31/341054531.db2.gz BYJZGAHKVIXKLK-BEFAXECRSA-N 2 1 314.473 4.451 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707155 341054532 /nfs/dbraw/zinc/05/45/32/341054532.db2.gz BYJZGAHKVIXKLK-BEFAXECRSA-N 2 1 314.473 4.451 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)Cc2ccsc2)CC1 ZINC000543988595 341065381 /nfs/dbraw/zinc/06/53/81/341065381.db2.gz DCVIUBVYWSCZDW-INIZCTEOSA-N 2 1 308.535 4.123 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CCC[C@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142035 341071887 /nfs/dbraw/zinc/07/18/87/341071887.db2.gz IHFWTZMFVHBZJZ-PKOBYXMFSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CCC[C@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142035 341071888 /nfs/dbraw/zinc/07/18/88/341071888.db2.gz IHFWTZMFVHBZJZ-PKOBYXMFSA-N 2 1 318.892 4.278 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccccc2Cl)C[C@H]1C ZINC000544146022 341072077 /nfs/dbraw/zinc/07/20/77/341072077.db2.gz PMADLIBYLDJKPW-NVXWUHKLSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccccc2Cl)C[C@H]1C ZINC000544146022 341072078 /nfs/dbraw/zinc/07/20/78/341072078.db2.gz PMADLIBYLDJKPW-NVXWUHKLSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccccc2Cl)C[C@H]1C ZINC000544146022 341072079 /nfs/dbraw/zinc/07/20/79/341072079.db2.gz PMADLIBYLDJKPW-NVXWUHKLSA-N 2 1 308.897 4.077 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccccc2Cl)C[C@@H]1C ZINC000544146005 341072085 /nfs/dbraw/zinc/07/20/85/341072085.db2.gz PMADLIBYLDJKPW-DOTOQJQBSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccccc2Cl)C[C@@H]1C ZINC000544146005 341072086 /nfs/dbraw/zinc/07/20/86/341072086.db2.gz PMADLIBYLDJKPW-DOTOQJQBSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccccc2Cl)C[C@@H]1C ZINC000544146005 341072087 /nfs/dbraw/zinc/07/20/87/341072087.db2.gz PMADLIBYLDJKPW-DOTOQJQBSA-N 2 1 308.897 4.077 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC000544146476 341072305 /nfs/dbraw/zinc/07/23/05/341072305.db2.gz RQEWVSSHMKQBPL-LJQANCHMSA-N 2 1 320.908 4.380 20 0 DIADMP C[C@H](C[N@@H+](C)Cc1cc(-n2ccnc2)cs1)c1ccccc1 ZINC000544351914 341077726 /nfs/dbraw/zinc/07/77/26/341077726.db2.gz RNEVVWUESLGYPW-OAHLLOKOSA-N 2 1 311.454 4.169 20 0 DIADMP CCC(CC)(C[NH2+][C@H](C)[C@@H]1CCCO1)[NH2+][C@@H](C)c1ccccc1 ZINC000544355442 341077841 /nfs/dbraw/zinc/07/78/41/341077841.db2.gz GHRGNFZZQDCFDG-SCTDSRPQSA-N 2 1 318.505 4.053 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC[N@@H+]1C ZINC000132217822 341118523 /nfs/dbraw/zinc/11/85/23/341118523.db2.gz DWVWNYPQFJZFAQ-JEBQAFNWSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC[N@H+]1C ZINC000132217822 341118524 /nfs/dbraw/zinc/11/85/24/341118524.db2.gz DWVWNYPQFJZFAQ-JEBQAFNWSA-N 2 1 306.881 4.254 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000545982880 341149534 /nfs/dbraw/zinc/14/95/34/341149534.db2.gz NHVUSCXNHDOQFE-SFHVURJKSA-N 2 1 317.864 4.366 20 0 DIADMP C[C@H](CC[NH2+]Cc1cccc2cc[nH]c21)[N@@H+](C)Cc1ccccc1 ZINC000237464961 341214459 /nfs/dbraw/zinc/21/44/59/341214459.db2.gz KBGXINJPPIVLHS-QGZVFWFLSA-N 2 1 321.468 4.168 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548156339 341249947 /nfs/dbraw/zinc/24/99/47/341249947.db2.gz JDOZQQGUWZSSRQ-SCTDSRPQSA-N 2 1 320.546 4.018 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548156337 341250021 /nfs/dbraw/zinc/25/00/21/341250021.db2.gz JDOZQQGUWZSSRQ-JENIJYKNSA-N 2 1 320.546 4.018 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245467148 341295701 /nfs/dbraw/zinc/29/57/01/341295701.db2.gz ZJFXHCXOWBLTIP-KGLIPLIRSA-N 2 1 314.395 4.040 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245467148 341295702 /nfs/dbraw/zinc/29/57/02/341295702.db2.gz ZJFXHCXOWBLTIP-KGLIPLIRSA-N 2 1 314.395 4.040 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245467148 341295703 /nfs/dbraw/zinc/29/57/03/341295703.db2.gz ZJFXHCXOWBLTIP-KGLIPLIRSA-N 2 1 314.395 4.040 20 0 DIADMP Fc1ccccc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245701847 341310581 /nfs/dbraw/zinc/31/05/81/341310581.db2.gz LTXDZLCSJFRGHI-ACDBMABISA-N 2 1 324.443 4.111 20 0 DIADMP Fc1ccccc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245701847 341310582 /nfs/dbraw/zinc/31/05/82/341310582.db2.gz LTXDZLCSJFRGHI-ACDBMABISA-N 2 1 324.443 4.111 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000550587810 341318830 /nfs/dbraw/zinc/31/88/30/341318830.db2.gz GCDWQSLVBBSDNI-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000550587810 341318831 /nfs/dbraw/zinc/31/88/31/341318831.db2.gz GCDWQSLVBBSDNI-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000550621995 341319815 /nfs/dbraw/zinc/31/98/15/341319815.db2.gz HWESMMOHZCXGDE-UMGGQSCQSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000550621995 341319816 /nfs/dbraw/zinc/31/98/16/341319816.db2.gz HWESMMOHZCXGDE-UMGGQSCQSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550623026 341319824 /nfs/dbraw/zinc/31/98/24/341319824.db2.gz RKUCMVIACVYZOF-ATZDWAIDSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550623026 341319825 /nfs/dbraw/zinc/31/98/25/341319825.db2.gz RKUCMVIACVYZOF-ATZDWAIDSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665993 341320913 /nfs/dbraw/zinc/32/09/13/341320913.db2.gz SOUZWXKIRGRMHA-ZRSLWSEBSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665993 341320914 /nfs/dbraw/zinc/32/09/14/341320914.db2.gz SOUZWXKIRGRMHA-ZRSLWSEBSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCCC2(C)C)C[C@H]1c1ccccc1 ZINC000550679876 341321390 /nfs/dbraw/zinc/32/13/90/341321390.db2.gz ARAYANNDYIVCJV-FHWLQOOXSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCCC2(C)C)C[C@H]1c1ccccc1 ZINC000550679876 341321391 /nfs/dbraw/zinc/32/13/91/341321391.db2.gz ARAYANNDYIVCJV-FHWLQOOXSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700288 341321605 /nfs/dbraw/zinc/32/16/05/341321605.db2.gz CUQSOSKJPHUAGK-YUXAGFNASA-N 2 1 320.480 4.407 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700288 341321606 /nfs/dbraw/zinc/32/16/06/341321606.db2.gz CUQSOSKJPHUAGK-YUXAGFNASA-N 2 1 320.480 4.407 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC2CCC(F)(F)CC2)C[C@H]1c1ccccc1 ZINC000550797657 341323260 /nfs/dbraw/zinc/32/32/60/341323260.db2.gz UHOKGAJAZWSBNK-ROUUACIJSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2CCC(F)(F)CC2)C[C@H]1c1ccccc1 ZINC000550797657 341323261 /nfs/dbraw/zinc/32/32/61/341323261.db2.gz UHOKGAJAZWSBNK-ROUUACIJSA-N 2 1 322.443 4.237 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550997996 341328628 /nfs/dbraw/zinc/32/86/28/341328628.db2.gz VRCZRTBXTJUJIP-YVWKXTFCSA-N 2 1 312.457 4.026 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550997996 341328629 /nfs/dbraw/zinc/32/86/29/341328629.db2.gz VRCZRTBXTJUJIP-YVWKXTFCSA-N 2 1 312.457 4.026 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551015337 341329302 /nfs/dbraw/zinc/32/93/02/341329302.db2.gz WIGJQRVVOAVOLD-NYVOZVTQSA-N 2 1 322.496 4.351 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551015337 341329303 /nfs/dbraw/zinc/32/93/03/341329303.db2.gz WIGJQRVVOAVOLD-NYVOZVTQSA-N 2 1 322.496 4.351 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000551052204 341330300 /nfs/dbraw/zinc/33/03/00/341330300.db2.gz WWAZVDCIHFJIEL-MDNKFWRPSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000551052204 341330301 /nfs/dbraw/zinc/33/03/01/341330301.db2.gz WWAZVDCIHFJIEL-MDNKFWRPSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2(c3ccccc3)CCC2)C[C@@H]1c1ccccc1 ZINC000551114759 341332044 /nfs/dbraw/zinc/33/20/44/341332044.db2.gz HHHMARSDICFOSR-LEWJYISDSA-N 2 1 320.480 4.491 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2(c3ccccc3)CCC2)C[C@@H]1c1ccccc1 ZINC000551114759 341332045 /nfs/dbraw/zinc/33/20/45/341332045.db2.gz HHHMARSDICFOSR-LEWJYISDSA-N 2 1 320.480 4.491 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551268263 341336329 /nfs/dbraw/zinc/33/63/29/341336329.db2.gz TYDFSBATLSSSQN-QREPNTDJSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000246500133 341350850 /nfs/dbraw/zinc/35/08/50/341350850.db2.gz SNCNOLURGMAZDJ-KAEUXLIGSA-N 2 1 306.881 4.109 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000246500133 341350851 /nfs/dbraw/zinc/35/08/51/341350851.db2.gz SNCNOLURGMAZDJ-KAEUXLIGSA-N 2 1 306.881 4.109 20 0 DIADMP COc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000246872911 341358126 /nfs/dbraw/zinc/35/81/26/341358126.db2.gz CQIICGVDYTXNBM-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000246872911 341358127 /nfs/dbraw/zinc/35/81/27/341358127.db2.gz CQIICGVDYTXNBM-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000247000817 341359724 /nfs/dbraw/zinc/35/97/24/341359724.db2.gz JWSOBSVBJVRDKN-NWANDNLSSA-N 2 1 323.550 4.272 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000247075196 341360736 /nfs/dbraw/zinc/36/07/36/341360736.db2.gz QJRWLBXFZHPECK-SJORKVTESA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000247075196 341360737 /nfs/dbraw/zinc/36/07/37/341360737.db2.gz QJRWLBXFZHPECK-SJORKVTESA-N 2 1 311.473 4.006 20 0 DIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000247176986 341361915 /nfs/dbraw/zinc/36/19/15/341361915.db2.gz UWVOPQVYSRBOKP-HZPDHXFCSA-N 2 1 300.446 4.042 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000247176986 341361916 /nfs/dbraw/zinc/36/19/16/341361916.db2.gz UWVOPQVYSRBOKP-HZPDHXFCSA-N 2 1 300.446 4.042 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)s1 ZINC000247210151 341362282 /nfs/dbraw/zinc/36/22/82/341362282.db2.gz WWJKVJIXCKMAHL-HUUCEWRRSA-N 2 1 323.550 4.319 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(Cl)s2)C1 ZINC000247202518 341362311 /nfs/dbraw/zinc/36/23/11/341362311.db2.gz WMDGNJDRYXUOJU-CHWSQXEVSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccccc1 ZINC000247347157 341363848 /nfs/dbraw/zinc/36/38/48/341363848.db2.gz AREWONJBHYDDJX-VDZJLULYSA-N 2 1 314.498 4.482 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccccc1 ZINC000247347157 341363849 /nfs/dbraw/zinc/36/38/49/341363849.db2.gz AREWONJBHYDDJX-VDZJLULYSA-N 2 1 314.498 4.482 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CCCC1 ZINC000248014411 341372304 /nfs/dbraw/zinc/37/23/04/341372304.db2.gz LOYMCARCJTXPFY-QILLFSRXSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CCCC1 ZINC000248014411 341372305 /nfs/dbraw/zinc/37/23/05/341372305.db2.gz LOYMCARCJTXPFY-QILLFSRXSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248392448 341376237 /nfs/dbraw/zinc/37/62/37/341376237.db2.gz DBGUYVRWXDPYDN-LZWOXQAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248400481 341376555 /nfs/dbraw/zinc/37/65/55/341376555.db2.gz KXZSJJQURGJYMZ-GGPKGHCWSA-N 2 1 314.517 4.250 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248403587 341376635 /nfs/dbraw/zinc/37/66/35/341376635.db2.gz OTJCAUJIKPCPJO-UXLLHSPISA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000552251060 341381360 /nfs/dbraw/zinc/38/13/60/341381360.db2.gz JMIIKAXCOYODHA-NBOOPKSLSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000552251060 341381361 /nfs/dbraw/zinc/38/13/61/341381361.db2.gz JMIIKAXCOYODHA-NBOOPKSLSA-N 2 1 306.519 4.155 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CC=CCC2)CC1 ZINC000552250931 341381384 /nfs/dbraw/zinc/38/13/84/341381384.db2.gz FZYTUHBLZHMEPO-KMFTYDHNSA-N 2 1 312.501 4.376 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCCC3)[C@H]1c1cccs1 ZINC000248969016 341391130 /nfs/dbraw/zinc/39/11/30/341391130.db2.gz CCRGOMZKZVPWHE-NXHRZFHOSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCCC3)[C@H]1c1cccs1 ZINC000248969016 341391131 /nfs/dbraw/zinc/39/11/31/341391131.db2.gz CCRGOMZKZVPWHE-NXHRZFHOSA-N 2 1 318.530 4.443 20 0 DIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)o1 ZINC000192710279 341883124 /nfs/dbraw/zinc/88/31/24/341883124.db2.gz WRAUAARUSKCDKT-UZLBHIALSA-N 2 1 324.468 4.289 20 0 DIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(Cl)s1 ZINC000178787195 341964915 /nfs/dbraw/zinc/96/49/15/341964915.db2.gz HBCZYAARDTXJNK-CYBMUJFWSA-N 2 1 311.882 4.428 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000151113486 517588181 /nfs/dbraw/zinc/58/81/81/517588181.db2.gz TXWDIWQGJJNAES-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000151113486 517588184 /nfs/dbraw/zinc/58/81/84/517588184.db2.gz TXWDIWQGJJNAES-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@@H](C)Sc3sccc32)CC1 ZINC000336825671 519674177 /nfs/dbraw/zinc/67/41/77/519674177.db2.gz AUDWYJRCYVOLQU-DOMZBBRYSA-N 2 1 310.532 4.136 20 0 DIADMP CCC[C@@H]([NH2+]CCCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000338008574 520773660 /nfs/dbraw/zinc/77/36/60/520773660.db2.gz PBLAOKLXTHEKAL-QGZVFWFLSA-N 2 1 305.853 4.366 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1ccccn1 ZINC000158644033 525439604 /nfs/dbraw/zinc/43/96/04/525439604.db2.gz CTUDNOZIDBIOAO-ROUUACIJSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226326661 526039771 /nfs/dbraw/zinc/03/97/71/526039771.db2.gz ICLGBMMUXAAJND-RYUDHWBXSA-N 2 1 301.261 4.115 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000339212888 526914512 /nfs/dbraw/zinc/91/45/12/526914512.db2.gz FYGOPNXELGBIMF-HNNXBMFYSA-N 2 1 320.527 4.120 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000339212888 526914515 /nfs/dbraw/zinc/91/45/15/526914515.db2.gz FYGOPNXELGBIMF-HNNXBMFYSA-N 2 1 320.527 4.120 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]2C2CCC2)cc1 ZINC000337985661 527381631 /nfs/dbraw/zinc/38/16/31/527381631.db2.gz AOLOVCXNLQWILD-PNHOKKKMSA-N 2 1 309.457 4.410 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCS2 ZINC000643546469 1035591431 /nfs/dbraw/zinc/59/14/31/1035591431.db2.gz PHEHIUGBVPFCLP-DZGCQCFKSA-N 2 1 322.905 4.141 20 0 DIADMP Fc1ccc([C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547262 1035601484 /nfs/dbraw/zinc/60/14/84/1035601484.db2.gz BXLWENKQQFTEMA-PMACEKPBSA-N 2 1 324.443 4.179 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](F)C2)cc1 ZINC000579832792 1035778222 /nfs/dbraw/zinc/77/82/22/1035778222.db2.gz UGUGNPRLJSSFGS-XKQJLSEDSA-N 2 1 301.409 4.112 20 0 DIADMP CC/C=C\CC[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001208734306 1035837841 /nfs/dbraw/zinc/83/78/41/1035837841.db2.gz VXDFBSVWRKMBKL-JLZAYFGNSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001208734306 1035837850 /nfs/dbraw/zinc/83/78/50/1035837850.db2.gz VXDFBSVWRKMBKL-JLZAYFGNSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001208734306 1035837861 /nfs/dbraw/zinc/83/78/61/1035837861.db2.gz VXDFBSVWRKMBKL-JLZAYFGNSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001208734305 1035838940 /nfs/dbraw/zinc/83/89/40/1035838940.db2.gz VXDFBSVWRKMBKL-HSSJFEOCSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001208734305 1035838958 /nfs/dbraw/zinc/83/89/58/1035838958.db2.gz VXDFBSVWRKMBKL-HSSJFEOCSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001208734305 1035838974 /nfs/dbraw/zinc/83/89/74/1035838974.db2.gz VXDFBSVWRKMBKL-HSSJFEOCSA-N 2 1 312.501 4.187 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000314916485 1035929929 /nfs/dbraw/zinc/92/99/29/1035929929.db2.gz MLUXUGMOIVXOOP-HOJAQTOUSA-N 2 1 300.490 4.033 20 0 DIADMP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000037197195 1035960841 /nfs/dbraw/zinc/96/08/41/1035960841.db2.gz LEYHHEICWMCMAG-AWEZNQCLSA-N 2 1 312.910 4.054 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)CCC2 ZINC000535621438 1035978691 /nfs/dbraw/zinc/97/86/91/1035978691.db2.gz LRBSBKWVWZSXHQ-OXJNMPFZSA-N 2 1 300.490 4.119 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](CCc1ccccc1F)C1CCCC1 ZINC001167248269 1036315912 /nfs/dbraw/zinc/31/59/12/1036315912.db2.gz KUQYDARMPVOPER-GOSISDBHSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](CCc1ccccc1F)C1CCCC1 ZINC001167248269 1036315929 /nfs/dbraw/zinc/31/59/29/1036315929.db2.gz KUQYDARMPVOPER-GOSISDBHSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](CCc1ccccc1F)C1CCCC1 ZINC001167248269 1036315950 /nfs/dbraw/zinc/31/59/50/1036315950.db2.gz KUQYDARMPVOPER-GOSISDBHSA-N 2 1 318.480 4.097 20 0 DIADMP CC1CCC([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000236827148 1036316310 /nfs/dbraw/zinc/31/63/10/1036316310.db2.gz PYTIVAUSCJGMMD-CGZBRXJRSA-N 2 1 306.519 4.128 20 0 DIADMP CC1CCC([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000236827148 1036316328 /nfs/dbraw/zinc/31/63/28/1036316328.db2.gz PYTIVAUSCJGMMD-CGZBRXJRSA-N 2 1 306.519 4.128 20 0 DIADMP Cc1ccc(C)c(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC001648802288 1036372685 /nfs/dbraw/zinc/37/26/85/1036372685.db2.gz DWPXKTICDJKGHJ-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP Cc1cccc(C)c1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC001648802653 1036377322 /nfs/dbraw/zinc/37/73/22/1036377322.db2.gz PFLAOSAJNLVJGZ-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP Cc1cc2cc(C[NH2+]C3CC[NH+](C4CCC4)CC3)oc2cc1C ZINC000530674076 1036389774 /nfs/dbraw/zinc/38/97/74/1036389774.db2.gz OXNJPWJICKJSLN-UHFFFAOYSA-N 2 1 312.457 4.156 20 0 DIADMP Cc1cc([C@@H](C)NCc2ccc(-n3ccnc3)c(F)c2)c(C)o1 ZINC000340414167 1036537385 /nfs/dbraw/zinc/53/73/85/1036537385.db2.gz AIBZTKICDUTBLZ-CYBMUJFWSA-N 2 1 313.376 4.072 20 0 DIADMP CC(C)c1cccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC001648816648 1036576420 /nfs/dbraw/zinc/57/64/20/1036576420.db2.gz CHJXLMSABLBEJK-SFHVURJKSA-N 2 1 302.506 4.412 20 0 DIADMP C[C@@H](C[NH2+]C[C@H](C1CC1)[NH+](C)C)Cc1ccc(C(C)(C)C)cc1 ZINC001648837413 1036617385 /nfs/dbraw/zinc/61/73/85/1036617385.db2.gz QEQJRXSJIRZXOG-OXQOHEQNSA-N 2 1 316.533 4.093 20 0 DIADMP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174581 1036629296 /nfs/dbraw/zinc/62/92/96/1036629296.db2.gz ATKKUKQASXQGRR-RYUDHWBXSA-N 2 1 308.878 4.114 20 0 DIADMP C[C@H]([NH3+])[C@H]1CCC[N@@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000070174581 1036629301 /nfs/dbraw/zinc/62/93/01/1036629301.db2.gz ATKKUKQASXQGRR-RYUDHWBXSA-N 2 1 308.878 4.114 20 0 DIADMP CC[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1(C)C ZINC000397652727 1036708537 /nfs/dbraw/zinc/70/85/37/1036708537.db2.gz MEHSOTOVVIXLSQ-IRFCIJBXSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1(C)C ZINC000397652739 1036709800 /nfs/dbraw/zinc/70/98/00/1036709800.db2.gz MEHSOTOVVIXLSQ-ZJOUEHCJSA-N 2 1 314.517 4.313 20 0 DIADMP CCc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001167326927 1036743213 /nfs/dbraw/zinc/74/32/13/1036743213.db2.gz YERJKGIAKKTEFH-NRFANRHFSA-N 2 1 314.517 4.337 20 0 DIADMP CCc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001167326927 1036743230 /nfs/dbraw/zinc/74/32/30/1036743230.db2.gz YERJKGIAKKTEFH-NRFANRHFSA-N 2 1 314.517 4.337 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000317326573 1036829244 /nfs/dbraw/zinc/82/92/44/1036829244.db2.gz WPLIEEFGPSPITG-UXPWSPDFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000317326573 1036829264 /nfs/dbraw/zinc/82/92/64/1036829264.db2.gz WPLIEEFGPSPITG-UXPWSPDFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000317326569 1036829374 /nfs/dbraw/zinc/82/93/74/1036829374.db2.gz WPLIEEFGPSPITG-LSTHTHJFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000317326569 1036829393 /nfs/dbraw/zinc/82/93/93/1036829393.db2.gz WPLIEEFGPSPITG-LSTHTHJFSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000580103893 1036954318 /nfs/dbraw/zinc/95/43/18/1036954318.db2.gz UFRQDWGWBXAHHG-SFTDATJTSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000580103893 1036954333 /nfs/dbraw/zinc/95/43/33/1036954333.db2.gz UFRQDWGWBXAHHG-SFTDATJTSA-N 2 1 308.469 4.044 20 0 DIADMP Cc1cccc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1C ZINC000379753500 1037090338 /nfs/dbraw/zinc/09/03/38/1037090338.db2.gz PVOVYOWUZDLKEQ-NRFANRHFSA-N 2 1 322.496 4.305 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398042217 1037111208 /nfs/dbraw/zinc/11/12/08/1037111208.db2.gz SVGOPDMTIILJJH-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398042217 1037111211 /nfs/dbraw/zinc/11/12/11/1037111211.db2.gz SVGOPDMTIILJJH-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398042218 1037111742 /nfs/dbraw/zinc/11/17/42/1037111742.db2.gz SVGOPDMTIILJJH-LCLWPZTBSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398042218 1037111749 /nfs/dbraw/zinc/11/17/49/1037111749.db2.gz SVGOPDMTIILJJH-LCLWPZTBSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc3ccccc3[nH]2)C1 ZINC000683927514 1037113116 /nfs/dbraw/zinc/11/31/16/1037113116.db2.gz KHLNQDFOTUHEMP-CALCHBBNSA-N 2 1 313.489 4.016 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@H]3CC[N@H+](C)C[C@@H]3C)c2)cc1 ZINC000537957794 1037200194 /nfs/dbraw/zinc/20/01/94/1037200194.db2.gz UZYDKHIAOSRFST-UWJYYQICSA-N 2 1 308.469 4.092 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398159113 1037244466 /nfs/dbraw/zinc/24/44/66/1037244466.db2.gz FLELBWBAXSOULH-YLJYHZDGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398159113 1037244479 /nfs/dbraw/zinc/24/44/79/1037244479.db2.gz FLELBWBAXSOULH-YLJYHZDGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCC(C)(C)C1 ZINC000398189046 1037278642 /nfs/dbraw/zinc/27/86/42/1037278642.db2.gz MEPAYFOFOSLYPJ-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCC(C)(C)C1 ZINC000398189046 1037278646 /nfs/dbraw/zinc/27/86/46/1037278646.db2.gz MEPAYFOFOSLYPJ-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000128299636 1037450594 /nfs/dbraw/zinc/45/05/94/1037450594.db2.gz OLZTUXQTHCBSGS-UHFFFAOYSA-N 2 1 317.864 4.294 20 0 DIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cc4ccccc4s3)C2)CC1 ZINC000581515831 1037705342 /nfs/dbraw/zinc/70/53/42/1037705342.db2.gz KSFBGHPUHMWRMU-KRWDZBQOSA-N 2 1 314.498 4.065 20 0 DIADMP C[N@H+](Cc1ccc(C2CCCC2)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC001167478562 1037909244 /nfs/dbraw/zinc/90/92/44/1037909244.db2.gz SPYSMEVQNRHTCM-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+](Cc1ccc(C2CCCC2)cc1)C[C@@H]1CCC[N@H+](C)C1 ZINC001167478562 1037909256 /nfs/dbraw/zinc/90/92/56/1037909256.db2.gz SPYSMEVQNRHTCM-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000090418591 1038113146 /nfs/dbraw/zinc/11/31/46/1038113146.db2.gz YODARWXGXNPQJE-GJZGRUSLSA-N 2 1 317.502 4.013 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000090418591 1038113152 /nfs/dbraw/zinc/11/31/52/1038113152.db2.gz YODARWXGXNPQJE-GJZGRUSLSA-N 2 1 317.502 4.013 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000341746132 1038257721 /nfs/dbraw/zinc/25/77/21/1038257721.db2.gz XPPMTBNTPGGIFE-SFHVURJKSA-N 2 1 317.864 4.366 20 0 DIADMP CCCC[C@@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(OC)cc1 ZINC000341796736 1038270130 /nfs/dbraw/zinc/27/01/30/1038270130.db2.gz JEKXZKZYGLUGAL-IEBWSBKVSA-N 2 1 304.478 4.000 20 0 DIADMP CC(C)[C@@H](C[NH2+][C@H](C)C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914714 1038376442 /nfs/dbraw/zinc/37/64/42/1038376442.db2.gz YGOFVMRRDZXBEN-QWFCFKBJSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@@H](C[NH2+][C@H](C)C[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914714 1038376455 /nfs/dbraw/zinc/37/64/55/1038376455.db2.gz YGOFVMRRDZXBEN-QWFCFKBJSA-N 2 1 302.506 4.136 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000604902875 1038460248 /nfs/dbraw/zinc/46/02/48/1038460248.db2.gz GKLKTWFFZFZKGC-VQTJNVASSA-N 2 1 314.517 4.234 20 0 DIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2nc(C)cs2)cc1 ZINC000623853610 1038462227 /nfs/dbraw/zinc/46/22/27/1038462227.db2.gz ADJNHQWZAWYDDH-OAHLLOKOSA-N 2 1 317.502 4.144 20 0 DIADMP CC(C[NH+]([C@H](C)C1CC1)C1CC1)C[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000605573354 1038536574 /nfs/dbraw/zinc/53/65/74/1038536574.db2.gz NWGKUJCSDBHDCF-HZPDHXFCSA-N 2 1 304.522 4.148 20 0 DIADMP Cc1ccc(CC[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000605575051 1038537329 /nfs/dbraw/zinc/53/73/29/1038537329.db2.gz GTLKNVQDONEKKQ-PZJWPPBQSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000605575051 1038537330 /nfs/dbraw/zinc/53/73/30/1038537330.db2.gz GTLKNVQDONEKKQ-PZJWPPBQSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000605575051 1038537334 /nfs/dbraw/zinc/53/73/34/1038537334.db2.gz GTLKNVQDONEKKQ-PZJWPPBQSA-N 2 1 314.517 4.124 20 0 DIADMP C[C@@H](Cc1cccs1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000684773099 1038596983 /nfs/dbraw/zinc/59/69/83/1038596983.db2.gz CDMOWBWMBIWLAA-DOTOQJQBSA-N 2 1 306.519 4.066 20 0 DIADMP C1=C(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCC1 ZINC001167553656 1038607683 /nfs/dbraw/zinc/60/76/83/1038607683.db2.gz GVXCJYRIWHYADP-OAQYLSRUSA-N 2 1 310.485 4.085 20 0 DIADMP C1=C(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCC1 ZINC001167553656 1038607688 /nfs/dbraw/zinc/60/76/88/1038607688.db2.gz GVXCJYRIWHYADP-OAQYLSRUSA-N 2 1 310.485 4.085 20 0 DIADMP C1=C(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCC1 ZINC001167553656 1038607691 /nfs/dbraw/zinc/60/76/91/1038607691.db2.gz GVXCJYRIWHYADP-OAQYLSRUSA-N 2 1 310.485 4.085 20 0 DIADMP C(CC[N@H+]1CCC[C@@H]2CCC[C@H]21)C[NH+]1CCC[C@H]2CCC[C@@H]21 ZINC000582339677 1038635317 /nfs/dbraw/zinc/63/53/17/1038635317.db2.gz CPGLNEKTBGXKEJ-JVSBHGNQSA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@@H+]1CCC[C@H]2CCC[C@@H]21)C[NH+]1CCC[C@@H]2CCC[C@H]21 ZINC000582339677 1038635321 /nfs/dbraw/zinc/63/53/21/1038635321.db2.gz CPGLNEKTBGXKEJ-JVSBHGNQSA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@H+]1CCC[C@H]2CCC[C@@H]21)C[NH+]1CCC[C@@H]2CCC[C@H]21 ZINC000582339677 1038635325 /nfs/dbraw/zinc/63/53/25/1038635325.db2.gz CPGLNEKTBGXKEJ-JVSBHGNQSA-N 2 1 304.522 4.296 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@]1(C)Cc1ccccc1 ZINC000342682836 1038721059 /nfs/dbraw/zinc/72/10/59/1038721059.db2.gz ULYLOXQSLYEVGP-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@]1(C)Cc1ccccc1 ZINC000342682836 1038721067 /nfs/dbraw/zinc/72/10/67/1038721067.db2.gz ULYLOXQSLYEVGP-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3cccnc32)c1 ZINC000684954937 1038738180 /nfs/dbraw/zinc/73/81/80/1038738180.db2.gz FGHYAVGYKYTGFH-FQEVSTJZSA-N 2 1 323.484 4.089 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000608061366 1038760636 /nfs/dbraw/zinc/76/06/36/1038760636.db2.gz RBELWGJWPYUHRT-UONOGXRCSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000608061366 1038760643 /nfs/dbraw/zinc/76/06/43/1038760643.db2.gz RBELWGJWPYUHRT-UONOGXRCSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000608061571 1038761025 /nfs/dbraw/zinc/76/10/25/1038761025.db2.gz ZBDFHWPUAVWLRR-BBRMVZONSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000608061571 1038761032 /nfs/dbraw/zinc/76/10/32/1038761032.db2.gz ZBDFHWPUAVWLRR-BBRMVZONSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC[N@H+]1C ZINC000608061586 1038761263 /nfs/dbraw/zinc/76/12/63/1038761263.db2.gz ZIYUBZVSTSXYTE-IEBWSBKVSA-N 2 1 323.484 4.027 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC000608063183 1038762892 /nfs/dbraw/zinc/76/28/92/1038762892.db2.gz CDPQJHLESXKITO-SVFBPWRDSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000608053857 1038766696 /nfs/dbraw/zinc/76/66/96/1038766696.db2.gz XCZQIKLBHGWJLE-QGZVFWFLSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000608053857 1038766701 /nfs/dbraw/zinc/76/67/01/1038766701.db2.gz XCZQIKLBHGWJLE-QGZVFWFLSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000608053856 1038767628 /nfs/dbraw/zinc/76/76/28/1038767628.db2.gz XCZQIKLBHGWJLE-KRWDZBQOSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000608053856 1038767632 /nfs/dbraw/zinc/76/76/32/1038767632.db2.gz XCZQIKLBHGWJLE-KRWDZBQOSA-N 2 1 312.457 4.252 20 0 DIADMP C(=C\C[N@H+]1CCC[C@@H]2CCC[C@@H]21)\C[NH+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564643 1038886668 /nfs/dbraw/zinc/88/66/68/1038886668.db2.gz QAJOHXAQOOHVRW-DWOKHNNDSA-N 2 1 302.506 4.072 20 0 DIADMP CCc1oc2ccccc2c1C[N@H+](C)CCCn1cc[nH+]c1C ZINC000342859603 1038924549 /nfs/dbraw/zinc/92/45/49/1038924549.db2.gz JQNYHWWLXUCGDG-UHFFFAOYSA-N 2 1 311.429 4.022 20 0 DIADMP CCc1oc2ccccc2c1C[N@@H+](C)CCCn1cc[nH+]c1C ZINC000342859603 1038924565 /nfs/dbraw/zinc/92/45/65/1038924565.db2.gz JQNYHWWLXUCGDG-UHFFFAOYSA-N 2 1 311.429 4.022 20 0 DIADMP Cc1nccn1CCC[N@@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000342858591 1038924982 /nfs/dbraw/zinc/92/49/82/1038924982.db2.gz BFBRMTKRNIHWOP-HXUWFJFHSA-N 2 1 309.457 4.124 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000342858591 1038924994 /nfs/dbraw/zinc/92/49/94/1038924994.db2.gz BFBRMTKRNIHWOP-HXUWFJFHSA-N 2 1 309.457 4.124 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000342858591 1038925007 /nfs/dbraw/zinc/92/50/07/1038925007.db2.gz BFBRMTKRNIHWOP-HXUWFJFHSA-N 2 1 309.457 4.124 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](CC1CCC1)[C@H](C)c1ccccc1 ZINC000342861007 1038927740 /nfs/dbraw/zinc/92/77/40/1038927740.db2.gz ULEPYLYASWEXIN-QGZVFWFLSA-N 2 1 311.473 4.445 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](CC1CCC1)[C@H](C)c1ccccc1 ZINC000342861007 1038927758 /nfs/dbraw/zinc/92/77/58/1038927758.db2.gz ULEPYLYASWEXIN-QGZVFWFLSA-N 2 1 311.473 4.445 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000342862802 1038928537 /nfs/dbraw/zinc/92/85/37/1038928537.db2.gz DHEQUGCHKWOBTA-CQSZACIVSA-N 2 1 317.864 4.461 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000342862802 1038928547 /nfs/dbraw/zinc/92/85/47/1038928547.db2.gz DHEQUGCHKWOBTA-CQSZACIVSA-N 2 1 317.864 4.461 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000534347020 1039033591 /nfs/dbraw/zinc/03/35/91/1039033591.db2.gz UKITWJLFOQKGRX-UHFFFAOYSA-N 2 1 314.473 4.293 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000121432036 1039048934 /nfs/dbraw/zinc/04/89/34/1039048934.db2.gz RIKXXPQGGLWCST-QWHCGFSZSA-N 2 1 320.506 4.067 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000714804006 1039090518 /nfs/dbraw/zinc/09/05/18/1039090518.db2.gz SIWANOXSXAOASP-DBOLQNLKSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2C[C@H]2C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000714804006 1039090533 /nfs/dbraw/zinc/09/05/33/1039090533.db2.gz SIWANOXSXAOASP-DBOLQNLKSA-N 2 1 312.501 4.065 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000539499527 1039273727 /nfs/dbraw/zinc/27/37/27/1039273727.db2.gz GVAXIUWQDQAHJV-MAUKXSAKSA-N 2 1 306.469 4.234 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]CC3=CC[N@@H+](C)CC3)s2)cc1 ZINC000539546110 1039286628 /nfs/dbraw/zinc/28/66/28/1039286628.db2.gz FRGFSQQDYOLVMS-UHFFFAOYSA-N 2 1 312.482 4.075 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508858462 1039312481 /nfs/dbraw/zinc/31/24/81/1039312481.db2.gz IORRMKWOUQJAGE-LJQANCHMSA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508858462 1039312499 /nfs/dbraw/zinc/31/24/99/1039312499.db2.gz IORRMKWOUQJAGE-LJQANCHMSA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508858462 1039312517 /nfs/dbraw/zinc/31/25/17/1039312517.db2.gz IORRMKWOUQJAGE-LJQANCHMSA-N 2 1 312.501 4.118 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693466 1039322797 /nfs/dbraw/zinc/32/27/97/1039322797.db2.gz IPROWJPYKSGYFS-LPHOPBHVSA-N 2 1 317.436 4.482 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693466 1039322816 /nfs/dbraw/zinc/32/28/16/1039322816.db2.gz IPROWJPYKSGYFS-LPHOPBHVSA-N 2 1 317.436 4.482 20 0 DIADMP CCCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCC)C2)cc1 ZINC000539824146 1039342410 /nfs/dbraw/zinc/34/24/10/1039342410.db2.gz YRULFIBHLVYEIX-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CCC)C2)cc1 ZINC000539824146 1039342422 /nfs/dbraw/zinc/34/24/22/1039342422.db2.gz YRULFIBHLVYEIX-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CCC)C2)cc1 ZINC000539824146 1039342433 /nfs/dbraw/zinc/34/24/33/1039342433.db2.gz YRULFIBHLVYEIX-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CCC)C2)cc1 ZINC000539824146 1039342445 /nfs/dbraw/zinc/34/24/45/1039342445.db2.gz YRULFIBHLVYEIX-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP Cc1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)o1 ZINC000539900233 1039385398 /nfs/dbraw/zinc/38/53/98/1039385398.db2.gz OOTNQRYRKVKIQD-TZIWHRDSSA-N 2 1 324.468 4.075 20 0 DIADMP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc(Cl)c1F ZINC000650755036 1039460401 /nfs/dbraw/zinc/46/04/01/1039460401.db2.gz XGWKRCBAIHZKJF-MRXNPFEDSA-N 2 1 324.802 4.318 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000540259876 1039463161 /nfs/dbraw/zinc/46/31/61/1039463161.db2.gz YLDBMNIHOYPHPX-YLJYHZDGSA-N 2 1 300.490 4.382 20 0 DIADMP Cc1cc([C@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)ccc1F ZINC000540299880 1039469675 /nfs/dbraw/zinc/46/96/75/1039469675.db2.gz UIRGMTMCAUOJOE-OXQOHEQNSA-N 2 1 318.480 4.295 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccccc1Cl)C(C)C ZINC000540319341 1039474163 /nfs/dbraw/zinc/47/41/63/1039474163.db2.gz ZERAAWFPZRJVBK-RDTXWAMCSA-N 2 1 319.880 4.468 20 0 DIADMP C[C@@H](c1ccccn1)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000151175390 1039482608 /nfs/dbraw/zinc/48/26/08/1039482608.db2.gz OKHHZLUHBDUKAZ-ROUUACIJSA-N 2 1 315.505 4.119 20 0 DIADMP C[C@@H](c1ccccn1)[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000151175338 1039483241 /nfs/dbraw/zinc/48/32/41/1039483241.db2.gz OKHHZLUHBDUKAZ-MSOLQXFVSA-N 2 1 315.505 4.119 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1cccc(F)c1)C(C)(C)C ZINC000540431265 1039493563 /nfs/dbraw/zinc/49/35/63/1039493563.db2.gz ZFRCEVUVRHZRML-KRWDZBQOSA-N 2 1 303.425 4.098 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000540609087 1039527556 /nfs/dbraw/zinc/52/75/56/1039527556.db2.gz XFLKVMNITFNTBF-QGZVFWFLSA-N 2 1 312.482 4.130 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+]CC2=CC[N@@H+](C)CC2)c1 ZINC000540645004 1039537939 /nfs/dbraw/zinc/53/79/39/1039537939.db2.gz XRUDTUABYIFYHH-UHFFFAOYSA-N 2 1 306.453 4.014 20 0 DIADMP C[C@H](C[NH2+]CC1=CC[N@@H+](C)CC1)Cc1ccc(C(C)(C)C)cc1 ZINC000540644938 1039538571 /nfs/dbraw/zinc/53/85/71/1039538571.db2.gz STIJCKLIMOZZEG-KRWDZBQOSA-N 2 1 314.517 4.014 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+]Cc2ccc(Sc3ccccc3)cc2)CC1 ZINC000540689099 1039542670 /nfs/dbraw/zinc/54/26/70/1039542670.db2.gz ZDJQZTLPZWDJHQ-UHFFFAOYSA-N 2 1 324.493 4.189 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c1 ZINC000540982106 1039603218 /nfs/dbraw/zinc/60/32/18/1039603218.db2.gz NYDGAVZEUUGMRI-LJQANCHMSA-N 2 1 308.469 4.046 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000541013149 1039613866 /nfs/dbraw/zinc/61/38/66/1039613866.db2.gz FGKBQGWUDBWCKA-APAOVFLISA-N 2 1 318.480 4.170 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000541203185 1039633703 /nfs/dbraw/zinc/63/37/03/1039633703.db2.gz VHTQDTUPKKDHEQ-KBOKABMXSA-N 2 1 315.486 4.211 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000541203185 1039633708 /nfs/dbraw/zinc/63/37/08/1039633708.db2.gz VHTQDTUPKKDHEQ-KBOKABMXSA-N 2 1 315.486 4.211 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000584224688 1039644816 /nfs/dbraw/zinc/64/48/16/1039644816.db2.gz NDWFKJSCTAXCSD-WLYUNCDWSA-N 2 1 308.432 4.065 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000584224688 1039644825 /nfs/dbraw/zinc/64/48/25/1039644825.db2.gz NDWFKJSCTAXCSD-WLYUNCDWSA-N 2 1 308.432 4.065 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](CCCc1cccc3ccccc31)CC2 ZINC000541340015 1039673539 /nfs/dbraw/zinc/67/35/39/1039673539.db2.gz WGYZRIRGYAOVIA-UHFFFAOYSA-N 2 1 322.496 4.333 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000708501014 1039676840 /nfs/dbraw/zinc/67/68/40/1039676840.db2.gz ARXWGDFCCLBLNJ-BJLQDIEVSA-N 2 1 302.506 4.026 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H](C)CCc2cccc(F)c2)CC1 ZINC000542150325 1039802934 /nfs/dbraw/zinc/80/29/34/1039802934.db2.gz DKMLKOONEISJEG-QGZVFWFLSA-N 2 1 320.496 4.199 20 0 DIADMP C[C@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542151111 1039804089 /nfs/dbraw/zinc/80/40/89/1039804089.db2.gz ADXYQOWMKXKHJF-LMMKCTJWSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@H](Cc1ccsc1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542151111 1039804114 /nfs/dbraw/zinc/80/41/14/1039804114.db2.gz ADXYQOWMKXKHJF-LMMKCTJWSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@H](Cc1ccsc1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542151111 1039804133 /nfs/dbraw/zinc/80/41/33/1039804133.db2.gz ADXYQOWMKXKHJF-LMMKCTJWSA-N 2 1 320.546 4.266 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccnc1 ZINC000091286814 1039836609 /nfs/dbraw/zinc/83/66/09/1039836609.db2.gz BFSAXSOQTCBRCD-WSTZPKSXSA-N 2 1 317.521 4.126 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000092071548 1039865581 /nfs/dbraw/zinc/86/55/81/1039865581.db2.gz JJODKGYEFCJLFA-CQSZACIVSA-N 2 1 303.837 4.060 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000166614967 1039874847 /nfs/dbraw/zinc/87/48/47/1039874847.db2.gz SWUJFTAQDRYTBI-RKVPGOIHSA-N 2 1 306.881 4.254 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000166614967 1039874867 /nfs/dbraw/zinc/87/48/67/1039874867.db2.gz SWUJFTAQDRYTBI-RKVPGOIHSA-N 2 1 306.881 4.254 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCSCC2)[C@H]1c1cccs1 ZINC000657886384 1039996475 /nfs/dbraw/zinc/99/64/75/1039996475.db2.gz FJJHPQMQAZNKPF-VYDXJSESSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCSCC2)[C@H]1c1cccs1 ZINC000657886384 1039996486 /nfs/dbraw/zinc/99/64/86/1039996486.db2.gz FJJHPQMQAZNKPF-VYDXJSESSA-N 2 1 324.559 4.006 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC000685455722 1040060638 /nfs/dbraw/zinc/06/06/38/1040060638.db2.gz TYHIXEICWRMURK-SCCNAQOGSA-N 2 1 314.517 4.280 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)cc1 ZINC000685470087 1040066886 /nfs/dbraw/zinc/06/68/86/1040066886.db2.gz SDIBWTFAERCZFE-PXNSSMCTSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000685470087 1040066899 /nfs/dbraw/zinc/06/68/99/1040066899.db2.gz SDIBWTFAERCZFE-PXNSSMCTSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000685470087 1040066919 /nfs/dbraw/zinc/06/69/19/1040066919.db2.gz SDIBWTFAERCZFE-PXNSSMCTSA-N 2 1 318.505 4.028 20 0 DIADMP Cc1cccc(C)c1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000708563597 1040083631 /nfs/dbraw/zinc/08/36/31/1040083631.db2.gz ZSUWPEYTRVKGFK-CTNGQTDRSA-N 2 1 322.496 4.161 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C(C3CCC3)C3CCC3)C2)cc1 ZINC000309652740 1040087795 /nfs/dbraw/zinc/08/77/95/1040087795.db2.gz AQNGYXPOTQUWDK-SFHVURJKSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccsc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309704556 1040091650 /nfs/dbraw/zinc/09/16/50/1040091650.db2.gz HJSNZNVLWBTRDJ-RYRKJORJSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccs1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309751681 1040093666 /nfs/dbraw/zinc/09/36/66/1040093666.db2.gz ZRHOUEDQSMSNED-RYRKJORJSA-N 2 1 314.498 4.309 20 0 DIADMP CCC1CCC([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309762762 1040094140 /nfs/dbraw/zinc/09/41/40/1040094140.db2.gz YPRVKQMAQLAZRV-SKINQDTJSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(C(F)F)nc1 ZINC000657901794 1040096895 /nfs/dbraw/zinc/09/68/95/1040096895.db2.gz XBDDLWUHORAAMI-CYBMUJFWSA-N 2 1 323.431 4.077 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1ccc(C(F)F)nc1)C(C)C ZINC000657900909 1040097647 /nfs/dbraw/zinc/09/76/47/1040097647.db2.gz UFMRZZPYVZTSMN-AWEZNQCLSA-N 2 1 313.436 4.179 20 0 DIADMP C[C@@H]([NH2+]CC1(C)CCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309900150 1040099116 /nfs/dbraw/zinc/09/91/16/1040099116.db2.gz HYCIJTPLKZTPQK-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cc(C)cc(C[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000062426539 1040105011 /nfs/dbraw/zinc/10/50/11/1040105011.db2.gz PJDNJNQWNHOPAI-OAQYLSRUSA-N 2 1 322.496 4.305 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310282570 1040115312 /nfs/dbraw/zinc/11/53/12/1040115312.db2.gz WSDYJRDBZDZVBQ-XQBPLPMBSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000310380613 1040116791 /nfs/dbraw/zinc/11/67/91/1040116791.db2.gz BIQDBZNNMXOERK-ZWCUEREDSA-N 2 1 320.480 4.347 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000310380609 1040118554 /nfs/dbraw/zinc/11/85/54/1040118554.db2.gz BIQDBZNNMXOERK-JUXOCIIHSA-N 2 1 320.480 4.347 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000685657922 1040198652 /nfs/dbraw/zinc/19/86/52/1040198652.db2.gz QCAMGROJWNLADG-QRVBRYPASA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000685657922 1040198664 /nfs/dbraw/zinc/19/86/64/1040198664.db2.gz QCAMGROJWNLADG-QRVBRYPASA-N 2 1 317.521 4.126 20 0 DIADMP C[C@H]([NH2+]CCSC(C)(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309720047 1040212743 /nfs/dbraw/zinc/21/27/43/1040212743.db2.gz NKYJNXOYWLDBGN-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCC(F)CC1 ZINC000658293121 1040410091 /nfs/dbraw/zinc/41/00/91/1040410091.db2.gz JDGIYUXLAHFKQC-IPJUCJBFSA-N 2 1 318.480 4.157 20 0 DIADMP C[C@H]1CCCCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309583003 1040710840 /nfs/dbraw/zinc/71/08/40/1040710840.db2.gz PFEJAESHZDFKQC-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000280756445 1040719882 /nfs/dbraw/zinc/71/98/82/1040719882.db2.gz CEXRLOWLGZHXJC-BPQIPLTHSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000280756445 1040719901 /nfs/dbraw/zinc/71/99/01/1040719901.db2.gz CEXRLOWLGZHXJC-BPQIPLTHSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000309770706 1040727573 /nfs/dbraw/zinc/72/75/73/1040727573.db2.gz HLESTOZNMPBWKV-ZIFCJYIRSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309811297 1040732822 /nfs/dbraw/zinc/73/28/22/1040732822.db2.gz WMQPYNWRFWXRLX-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310103783 1040752953 /nfs/dbraw/zinc/75/29/53/1040752953.db2.gz ZBTVDWGIVWGXHG-FPOVZHCZSA-N 2 1 322.496 4.292 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346503 1040906062 /nfs/dbraw/zinc/90/60/62/1040906062.db2.gz GVCBGZBDOOJJHD-FXAWDEMLSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346503 1040906084 /nfs/dbraw/zinc/90/60/84/1040906084.db2.gz GVCBGZBDOOJJHD-FXAWDEMLSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346519 1040906339 /nfs/dbraw/zinc/90/63/39/1040906339.db2.gz GVCBGZBDOOJJHD-YLJYHZDGSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346519 1040906347 /nfs/dbraw/zinc/90/63/47/1040906347.db2.gz GVCBGZBDOOJJHD-YLJYHZDGSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccncc2)cc1 ZINC000414170059 1040949773 /nfs/dbraw/zinc/94/97/73/1040949773.db2.gz BNLBRTLLIFBZSE-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000414169215 1040951043 /nfs/dbraw/zinc/95/10/43/1040951043.db2.gz AUPYWOVZGIDTCP-HZPDHXFCSA-N 2 1 306.519 4.181 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cc2ccccc2s1 ZINC000414173116 1040956486 /nfs/dbraw/zinc/95/64/86/1040956486.db2.gz FLDKPWJEINBQAQ-LSDHHAIUSA-N 2 1 302.487 4.284 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000414179677 1040965374 /nfs/dbraw/zinc/96/53/74/1040965374.db2.gz LMTQDPXXWVFKCF-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccncc2)c1 ZINC000414183161 1040969713 /nfs/dbraw/zinc/96/97/13/1040969713.db2.gz NPOIBAQUFSCXDM-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP CC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000414196772 1040984914 /nfs/dbraw/zinc/98/49/14/1040984914.db2.gz WBUZHPUROOENIV-CHWSQXEVSA-N 2 1 300.899 4.174 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCO[C@H]2CCCC[C@H]2C)CC1 ZINC000613491442 1041001781 /nfs/dbraw/zinc/00/17/81/1041001781.db2.gz RTHBCEWYJMLLIK-QUCCMNQESA-N 2 1 324.553 4.026 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000809631331 1041207943 /nfs/dbraw/zinc/20/79/43/1041207943.db2.gz VCDXAZYEPYLQSX-KRWDZBQOSA-N 2 1 317.521 4.311 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C/C=C/c2ccc(F)cc2)cc1 ZINC000809738639 1041240750 /nfs/dbraw/zinc/24/07/50/1041240750.db2.gz CPGNJRKQIZJKHV-SNAWJCMRSA-N 2 1 312.432 4.033 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc[nH+]cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000301567220 1041246390 /nfs/dbraw/zinc/24/63/90/1041246390.db2.gz WQOTXYWSLCYTAK-HOCLYGCPSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc[nH+]cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301567220 1041246402 /nfs/dbraw/zinc/24/64/02/1041246402.db2.gz WQOTXYWSLCYTAK-HOCLYGCPSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@H](CCc1ccc(Cl)s1)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624121988 1041357729 /nfs/dbraw/zinc/35/77/29/1041357729.db2.gz HHRWXAAMCMBQCO-KGLIPLIRSA-N 2 1 314.926 4.044 20 0 DIADMP CC[C@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccncc1 ZINC000163714944 1041413849 /nfs/dbraw/zinc/41/38/49/1041413849.db2.gz LXKNWMBAQRCBSD-QRWLVFNGSA-N 2 1 320.440 4.378 20 0 DIADMP c1ccc2c(c1)CC[C@H]2CC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000659946060 1041554119 /nfs/dbraw/zinc/55/41/19/1041554119.db2.gz ZKJVALAHMIXLRF-VQTJNVASSA-N 2 1 312.501 4.057 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000659946062 1041554492 /nfs/dbraw/zinc/55/44/92/1041554492.db2.gz ZKJVALAHMIXLRF-WOJBJXKFSA-N 2 1 312.501 4.057 20 0 DIADMP C[C@H](CC1CCC1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309741375 1041591222 /nfs/dbraw/zinc/59/12/22/1041591222.db2.gz RXEKMIUCYAFOIO-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)o2)c1 ZINC000065976567 1041623143 /nfs/dbraw/zinc/62/31/43/1041623143.db2.gz VFIRHBDBYGMLSI-UHFFFAOYSA-N 2 1 306.837 4.063 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)o2)c1 ZINC000065976567 1041623145 /nfs/dbraw/zinc/62/31/45/1041623145.db2.gz VFIRHBDBYGMLSI-UHFFFAOYSA-N 2 1 306.837 4.063 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417313715 1041656291 /nfs/dbraw/zinc/65/62/91/1041656291.db2.gz WTDILZDMHKUBGO-XLAORIBOSA-N 2 1 320.546 4.198 20 0 DIADMP CC1(C)CC[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813878708 1041741642 /nfs/dbraw/zinc/74/16/42/1041741642.db2.gz FLVBNZXEDMAVSC-RAFMOHDBSA-N 2 1 312.501 4.350 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([N@@H+](CC3CCCC3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170736183 1041800186 /nfs/dbraw/zinc/80/01/86/1041800186.db2.gz HQFGBYZHOMAQJM-YCEIQTCASA-N 2 1 304.522 4.183 20 0 DIADMP C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(-c2ccccc2)cn1 ZINC000651822760 1041924483 /nfs/dbraw/zinc/92/44/83/1041924483.db2.gz JOWDYXSRDXVFEY-FAXKSRBJSA-N 2 1 321.468 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661435787 1041937263 /nfs/dbraw/zinc/93/72/63/1041937263.db2.gz HNEHITXNIRYBPN-SFHVURJKSA-N 2 1 313.445 4.182 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661435787 1041937272 /nfs/dbraw/zinc/93/72/72/1041937272.db2.gz HNEHITXNIRYBPN-SFHVURJKSA-N 2 1 313.445 4.182 20 0 DIADMP Cc1nccn1CCCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000511896140 1041995721 /nfs/dbraw/zinc/99/57/21/1041995721.db2.gz ZXAJMWKZRJYIJJ-NJYVYQBISA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000511896140 1041995727 /nfs/dbraw/zinc/99/57/27/1041995727.db2.gz ZXAJMWKZRJYIJJ-NJYVYQBISA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000511896140 1041995731 /nfs/dbraw/zinc/99/57/31/1041995731.db2.gz ZXAJMWKZRJYIJJ-NJYVYQBISA-N 2 1 323.484 4.240 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C2CC3(CCC3)C2)CC1 ZINC000652327910 1042008221 /nfs/dbraw/zinc/00/82/21/1042008221.db2.gz OANOTTHSBPXEIH-UHFFFAOYSA-N 2 1 312.501 4.352 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccnc1 ZINC000248518629 1042067208 /nfs/dbraw/zinc/06/72/08/1042067208.db2.gz QANDCBCIVXFVQQ-MJGOQNOKSA-N 2 1 303.494 4.025 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)C2)cc1 ZINC000663344063 1042126441 /nfs/dbraw/zinc/12/64/41/1042126441.db2.gz NHZAZFMBYZZHMX-TYPHKJRUSA-N 2 1 312.501 4.034 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1OC ZINC000817898607 1042128144 /nfs/dbraw/zinc/12/81/44/1042128144.db2.gz JWQZYBFQIZXSQX-HOJAQTOUSA-N 2 1 324.468 4.229 20 0 DIADMP CCC(CC)(C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1 ZINC000663353854 1042130545 /nfs/dbraw/zinc/13/05/45/1042130545.db2.gz DMWSYDMQDLIOJJ-RTBURBONSA-N 2 1 318.480 4.100 20 0 DIADMP CCC(CC)(C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1 ZINC000663353853 1042130789 /nfs/dbraw/zinc/13/07/89/1042130789.db2.gz DMWSYDMQDLIOJJ-RBUKOAKNSA-N 2 1 318.480 4.100 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cccc(Cl)c2C1 ZINC001170910517 1042155298 /nfs/dbraw/zinc/15/52/98/1042155298.db2.gz JQYJTASFGQBZQE-BRWVUGGUSA-N 2 1 320.908 4.178 20 0 DIADMP CCCCC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000314782820 1042169450 /nfs/dbraw/zinc/16/94/50/1042169450.db2.gz YIHIGGUXCYNDIF-YLJYHZDGSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466608 1042178921 /nfs/dbraw/zinc/17/89/21/1042178921.db2.gz VZFMKESVEGOGCE-GXTWGEPZSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466608 1042178927 /nfs/dbraw/zinc/17/89/27/1042178927.db2.gz VZFMKESVEGOGCE-GXTWGEPZSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466608 1042178932 /nfs/dbraw/zinc/17/89/32/1042178932.db2.gz VZFMKESVEGOGCE-GXTWGEPZSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466611 1042179231 /nfs/dbraw/zinc/17/92/31/1042179231.db2.gz VZFMKESVEGOGCE-TZMCWYRMSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466611 1042179233 /nfs/dbraw/zinc/17/92/33/1042179233.db2.gz VZFMKESVEGOGCE-TZMCWYRMSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466611 1042179237 /nfs/dbraw/zinc/17/92/37/1042179237.db2.gz VZFMKESVEGOGCE-TZMCWYRMSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2c(s1)CCC2 ZINC000663467934 1042179467 /nfs/dbraw/zinc/17/94/67/1042179467.db2.gz IOYAUAUUHHWZOC-ZBFHGGJFSA-N 2 1 318.530 4.009 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c(C)s1 ZINC000663472136 1042184161 /nfs/dbraw/zinc/18/41/61/1042184161.db2.gz YYRRWJBUTMIERC-RHSMWYFYSA-N 2 1 306.519 4.138 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001167824171 1042210290 /nfs/dbraw/zinc/21/02/90/1042210290.db2.gz CBUGBGQWNVNUFV-IEBWSBKVSA-N 2 1 320.546 4.287 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC001167825816 1042214835 /nfs/dbraw/zinc/21/48/35/1042214835.db2.gz KUWLLUMRIJJBAP-SJORKVTESA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001167825932 1042215970 /nfs/dbraw/zinc/21/59/70/1042215970.db2.gz LTDQSRBLXGWODO-QUCCMNQESA-N 2 1 302.506 4.062 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC001167826561 1042216718 /nfs/dbraw/zinc/21/67/18/1042216718.db2.gz QDZFOIKYUAYQMP-INIZCTEOSA-N 2 1 310.913 4.325 20 0 DIADMP Cc1ccccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)C1CC1 ZINC000820810549 1042229076 /nfs/dbraw/zinc/22/90/76/1042229076.db2.gz ZAEIVOWZJJDJEM-VZKPYBMVSA-N 2 1 310.485 4.194 20 0 DIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546675 1042229831 /nfs/dbraw/zinc/22/98/31/1042229831.db2.gz SPUKOXIQOZJNDM-UKRRQHHQSA-N 2 1 322.880 4.064 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC000316616739 1042244237 /nfs/dbraw/zinc/24/42/37/1042244237.db2.gz KTYCIXRFAZHHMT-KKXNLOMOSA-N 2 1 300.490 4.033 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC000432789401 1042245468 /nfs/dbraw/zinc/24/54/68/1042245468.db2.gz RTRXHPJJFYUHBX-OAQYLSRUSA-N 2 1 308.469 4.270 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001167836258 1042248641 /nfs/dbraw/zinc/24/86/41/1042248641.db2.gz YMJCAPOKMQFQTQ-FXAWDEMLSA-N 2 1 320.496 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)CCCc1cccc(OC)c1 ZINC001167836636 1042248697 /nfs/dbraw/zinc/24/86/97/1042248697.db2.gz GGAJCIMINSTOOY-GOSISDBHSA-N 2 1 320.521 4.070 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@H](C)Cc1ccccc1OC ZINC001167840367 1042252939 /nfs/dbraw/zinc/25/29/39/1042252939.db2.gz FQPXWJWUBNFJOZ-QZTJIDSGSA-N 2 1 320.521 4.069 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001167840689 1042254276 /nfs/dbraw/zinc/25/42/76/1042254276.db2.gz HMGVCDHWHRIBTJ-VQIMIIECSA-N 2 1 306.469 4.473 20 0 DIADMP CCCCC[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000236859532 1042348734 /nfs/dbraw/zinc/34/87/34/1042348734.db2.gz LQYPQMYITZWNEK-SFHVURJKSA-N 2 1 302.506 4.252 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000391414388 1042354751 /nfs/dbraw/zinc/35/47/51/1042354751.db2.gz XBXHXQSVFZYOMV-HZPDHXFCSA-N 2 1 314.473 4.348 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000391414388 1042354758 /nfs/dbraw/zinc/35/47/58/1042354758.db2.gz XBXHXQSVFZYOMV-HZPDHXFCSA-N 2 1 314.473 4.348 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H]2C[C@H](c3ccccc3)C[C@H](C)C2)C1 ZINC000391478028 1042373705 /nfs/dbraw/zinc/37/37/05/1042373705.db2.gz XKHNXXJHLYUFCI-MMKMLUHNSA-N 2 1 314.517 4.279 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000513488489 1042546924 /nfs/dbraw/zinc/54/69/24/1042546924.db2.gz VYNDFPIOXLDCIJ-FYXHJSOBSA-N 2 1 320.908 4.453 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000513493473 1042547341 /nfs/dbraw/zinc/54/73/41/1042547341.db2.gz BAORHFPSKALTLP-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)CC3CC[NH+](C)CC3)o2)cc1 ZINC000513736749 1042622754 /nfs/dbraw/zinc/62/27/54/1042622754.db2.gz KUZIHCYVYLPZHS-UHFFFAOYSA-N 2 1 312.457 4.029 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]CC(C)(C)C ZINC000237177626 1042627920 /nfs/dbraw/zinc/62/79/20/1042627920.db2.gz RSZIIIYYVIGLJH-UHFFFAOYSA-N 2 1 300.446 4.047 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cc(C)nc(C)c2)cc1 ZINC000421377156 1042634123 /nfs/dbraw/zinc/63/41/23/1042634123.db2.gz FVBBVTUOZKGSBI-INIZCTEOSA-N 2 1 320.440 4.043 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000421834369 1042655109 /nfs/dbraw/zinc/65/51/09/1042655109.db2.gz CDTWWUMCIWDNKX-ILXRZTDVSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000421834369 1042655111 /nfs/dbraw/zinc/65/51/11/1042655111.db2.gz CDTWWUMCIWDNKX-ILXRZTDVSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000421834373 1042655250 /nfs/dbraw/zinc/65/52/50/1042655250.db2.gz CDTWWUMCIWDNKX-QLFBSQMISA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000421834373 1042655253 /nfs/dbraw/zinc/65/52/53/1042655253.db2.gz CDTWWUMCIWDNKX-QLFBSQMISA-N 2 1 321.896 4.039 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3C[C@@H]4CC[C@@H](C4)C3)C2)cc1 ZINC000711147228 1042687196 /nfs/dbraw/zinc/68/71/96/1042687196.db2.gz RMMYOZLSDDSAAD-PLACYPQZSA-N 2 1 312.501 4.067 20 0 DIADMP COc1ccc([C@H]([NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C(C)C)cc1 ZINC000422791790 1042690958 /nfs/dbraw/zinc/69/09/58/1042690958.db2.gz VFDHUTNVBCVIKU-HSALFYBXSA-N 2 1 310.441 4.127 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)c1c[nH+]ccc1N)c1c(Cl)cccc1Cl ZINC000422885979 1042692676 /nfs/dbraw/zinc/69/26/76/1042692676.db2.gz ZTUURHIDCGXSQN-MNOVXSKESA-N 2 1 324.255 4.255 20 0 DIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](c1cc2ccccc2o1)c1ccccc1 ZINC000422930436 1042693141 /nfs/dbraw/zinc/69/31/41/1042693141.db2.gz UKFUPWPZQPZJDH-AUSJPIAWSA-N 2 1 308.425 4.238 20 0 DIADMP C[C@@H](Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1c[nH+]ccc1N ZINC000422921345 1042693828 /nfs/dbraw/zinc/69/38/28/1042693828.db2.gz NXKOSMIMALOXBH-JKSUJKDBSA-N 2 1 324.472 4.042 20 0 DIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423053924 1042697152 /nfs/dbraw/zinc/69/71/52/1042697152.db2.gz BGZJOKQDRLMADD-DLBZAZTESA-N 2 1 320.358 4.248 20 0 DIADMP CC(F)(F)c1ccc(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000423134488 1042698793 /nfs/dbraw/zinc/69/87/93/1042698793.db2.gz MEKGEGFDTYJKHD-IRXDYDNUSA-N 2 1 302.368 4.033 20 0 DIADMP C[C@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(-c2ccncc2)cc1 ZINC000423183908 1042698878 /nfs/dbraw/zinc/69/88/78/1042698878.db2.gz SISUCMFNZBRCCH-INIZCTEOSA-N 2 1 309.457 4.061 20 0 DIADMP Clc1ccc([C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423212695 1042699579 /nfs/dbraw/zinc/69/95/79/1042699579.db2.gz MAUXMFMXPVSZCF-BEFAXECRSA-N 2 1 314.860 4.019 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423202676 1042700355 /nfs/dbraw/zinc/70/03/55/1042700355.db2.gz BMILVQLECJMCOG-GXSJLCMTSA-N 2 1 319.301 4.022 20 0 DIADMP C[C@H]([NH2+]CC[NH3+])c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000423196377 1042700731 /nfs/dbraw/zinc/70/07/31/1042700731.db2.gz ZTPFHERTMOOZNG-JTQLQIEISA-N 2 1 314.376 4.043 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+][C@H](C[NH3+])CC(C)C)cs2)cs1 ZINC000423261491 1042702940 /nfs/dbraw/zinc/70/29/40/1042702940.db2.gz JWJDZFLNXYWVGH-FZMZJTMJSA-N 2 1 323.531 4.204 20 0 DIADMP CC(C)([NH3+])C[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423288568 1042704021 /nfs/dbraw/zinc/70/40/21/1042704021.db2.gz SXEKPWXYFRNRNU-OAHLLOKOSA-N 2 1 308.878 4.012 20 0 DIADMP CCCC[C@@H](C[NH3+])[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423298093 1042706072 /nfs/dbraw/zinc/70/60/72/1042706072.db2.gz NCZOHVGFXJAWGZ-MROQNXINSA-N 2 1 300.899 4.001 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cc2c(ccc3ccccc23)o1 ZINC000423376796 1042710301 /nfs/dbraw/zinc/71/03/01/1042710301.db2.gz LFDOZMDDRSCWBE-YCPHGPKFSA-N 2 1 308.425 4.377 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]1 ZINC000423393041 1042710381 /nfs/dbraw/zinc/71/03/81/1042710381.db2.gz YBNJRZGYBVZRHQ-MDASCCDHSA-N 2 1 314.860 4.160 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000423401239 1042710731 /nfs/dbraw/zinc/71/07/31/1042710731.db2.gz XBMRJBCZAFHFCG-ILXRZTDVSA-N 2 1 300.446 4.095 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](C(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000514083314 1042770405 /nfs/dbraw/zinc/77/04/05/1042770405.db2.gz MJPPXWVSVSCFMG-RTWAWAEBSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](C(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000514083314 1042770409 /nfs/dbraw/zinc/77/04/09/1042770409.db2.gz MJPPXWVSVSCFMG-RTWAWAEBSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](C(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000514083314 1042770413 /nfs/dbraw/zinc/77/04/13/1042770413.db2.gz MJPPXWVSVSCFMG-RTWAWAEBSA-N 2 1 320.480 4.192 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167958953 1042799950 /nfs/dbraw/zinc/79/99/50/1042799950.db2.gz KSQRRERPEMYUEM-BRIRTLKKSA-N 2 1 312.501 4.003 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CC[C@]2(C1)CCC[NH+](CCOCC)C2 ZINC001280151318 1042828523 /nfs/dbraw/zinc/82/85/23/1042828523.db2.gz HVZABZYEPVLKMS-WOJBJXKFSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC[C@]2(C1)CCC[N@H+](CCOCC)C2 ZINC001280151318 1042828524 /nfs/dbraw/zinc/82/85/24/1042828524.db2.gz HVZABZYEPVLKMS-WOJBJXKFSA-N 2 1 324.553 4.027 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144205 1042869100 /nfs/dbraw/zinc/86/91/00/1042869100.db2.gz JUIBCVXRBVIIQG-IEBWSBKVSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144205 1042869106 /nfs/dbraw/zinc/86/91/06/1042869106.db2.gz JUIBCVXRBVIIQG-IEBWSBKVSA-N 2 1 300.490 4.208 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCCC2CC2)CC1 ZINC000517187897 1042871541 /nfs/dbraw/zinc/87/15/41/1042871541.db2.gz ZNHFWQLYRKZGIT-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3ccccc3c2)C1 ZINC000517536443 1042885722 /nfs/dbraw/zinc/88/57/22/1042885722.db2.gz IZOGIHDGRYGNJI-SFHVURJKSA-N 2 1 310.485 4.442 20 0 DIADMP CCCCC/C(=C\c1ccccc1)C[N@@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000425997617 1042896822 /nfs/dbraw/zinc/89/68/22/1042896822.db2.gz YCHUSVYPSRMASQ-WKTZDBDBSA-N 2 1 312.501 4.144 20 0 DIADMP CCCCC/C(=C\c1ccccc1)C[NH+]1C[C@H]2C[N@@H+](C)C[C@H]2C1 ZINC000425997617 1042896827 /nfs/dbraw/zinc/89/68/27/1042896827.db2.gz YCHUSVYPSRMASQ-WKTZDBDBSA-N 2 1 312.501 4.144 20 0 DIADMP C(CC1CCCCCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167965918 1042936214 /nfs/dbraw/zinc/93/62/14/1042936214.db2.gz QHBVNEMPRFUZMZ-IHWFROFDSA-N 2 1 304.522 4.342 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccc1C ZINC001167970558 1042962006 /nfs/dbraw/zinc/96/20/06/1042962006.db2.gz MTXLTPFGWBEBDR-SMLSOGCJSA-N 2 1 312.501 4.441 20 0 DIADMP Cc1cc(C)cc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167970571 1042962039 /nfs/dbraw/zinc/96/20/39/1042962039.db2.gz NAOLDKGURLHIKK-ZNDGOPKYSA-N 2 1 312.501 4.359 20 0 DIADMP Cc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCC2)c1 ZINC001167978277 1042973487 /nfs/dbraw/zinc/97/34/87/1042973487.db2.gz NUGZTUBICSJQAQ-SEJPIABJSA-N 2 1 324.512 4.369 20 0 DIADMP C[C@H]1[C@H]2C[C@@H](C[C@H]1[NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3CC1CC1)C2(C)C ZINC001167979147 1042973518 /nfs/dbraw/zinc/97/35/18/1042973518.db2.gz WTIKKSOMQLVQAZ-LQAOYFIPSA-N 2 1 316.533 4.052 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3)s2)[C@H](C)C1 ZINC000608067433 1042976300 /nfs/dbraw/zinc/97/63/00/1042976300.db2.gz CGFGVBBTZDDDTN-CRAIPNDOSA-N 2 1 314.498 4.235 20 0 DIADMP C[C@H]1C[N@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)Cc2ccccc21 ZINC001167985091 1042983247 /nfs/dbraw/zinc/98/32/47/1042983247.db2.gz VFIAKNYFYHNIRZ-LATSOQNDSA-N 2 1 310.485 4.011 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCCC3(CCCC3)C1)C2 ZINC001167985059 1042983338 /nfs/dbraw/zinc/98/33/38/1042983338.db2.gz UCVMJPIPVDYSTF-DFNIBXOVSA-N 2 1 302.506 4.048 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)c(F)c1 ZINC000467839913 1042995726 /nfs/dbraw/zinc/99/57/26/1042995726.db2.gz FMBSBAWHMGHDPI-HUUCEWRRSA-N 2 1 310.432 4.270 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000188068991 1043011261 /nfs/dbraw/zinc/01/12/61/1043011261.db2.gz WRKOASFQBXPENY-PMACEKPBSA-N 2 1 311.473 4.072 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441393805 1043043282 /nfs/dbraw/zinc/04/32/82/1043043282.db2.gz IAZCJCNFQGTFDD-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441393805 1043043287 /nfs/dbraw/zinc/04/32/87/1043043287.db2.gz IAZCJCNFQGTFDD-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441393805 1043043292 /nfs/dbraw/zinc/04/32/92/1043043292.db2.gz IAZCJCNFQGTFDD-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441393805 1043043297 /nfs/dbraw/zinc/04/32/97/1043043297.db2.gz IAZCJCNFQGTFDD-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1F ZINC000178699469 1043136181 /nfs/dbraw/zinc/13/61/81/1043136181.db2.gz FKTSOLCNEWGKQV-QWHCGFSZSA-N 2 1 321.465 4.039 20 0 DIADMP Clc1ccc(CCC[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000441463912 1043143881 /nfs/dbraw/zinc/14/38/81/1043143881.db2.gz MAGKZSWDIFDJAQ-GOSISDBHSA-N 2 1 320.908 4.080 20 0 DIADMP c1ccc(C2CCC(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000166545571 1043154099 /nfs/dbraw/zinc/15/40/99/1043154099.db2.gz DESSBGODUADGLT-NLDTVIPQSA-N 2 1 312.501 4.177 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@@H+]1C ZINC000246931389 1043160052 /nfs/dbraw/zinc/16/00/52/1043160052.db2.gz GNCQHCNZGCEFET-HACGYAERSA-N 2 1 310.432 4.124 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@H+]1C ZINC000246931389 1043160056 /nfs/dbraw/zinc/16/00/56/1043160056.db2.gz GNCQHCNZGCEFET-HACGYAERSA-N 2 1 310.432 4.124 20 0 DIADMP Cc1cncc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000184277881 1043180753 /nfs/dbraw/zinc/18/07/53/1043180753.db2.gz VQBCCEIYSFSWIC-KRWDZBQOSA-N 2 1 311.473 4.081 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccnc1 ZINC000184833756 1043190960 /nfs/dbraw/zinc/19/09/60/1043190960.db2.gz KOFRRUVQSPOPOQ-OAQYLSRUSA-N 2 1 323.484 4.177 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cs1 ZINC000186226126 1043219094 /nfs/dbraw/zinc/21/90/94/1043219094.db2.gz WUGZHLBHYCXJMJ-CQSZACIVSA-N 2 1 317.502 4.179 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCS2 ZINC000186957831 1043237092 /nfs/dbraw/zinc/23/70/92/1043237092.db2.gz DOJOXTPWDHWPTB-GOSISDBHSA-N 2 1 316.514 4.057 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)CC1 ZINC000427607164 1043238246 /nfs/dbraw/zinc/23/82/46/1043238246.db2.gz RWBWZRULVCBDDG-QFIPXVFZSA-N 2 1 320.480 4.415 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccsc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168005109 1043243718 /nfs/dbraw/zinc/24/37/18/1043243718.db2.gz FZIJRRMCJBBSDD-HGKCTWBKSA-N 2 1 314.498 4.279 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccsc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005109 1043243726 /nfs/dbraw/zinc/24/37/26/1043243726.db2.gz FZIJRRMCJBBSDD-HGKCTWBKSA-N 2 1 314.498 4.279 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@@H](F)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008196 1043269275 /nfs/dbraw/zinc/26/92/75/1043269275.db2.gz WNAQCKQQRQKKOJ-IRCVMFFPSA-N 2 1 318.480 4.298 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)ccc1-c1ccccc1 ZINC000427862913 1043312266 /nfs/dbraw/zinc/31/22/66/1043312266.db2.gz IPDMOXWCQYXBHN-LAUBAEHRSA-N 2 1 308.469 4.092 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792271 1043331809 /nfs/dbraw/zinc/33/18/09/1043331809.db2.gz VFPHZRYORADPQH-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792271 1043331826 /nfs/dbraw/zinc/33/18/26/1043331826.db2.gz VFPHZRYORADPQH-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)COC3)c1 ZINC000268862708 1043338870 /nfs/dbraw/zinc/33/88/70/1043338870.db2.gz JZWNPQSIUNBFEY-MRXNPFEDSA-N 2 1 324.468 4.019 20 0 DIADMP COc1ccc2cc([C@@H](C)[NH2+]CCCn3cc[nH+]c3C)ccc2c1 ZINC000268883189 1043341479 /nfs/dbraw/zinc/34/14/79/1043341479.db2.gz SBDRWUUPJQZOLL-OAHLLOKOSA-N 2 1 323.440 4.094 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccncc1 ZINC000268937007 1043344620 /nfs/dbraw/zinc/34/46/20/1043344620.db2.gz YYDPBEATZDFNQU-YYWHXJBOSA-N 2 1 323.484 4.175 20 0 DIADMP c1ccc([C@H]2CC[C@H]2[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000665274446 1043359289 /nfs/dbraw/zinc/35/92/89/1043359289.db2.gz QINIKEMZXAPTOE-DOIPELPJSA-N 2 1 306.453 4.016 20 0 DIADMP Cc1nc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cs1 ZINC000269422219 1043365310 /nfs/dbraw/zinc/36/53/10/1043365310.db2.gz MGSXIQAAIBQQQK-AWEZNQCLSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cs1 ZINC000269422219 1043365320 /nfs/dbraw/zinc/36/53/20/1043365320.db2.gz MGSXIQAAIBQQQK-AWEZNQCLSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)cs1 ZINC000269422221 1043365607 /nfs/dbraw/zinc/36/56/07/1043365607.db2.gz MGSXIQAAIBQQQK-CQSZACIVSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cs1 ZINC000269422221 1043365611 /nfs/dbraw/zinc/36/56/11/1043365611.db2.gz MGSXIQAAIBQQQK-CQSZACIVSA-N 2 1 317.502 4.143 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C1CCC(C(F)F)CC1 ZINC000442721721 1043412942 /nfs/dbraw/zinc/41/29/42/1043412942.db2.gz UFEOYJGKFXBGBQ-UHFFFAOYSA-N 2 1 324.459 4.440 20 0 DIADMP CC1(C)C[C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2S1 ZINC000872020816 1043422245 /nfs/dbraw/zinc/42/22/45/1043422245.db2.gz KPRZNZDKZHAILE-YOEHRIQHSA-N 2 1 316.514 4.076 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccc(CF)cc3)C2)CC1 ZINC000777567358 1043435655 /nfs/dbraw/zinc/43/56/55/1043435655.db2.gz SYNLRUNIDSDCBN-FQEVSTJZSA-N 2 1 318.480 4.100 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccc(CF)cc3)C2)CC1 ZINC000777567358 1043435663 /nfs/dbraw/zinc/43/56/63/1043435663.db2.gz SYNLRUNIDSDCBN-FQEVSTJZSA-N 2 1 318.480 4.100 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000442859422 1043436976 /nfs/dbraw/zinc/43/69/76/1043436976.db2.gz VJERRVKSVUACHO-RISCZKNCSA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000442859422 1043436985 /nfs/dbraw/zinc/43/69/85/1043436985.db2.gz VJERRVKSVUACHO-RISCZKNCSA-N 2 1 322.905 4.435 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000442867283 1043438453 /nfs/dbraw/zinc/43/84/53/1043438453.db2.gz YHBIKFCKHUPVLJ-HNNXBMFYSA-N 2 1 306.519 4.181 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C ZINC000442853840 1043443628 /nfs/dbraw/zinc/44/36/28/1043443628.db2.gz JXXKCWLRCUVMDF-XHDPSFHLSA-N 2 1 322.905 4.293 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000442875683 1043443893 /nfs/dbraw/zinc/44/38/93/1043443893.db2.gz UFQVZINBJAMIAS-SJORKVTESA-N 2 1 320.546 4.427 20 0 DIADMP CCC1([NH3+])CC[NH+]([C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000925755022 1043465027 /nfs/dbraw/zinc/46/50/27/1043465027.db2.gz BBJCEJHWEOPMJE-AWEZNQCLSA-N 2 1 310.894 4.080 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CC[C@@H]2C2CC2)C[N@H+]1Cc1ccccc1 ZINC000558252602 1043474502 /nfs/dbraw/zinc/47/45/02/1043474502.db2.gz QCWGTAUAMOPBII-PLWAMTLXSA-N 2 1 312.501 4.065 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC000925832435 1043480710 /nfs/dbraw/zinc/48/07/10/1043480710.db2.gz VTPLYGSFDMEIKO-FFZOFVMBSA-N 2 1 324.468 4.148 20 0 DIADMP CCCOc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000521818208 1043485031 /nfs/dbraw/zinc/48/50/31/1043485031.db2.gz BGZURDFTWMAOKD-GOSISDBHSA-N 2 1 318.505 4.220 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccsc1 ZINC000443097875 1043492328 /nfs/dbraw/zinc/49/23/28/1043492328.db2.gz ZWZIVPKVLLHKTE-JZXOWHBKSA-N 2 1 324.534 4.068 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc2ccccc2o1 ZINC000349154366 1043492812 /nfs/dbraw/zinc/49/28/12/1043492812.db2.gz UDGBJJZKSAKBHL-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc2ccccc2o1 ZINC000349154366 1043492825 /nfs/dbraw/zinc/49/28/25/1043492825.db2.gz UDGBJJZKSAKBHL-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2scnc2C)CC1)CC(C)C ZINC000558422341 1043505271 /nfs/dbraw/zinc/50/52/71/1043505271.db2.gz BDCSZAUSVWIIAB-UHFFFAOYSA-N 2 1 323.550 4.032 20 0 DIADMP CSc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000558486166 1043520292 /nfs/dbraw/zinc/52/02/92/1043520292.db2.gz RVNKSZNZXMSBJC-UONOGXRCSA-N 2 1 324.559 4.213 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000645457573 1043560915 /nfs/dbraw/zinc/56/09/15/1043560915.db2.gz QPPMUJLHEGMSGW-YSFYHYPLSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000645457573 1043560919 /nfs/dbraw/zinc/56/09/19/1043560919.db2.gz QPPMUJLHEGMSGW-YSFYHYPLSA-N 2 1 320.480 4.358 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000474061176 1043561463 /nfs/dbraw/zinc/56/14/63/1043561463.db2.gz WAUVOELZJNJHEQ-MISYRCLQSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000474061176 1043561478 /nfs/dbraw/zinc/56/14/78/1043561478.db2.gz WAUVOELZJNJHEQ-MISYRCLQSA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)C2CCC(F)(F)CC2)C1 ZINC000474066009 1043566880 /nfs/dbraw/zinc/56/68/80/1043566880.db2.gz NOKCZPUGFYOLCS-HZPDHXFCSA-N 2 1 316.480 4.158 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069266 1043568185 /nfs/dbraw/zinc/56/81/85/1043568185.db2.gz URDLHIYQAKDADX-RHSMWYFYSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069266 1043568195 /nfs/dbraw/zinc/56/81/95/1043568195.db2.gz URDLHIYQAKDADX-RHSMWYFYSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(C)(C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168021548 1043590977 /nfs/dbraw/zinc/59/09/77/1043590977.db2.gz QEXLLUMJSOCVDY-ALXJQNPVSA-N 2 1 300.490 4.206 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCC23CCCC3)cc1F ZINC000353272626 1043595023 /nfs/dbraw/zinc/59/50/23/1043595023.db2.gz OGGJAXDHHOYFRK-SFHVURJKSA-N 2 1 313.420 4.132 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1csc(C(F)(F)F)c1 ZINC000926560624 1043598397 /nfs/dbraw/zinc/59/83/97/1043598397.db2.gz UAJFFXVNHDIOON-LLVKDONJSA-N 2 1 320.424 4.292 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926574758 1043600441 /nfs/dbraw/zinc/60/04/41/1043600441.db2.gz YFLBRURADFTTGO-NEPJUHHUSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754860 1043626135 /nfs/dbraw/zinc/62/61/35/1043626135.db2.gz SQNRTRWUZGQADN-NEPJUHHUSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754860 1043626139 /nfs/dbraw/zinc/62/61/39/1043626139.db2.gz SQNRTRWUZGQADN-NEPJUHHUSA-N 2 1 320.424 4.149 20 0 DIADMP Cc1ccoc1C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000353641537 1043627718 /nfs/dbraw/zinc/62/77/18/1043627718.db2.gz FRSWFXOCCQHMAH-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000926811238 1043636853 /nfs/dbraw/zinc/63/68/53/1043636853.db2.gz YOKNONYYZGRTNW-IFXJQAMLSA-N 2 1 318.411 4.249 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCS[C@@H](C)C2)cc1 ZINC000927032944 1043670293 /nfs/dbraw/zinc/67/02/93/1043670293.db2.gz QVVVGRBXTDRFPO-ZQIUZPCESA-N 2 1 315.486 4.115 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000354825457 1043720887 /nfs/dbraw/zinc/72/08/87/1043720887.db2.gz CGCFQNWCZDAYDI-GJZGRUSLSA-N 2 1 315.436 4.119 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000354825457 1043720893 /nfs/dbraw/zinc/72/08/93/1043720893.db2.gz CGCFQNWCZDAYDI-GJZGRUSLSA-N 2 1 315.436 4.119 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC000354825459 1043721227 /nfs/dbraw/zinc/72/12/27/1043721227.db2.gz CGCFQNWCZDAYDI-LSDHHAIUSA-N 2 1 315.436 4.119 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC000354825459 1043721245 /nfs/dbraw/zinc/72/12/45/1043721245.db2.gz CGCFQNWCZDAYDI-LSDHHAIUSA-N 2 1 315.436 4.119 20 0 DIADMP CSCC[C@H](C)[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877056556 1043740072 /nfs/dbraw/zinc/74/00/72/1043740072.db2.gz VITGLXOHELSARE-WDYCEAGBSA-N 2 1 318.530 4.086 20 0 DIADMP CSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877056556 1043740084 /nfs/dbraw/zinc/74/00/84/1043740084.db2.gz VITGLXOHELSARE-WDYCEAGBSA-N 2 1 318.530 4.086 20 0 DIADMP CC[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C1CC1 ZINC000777696638 1043763478 /nfs/dbraw/zinc/76/34/78/1043763478.db2.gz SKUBSZKTLNXWES-HXUWFJFHSA-N 2 1 315.505 4.065 20 0 DIADMP CC[NH+](CC)CCC[NH2+]Cc1ccc(SC(F)(F)F)cc1 ZINC000022147900 1043768263 /nfs/dbraw/zinc/76/82/63/1043768263.db2.gz LISSJKIDTMRNSR-UHFFFAOYSA-N 2 1 320.424 4.120 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000355594297 1043778984 /nfs/dbraw/zinc/77/89/84/1043778984.db2.gz DSWCVGQODCHSAB-CQSZACIVSA-N 2 1 303.837 4.005 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1cccc(O)c1 ZINC000126619342 1043782239 /nfs/dbraw/zinc/78/22/39/1043782239.db2.gz IPQXNIIWRJRBTE-INIZCTEOSA-N 2 1 316.489 4.088 20 0 DIADMP CC(C)C[C@H](C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000474476233 1043795393 /nfs/dbraw/zinc/79/53/93/1043795393.db2.gz OSCJKLHRUHPKMP-VAMGGRTRSA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)C[C@@H](C[NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000474482293 1043796706 /nfs/dbraw/zinc/79/67/06/1043796706.db2.gz KHFUBGCSWTXFBZ-SFHVURJKSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474480131 1043796746 /nfs/dbraw/zinc/79/67/46/1043796746.db2.gz YXPZHGMCYSRGRO-SBJFKYEJSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474483399 1043798958 /nfs/dbraw/zinc/79/89/58/1043798958.db2.gz WFPXSQMHVUUUTP-ZIAGYGMSSA-N 2 1 306.881 4.048 20 0 DIADMP CC1([NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834845 1043805784 /nfs/dbraw/zinc/80/57/84/1043805784.db2.gz XUYRMSRXJIHDQB-RDJZCZTQSA-N 2 1 320.427 4.132 20 0 DIADMP CC1([NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834845 1043805806 /nfs/dbraw/zinc/80/58/06/1043805806.db2.gz XUYRMSRXJIHDQB-RDJZCZTQSA-N 2 1 320.427 4.132 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cscc2C(F)(F)F)C[C@@H]1C ZINC000356132458 1043815840 /nfs/dbraw/zinc/81/58/40/1043815840.db2.gz HVAUOIXPZFPYHC-AAEUAGOBSA-N 2 1 320.424 4.072 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2nccc3ccccc32)C1 ZINC000289704547 1043867299 /nfs/dbraw/zinc/86/72/99/1043867299.db2.gz KNZYLGBXLZJQJN-DLBZAZTESA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2nccc3ccccc32)C1 ZINC000289704547 1043867323 /nfs/dbraw/zinc/86/73/23/1043867323.db2.gz KNZYLGBXLZJQJN-DLBZAZTESA-N 2 1 311.473 4.006 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCCC2(F)F)C[C@H]1c1ccccc1 ZINC000453244856 1043867328 /nfs/dbraw/zinc/86/73/28/1043867328.db2.gz HPXQSPMTKSTPLS-BZSNNMDCSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCCC2(F)F)C[C@H]1c1ccccc1 ZINC000453244856 1043867349 /nfs/dbraw/zinc/86/73/49/1043867349.db2.gz HPXQSPMTKSTPLS-BZSNNMDCSA-N 2 1 322.443 4.237 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCC[C@@H](C(C)C)C3)CC2)[nH+]c1 ZINC000474796235 1043920302 /nfs/dbraw/zinc/92/03/02/1043920302.db2.gz LPWXTINCBYINCZ-MJGOQNOKSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@@H]1CC([N@@H+]2CC[C@@](C)(CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168042068 1043930662 /nfs/dbraw/zinc/93/06/62/1043930662.db2.gz YODDVXFMAJXEPC-HLIPFELVSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC([N@H+]2CC[C@@](C)(CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168042068 1043930668 /nfs/dbraw/zinc/93/06/68/1043930668.db2.gz YODDVXFMAJXEPC-HLIPFELVSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1F ZINC001168041993 1043931936 /nfs/dbraw/zinc/93/19/36/1043931936.db2.gz XKSXTGYXGPZNJF-HPUSYDDDSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1F ZINC001168041993 1043931944 /nfs/dbraw/zinc/93/19/44/1043931944.db2.gz XKSXTGYXGPZNJF-HPUSYDDDSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1F ZINC001168041993 1043931952 /nfs/dbraw/zinc/93/19/52/1043931952.db2.gz XKSXTGYXGPZNJF-HPUSYDDDSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1F ZINC001168041993 1043931956 /nfs/dbraw/zinc/93/19/56/1043931956.db2.gz XKSXTGYXGPZNJF-HPUSYDDDSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@H](C)C2)C[C@H](C)N1Cc1ccccc1 ZINC001168042313 1043934042 /nfs/dbraw/zinc/93/40/42/1043934042.db2.gz YUGUGIFCMTYARF-GNBUJSLZSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168042313 1043934052 /nfs/dbraw/zinc/93/40/52/1043934052.db2.gz YUGUGIFCMTYARF-GNBUJSLZSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@H](C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168042313 1043934060 /nfs/dbraw/zinc/93/40/60/1043934060.db2.gz YUGUGIFCMTYARF-GNBUJSLZSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168042313 1043934069 /nfs/dbraw/zinc/93/40/69/1043934069.db2.gz YUGUGIFCMTYARF-GNBUJSLZSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168042313 1043934075 /nfs/dbraw/zinc/93/40/75/1043934075.db2.gz YUGUGIFCMTYARF-GNBUJSLZSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C[NH+]2CCCC2)c2ccsc2S1 ZINC000357845912 1043992659 /nfs/dbraw/zinc/99/26/59/1043992659.db2.gz HMMIZQKSIHIXPC-HIFRSBDPSA-N 2 1 324.559 4.385 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CCSc2ccc(F)cc21)C[NH+]1CCCC1 ZINC000357848460 1043993067 /nfs/dbraw/zinc/99/30/67/1043993067.db2.gz KEZOEPXDXOCWEU-MRXNPFEDSA-N 2 1 322.493 4.074 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000358061576 1044015689 /nfs/dbraw/zinc/01/56/89/1044015689.db2.gz METKUUNPAVUTND-KRWDZBQOSA-N 2 1 322.880 4.016 20 0 DIADMP C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984394 1044042633 /nfs/dbraw/zinc/04/26/33/1044042633.db2.gz YNAAQUBTLZGSML-DYESRHJHSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984394 1044042647 /nfs/dbraw/zinc/04/26/47/1044042647.db2.gz YNAAQUBTLZGSML-DYESRHJHSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984394 1044042663 /nfs/dbraw/zinc/04/26/63/1044042663.db2.gz YNAAQUBTLZGSML-DYESRHJHSA-N 2 1 324.468 4.251 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000562058770 1044055449 /nfs/dbraw/zinc/05/54/49/1044055449.db2.gz RRUFRFDWFXLOMI-QYZOEREBSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000562058770 1044055462 /nfs/dbraw/zinc/05/54/62/1044055462.db2.gz RRUFRFDWFXLOMI-QYZOEREBSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[C@@H](C)[N@@H+](C)Cc1cncc(C[NH+](C)[C@@H](C)C(C)C)c1 ZINC000562686971 1044149916 /nfs/dbraw/zinc/14/99/16/1044149916.db2.gz DLOCBNJQZCWMFN-CALCHBBNSA-N 2 1 305.510 4.034 20 0 DIADMP CC(C)[C@@H](C)[NH+](C)Cc1cncc(C[N@H+](C)[C@@H](C)C(C)C)c1 ZINC000562686971 1044149922 /nfs/dbraw/zinc/14/99/22/1044149922.db2.gz DLOCBNJQZCWMFN-CALCHBBNSA-N 2 1 305.510 4.034 20 0 DIADMP CC(C)[C@@H](C)[NH+](C)Cc1cncc(C[N@@H+](C)[C@@H](C)C(C)C)c1 ZINC000562686971 1044149927 /nfs/dbraw/zinc/14/99/27/1044149927.db2.gz DLOCBNJQZCWMFN-CALCHBBNSA-N 2 1 305.510 4.034 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000359427015 1044166742 /nfs/dbraw/zinc/16/67/42/1044166742.db2.gz FSOPHWMYGVMMPT-YOEHRIQHSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000359427015 1044166747 /nfs/dbraw/zinc/16/67/47/1044166747.db2.gz FSOPHWMYGVMMPT-YOEHRIQHSA-N 2 1 322.493 4.217 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](C)C(F)(F)F)cc1 ZINC000359541908 1044176726 /nfs/dbraw/zinc/17/67/26/1044176726.db2.gz SFNOEHKDINQLGV-VXGBXAGGSA-N 2 1 311.351 4.030 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1)c1c[nH+]ccc1N ZINC000562958874 1044211136 /nfs/dbraw/zinc/21/11/36/1044211136.db2.gz ZAVOKRZAANEIQH-NOLJZWGESA-N 2 1 315.848 4.134 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2ccsc2S1 ZINC000360442664 1044270330 /nfs/dbraw/zinc/27/03/30/1044270330.db2.gz KNIMAKFTAXKBPE-WBMJQRKESA-N 2 1 322.543 4.138 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCC(C)(C)CC2)cc1F ZINC000360503777 1044279446 /nfs/dbraw/zinc/27/94/46/1044279446.db2.gz AODKUMMGOAUSOA-UHFFFAOYSA-N 2 1 315.436 4.378 20 0 DIADMP C[C@@H]1C[N@@H+]([C@@H]2C[C@@H](C)N(Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056846 1044288933 /nfs/dbraw/zinc/28/89/33/1044288933.db2.gz JEBNIVQYUFXMQX-GNBUJSLZSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056846 1044288943 /nfs/dbraw/zinc/28/89/43/1044288943.db2.gz JEBNIVQYUFXMQX-GNBUJSLZSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056846 1044288956 /nfs/dbraw/zinc/28/89/56/1044288956.db2.gz JEBNIVQYUFXMQX-GNBUJSLZSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056846 1044288966 /nfs/dbraw/zinc/28/89/66/1044288966.db2.gz JEBNIVQYUFXMQX-GNBUJSLZSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C2(CC2)C1 ZINC001168056846 1044288977 /nfs/dbraw/zinc/28/89/77/1044288977.db2.gz JEBNIVQYUFXMQX-GNBUJSLZSA-N 2 1 312.501 4.302 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000360702111 1044301388 /nfs/dbraw/zinc/30/13/88/1044301388.db2.gz ZHQZNHNTCIQQGH-IMUUDWKMSA-N 2 1 317.864 4.017 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H](C)CC[NH+](C)C)cs2)cs1 ZINC000360862955 1044319670 /nfs/dbraw/zinc/31/96/70/1044319670.db2.gz YBURXOICJNUSFY-RYUDHWBXSA-N 2 1 323.531 4.171 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1cccc(-c2cccnc2)c1 ZINC000564129630 1044343735 /nfs/dbraw/zinc/34/37/35/1044343735.db2.gz NKDXWZFQENZUEQ-UHFFFAOYSA-N 2 1 323.484 4.056 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069566 1044353088 /nfs/dbraw/zinc/35/30/88/1044353088.db2.gz RDEDKVLKJRMKQA-WBVHZDCISA-N 2 1 304.478 4.003 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069566 1044353100 /nfs/dbraw/zinc/35/31/00/1044353100.db2.gz RDEDKVLKJRMKQA-WBVHZDCISA-N 2 1 304.478 4.003 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccccc32)c1 ZINC000361079499 1044358286 /nfs/dbraw/zinc/35/82/86/1044358286.db2.gz JVFPACLVYLINLL-NRFANRHFSA-N 2 1 308.469 4.306 20 0 DIADMP C[C@H](Nc1cc2c(cn1)CCCC2)c1ccc(-n2ccnc2)cc1 ZINC000361190056 1044372022 /nfs/dbraw/zinc/37/20/22/1044372022.db2.gz OLAIDESRRJUCTN-HNNXBMFYSA-N 2 1 318.424 4.319 20 0 DIADMP CCc1[nH+]ccn1[C@H]1CCCN(c2nccc3c(C)cccc32)C1 ZINC000564893830 1044407352 /nfs/dbraw/zinc/40/73/52/1044407352.db2.gz WJIWMQCGEWPZBW-INIZCTEOSA-N 2 1 320.440 4.144 20 0 DIADMP CCC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccccc1 ZINC000361508822 1044413272 /nfs/dbraw/zinc/41/32/72/1044413272.db2.gz QBMDYRKPMGKUCF-HXUWFJFHSA-N 2 1 323.484 4.490 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000565257156 1044422537 /nfs/dbraw/zinc/42/25/37/1044422537.db2.gz DGLSJXGIAZJXIQ-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000565257156 1044422547 /nfs/dbraw/zinc/42/25/47/1044422547.db2.gz DGLSJXGIAZJXIQ-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000565257156 1044422551 /nfs/dbraw/zinc/42/25/51/1044422551.db2.gz DGLSJXGIAZJXIQ-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000565257156 1044422560 /nfs/dbraw/zinc/42/25/60/1044422560.db2.gz DGLSJXGIAZJXIQ-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000565257156 1044422563 /nfs/dbraw/zinc/42/25/63/1044422563.db2.gz DGLSJXGIAZJXIQ-ZWKOTPCHSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753566 1044438358 /nfs/dbraw/zinc/43/83/58/1044438358.db2.gz KTVHZOQIENTELC-RPVQJOFSSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753566 1044438366 /nfs/dbraw/zinc/43/83/66/1044438366.db2.gz KTVHZOQIENTELC-RPVQJOFSSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1(C)CC1 ZINC000361772893 1044441974 /nfs/dbraw/zinc/44/19/74/1044441974.db2.gz YZIXYYLQDFZTAE-MRXNPFEDSA-N 2 1 312.457 4.190 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000566394688 1044488831 /nfs/dbraw/zinc/48/88/31/1044488831.db2.gz LLFRXQJDKUGUHU-IBGZPJMESA-N 2 1 322.496 4.440 20 0 DIADMP CC(C)(C)c1ccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475562932 1044504831 /nfs/dbraw/zinc/50/48/31/1044504831.db2.gz AKKDGPUGUIACJB-UHFFFAOYSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000567026874 1044535692 /nfs/dbraw/zinc/53/56/92/1044535692.db2.gz XEVAEGWFNUIDAR-XMSQKQJNSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000567026874 1044535710 /nfs/dbraw/zinc/53/57/10/1044535710.db2.gz XEVAEGWFNUIDAR-XMSQKQJNSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)c1 ZINC000567026874 1044535726 /nfs/dbraw/zinc/53/57/26/1044535726.db2.gz XEVAEGWFNUIDAR-XMSQKQJNSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)c1 ZINC000567026874 1044535743 /nfs/dbraw/zinc/53/57/43/1044535743.db2.gz XEVAEGWFNUIDAR-XMSQKQJNSA-N 2 1 322.496 4.434 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000885923190 1044590996 /nfs/dbraw/zinc/59/09/96/1044590996.db2.gz SSZUWRSIODVTIB-MOPGFXCFSA-N 2 1 322.537 4.113 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)c1 ZINC000885999813 1044600123 /nfs/dbraw/zinc/60/01/23/1044600123.db2.gz NUPMFBILOSQVLP-UHFFFAOYSA-N 2 1 324.424 4.103 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3ccc(Cl)cc3)CC2)[nH+]c1C ZINC000886661414 1044677543 /nfs/dbraw/zinc/67/75/43/1044677543.db2.gz URZUTDANVNPTQJ-UHFFFAOYSA-N 2 1 303.837 4.060 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCC[C@@H](F)C2)CC1 ZINC000570043123 1044729198 /nfs/dbraw/zinc/72/91/98/1044729198.db2.gz HWILGDARRXUWAD-SOAISFHBSA-N 2 1 318.480 4.300 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CC(C)=C[C@H](C)C1 ZINC000570371584 1044754322 /nfs/dbraw/zinc/75/43/22/1044754322.db2.gz SGEOIQCBFMGKSL-WMZOPIPTSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CC(C)=C[C@H](C)C1 ZINC000570371584 1044754331 /nfs/dbraw/zinc/75/43/31/1044754331.db2.gz SGEOIQCBFMGKSL-WMZOPIPTSA-N 2 1 303.494 4.150 20 0 DIADMP CSC1(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)CCC1 ZINC000368217207 1044770752 /nfs/dbraw/zinc/77/07/52/1044770752.db2.gz WOAWLVWMNTWRSV-MRXNPFEDSA-N 2 1 318.530 4.087 20 0 DIADMP Fc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1Cl ZINC000570743995 1044778204 /nfs/dbraw/zinc/77/82/04/1044778204.db2.gz WQNRAXLCXXVXKN-UHFFFAOYSA-N 2 1 324.871 4.366 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2sccc2C)c1 ZINC000123936159 1044788813 /nfs/dbraw/zinc/78/88/13/1044788813.db2.gz YVMIVSSQTOHFDO-HNNXBMFYSA-N 2 1 302.487 4.359 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC000572051846 1044840112 /nfs/dbraw/zinc/84/01/12/1044840112.db2.gz SGHGIIOGUZPPPI-OLZOCXBDSA-N 2 1 302.915 4.041 20 0 DIADMP CCc1[nH+]c2ccccc2c(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c1C ZINC000571114797 1044797866 /nfs/dbraw/zinc/79/78/66/1044797866.db2.gz UVWHQGJPHPKJGZ-HNNXBMFYSA-N 2 1 320.440 4.213 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@@H]1c1ccccc1 ZINC000571424822 1044810563 /nfs/dbraw/zinc/81/05/63/1044810563.db2.gz UAXWVWWMEZCDIQ-FGZHOGPDSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@@H]1c1ccccc1 ZINC000571424822 1044810581 /nfs/dbraw/zinc/81/05/81/1044810581.db2.gz UAXWVWWMEZCDIQ-FGZHOGPDSA-N 2 1 320.480 4.489 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC000572051846 1044840090 /nfs/dbraw/zinc/84/00/90/1044840090.db2.gz SGHGIIOGUZPPPI-OLZOCXBDSA-N 2 1 302.915 4.041 20 0 DIADMP C[C@@H](C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890167 1044881383 /nfs/dbraw/zinc/88/13/83/1044881383.db2.gz QKADYBYNVRGXAA-RDJZCZTQSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890167 1044881409 /nfs/dbraw/zinc/88/14/09/1044881409.db2.gz QKADYBYNVRGXAA-RDJZCZTQSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@@H](C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890167 1044881424 /nfs/dbraw/zinc/88/14/24/1044881424.db2.gz QKADYBYNVRGXAA-RDJZCZTQSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@@H](C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890167 1044881440 /nfs/dbraw/zinc/88/14/40/1044881440.db2.gz QKADYBYNVRGXAA-RDJZCZTQSA-N 2 1 320.908 4.107 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000524593485 1044882881 /nfs/dbraw/zinc/88/28/81/1044882881.db2.gz BRHFIBUDMYJOPP-FQEVSTJZSA-N 2 1 308.469 4.290 20 0 DIADMP Cc1cc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)oc1C ZINC000337390018 1044888325 /nfs/dbraw/zinc/88/83/25/1044888325.db2.gz KFRXZPPRXRWSAK-INIZCTEOSA-N 2 1 312.457 4.343 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCC12CCC2 ZINC000337469413 1044905232 /nfs/dbraw/zinc/90/52/32/1044905232.db2.gz MYNILYSRUKHSAR-HXUWFJFHSA-N 2 1 324.468 4.334 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cccc(Oc2ccccc2)c1 ZINC000337950689 1044967075 /nfs/dbraw/zinc/96/70/75/1044967075.db2.gz MYNKQZSEUGPMET-UHFFFAOYSA-N 2 1 321.424 4.164 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045813 1044983965 /nfs/dbraw/zinc/98/39/65/1044983965.db2.gz SHYJMICTZFVQNB-CEXWTWQISA-N 2 1 316.464 4.054 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045813 1044983979 /nfs/dbraw/zinc/98/39/79/1044983979.db2.gz SHYJMICTZFVQNB-CEXWTWQISA-N 2 1 316.464 4.054 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1Cl ZINC000575974957 1045022630 /nfs/dbraw/zinc/02/26/30/1045022630.db2.gz IKQLMGAGHPODOI-DZKIICNBSA-N 2 1 324.896 4.261 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000446755215 1045029877 /nfs/dbraw/zinc/02/98/77/1045029877.db2.gz YZQBRTQUSXEYNY-UWJYYQICSA-N 2 1 312.501 4.300 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccnc(Cl)c1 ZINC000158585308 1045042447 /nfs/dbraw/zinc/04/24/47/1045042447.db2.gz DIJQEXOXUADZAP-XHSDSOJGSA-N 2 1 323.912 4.144 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1 ZINC000576353288 1045052588 /nfs/dbraw/zinc/05/25/88/1045052588.db2.gz CGYMIXLXWNCRFZ-MAUKXSAKSA-N 2 1 320.908 4.107 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCc3ccccc32)cc1F ZINC000153700473 1045060131 /nfs/dbraw/zinc/06/01/31/1045060131.db2.gz XUQBTSHSCTWWTI-IBGZPJMESA-N 2 1 321.399 4.097 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(F)c1 ZINC000446942704 1045075292 /nfs/dbraw/zinc/07/52/92/1045075292.db2.gz UCRVPCZWPLPBJE-VQIMIIECSA-N 2 1 306.469 4.234 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000525488191 1045076616 /nfs/dbraw/zinc/07/66/16/1045076616.db2.gz FRFZBXFRSUYRFG-DLBZAZTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000525488191 1045076629 /nfs/dbraw/zinc/07/66/29/1045076629.db2.gz FRFZBXFRSUYRFG-DLBZAZTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000525488191 1045076641 /nfs/dbraw/zinc/07/66/41/1045076641.db2.gz FRFZBXFRSUYRFG-DLBZAZTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000525488191 1045076650 /nfs/dbraw/zinc/07/66/50/1045076650.db2.gz FRFZBXFRSUYRFG-DLBZAZTESA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000525488191 1045076660 /nfs/dbraw/zinc/07/66/60/1045076660.db2.gz FRFZBXFRSUYRFG-DLBZAZTESA-N 2 1 302.506 4.319 20 0 DIADMP CCC[C@H](CC)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447572421 1045147337 /nfs/dbraw/zinc/14/73/37/1045147337.db2.gz BTIZMLJEFXVXLD-HAGHYFMRSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(C(F)F)cc1 ZINC000525980865 1045149429 /nfs/dbraw/zinc/14/94/29/1045149429.db2.gz KGJQEQNLPZRLCY-HNNXBMFYSA-N 2 1 310.432 4.368 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2CCC4(CC4)CC2)C3)cc1 ZINC000447590247 1045154833 /nfs/dbraw/zinc/15/48/33/1045154833.db2.gz BDPLNIFJSKRDFG-WKCHPHFGSA-N 2 1 324.512 4.494 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)o1 ZINC000447595674 1045156374 /nfs/dbraw/zinc/15/63/74/1045156374.db2.gz AJXKXEKNAUCQHM-VYDXJSESSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)o1 ZINC000447595674 1045156378 /nfs/dbraw/zinc/15/63/78/1045156378.db2.gz AJXKXEKNAUCQHM-VYDXJSESSA-N 2 1 304.478 4.200 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2CC24CCCC4)C3)cc1 ZINC000447600709 1045159988 /nfs/dbraw/zinc/15/99/88/1045159988.db2.gz NCNGCJXOVZEXJG-YSTOQKLRSA-N 2 1 310.485 4.104 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccccn2)C2CCC2)C1 ZINC000924684143 1045189793 /nfs/dbraw/zinc/18/97/93/1045189793.db2.gz CEZIEPGKDQSGEH-FXAWDEMLSA-N 2 1 315.505 4.025 20 0 DIADMP Cc1ccccc1C[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccco1 ZINC000924700918 1045190821 /nfs/dbraw/zinc/19/08/21/1045190821.db2.gz ZLTAGTQYKYEJOV-ZCNNSNEGSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccco1 ZINC000924700918 1045190825 /nfs/dbraw/zinc/19/08/25/1045190825.db2.gz ZLTAGTQYKYEJOV-ZCNNSNEGSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccco1 ZINC000924700918 1045190829 /nfs/dbraw/zinc/19/08/29/1045190829.db2.gz ZLTAGTQYKYEJOV-ZCNNSNEGSA-N 2 1 324.468 4.088 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192208 1045219741 /nfs/dbraw/zinc/21/97/41/1045219741.db2.gz HELATJLJCACYNZ-YLJYHZDGSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578192208 1045219747 /nfs/dbraw/zinc/21/97/47/1045219747.db2.gz HELATJLJCACYNZ-YLJYHZDGSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)CC[N@@H+]1C ZINC000527664025 1045246135 /nfs/dbraw/zinc/24/61/35/1045246135.db2.gz CHQDLSAUXBKMEK-VBSBHUPXSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)CC[N@H+]1C ZINC000527664025 1045246142 /nfs/dbraw/zinc/24/61/42/1045246142.db2.gz CHQDLSAUXBKMEK-VBSBHUPXSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)[C@@H]1CC12CC2 ZINC000527872735 1045271647 /nfs/dbraw/zinc/27/16/47/1045271647.db2.gz YSRFJUPJYOXLDJ-JXFKEZNVSA-N 2 1 324.468 4.190 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccccc2)c1 ZINC000579185984 1045299649 /nfs/dbraw/zinc/29/96/49/1045299649.db2.gz JESURXXFPPZSPA-MSOLQXFVSA-N 2 1 308.469 4.346 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000449061121 1045337705 /nfs/dbraw/zinc/33/77/05/1045337705.db2.gz HMVSJYBTWLTMNM-ZJRDLVKKSA-N 2 1 322.537 4.111 20 0 DIADMP CSCC1CCC([NH2+]CCCC[N@H+]2CCC[C@H](C)C2)CC1 ZINC000449082043 1045345643 /nfs/dbraw/zinc/34/56/43/1045345643.db2.gz JZXJXUZOFFLKEC-AOCRQIFASA-N 2 1 312.567 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC000449090196 1045347281 /nfs/dbraw/zinc/34/72/81/1045347281.db2.gz MKTSXCHGMVCCBV-HNAYVOBHSA-N 2 1 318.892 4.207 20 0 DIADMP Cc1ccc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cn1 ZINC000449090729 1045348469 /nfs/dbraw/zinc/34/84/69/1045348469.db2.gz NPWJRMKDCKUKJV-UHFFFAOYSA-N 2 1 317.521 4.159 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3ccoc32)c1 ZINC000449131362 1045349635 /nfs/dbraw/zinc/34/96/35/1045349635.db2.gz MBTQLCZHKUCDFR-UHFFFAOYSA-N 2 1 308.425 4.174 20 0 DIADMP Cc1cncc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c1 ZINC000449208491 1045361111 /nfs/dbraw/zinc/36/11/11/1045361111.db2.gz PGSPDIIZAHVHQH-UHFFFAOYSA-N 2 1 317.521 4.159 20 0 DIADMP Cc1cccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1F ZINC000449220741 1045364775 /nfs/dbraw/zinc/36/47/75/1045364775.db2.gz RGWHIORSEZVDRA-UHFFFAOYSA-N 2 1 314.448 4.264 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc2ccoc21 ZINC000449326534 1045375449 /nfs/dbraw/zinc/37/54/49/1045375449.db2.gz WYBJTFOTQONFSR-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc2ccoc21 ZINC000449326534 1045375451 /nfs/dbraw/zinc/37/54/51/1045375451.db2.gz WYBJTFOTQONFSR-UHFFFAOYSA-N 2 1 311.429 4.104 20 0 DIADMP Cc1csc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1 ZINC000449482509 1045400545 /nfs/dbraw/zinc/40/05/45/1045400545.db2.gz YOQWDZVDZVSUIJ-AWEZNQCLSA-N 2 1 311.454 4.401 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)C2CC(F)(F)C2)c1 ZINC000529531163 1045488609 /nfs/dbraw/zinc/48/86/09/1045488609.db2.gz KRBLASUQXWXGSX-CQSZACIVSA-N 2 1 310.432 4.050 20 0 DIADMP C[C@H]([NH2+]CC/C=C/c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450729083 1045553954 /nfs/dbraw/zinc/55/39/54/1045553954.db2.gz QZVBWZXESBVYED-RUJVBFRSSA-N 2 1 312.501 4.333 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380965850 1045556447 /nfs/dbraw/zinc/55/64/47/1045556447.db2.gz CPMMROXMAICYBW-MISYRCLQSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+]CCc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450724600 1045557604 /nfs/dbraw/zinc/55/76/04/1045557604.db2.gz GRIFLYDUGZMGKV-DOTOQJQBSA-N 2 1 320.908 4.125 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc3ccccc3o2)CC1 ZINC001139064908 1045623882 /nfs/dbraw/zinc/62/38/82/1045623882.db2.gz JIKWLGOUIITBNO-UHFFFAOYSA-N 2 1 300.446 4.129 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc3ccccc3o2)CC1 ZINC001139064908 1045623898 /nfs/dbraw/zinc/62/38/98/1045623898.db2.gz JIKWLGOUIITBNO-UHFFFAOYSA-N 2 1 300.446 4.129 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000392241989 1045641768 /nfs/dbraw/zinc/64/17/68/1045641768.db2.gz OEUAHEKGZPACSE-UHFFFAOYSA-N 2 1 312.457 4.127 20 0 DIADMP Cc1nccn1CCCC[N@H+]1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C ZINC000451191842 1045644614 /nfs/dbraw/zinc/64/46/14/1045644614.db2.gz UWSXLXKOJWDAKQ-FUHIMQAGSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C ZINC000451191842 1045644619 /nfs/dbraw/zinc/64/46/19/1045644619.db2.gz UWSXLXKOJWDAKQ-FUHIMQAGSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C ZINC000451191842 1045644624 /nfs/dbraw/zinc/64/46/24/1045644624.db2.gz UWSXLXKOJWDAKQ-FUHIMQAGSA-N 2 1 311.473 4.238 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(-c2cccs2)cc1 ZINC000530460379 1045670879 /nfs/dbraw/zinc/67/08/79/1045670879.db2.gz OJLOMWOJLQJOKI-CQSZACIVSA-N 2 1 311.454 4.042 20 0 DIADMP Cc1nccn1CC[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000451738075 1045725091 /nfs/dbraw/zinc/72/50/91/1045725091.db2.gz RNMNVBWKKLGIAD-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000530949726 1045760241 /nfs/dbraw/zinc/76/02/41/1045760241.db2.gz JHOJIAVVUQPWQQ-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000530949726 1045760252 /nfs/dbraw/zinc/76/02/52/1045760252.db2.gz JHOJIAVVUQPWQQ-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949726 1045760267 /nfs/dbraw/zinc/76/02/67/1045760267.db2.gz JHOJIAVVUQPWQQ-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949726 1045760278 /nfs/dbraw/zinc/76/02/78/1045760278.db2.gz JHOJIAVVUQPWQQ-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194265 1045831325 /nfs/dbraw/zinc/83/13/25/1045831325.db2.gz WWSWFRVTSKUGEH-OALUTQOASA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194265 1045831335 /nfs/dbraw/zinc/83/13/35/1045831335.db2.gz WWSWFRVTSKUGEH-OALUTQOASA-N 2 1 310.485 4.106 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@@H+]1C ZINC000531683330 1045896871 /nfs/dbraw/zinc/89/68/71/1045896871.db2.gz GPBXWGUUHCDUSN-ZTFGCOKTSA-N 2 1 306.469 4.375 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@H+]1C ZINC000531683330 1045896877 /nfs/dbraw/zinc/89/68/77/1045896877.db2.gz GPBXWGUUHCDUSN-ZTFGCOKTSA-N 2 1 306.469 4.375 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000531707611 1045902232 /nfs/dbraw/zinc/90/22/32/1045902232.db2.gz NQAXVMZTYNNDTC-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000531707611 1045902239 /nfs/dbraw/zinc/90/22/39/1045902239.db2.gz NQAXVMZTYNNDTC-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000531715401 1045903125 /nfs/dbraw/zinc/90/31/25/1045903125.db2.gz XOCJEKAUBHZRLJ-KDOFPFPSSA-N 2 1 306.881 4.039 20 0 DIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000531737430 1045908875 /nfs/dbraw/zinc/90/88/75/1045908875.db2.gz OLBBSMVTCPCXPG-INIZCTEOSA-N 2 1 316.489 4.061 20 0 DIADMP c1cnc2cccc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c2c1 ZINC001137627912 1045910958 /nfs/dbraw/zinc/91/09/58/1045910958.db2.gz FJEXFZUUWZKUHO-LJQANCHMSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@H](CCCc1cccnc1)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000453057280 1045920884 /nfs/dbraw/zinc/92/08/84/1045920884.db2.gz HULLIYLIOHDRQZ-RTBURBONSA-N 2 1 317.521 4.037 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1csc2ccccc12 ZINC000754793407 1045928089 /nfs/dbraw/zinc/92/80/89/1045928089.db2.gz HLHPSDZTKOLJBW-KKUMJFAQSA-N 2 1 300.471 4.179 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2sccc21 ZINC000453082683 1045929192 /nfs/dbraw/zinc/92/91/92/1045929192.db2.gz MEGMNDCLBTZYOE-SUMWQHHRSA-N 2 1 304.503 4.293 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2sccc21 ZINC000453082674 1045929566 /nfs/dbraw/zinc/92/95/66/1045929566.db2.gz MEGMNDCLBTZYOE-DYVFJYSZSA-N 2 1 304.503 4.293 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2cc3ccccc3s2)CC1 ZINC001137686468 1045932355 /nfs/dbraw/zinc/93/23/55/1045932355.db2.gz JWCAOMBJGVAHNT-UHFFFAOYSA-N 2 1 314.498 4.352 20 0 DIADMP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC001137687836 1045936234 /nfs/dbraw/zinc/93/62/34/1045936234.db2.gz FKQNKYWNENGHDF-INIZCTEOSA-N 2 1 324.449 4.258 20 0 DIADMP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC001137687836 1045936242 /nfs/dbraw/zinc/93/62/42/1045936242.db2.gz FKQNKYWNENGHDF-INIZCTEOSA-N 2 1 324.449 4.258 20 0 DIADMP CCC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)C(C)(C)C ZINC000453129716 1045953338 /nfs/dbraw/zinc/95/33/38/1045953338.db2.gz TZJNXEWHOPIQPI-KRWDZBQOSA-N 2 1 303.494 4.163 20 0 DIADMP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192918368 1045955187 /nfs/dbraw/zinc/95/51/87/1045955187.db2.gz YLHQAVCBAGJTHQ-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453174667 1045956836 /nfs/dbraw/zinc/95/68/36/1045956836.db2.gz JOIKFGZADIIGND-GOSISDBHSA-N 2 1 304.865 4.033 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccsc1 ZINC000453200005 1045979786 /nfs/dbraw/zinc/97/97/86/1045979786.db2.gz UCLJZPLEGWOQQZ-DAYGRLMNSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001137849653 1045986355 /nfs/dbraw/zinc/98/63/55/1045986355.db2.gz YXAGZOKQQBPVDZ-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c(C)s1 ZINC000531866298 1045989646 /nfs/dbraw/zinc/98/96/46/1045989646.db2.gz GNCPMJHEAKXZPA-UHFFFAOYSA-N 2 1 316.514 4.495 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cccc(Cl)c2F)CC1 ZINC001137961621 1046034702 /nfs/dbraw/zinc/03/47/02/1046034702.db2.gz VNRALOYIATYRMZ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)C1(c2ccccc2)CCCC1 ZINC000453338390 1046043176 /nfs/dbraw/zinc/04/31/76/1046043176.db2.gz FWYSNPIMTXKUNW-VOBGVNJCSA-N 2 1 312.501 4.102 20 0 DIADMP CC(C)[C@H](CSc1ccccc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000453353237 1046051922 /nfs/dbraw/zinc/05/19/22/1046051922.db2.gz NONAAAZYUJVPFH-PHSGOXPASA-N 2 1 318.530 4.018 20 0 DIADMP Cc1ccc(C[NH+]2CCC([N@H+](C)C3CC3)CC2)c2ccccc12 ZINC001138018199 1046059551 /nfs/dbraw/zinc/05/95/51/1046059551.db2.gz NYXWHHCDKFVIIB-UHFFFAOYSA-N 2 1 308.469 4.207 20 0 DIADMP Cc1ccc(C[NH+]2CCC([N@@H+](C)C3CC3)CC2)c2ccccc12 ZINC001138018199 1046059567 /nfs/dbraw/zinc/05/95/67/1046059567.db2.gz NYXWHHCDKFVIIB-UHFFFAOYSA-N 2 1 308.469 4.207 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753820 1046060452 /nfs/dbraw/zinc/06/04/52/1046060452.db2.gz UGOGPCWDGAWWSG-SDDRHHMPSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753820 1046060464 /nfs/dbraw/zinc/06/04/64/1046060464.db2.gz UGOGPCWDGAWWSG-SDDRHHMPSA-N 2 1 318.408 4.044 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C1CC1 ZINC000453387101 1046063593 /nfs/dbraw/zinc/06/35/93/1046063593.db2.gz AVZYNSNIKZZGMB-GOSISDBHSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(-c2ccccc2)o1 ZINC000453365666 1046066166 /nfs/dbraw/zinc/06/61/66/1046066166.db2.gz SRQFNSIIFVRTLQ-MIGBEJBISA-N 2 1 310.441 4.222 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(-c2ccccc2)o1 ZINC000453365666 1046066184 /nfs/dbraw/zinc/06/61/84/1046066184.db2.gz SRQFNSIIFVRTLQ-MIGBEJBISA-N 2 1 310.441 4.222 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)oc2cc1C ZINC000453378757 1046073141 /nfs/dbraw/zinc/07/31/41/1046073141.db2.gz ZQUZOMFHGUXEIZ-CCNLRDMRSA-N 2 1 312.457 4.325 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)oc2cc1C ZINC000453378757 1046073158 /nfs/dbraw/zinc/07/31/58/1046073158.db2.gz ZQUZOMFHGUXEIZ-CCNLRDMRSA-N 2 1 312.457 4.325 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2ccccc2o1 ZINC000453378733 1046073425 /nfs/dbraw/zinc/07/34/25/1046073425.db2.gz ZQEFJMDLJCGOLS-KVMCETHSSA-N 2 1 312.457 4.345 20 0 DIADMP CC[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Cl)s1 ZINC000453410778 1046080275 /nfs/dbraw/zinc/08/02/75/1046080275.db2.gz VDXAITDMQGXUFZ-ZDUSSCGKSA-N 2 1 300.899 4.317 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)cc1 ZINC000453410865 1046080800 /nfs/dbraw/zinc/08/08/00/1046080800.db2.gz VLQPRBMYJGJBMF-HNNXBMFYSA-N 2 1 306.519 4.324 20 0 DIADMP C[C@H]([NH2+][C@H](C1CC1)C1CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000453445008 1046086239 /nfs/dbraw/zinc/08/62/39/1046086239.db2.gz ZNGFGJFKUUKOCM-NDXORKPFSA-N 2 1 312.501 4.065 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)C2CC2)cc1 ZINC000903066781 1046153373 /nfs/dbraw/zinc/15/33/73/1046153373.db2.gz LOYMYPNLIDVECM-KRIYCRJKSA-N 2 1 310.485 4.194 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH+]2CCC3(CCCC3)CC2)cc1 ZINC001138544099 1046219858 /nfs/dbraw/zinc/21/98/58/1046219858.db2.gz CHJVYEFAEZVESF-UHFFFAOYSA-N 2 1 309.457 4.337 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@H](C)C(F)(F)CC2)cc1 ZINC001138545441 1046220753 /nfs/dbraw/zinc/22/07/53/1046220753.db2.gz XKSLWFRKCMRWPN-AWEZNQCLSA-N 2 1 319.399 4.048 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@H](C)C(F)(F)CC2)cc1 ZINC001138545441 1046220761 /nfs/dbraw/zinc/22/07/61/1046220761.db2.gz XKSLWFRKCMRWPN-AWEZNQCLSA-N 2 1 319.399 4.048 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC001138548469 1046223350 /nfs/dbraw/zinc/22/33/50/1046223350.db2.gz DUXYMGARWWCZES-HXUWFJFHSA-N 2 1 303.409 4.128 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC001138548469 1046223360 /nfs/dbraw/zinc/22/33/60/1046223360.db2.gz DUXYMGARWWCZES-HXUWFJFHSA-N 2 1 303.409 4.128 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2Cc3ccccc3C[C@@H]2C)cc1 ZINC001138549404 1046223795 /nfs/dbraw/zinc/22/37/95/1046223795.db2.gz WFIZHSJACFVZBF-INIZCTEOSA-N 2 1 317.436 4.128 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cc1 ZINC001138549404 1046223810 /nfs/dbraw/zinc/22/38/10/1046223810.db2.gz WFIZHSJACFVZBF-INIZCTEOSA-N 2 1 317.436 4.128 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(Cl)cc2)C1 ZINC001168167415 1046230702 /nfs/dbraw/zinc/23/07/02/1046230702.db2.gz OTDOCBHYYQHZID-PBHICJAKSA-N 2 1 308.897 4.124 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(Cl)cc2)C1 ZINC001168167415 1046230712 /nfs/dbraw/zinc/23/07/12/1046230712.db2.gz OTDOCBHYYQHZID-PBHICJAKSA-N 2 1 308.897 4.124 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168168519 1046232852 /nfs/dbraw/zinc/23/28/52/1046232852.db2.gz UQFAFNAOIBUIFU-WBAXXEDZSA-N 2 1 308.897 4.251 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168168522 1046233615 /nfs/dbraw/zinc/23/36/15/1046233615.db2.gz UQFAFNAOIBUIFU-ZTFGCOKTSA-N 2 1 308.897 4.251 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001168168656 1046235566 /nfs/dbraw/zinc/23/55/66/1046235566.db2.gz BMEBWOLDHUTMFV-INIZCTEOSA-N 2 1 320.908 4.221 20 0 DIADMP Cc1[nH+]ccn1Cc1ccc(-c2ccc(CC[NH+](C)C)cc2)cc1 ZINC000653510801 1046245751 /nfs/dbraw/zinc/24/57/51/1046245751.db2.gz NBBKBWICSREYMW-UHFFFAOYSA-N 2 1 319.452 4.011 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+][C@@H]1CC[C@H](c2ccccc2)C1)c1cccnc1 ZINC000903380530 1046261616 /nfs/dbraw/zinc/26/16/16/1046261616.db2.gz NFHBAPOIEWLHHD-TYPHKJRUSA-N 2 1 323.484 4.000 20 0 DIADMP C[NH+](C)C1CC[NH+](Cc2ccc(-c3ccc(F)cc3)cc2)CC1 ZINC001138682620 1046265282 /nfs/dbraw/zinc/26/52/82/1046265282.db2.gz WDAJVSDWOLWKJV-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000653579321 1046290917 /nfs/dbraw/zinc/29/09/17/1046290917.db2.gz ZOLBBUHAEIPLNQ-FQEVSTJZSA-N 2 1 322.456 4.061 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000653579321 1046290928 /nfs/dbraw/zinc/29/09/28/1046290928.db2.gz ZOLBBUHAEIPLNQ-FQEVSTJZSA-N 2 1 322.456 4.061 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903896284 1046336431 /nfs/dbraw/zinc/33/64/31/1046336431.db2.gz ADRQYBKGLRNXFO-WZYMTQMTSA-N 2 1 321.534 4.098 20 0 DIADMP CN1CCC([N@@H+](C)Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001139064909 1046372032 /nfs/dbraw/zinc/37/20/32/1046372032.db2.gz JLBZBCXNSBKKHT-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccc(F)cc2)c1)C1CC[NH+](C)CC1 ZINC001139064909 1046372045 /nfs/dbraw/zinc/37/20/45/1046372045.db2.gz JLBZBCXNSBKKHT-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)C1CC[NH+](C)CC1 ZINC001139064909 1046372048 /nfs/dbraw/zinc/37/20/48/1046372048.db2.gz JLBZBCXNSBKKHT-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639215461 1046372384 /nfs/dbraw/zinc/37/23/84/1046372384.db2.gz BEGRFKKSIKVVKP-SJLPKXTDSA-N 2 1 322.443 4.380 20 0 DIADMP CC(F)(F)CCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639215461 1046372396 /nfs/dbraw/zinc/37/23/96/1046372396.db2.gz BEGRFKKSIKVVKP-SJLPKXTDSA-N 2 1 322.443 4.380 20 0 DIADMP c1c2ccccc2oc1C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001139066596 1046375365 /nfs/dbraw/zinc/37/53/65/1046375365.db2.gz ZMRCTFHIMDPASQ-SFHVURJKSA-N 2 1 312.457 4.273 20 0 DIADMP c1c2ccccc2oc1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001139066596 1046375381 /nfs/dbraw/zinc/37/53/81/1046375381.db2.gz ZMRCTFHIMDPASQ-SFHVURJKSA-N 2 1 312.457 4.273 20 0 DIADMP CC1CCC([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)CC1 ZINC001168218962 1046427876 /nfs/dbraw/zinc/42/78/76/1046427876.db2.gz AKTCOCOQTUMESQ-UHFFFAOYSA-N 2 1 312.501 4.088 20 0 DIADMP CC1CCC([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)CC1 ZINC001168218962 1046427880 /nfs/dbraw/zinc/42/78/80/1046427880.db2.gz AKTCOCOQTUMESQ-UHFFFAOYSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccnc(Cl)c1 ZINC000781426470 1046444026 /nfs/dbraw/zinc/44/40/26/1046444026.db2.gz OUEYGDVEKOPVOY-DZKIICNBSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC000677129739 1046466697 /nfs/dbraw/zinc/46/66/97/1046466697.db2.gz OAEZNMWZBKVYAL-AUUYWEPGSA-N 2 1 322.443 4.196 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125809368 1046471949 /nfs/dbraw/zinc/47/19/49/1046471949.db2.gz SNQJKWMZHUJLGE-LZWOXQAQSA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125809368 1046471952 /nfs/dbraw/zinc/47/19/52/1046471952.db2.gz SNQJKWMZHUJLGE-LZWOXQAQSA-N 2 1 324.559 4.384 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125797941 1046472568 /nfs/dbraw/zinc/47/25/68/1046472568.db2.gz REBOEIXPGXJJFU-KBXCAEBGSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125797941 1046472575 /nfs/dbraw/zinc/47/25/75/1046472575.db2.gz REBOEIXPGXJJFU-KBXCAEBGSA-N 2 1 310.432 4.126 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccs1 ZINC000677237878 1046477402 /nfs/dbraw/zinc/47/74/02/1046477402.db2.gz PDSXHBJFSHMUHL-BQFCYCMXSA-N 2 1 306.519 4.442 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)CC(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000694020658 1046536653 /nfs/dbraw/zinc/53/66/53/1046536653.db2.gz FCISDJPJDRKHQH-NVXWUHKLSA-N 2 1 324.459 4.168 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cncc2ccccc21 ZINC001139897079 1046549369 /nfs/dbraw/zinc/54/93/69/1046549369.db2.gz SNJAIGPUSBTOAZ-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cncc2ccccc21 ZINC001139897079 1046549383 /nfs/dbraw/zinc/54/93/83/1046549383.db2.gz SNJAIGPUSBTOAZ-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cncc2ccccc21 ZINC001139897079 1046549391 /nfs/dbraw/zinc/54/93/91/1046549391.db2.gz SNJAIGPUSBTOAZ-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001140029211 1046572811 /nfs/dbraw/zinc/57/28/11/1046572811.db2.gz JLLVAKZPPKBJPS-NRFANRHFSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC001140029211 1046572827 /nfs/dbraw/zinc/57/28/27/1046572827.db2.gz JLLVAKZPPKBJPS-NRFANRHFSA-N 2 1 317.436 4.300 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1C[C@@H]1C ZINC000322090842 1046584205 /nfs/dbraw/zinc/58/42/05/1046584205.db2.gz WIAHFTPATOIMPZ-OCDRYEAFSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248411997 1046610717 /nfs/dbraw/zinc/61/07/17/1046610717.db2.gz ZUZYJKPMQYYOEH-OAGGEKHMSA-N 2 1 312.567 4.149 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000245547568 1046613408 /nfs/dbraw/zinc/61/34/08/1046613408.db2.gz NNNCWOPIYSBDLZ-RDJZCZTQSA-N 2 1 301.434 4.038 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000245547568 1046613414 /nfs/dbraw/zinc/61/34/14/1046613414.db2.gz NNNCWOPIYSBDLZ-RDJZCZTQSA-N 2 1 301.434 4.038 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000642630970 1046626183 /nfs/dbraw/zinc/62/61/83/1046626183.db2.gz SWXQSGZUCOJHST-MOPGFXCFSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000642630970 1046626185 /nfs/dbraw/zinc/62/61/85/1046626185.db2.gz SWXQSGZUCOJHST-MOPGFXCFSA-N 2 1 322.452 4.195 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c(C)n1 ZINC000678412657 1046629914 /nfs/dbraw/zinc/62/99/14/1046629914.db2.gz YOOOTVKAUCBTHI-SFHVURJKSA-N 2 1 323.484 4.014 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532989346 1046635507 /nfs/dbraw/zinc/63/55/07/1046635507.db2.gz QMRKVQVQFTVTPV-QUCCMNQESA-N 2 1 308.469 4.202 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000678425760 1046636197 /nfs/dbraw/zinc/63/61/97/1046636197.db2.gz CMTMRPNQXZKZMJ-VDZJLULYSA-N 2 1 315.505 4.084 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000678425757 1046636499 /nfs/dbraw/zinc/63/64/99/1046636499.db2.gz CMTMRPNQXZKZMJ-HHXXYDBFSA-N 2 1 315.505 4.084 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000245747944 1046646629 /nfs/dbraw/zinc/64/66/29/1046646629.db2.gz YJWMYMPHOJQFNO-KXBFYZLASA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000245747944 1046646636 /nfs/dbraw/zinc/64/66/36/1046646636.db2.gz YJWMYMPHOJQFNO-KXBFYZLASA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000245747937 1046646767 /nfs/dbraw/zinc/64/67/67/1046646767.db2.gz YJWMYMPHOJQFNO-BEFAXECRSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000245747937 1046646780 /nfs/dbraw/zinc/64/67/80/1046646780.db2.gz YJWMYMPHOJQFNO-BEFAXECRSA-N 2 1 315.436 4.194 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000245862335 1046662313 /nfs/dbraw/zinc/66/23/13/1046662313.db2.gz FOHQHSLNNYYOSI-QZTJIDSGSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000245862335 1046662314 /nfs/dbraw/zinc/66/23/14/1046662314.db2.gz FOHQHSLNNYYOSI-QZTJIDSGSA-N 2 1 323.484 4.307 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548789 1046673266 /nfs/dbraw/zinc/67/32/66/1046673266.db2.gz VGKTWBNACSTNEV-CABCVRRESA-N 2 1 312.457 4.321 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533288995 1046686740 /nfs/dbraw/zinc/68/67/40/1046686740.db2.gz MVWOHPYRYJPTDP-YJBOKZPZSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533288995 1046686764 /nfs/dbraw/zinc/68/67/64/1046686764.db2.gz MVWOHPYRYJPTDP-YJBOKZPZSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533288994 1046687385 /nfs/dbraw/zinc/68/73/85/1046687385.db2.gz MVWOHPYRYJPTDP-QAPCUYQASA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533288994 1046687392 /nfs/dbraw/zinc/68/73/92/1046687392.db2.gz MVWOHPYRYJPTDP-QAPCUYQASA-N 2 1 306.881 4.351 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3ccc(F)cc23)CC1 ZINC001137344043 1046689147 /nfs/dbraw/zinc/68/91/47/1046689147.db2.gz RZTQXVYXJOBZTB-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc(C)c(OC)c(Cl)c2)CC1 ZINC000796678146 1046716707 /nfs/dbraw/zinc/71/67/07/1046716707.db2.gz YNQZTSJZPRHOAT-CQSZACIVSA-N 2 1 324.896 4.182 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cc1 ZINC000679073862 1046768669 /nfs/dbraw/zinc/76/86/69/1046768669.db2.gz NRTIURMCMUBTBW-IUODEOHRSA-N 2 1 305.372 4.019 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1C(C)(C)C ZINC000533637923 1046771268 /nfs/dbraw/zinc/77/12/68/1046771268.db2.gz BMMJNOYUBGXCSO-CVEARBPZSA-N 2 1 300.490 4.119 20 0 DIADMP C[C@@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1ccc(F)c2ccccc21 ZINC000645406982 1046788598 /nfs/dbraw/zinc/78/85/98/1046788598.db2.gz UWYIDVXMLNZEJU-ZBFHGGJFSA-N 2 1 312.432 4.114 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]Cc2ccc(O)cc2)cc1 ZINC000679392646 1046835270 /nfs/dbraw/zinc/83/52/70/1046835270.db2.gz DDBOFYLUMCGBMT-QGZVFWFLSA-N 2 1 324.468 4.056 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)o1 ZINC000067668270 1046892041 /nfs/dbraw/zinc/89/20/41/1046892041.db2.gz YKCUGXXLZHYTMF-INIZCTEOSA-N 2 1 312.457 4.252 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2coc3ccccc23)CC1 ZINC001140786220 1046897807 /nfs/dbraw/zinc/89/78/07/1046897807.db2.gz JHDLZBXMAKHAKE-UHFFFAOYSA-N 2 1 300.446 4.129 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2coc3ccccc23)CC1 ZINC001140786220 1046897820 /nfs/dbraw/zinc/89/78/20/1046897820.db2.gz JHDLZBXMAKHAKE-UHFFFAOYSA-N 2 1 300.446 4.129 20 0 DIADMP c1oc2ccccc2c1C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001140783235 1046899167 /nfs/dbraw/zinc/89/91/67/1046899167.db2.gz NQSILLPFBLENLI-UHFFFAOYSA-N 2 1 324.468 4.273 20 0 DIADMP c1oc2ccccc2c1C[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001140783235 1046899184 /nfs/dbraw/zinc/89/91/84/1046899184.db2.gz NQSILLPFBLENLI-UHFFFAOYSA-N 2 1 324.468 4.273 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(SC2CCCC2)cc1 ZINC000161521618 1046904956 /nfs/dbraw/zinc/90/49/56/1046904956.db2.gz COJOCRUQSJRBPV-HNNXBMFYSA-N 2 1 318.530 4.466 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001140803567 1046907527 /nfs/dbraw/zinc/90/75/27/1046907527.db2.gz RTHGGNIGTPSSNM-KRWDZBQOSA-N 2 1 305.425 4.018 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001140803567 1046907537 /nfs/dbraw/zinc/90/75/37/1046907537.db2.gz RTHGGNIGTPSSNM-KRWDZBQOSA-N 2 1 305.425 4.018 20 0 DIADMP C[N@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1cccc2ccccc21 ZINC001140803333 1046908385 /nfs/dbraw/zinc/90/83/85/1046908385.db2.gz OLQBMIBZYUGPLP-UHFFFAOYSA-N 2 1 301.393 4.348 20 0 DIADMP C[N@@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1cccc2ccccc21 ZINC001140803333 1046908392 /nfs/dbraw/zinc/90/83/92/1046908392.db2.gz OLQBMIBZYUGPLP-UHFFFAOYSA-N 2 1 301.393 4.348 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+](Cc3c[nH]c4cc[nH+]cc34)C2)cc1 ZINC001140805281 1046909039 /nfs/dbraw/zinc/90/90/39/1046909039.db2.gz ZDEYJHXKRUZIHM-CQSZACIVSA-N 2 1 311.816 4.206 20 0 DIADMP Clc1ccc([C@@H]2CC[N@@H+](Cc3c[nH]c4cc[nH+]cc34)C2)cc1 ZINC001140805281 1046909057 /nfs/dbraw/zinc/90/90/57/1046909057.db2.gz ZDEYJHXKRUZIHM-CQSZACIVSA-N 2 1 311.816 4.206 20 0 DIADMP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)F ZINC000647318965 1046975279 /nfs/dbraw/zinc/97/52/79/1046975279.db2.gz HDIULEBJBQWHKQ-NRSFXHEJSA-N 2 1 322.443 4.063 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccs1 ZINC000647343875 1046983563 /nfs/dbraw/zinc/98/35/63/1046983563.db2.gz FAFPDOPAWQOKFQ-SQNIBIBYSA-N 2 1 314.498 4.134 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000647343308 1046984029 /nfs/dbraw/zinc/98/40/29/1046984029.db2.gz LRVIXJJNEQNPJA-QHAWAJNXSA-N 2 1 308.469 4.073 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]([C@@H]3CCCc4ccc(F)cc43)C2)CC1 ZINC000799178109 1047008101 /nfs/dbraw/zinc/00/81/01/1047008101.db2.gz GEUSBALGOLXBCV-LJQANCHMSA-N 2 1 316.464 4.011 20 0 DIADMP [NH3+][C@H]1C[C@@H]([NH2+]C2(c3cccc(Cl)c3)CCC2)c2ccccc21 ZINC000647804773 1047016122 /nfs/dbraw/zinc/01/61/22/1047016122.db2.gz YMSMFGFKYSYBAH-ZWKOTPCHSA-N 2 1 312.844 4.454 20 0 DIADMP CCc1ccccc1C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001141224607 1047052901 /nfs/dbraw/zinc/05/29/01/1047052901.db2.gz DXTBWHBPWHXQBU-UHFFFAOYSA-N 2 1 322.496 4.345 20 0 DIADMP CCc1ccccc1C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001141224607 1047052915 /nfs/dbraw/zinc/05/29/15/1047052915.db2.gz DXTBWHBPWHXQBU-UHFFFAOYSA-N 2 1 322.496 4.345 20 0 DIADMP CCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000536662651 1047058342 /nfs/dbraw/zinc/05/83/42/1047058342.db2.gz OWRKNMMFTBZTAK-FXAWDEMLSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000536662651 1047058352 /nfs/dbraw/zinc/05/83/52/1047058352.db2.gz OWRKNMMFTBZTAK-FXAWDEMLSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000536662651 1047058363 /nfs/dbraw/zinc/05/83/63/1047058363.db2.gz OWRKNMMFTBZTAK-FXAWDEMLSA-N 2 1 318.505 4.028 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536695324 1047073488 /nfs/dbraw/zinc/07/34/88/1047073488.db2.gz AECIQKKXGSWFMT-HNNXBMFYSA-N 2 1 308.535 4.209 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536695324 1047073503 /nfs/dbraw/zinc/07/35/03/1047073503.db2.gz AECIQKKXGSWFMT-HNNXBMFYSA-N 2 1 308.535 4.209 20 0 DIADMP CC[N@@H+](Cc1ccsc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536709239 1047084260 /nfs/dbraw/zinc/08/42/60/1047084260.db2.gz LUKMUCQZNBARTP-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP CC[N@H+](Cc1ccsc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536709239 1047084274 /nfs/dbraw/zinc/08/42/74/1047084274.db2.gz LUKMUCQZNBARTP-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP CC[NH+](Cc1ccsc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536709239 1047084290 /nfs/dbraw/zinc/08/42/90/1047084290.db2.gz LUKMUCQZNBARTP-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP CC[NH+](Cc1ccsc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536709239 1047084303 /nfs/dbraw/zinc/08/43/03/1047084303.db2.gz LUKMUCQZNBARTP-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP CC[N@H+](Cc1cccs1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536710352 1047084955 /nfs/dbraw/zinc/08/49/55/1047084955.db2.gz QZQDAPAMBWLSQO-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP CC[NH+](Cc1cccs1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536710352 1047084969 /nfs/dbraw/zinc/08/49/69/1047084969.db2.gz QZQDAPAMBWLSQO-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP CC[NH+](Cc1cccs1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536710352 1047084983 /nfs/dbraw/zinc/08/49/83/1047084983.db2.gz QZQDAPAMBWLSQO-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP Cc1nccn1CCC[N@H+](C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000536732998 1047087171 /nfs/dbraw/zinc/08/71/71/1047087171.db2.gz PIGOKMWRWNRBJX-CABCVRRESA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000536732998 1047087182 /nfs/dbraw/zinc/08/71/82/1047087182.db2.gz PIGOKMWRWNRBJX-CABCVRRESA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000536732998 1047087196 /nfs/dbraw/zinc/08/71/96/1047087196.db2.gz PIGOKMWRWNRBJX-CABCVRRESA-N 2 1 319.880 4.359 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(Cl)c1 ZINC000191509496 1047088421 /nfs/dbraw/zinc/08/84/21/1047088421.db2.gz YGULHYVZAQWITJ-UHFFFAOYSA-N 2 1 305.853 4.011 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(Cl)c1 ZINC000191509496 1047088434 /nfs/dbraw/zinc/08/84/34/1047088434.db2.gz YGULHYVZAQWITJ-UHFFFAOYSA-N 2 1 305.853 4.011 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651554 1047090534 /nfs/dbraw/zinc/09/05/34/1047090534.db2.gz UVCVCKIRKQPCKV-NXHRZFHOSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1ccccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379641911 1047092986 /nfs/dbraw/zinc/09/29/86/1047092986.db2.gz DMKVQPBWGBCQIY-RXVVDRJESA-N 2 1 308.469 4.138 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379640718 1047093248 /nfs/dbraw/zinc/09/32/48/1047093248.db2.gz CCJVSHSZFWCPOF-WFXMLNOXSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379640718 1047093258 /nfs/dbraw/zinc/09/32/58/1047093258.db2.gz CCJVSHSZFWCPOF-WFXMLNOXSA-N 2 1 308.469 4.390 20 0 DIADMP CC(C)C1CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379658526 1047094853 /nfs/dbraw/zinc/09/48/53/1047094853.db2.gz WPJZUPPSOJPRCO-OXHPOLQJSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C1CC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379658526 1047094867 /nfs/dbraw/zinc/09/48/67/1047094867.db2.gz WPJZUPPSOJPRCO-OXHPOLQJSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccsc1 ZINC000379641852 1047095305 /nfs/dbraw/zinc/09/53/05/1047095305.db2.gz YPIMXLVTGUOUTA-JKSUJKDBSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccsc1 ZINC000379641852 1047095322 /nfs/dbraw/zinc/09/53/22/1047095322.db2.gz YPIMXLVTGUOUTA-JKSUJKDBSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379657299 1047096086 /nfs/dbraw/zinc/09/60/86/1047096086.db2.gz RZXMJMFELKSXIP-KNKQGSTJSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379657299 1047096099 /nfs/dbraw/zinc/09/60/99/1047096099.db2.gz RZXMJMFELKSXIP-KNKQGSTJSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379657114 1047096207 /nfs/dbraw/zinc/09/62/07/1047096207.db2.gz RSUASWGEEWRONX-PIPMEXSNSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000379657114 1047096221 /nfs/dbraw/zinc/09/62/21/1047096221.db2.gz RSUASWGEEWRONX-PIPMEXSNSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379657111 1047097324 /nfs/dbraw/zinc/09/73/24/1047097324.db2.gz RSUASWGEEWRONX-NQSCKRDGSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000379657111 1047097334 /nfs/dbraw/zinc/09/73/34/1047097334.db2.gz RSUASWGEEWRONX-NQSCKRDGSA-N 2 1 320.480 4.317 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(-c3ccccc3C)c2)C1 ZINC001116019130 1047102048 /nfs/dbraw/zinc/10/20/48/1047102048.db2.gz QUKOCGLPVNRLPN-FQEVSTJZSA-N 2 1 322.496 4.484 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000536833849 1047106824 /nfs/dbraw/zinc/10/68/24/1047106824.db2.gz PCDFTIQNBPXGRO-KURKYZTESA-N 2 1 320.546 4.246 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000536833849 1047106835 /nfs/dbraw/zinc/10/68/35/1047106835.db2.gz PCDFTIQNBPXGRO-KURKYZTESA-N 2 1 320.546 4.246 20 0 DIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536839253 1047107973 /nfs/dbraw/zinc/10/79/73/1047107973.db2.gz MYEHMNRQPJNSAH-ROUUACIJSA-N 2 1 318.505 4.022 20 0 DIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536839253 1047107977 /nfs/dbraw/zinc/10/79/77/1047107977.db2.gz MYEHMNRQPJNSAH-ROUUACIJSA-N 2 1 318.505 4.022 20 0 DIADMP CC[C@@H](C)[C@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000537113193 1047140123 /nfs/dbraw/zinc/14/01/23/1047140123.db2.gz BQRDUVCDXUGHNQ-DYVFJYSZSA-N 2 1 305.853 4.222 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180924 1047147179 /nfs/dbraw/zinc/14/71/79/1047147179.db2.gz BSANLANLKQVJOL-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180924 1047147186 /nfs/dbraw/zinc/14/71/86/1047147186.db2.gz BSANLANLKQVJOL-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180924 1047147189 /nfs/dbraw/zinc/14/71/89/1047147189.db2.gz BSANLANLKQVJOL-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180924 1047147192 /nfs/dbraw/zinc/14/71/92/1047147192.db2.gz BSANLANLKQVJOL-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072718 1047168120 /nfs/dbraw/zinc/16/81/20/1047168120.db2.gz LWAXPYXVQVFPPU-QZTJIDSGSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072718 1047168126 /nfs/dbraw/zinc/16/81/26/1047168126.db2.gz LWAXPYXVQVFPPU-QZTJIDSGSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072718 1047168130 /nfs/dbraw/zinc/16/81/30/1047168130.db2.gz LWAXPYXVQVFPPU-QZTJIDSGSA-N 2 1 318.505 4.037 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2(c3ccccc3)CC2)CC1 ZINC000537421591 1047182718 /nfs/dbraw/zinc/18/27/18/1047182718.db2.gz HBZOINQBYPUHSN-XLIONFOSSA-N 2 1 312.501 4.308 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCC34CCCC4)C2)cc1 ZINC000682731695 1047216932 /nfs/dbraw/zinc/21/69/32/1047216932.db2.gz GBLKAQGVXJCHLL-VQTJNVASSA-N 2 1 312.501 4.211 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCSC(C)(C)C ZINC000398178822 1047328246 /nfs/dbraw/zinc/32/82/46/1047328246.db2.gz WMXISQJNVYVDFB-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCCC34CCCC4)C2)cc1 ZINC000328123267 1047328680 /nfs/dbraw/zinc/32/86/80/1047328680.db2.gz RXBFXLUIQDRLBF-WOJBJXKFSA-N 2 1 312.501 4.211 20 0 DIADMP CCCC[N@H+](CCCc1c[nH+]cn1C)[C@H](C)c1ccc(C)o1 ZINC000653522356 1047395790 /nfs/dbraw/zinc/39/57/90/1047395790.db2.gz FZUKCYMPLKIFRZ-MRXNPFEDSA-N 2 1 303.450 4.117 20 0 DIADMP CCCC[N@@H+](CCCc1c[nH+]cn1C)[C@H](C)c1ccc(C)o1 ZINC000653522356 1047395806 /nfs/dbraw/zinc/39/58/06/1047395806.db2.gz FZUKCYMPLKIFRZ-MRXNPFEDSA-N 2 1 303.450 4.117 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000108428250 1047400699 /nfs/dbraw/zinc/40/06/99/1047400699.db2.gz HUJQKYKGZGZQBD-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000108428250 1047400702 /nfs/dbraw/zinc/40/07/02/1047400702.db2.gz HUJQKYKGZGZQBD-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CC[C@H](CSc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623470842 1047422261 /nfs/dbraw/zinc/42/22/61/1047422261.db2.gz DYMPHOBUQFFAFV-HZPDHXFCSA-N 2 1 306.519 4.020 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CC[C@]4(CC[N@H+](C)C4)C3)cc2)cc1 ZINC001142309542 1047429071 /nfs/dbraw/zinc/42/90/71/1047429071.db2.gz GRUKQDMTLZEKFH-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CC[C@]4(CC[NH+](C)C4)C3)cc2)cc1 ZINC001142309542 1047429082 /nfs/dbraw/zinc/42/90/82/1047429082.db2.gz GRUKQDMTLZEKFH-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@]4(CC[NH+](C)C4)C3)cc2)cc1 ZINC001142309542 1047429087 /nfs/dbraw/zinc/42/90/87/1047429087.db2.gz GRUKQDMTLZEKFH-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001142383532 1047439102 /nfs/dbraw/zinc/43/91/02/1047439102.db2.gz IYZPHWGNGSCVRS-UHFFFAOYSA-N 2 1 308.469 4.207 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2cccc(Cl)c2Cl)CC1 ZINC001168324800 1047445971 /nfs/dbraw/zinc/44/59/71/1047445971.db2.gz XKJXCNPMSVHTEJ-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2C2CCC([NH+](C)C)CC2)cc1 ZINC001168324209 1047446491 /nfs/dbraw/zinc/44/64/91/1047446491.db2.gz KFMGNDXKJBGMAH-QLOJAFMTSA-N 2 1 316.489 4.095 20 0 DIADMP Cc1ccsc1C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000119317707 1047449442 /nfs/dbraw/zinc/44/94/42/1047449442.db2.gz NTZPKBPDWRJDSD-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP Cc1ccsc1C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000119317707 1047449446 /nfs/dbraw/zinc/44/94/46/1047449446.db2.gz NTZPKBPDWRJDSD-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC000121224605 1047515313 /nfs/dbraw/zinc/51/53/13/1047515313.db2.gz VTCVFZRTGNJERZ-RTBURBONSA-N 2 1 322.496 4.138 20 0 DIADMP C[N@@H+](Cc1cc(-c2ccccc2)cs1)C1CCC([NH3+])CC1 ZINC000843055442 1047526590 /nfs/dbraw/zinc/52/65/90/1047526590.db2.gz CESGDALBRIUEMS-UHFFFAOYSA-N 2 1 300.471 4.117 20 0 DIADMP Fc1ccc2oc(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2c1 ZINC000093563660 1047548468 /nfs/dbraw/zinc/54/84/68/1047548468.db2.gz WOBJWIIVDYWGPR-KRWDZBQOSA-N 2 1 316.420 4.022 20 0 DIADMP Fc1ccc2oc(C[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)cc2c1 ZINC000093563660 1047548470 /nfs/dbraw/zinc/54/84/70/1047548470.db2.gz WOBJWIIVDYWGPR-KRWDZBQOSA-N 2 1 316.420 4.022 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccc1N(C)C ZINC000537655604 1047569104 /nfs/dbraw/zinc/56/91/04/1047569104.db2.gz ZLCXMSVDKVJPAS-ROUUACIJSA-N 2 1 317.521 4.058 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001206639914 1047593488 /nfs/dbraw/zinc/59/34/88/1047593488.db2.gz GILQNQURKOMEIR-SFHVURJKSA-N 2 1 324.468 4.348 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1cc2ccccc2o1)C1CCCCC1 ZINC000315120083 1047598179 /nfs/dbraw/zinc/59/81/79/1047598179.db2.gz RZPIFKNLRWPHKE-UHFFFAOYSA-N 2 1 300.446 4.177 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1cc2ccccc2o1)C1CCCCC1 ZINC000315120083 1047598182 /nfs/dbraw/zinc/59/81/82/1047598182.db2.gz RZPIFKNLRWPHKE-UHFFFAOYSA-N 2 1 300.446 4.177 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(Cl)c(F)c1 ZINC001168356345 1047608115 /nfs/dbraw/zinc/60/81/15/1047608115.db2.gz PYUKMXDQSWQQNH-GFCCVEGCSA-N 2 1 310.844 4.004 20 0 DIADMP Cc1ccccc1C[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537842254 1047640351 /nfs/dbraw/zinc/64/03/51/1047640351.db2.gz YCKSSSBZLUHYLC-UHFFFAOYSA-N 2 1 323.484 4.129 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000537983233 1047650074 /nfs/dbraw/zinc/65/00/74/1047650074.db2.gz DCDXEAZDYTYYOF-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000537983233 1047650076 /nfs/dbraw/zinc/65/00/76/1047650076.db2.gz DCDXEAZDYTYYOF-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP C[N@@H+]1CCCC12CC[NH+](Cc1ccc(C(C)(C)C)cc1)CC2 ZINC000538097981 1047657732 /nfs/dbraw/zinc/65/77/32/1047657732.db2.gz YDVAJDWMKOAOBO-UHFFFAOYSA-N 2 1 300.490 4.044 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](Cc1ccc(C(C)(C)C)cc1)CC2 ZINC000538097981 1047657734 /nfs/dbraw/zinc/65/77/34/1047657734.db2.gz YDVAJDWMKOAOBO-UHFFFAOYSA-N 2 1 300.490 4.044 20 0 DIADMP CC(C)(C)C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1 ZINC000538398081 1047675032 /nfs/dbraw/zinc/67/50/32/1047675032.db2.gz DDRWCGPBTQQQDV-KXBFYZLASA-N 2 1 318.480 4.377 20 0 DIADMP Cc1ccc2cc[nH+]c(NCc3cccc(C[NH+](C)C)c3)c2c1 ZINC001156044672 1047698154 /nfs/dbraw/zinc/69/81/54/1047698154.db2.gz SANYELIWEJFTGU-UHFFFAOYSA-N 2 1 305.425 4.217 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2csc3ccccc23)[C@H](C)C1 ZINC000538717313 1047698984 /nfs/dbraw/zinc/69/89/84/1047698984.db2.gz TVPQFGBJUGZOFE-RHSMWYFYSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2csc3ccccc23)[C@H](C)C1 ZINC000538717313 1047698988 /nfs/dbraw/zinc/69/89/88/1047698988.db2.gz TVPQFGBJUGZOFE-RHSMWYFYSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2csc3ccccc23)[C@H](C)C1 ZINC000538717313 1047698989 /nfs/dbraw/zinc/69/89/89/1047698989.db2.gz TVPQFGBJUGZOFE-RHSMWYFYSA-N 2 1 302.487 4.063 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)s2)C1 ZINC000538750100 1047707508 /nfs/dbraw/zinc/70/75/08/1047707508.db2.gz ASCGCFZKNDHDRU-INIZCTEOSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC000538750100 1047707511 /nfs/dbraw/zinc/70/75/11/1047707511.db2.gz ASCGCFZKNDHDRU-INIZCTEOSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC000538750100 1047707517 /nfs/dbraw/zinc/70/75/17/1047707517.db2.gz ASCGCFZKNDHDRU-INIZCTEOSA-N 2 1 314.498 4.189 20 0 DIADMP Cc1c[nH+]c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)cc1C ZINC001156318615 1047707706 /nfs/dbraw/zinc/70/77/06/1047707706.db2.gz WSRQKOVEYHHUOU-VAMGGRTRSA-N 2 1 321.468 4.021 20 0 DIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752141 1047708536 /nfs/dbraw/zinc/70/85/36/1047708536.db2.gz LGQHBDVBNVOEAV-KRWDZBQOSA-N 2 1 312.457 4.029 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752141 1047708540 /nfs/dbraw/zinc/70/85/40/1047708540.db2.gz LGQHBDVBNVOEAV-KRWDZBQOSA-N 2 1 312.457 4.029 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752141 1047708541 /nfs/dbraw/zinc/70/85/41/1047708541.db2.gz LGQHBDVBNVOEAV-KRWDZBQOSA-N 2 1 312.457 4.029 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752141 1047708545 /nfs/dbraw/zinc/70/85/45/1047708545.db2.gz LGQHBDVBNVOEAV-KRWDZBQOSA-N 2 1 312.457 4.029 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cccs2)C2CCCC2)C1 ZINC000538985391 1047723854 /nfs/dbraw/zinc/72/38/54/1047723854.db2.gz RMKJPRCGIHIENN-YJBOKZPZSA-N 2 1 306.519 4.301 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(OC)c1 ZINC000539052586 1047728635 /nfs/dbraw/zinc/72/86/35/1047728635.db2.gz JGHKCTRKDSORCI-FXAWDEMLSA-N 2 1 318.505 4.104 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCC(F)(F)F)CC1)CC(C)C ZINC000539096925 1047735597 /nfs/dbraw/zinc/73/55/97/1047735597.db2.gz MPQCNSSOLTYJOZ-UHFFFAOYSA-N 2 1 308.432 4.019 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@H](C)c2ccccn2)CC1)CC(C)C ZINC000539098465 1047736630 /nfs/dbraw/zinc/73/66/30/1047736630.db2.gz OVKDUGUALIAAOC-GOSISDBHSA-N 2 1 317.521 4.223 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)cc1 ZINC000539300907 1047745401 /nfs/dbraw/zinc/74/54/01/1047745401.db2.gz QRQHKGUSUGAKSE-NVXWUHKLSA-N 2 1 306.519 4.322 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001159288147 1047826771 /nfs/dbraw/zinc/82/67/71/1047826771.db2.gz LNZCCSKBOJNXFT-OWZKRDHZSA-N 2 1 321.468 4.306 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048389 1047832927 /nfs/dbraw/zinc/83/29/27/1047832927.db2.gz ASNHONLBPYFSIF-KXBFYZLASA-N 2 1 324.459 4.372 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048389 1047832936 /nfs/dbraw/zinc/83/29/36/1047832936.db2.gz ASNHONLBPYFSIF-KXBFYZLASA-N 2 1 324.459 4.372 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCCC1)C1(Cc2ccccc2)CCCC1 ZINC001197563994 1047845732 /nfs/dbraw/zinc/84/57/32/1047845732.db2.gz DVDULLSKHSEBSQ-UHFFFAOYSA-N 2 1 314.517 4.350 20 0 DIADMP c1cc2cc(Nc3ccc(C4CC[NH2+]CC4)cc3)ccc2c[nH+]1 ZINC001159448502 1047845930 /nfs/dbraw/zinc/84/59/30/1047845930.db2.gz YBJKEDVKASNTAH-UHFFFAOYSA-N 2 1 303.409 4.445 20 0 DIADMP c1cc2cc[nH+]cc2c(Nc2ccc(C3CC[NH2+]CC3)cc2)c1 ZINC001159563707 1047867167 /nfs/dbraw/zinc/86/71/67/1047867167.db2.gz KJRKTEHMGGKPPG-UHFFFAOYSA-N 2 1 303.409 4.445 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)cc1Cl ZINC001183065744 1047886926 /nfs/dbraw/zinc/88/69/26/1047886926.db2.gz OYRNHGWXCWKVLT-QAPCUYQASA-N 2 1 308.897 4.201 20 0 DIADMP Cc1ccc(C[N@@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)cc1Cl ZINC001183065744 1047886938 /nfs/dbraw/zinc/88/69/38/1047886938.db2.gz OYRNHGWXCWKVLT-QAPCUYQASA-N 2 1 308.897 4.201 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)c1C ZINC001183268165 1047914300 /nfs/dbraw/zinc/91/43/00/1047914300.db2.gz GFBSSHJLSSMZOO-IFXJQAMLSA-N 2 1 320.546 4.498 20 0 DIADMP CCCc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479522925 1047915002 /nfs/dbraw/zinc/91/50/02/1047915002.db2.gz FBEIIEXNPPSSKR-PBPGXSGUSA-N 2 1 300.490 4.307 20 0 DIADMP CC[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(Cl)cc1 ZINC000479523855 1047915444 /nfs/dbraw/zinc/91/54/44/1047915444.db2.gz AGMURELJIPNNSI-DAWZGUTISA-N 2 1 306.881 4.398 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC(N2CCCCC2)C1)c1cccs1 ZINC000479529644 1047916056 /nfs/dbraw/zinc/91/60/56/1047916056.db2.gz UREOPQLXFLEBMA-JCYILVPMSA-N 2 1 306.519 4.442 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccs1 ZINC000479529644 1047916067 /nfs/dbraw/zinc/91/60/67/1047916067.db2.gz UREOPQLXFLEBMA-JCYILVPMSA-N 2 1 306.519 4.442 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2ccccc21 ZINC000479538100 1047922049 /nfs/dbraw/zinc/92/20/49/1047922049.db2.gz DLFPNOJOIDERMT-MZZRDLGESA-N 2 1 312.501 4.478 20 0 DIADMP Cc1cc([C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)C2CC2)ccc1F ZINC000479549251 1047926463 /nfs/dbraw/zinc/92/64/63/1047926463.db2.gz GESSCADGVLNBCJ-QLOJAFMTSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479532711 1047926541 /nfs/dbraw/zinc/92/65/41/1047926541.db2.gz YXNVUNSUAXDNDI-AFMYVXGZSA-N 2 1 312.501 4.287 20 0 DIADMP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479532712 1047926883 /nfs/dbraw/zinc/92/68/83/1047926883.db2.gz YXNVUNSUAXDNDI-QLOJAFMTSA-N 2 1 312.501 4.287 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)CCc1cccc(Cl)c1 ZINC001183511451 1047941103 /nfs/dbraw/zinc/94/11/03/1047941103.db2.gz OSFDRDBHASOGLX-UHFFFAOYSA-N 2 1 308.897 4.080 20 0 DIADMP CCc1cccc2cc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)oc21 ZINC000667533073 1047951064 /nfs/dbraw/zinc/95/10/64/1047951064.db2.gz FAMNGPSZYGGNNN-MRXNPFEDSA-N 2 1 309.413 4.098 20 0 DIADMP c1c2ccccc2[nH]c1[C@H]1CCCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000479689343 1047954309 /nfs/dbraw/zinc/95/43/09/1047954309.db2.gz SLPCDANBRRZEHH-HXUWFJFHSA-N 2 1 311.473 4.085 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCC[N@@H+]1CCCC[C@@H]1C ZINC000479908500 1048003143 /nfs/dbraw/zinc/00/31/43/1048003143.db2.gz AKESXAAWLDERPH-GJZGRUSLSA-N 2 1 323.550 4.490 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC000479908500 1048003155 /nfs/dbraw/zinc/00/31/55/1048003155.db2.gz AKESXAAWLDERPH-GJZGRUSLSA-N 2 1 323.550 4.490 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@@H]2C1 ZINC001184304043 1048022765 /nfs/dbraw/zinc/02/27/65/1048022765.db2.gz UTSANQYYJUXGQY-BBWFWOEESA-N 2 1 320.908 4.065 20 0 DIADMP C[NH+](C)CC(C)(C)C[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001198960452 1048022835 /nfs/dbraw/zinc/02/28/35/1048022835.db2.gz WJWBFBNSIGCWDS-UHFFFAOYSA-N 2 1 322.802 4.036 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)cc1 ZINC001184292411 1048026686 /nfs/dbraw/zinc/02/66/86/1048026686.db2.gz YOVISWCIIDSVPK-PWRODBHTSA-N 2 1 314.517 4.015 20 0 DIADMP CC[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc(F)ccc1F ZINC000480016756 1048029736 /nfs/dbraw/zinc/02/97/36/1048029736.db2.gz NMPOTAPNHJVKJS-INIZCTEOSA-N 2 1 310.432 4.315 20 0 DIADMP CC[NH+](CC)CC[C@@H]([NH2+]C[C@]1(C)CCCCO1)c1ccccc1 ZINC001184340358 1048031004 /nfs/dbraw/zinc/03/10/04/1048031004.db2.gz VWARQNLNWREFIU-UXHICEINSA-N 2 1 318.505 4.008 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000480046443 1048036696 /nfs/dbraw/zinc/03/66/96/1048036696.db2.gz FUIBBAPFHMYZNG-QGZVFWFLSA-N 2 1 308.469 4.489 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)CC1(C)C ZINC001199237547 1048045865 /nfs/dbraw/zinc/04/58/65/1048045865.db2.gz DBFOABKQFITQRG-ACBHZAAOSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC001199336872 1048056255 /nfs/dbraw/zinc/05/62/55/1048056255.db2.gz ZATRMBODYSKGMJ-WOJBJXKFSA-N 2 1 316.533 4.357 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](CC)c2cc(Cl)ccc2OC)CC1 ZINC000480139219 1048064019 /nfs/dbraw/zinc/06/40/19/1048064019.db2.gz OEFAJSPWBPTPDV-KRWDZBQOSA-N 2 1 324.896 4.264 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000554348393 1048073974 /nfs/dbraw/zinc/07/39/74/1048073974.db2.gz ATEAXITYRFTVNG-RTBURBONSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1cccc(-c2ccncc2)c1 ZINC000480193478 1048089320 /nfs/dbraw/zinc/08/93/20/1048089320.db2.gz KUXBAWHCXVUOFF-QGZVFWFLSA-N 2 1 311.473 4.130 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H](C1CCCCC1)[NH+](C)C ZINC000480219153 1048095337 /nfs/dbraw/zinc/09/53/37/1048095337.db2.gz CIFDRHULGTVGDZ-ZFWWWQNUSA-N 2 1 308.432 4.208 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000480232469 1048099470 /nfs/dbraw/zinc/09/94/70/1048099470.db2.gz OIYINSAJYOJDGI-INIZCTEOSA-N 2 1 314.498 4.156 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000480232469 1048099486 /nfs/dbraw/zinc/09/94/86/1048099486.db2.gz OIYINSAJYOJDGI-INIZCTEOSA-N 2 1 314.498 4.156 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1cccs1 ZINC000480235295 1048100056 /nfs/dbraw/zinc/10/00/56/1048100056.db2.gz SWYHXZJBVATECI-GOSISDBHSA-N 2 1 314.498 4.237 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1cccs1 ZINC000480235295 1048100071 /nfs/dbraw/zinc/10/00/71/1048100071.db2.gz SWYHXZJBVATECI-GOSISDBHSA-N 2 1 314.498 4.237 20 0 DIADMP CC(C)C[C@H](NCCC[N@@H+](C)C1CCCCC1)c1ccccn1 ZINC000480249301 1048103320 /nfs/dbraw/zinc/10/33/20/1048103320.db2.gz PMUDDJNINDOZSG-FQEVSTJZSA-N 2 1 317.521 4.413 20 0 DIADMP CC(C)C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccccn1 ZINC000480249301 1048103325 /nfs/dbraw/zinc/10/33/25/1048103325.db2.gz PMUDDJNINDOZSG-FQEVSTJZSA-N 2 1 317.521 4.413 20 0 DIADMP CC(C)C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccccn1 ZINC000480249301 1048103330 /nfs/dbraw/zinc/10/33/30/1048103330.db2.gz PMUDDJNINDOZSG-FQEVSTJZSA-N 2 1 317.521 4.413 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000480266031 1048106623 /nfs/dbraw/zinc/10/66/23/1048106623.db2.gz NPOZFFYSHCYUEI-FQEVSTJZSA-N 2 1 300.490 4.299 20 0 DIADMP CCC(CC)[NH+]1CCC([NH2+]C(C)(C)c2ccnc(Cl)c2)CC1 ZINC001161100914 1048110629 /nfs/dbraw/zinc/11/06/29/1048110629.db2.gz YMIOYKYBHRAGGT-UHFFFAOYSA-N 2 1 323.912 4.213 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@H+]2Cc2cnc(C)n2C)o1 ZINC000667658066 1048119234 /nfs/dbraw/zinc/11/92/34/1048119234.db2.gz YQEYEPOGHULCLL-QGZVFWFLSA-N 2 1 301.434 4.001 20 0 DIADMP CCc1ccc([C@H]2CCCCCN2Cc2cnc(C)n2C)o1 ZINC000667658066 1048119243 /nfs/dbraw/zinc/11/92/43/1048119243.db2.gz YQEYEPOGHULCLL-QGZVFWFLSA-N 2 1 301.434 4.001 20 0 DIADMP CC[N@H+](CC[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1)C(C)C ZINC001199991123 1048131175 /nfs/dbraw/zinc/13/11/75/1048131175.db2.gz RDRCOPAUBNCYOC-YZGWKJHDSA-N 2 1 302.506 4.279 20 0 DIADMP CC[N@@H+](CC[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1)C(C)C ZINC001199991123 1048131185 /nfs/dbraw/zinc/13/11/85/1048131185.db2.gz RDRCOPAUBNCYOC-YZGWKJHDSA-N 2 1 302.506 4.279 20 0 DIADMP CC[N@H+](CC[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1)C(C)C ZINC001199991120 1048131357 /nfs/dbraw/zinc/13/13/57/1048131357.db2.gz RDRCOPAUBNCYOC-MISYRCLQSA-N 2 1 302.506 4.279 20 0 DIADMP CC[N@@H+](CC[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1)C(C)C ZINC001199991120 1048131364 /nfs/dbraw/zinc/13/13/64/1048131364.db2.gz RDRCOPAUBNCYOC-MISYRCLQSA-N 2 1 302.506 4.279 20 0 DIADMP CC[N@@H+](C)Cc1cccc(CNc2cc(C)[nH+]c3ccccc23)c1 ZINC000480377374 1048132187 /nfs/dbraw/zinc/13/21/87/1048132187.db2.gz PZYPZJBKHVDAIF-UHFFFAOYSA-N 2 1 319.452 4.029 20 0 DIADMP CC(C)(C)CN(c1ccc2c([nH+]1)CCCC2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001161675107 1048153819 /nfs/dbraw/zinc/15/38/19/1048153819.db2.gz MCXFJGLNHFDPDK-QAQDUYKDSA-N 2 1 315.505 4.083 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480600518 1048186903 /nfs/dbraw/zinc/18/69/03/1048186903.db2.gz ISJNOIBWOPGMLM-QLFBSQMISA-N 2 1 323.550 4.033 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480600518 1048186909 /nfs/dbraw/zinc/18/69/09/1048186909.db2.gz ISJNOIBWOPGMLM-QLFBSQMISA-N 2 1 323.550 4.033 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)ccc1F ZINC000480613769 1048192423 /nfs/dbraw/zinc/19/24/23/1048192423.db2.gz QBDRMEIQVZKRLW-CABCVRRESA-N 2 1 310.432 4.270 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)c2ccccc12 ZINC000480633699 1048201244 /nfs/dbraw/zinc/20/12/44/1048201244.db2.gz YNTSJNIQDNVAMG-RYGJVYDSSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)c2ccccc12 ZINC000480633699 1048201257 /nfs/dbraw/zinc/20/12/57/1048201257.db2.gz YNTSJNIQDNVAMG-RYGJVYDSSA-N 2 1 324.468 4.126 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc2c(c1)COC2 ZINC000480636942 1048205570 /nfs/dbraw/zinc/20/55/70/1048205570.db2.gz GGHDIEOXOKMINJ-IAGOWNOFSA-N 2 1 316.489 4.022 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@H]1CC[NH+](C)C[C@H]1C)c1ccccc1 ZINC000554890890 1048219200 /nfs/dbraw/zinc/21/92/00/1048219200.db2.gz ZQIOHDZQDJRUOY-RLLQIKCJSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@H]1CC[NH+](C)C[C@H]1C)c1ccccc1 ZINC000554890890 1048219212 /nfs/dbraw/zinc/21/92/12/1048219212.db2.gz ZQIOHDZQDJRUOY-RLLQIKCJSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@H+](C)C[C@H]1C)c1ccccc1 ZINC000554890890 1048219223 /nfs/dbraw/zinc/21/92/23/1048219223.db2.gz ZQIOHDZQDJRUOY-RLLQIKCJSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@H]1CC[N@@H+](C)C[C@H]1C)c1ccccc1 ZINC000554890890 1048219235 /nfs/dbraw/zinc/21/92/35/1048219235.db2.gz ZQIOHDZQDJRUOY-RLLQIKCJSA-N 2 1 302.506 4.088 20 0 DIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3csc4ccccc34)C2)CC1 ZINC000554879463 1048220557 /nfs/dbraw/zinc/22/05/57/1048220557.db2.gz UEPLKVZKAHKTSP-INIZCTEOSA-N 2 1 314.498 4.065 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CCC[C@@H](C[NH3+])[C@H]3C)c(C)c12 ZINC001205915152 1048227198 /nfs/dbraw/zinc/22/71/98/1048227198.db2.gz OQXYGXOFUPZBRQ-OLZOCXBDSA-N 2 1 308.516 4.139 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CCC[C@H](C[NH3+])[C@@H]3C)c(C)c12 ZINC001205915155 1048227312 /nfs/dbraw/zinc/22/73/12/1048227312.db2.gz OQXYGXOFUPZBRQ-QWHCGFSZSA-N 2 1 308.516 4.139 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)oc2cc1C ZINC000480738101 1048230699 /nfs/dbraw/zinc/23/06/99/1048230699.db2.gz JOAFZSXLJSETHK-JQHSSLGASA-N 2 1 312.457 4.327 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)oc2cc1C ZINC000480738101 1048230711 /nfs/dbraw/zinc/23/07/11/1048230711.db2.gz JOAFZSXLJSETHK-JQHSSLGASA-N 2 1 312.457 4.327 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000554941117 1048235590 /nfs/dbraw/zinc/23/55/90/1048235590.db2.gz WFIQCOQERQNSAV-ZWKOTPCHSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000554941116 1048236383 /nfs/dbraw/zinc/23/63/83/1048236383.db2.gz WFIQCOQERQNSAV-ROUUACIJSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000554941115 1048236602 /nfs/dbraw/zinc/23/66/02/1048236602.db2.gz WFIQCOQERQNSAV-QZTJIDSGSA-N 2 1 314.517 4.463 20 0 DIADMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)C[C@H]1CC=CCC1 ZINC001201421447 1048261451 /nfs/dbraw/zinc/26/14/51/1048261451.db2.gz BVAWWPCJCLISGD-IBGZPJMESA-N 2 1 312.501 4.187 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@H]3C2)cc1 ZINC001201426333 1048262956 /nfs/dbraw/zinc/26/29/56/1048262956.db2.gz JAFLHSGTYWTDNR-FKBYEOEOSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]3C2)cc1 ZINC001201426333 1048262965 /nfs/dbraw/zinc/26/29/65/1048262965.db2.gz JAFLHSGTYWTDNR-FKBYEOEOSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]3C2)cc1 ZINC001201426333 1048262969 /nfs/dbraw/zinc/26/29/69/1048262969.db2.gz JAFLHSGTYWTDNR-FKBYEOEOSA-N 2 1 324.512 4.187 20 0 DIADMP C[NH+]1CCC([N@@H+](Cc2ccc(F)cc2)C[C@H]2CC=CCC2)CC1 ZINC001201427080 1048264105 /nfs/dbraw/zinc/26/41/05/1048264105.db2.gz KVUASPRNOQOHEI-KRWDZBQOSA-N 2 1 316.464 4.078 20 0 DIADMP C[NH+]1CCC([N@H+](Cc2ccc(F)cc2)C[C@H]2CC=CCC2)CC1 ZINC001201427080 1048264111 /nfs/dbraw/zinc/26/41/11/1048264111.db2.gz KVUASPRNOQOHEI-KRWDZBQOSA-N 2 1 316.464 4.078 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000481041991 1048296678 /nfs/dbraw/zinc/29/66/78/1048296678.db2.gz BUQSEDJTDXUQQL-HUUCEWRRSA-N 2 1 306.519 4.009 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3c(s2)CCCC3)C1 ZINC000481041988 1048298863 /nfs/dbraw/zinc/29/88/63/1048298863.db2.gz BUQSEDJTDXUQQL-CABCVRRESA-N 2 1 306.519 4.009 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053955 1048302067 /nfs/dbraw/zinc/30/20/67/1048302067.db2.gz QVHDPTROLCANHP-CABCVRRESA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053955 1048302072 /nfs/dbraw/zinc/30/20/72/1048302072.db2.gz QVHDPTROLCANHP-CABCVRRESA-N 2 1 324.896 4.121 20 0 DIADMP C[C@H]([NH2+]CCCCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000481051750 1048302305 /nfs/dbraw/zinc/30/23/05/1048302305.db2.gz CLZQACVAJDMNFH-ICSRJNTNSA-N 2 1 314.517 4.252 20 0 DIADMP CC(C)CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C1CC1 ZINC000555235895 1048304799 /nfs/dbraw/zinc/30/47/99/1048304799.db2.gz OGTUJHCXNOSMCB-QRFRQXIXSA-N 2 1 306.538 4.444 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CCCC2)CC[N@H+]1C ZINC000481163110 1048316115 /nfs/dbraw/zinc/31/61/15/1048316115.db2.gz DNLPUJWRDRFQDF-QAPCUYQASA-N 2 1 320.908 4.224 20 0 DIADMP CC[N@H+](Cc1ccccc1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001201604330 1048330084 /nfs/dbraw/zinc/33/00/84/1048330084.db2.gz QZKNYIKTVUFZMW-UHFFFAOYSA-N 2 1 322.496 4.216 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](CCc2ccccc2)CC1 ZINC001201604330 1048330097 /nfs/dbraw/zinc/33/00/97/1048330097.db2.gz QZKNYIKTVUFZMW-UHFFFAOYSA-N 2 1 322.496 4.216 20 0 DIADMP CC(C)CC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201617036 1048333382 /nfs/dbraw/zinc/33/33/82/1048333382.db2.gz FFHFDCKXUJKDQT-YTQUADARSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201617036 1048333394 /nfs/dbraw/zinc/33/33/94/1048333394.db2.gz FFHFDCKXUJKDQT-YTQUADARSA-N 2 1 320.546 4.327 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201617036 1048333409 /nfs/dbraw/zinc/33/34/09/1048333409.db2.gz FFHFDCKXUJKDQT-YTQUADARSA-N 2 1 320.546 4.327 20 0 DIADMP c1ccc(C[N@H+]2CC=C(Nc3ccc4c[nH+]ccc4c3)CC2)cc1 ZINC001175505745 1048340246 /nfs/dbraw/zinc/34/02/46/1048340246.db2.gz QWGIEWADXVAEBC-UHFFFAOYSA-N 2 1 315.420 4.437 20 0 DIADMP c1ccc(C[N@@H+]2CC=C(Nc3ccc4c[nH+]ccc4c3)CC2)cc1 ZINC001175505745 1048340261 /nfs/dbraw/zinc/34/02/61/1048340261.db2.gz QWGIEWADXVAEBC-UHFFFAOYSA-N 2 1 315.420 4.437 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000481308005 1048360722 /nfs/dbraw/zinc/36/07/22/1048360722.db2.gz ACMTVWYITUWBOK-RDTXWAMCSA-N 2 1 306.881 4.039 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](CCC(C)C)c2ccc(OC)cc2)C1 ZINC000481301217 1048361516 /nfs/dbraw/zinc/36/15/16/1048361516.db2.gz XZTDOXZKAZAIQU-YLJYHZDGSA-N 2 1 318.505 4.104 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](CC)C2)cc1 ZINC000481319100 1048364184 /nfs/dbraw/zinc/36/41/84/1048364184.db2.gz FKFLOCGKPVSDIU-ROUUACIJSA-N 2 1 318.505 4.248 20 0 DIADMP CCCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](CC)C2)cc1 ZINC000481319098 1048364498 /nfs/dbraw/zinc/36/44/98/1048364498.db2.gz FKFLOCGKPVSDIU-MSOLQXFVSA-N 2 1 318.505 4.248 20 0 DIADMP CCCCC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001201734467 1048373001 /nfs/dbraw/zinc/37/30/01/1048373001.db2.gz BDRIMCSTQGNQPV-UHFFFAOYSA-N 2 1 300.490 4.165 20 0 DIADMP CSc1ccc(CN[C@@H](C)c2ccc(-n3ccnc3)cc2)o1 ZINC001201851247 1048381481 /nfs/dbraw/zinc/38/14/81/1048381481.db2.gz SHPHLRBXBRSHFC-ZDUSSCGKSA-N 2 1 313.426 4.038 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555597468 1048402819 /nfs/dbraw/zinc/40/28/19/1048402819.db2.gz IHEIQFMXHKBPQP-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555597468 1048402824 /nfs/dbraw/zinc/40/28/24/1048402824.db2.gz IHEIQFMXHKBPQP-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000555597468 1048402831 /nfs/dbraw/zinc/40/28/31/1048402831.db2.gz IHEIQFMXHKBPQP-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000555597468 1048402834 /nfs/dbraw/zinc/40/28/34/1048402834.db2.gz IHEIQFMXHKBPQP-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001201947418 1048407722 /nfs/dbraw/zinc/40/77/22/1048407722.db2.gz YJBQKJTZMXEXCS-ZSYWTGECSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3cccc(F)c3)CCCCC2)CC[N@H+]1C ZINC000481539973 1048427456 /nfs/dbraw/zinc/42/74/56/1048427456.db2.gz FPCBNCFNVAEUPA-VQIMIIECSA-N 2 1 318.480 4.100 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCCC2)CC[N@H+]1C ZINC000481554235 1048428521 /nfs/dbraw/zinc/42/85/21/1048428521.db2.gz ASWGMHNMEIVOSV-MAUKXSAKSA-N 2 1 320.908 4.224 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](CCC(C)(C)C)CC2 ZINC001202065482 1048435344 /nfs/dbraw/zinc/43/53/44/1048435344.db2.gz PMRKCWADPQTYAH-GOSISDBHSA-N 2 1 318.505 4.392 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](CCC(C)(C)C)CC2 ZINC001202065483 1048435474 /nfs/dbraw/zinc/43/54/74/1048435474.db2.gz PMRKCWADPQTYAH-SFHVURJKSA-N 2 1 318.505 4.392 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001202086472 1048446803 /nfs/dbraw/zinc/44/68/03/1048446803.db2.gz AEJMXBWLDLUFNE-UHFFFAOYSA-N 2 1 302.506 4.409 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@@H+]1C ZINC000481717205 1048464204 /nfs/dbraw/zinc/46/42/04/1048464204.db2.gz JKVPPGDXJXIFAR-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@H+]1C ZINC000481717205 1048464209 /nfs/dbraw/zinc/46/42/09/1048464209.db2.gz JKVPPGDXJXIFAR-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](CC4CCCC4)CC[C@H]3C2)cc1 ZINC001202204830 1048480647 /nfs/dbraw/zinc/48/06/47/1048480647.db2.gz ICZVEBOXXKHSKF-SFTDATJTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]3C[NH+](CC4CCCC4)CC[C@H]3C2)cc1 ZINC001202204830 1048480653 /nfs/dbraw/zinc/48/06/53/1048480653.db2.gz ICZVEBOXXKHSKF-SFTDATJTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]3C[NH+](CC4CCCC4)CC[C@H]3C2)cc1 ZINC001202204830 1048480658 /nfs/dbraw/zinc/48/06/58/1048480658.db2.gz ICZVEBOXXKHSKF-SFTDATJTSA-N 2 1 312.501 4.021 20 0 DIADMP CC1(C)CCC[C@@H](C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202227571 1048487962 /nfs/dbraw/zinc/48/79/62/1048487962.db2.gz MVZBRIKNYMUCMY-UXHICEINSA-N 2 1 314.517 4.315 20 0 DIADMP C[C@]12C[NH+]([C@@H]3C=CCCCCC3)C[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001175975276 1048514233 /nfs/dbraw/zinc/51/42/33/1048514233.db2.gz XCVGHVNCVDNKSC-VSKRKVRLSA-N 2 1 324.512 4.329 20 0 DIADMP C[C@]12C[NH+]([C@@H]3C=CCCCCC3)C[C@H]1C[N@H+](Cc1ccccc1)C2 ZINC001175975276 1048514238 /nfs/dbraw/zinc/51/42/38/1048514238.db2.gz XCVGHVNCVDNKSC-VSKRKVRLSA-N 2 1 324.512 4.329 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@@H+]([C@@H]1C=CCCCCC1)C2 ZINC001175975276 1048514247 /nfs/dbraw/zinc/51/42/47/1048514247.db2.gz XCVGHVNCVDNKSC-VSKRKVRLSA-N 2 1 324.512 4.329 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@H+]([C@@H]1C=CCCCCC1)C2 ZINC001175975276 1048514256 /nfs/dbraw/zinc/51/42/56/1048514256.db2.gz XCVGHVNCVDNKSC-VSKRKVRLSA-N 2 1 324.512 4.329 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556037635 1048518414 /nfs/dbraw/zinc/51/84/14/1048518414.db2.gz HBRAZUFTIXSUJS-BVYCBKJFSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556037635 1048518425 /nfs/dbraw/zinc/51/84/25/1048518425.db2.gz HBRAZUFTIXSUJS-BVYCBKJFSA-N 2 1 322.496 4.433 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](CCc1ccc(Cl)cc1)C(C)C ZINC000482136875 1048560291 /nfs/dbraw/zinc/56/02/91/1048560291.db2.gz QHSSGRCDCPUIJR-SFHVURJKSA-N 2 1 319.880 4.092 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+][C@H](C)c1ccc2ccccc2n1 ZINC000482232640 1048572289 /nfs/dbraw/zinc/57/22/89/1048572289.db2.gz BGADDXBENQKXMC-QGZVFWFLSA-N 2 1 313.489 4.398 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC)cc1 ZINC000482340552 1048590338 /nfs/dbraw/zinc/59/03/38/1048590338.db2.gz ATOXMFDLGKKADR-PXNSSMCTSA-N 2 1 318.505 4.246 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359814 1048593855 /nfs/dbraw/zinc/59/38/55/1048593855.db2.gz QUFSBJSLCORPSD-KGLIPLIRSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359814 1048593871 /nfs/dbraw/zinc/59/38/71/1048593871.db2.gz QUFSBJSLCORPSD-KGLIPLIRSA-N 2 1 312.860 4.250 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccnc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000781426477 1048603691 /nfs/dbraw/zinc/60/36/91/1048603691.db2.gz OUEYGDVEKOPVOY-LZWOXQAQSA-N 2 1 321.896 4.039 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000482448291 1048608193 /nfs/dbraw/zinc/60/81/93/1048608193.db2.gz FSCJAPCJWSDSRQ-TZIWHRDSSA-N 2 1 322.496 4.210 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCCC(C)(C)CC2)cn1 ZINC000850037698 1048613168 /nfs/dbraw/zinc/61/31/68/1048613168.db2.gz GQVIMIWRZBMYOK-QGZVFWFLSA-N 2 1 312.461 4.024 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+](Cc2cccc(C(C)(C)C)c2)CC1 ZINC001176242846 1048613490 /nfs/dbraw/zinc/61/34/90/1048613490.db2.gz HILGOMQWRYFYHO-UHFFFAOYSA-N 2 1 314.517 4.434 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@]1(C)Cc1cccs1 ZINC001176665747 1048752688 /nfs/dbraw/zinc/75/26/88/1048752688.db2.gz XZQBKYLYNUSSLJ-GOSISDBHSA-N 2 1 317.502 4.130 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@]1(C)Cc1cccs1 ZINC001176665747 1048752696 /nfs/dbraw/zinc/75/26/96/1048752696.db2.gz XZQBKYLYNUSSLJ-GOSISDBHSA-N 2 1 317.502 4.130 20 0 DIADMP CC[NH+](CC)CCC[N@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC001190597702 1048764965 /nfs/dbraw/zinc/76/49/65/1048764965.db2.gz RPLMRXKCJHYTBF-CQSZACIVSA-N 2 1 316.411 4.430 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC001190597702 1048764972 /nfs/dbraw/zinc/76/49/72/1048764972.db2.gz RPLMRXKCJHYTBF-CQSZACIVSA-N 2 1 316.411 4.430 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC=C(c2cccc3ccccc32)CC1 ZINC001190628359 1048770493 /nfs/dbraw/zinc/77/04/93/1048770493.db2.gz XEKBCHNCQMKHRO-HXUWFJFHSA-N 2 1 320.480 4.413 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001190628359 1048770509 /nfs/dbraw/zinc/77/05/09/1048770509.db2.gz XEKBCHNCQMKHRO-HXUWFJFHSA-N 2 1 320.480 4.413 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001190628359 1048770521 /nfs/dbraw/zinc/77/05/21/1048770521.db2.gz XEKBCHNCQMKHRO-HXUWFJFHSA-N 2 1 320.480 4.413 20 0 DIADMP CCc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC001190651070 1048772788 /nfs/dbraw/zinc/77/27/88/1048772788.db2.gz GWCVLOOTIZVUMR-OAQYLSRUSA-N 2 1 314.517 4.193 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c(C)c1 ZINC001190650750 1048773272 /nfs/dbraw/zinc/77/32/72/1048773272.db2.gz GCLQYHZZGUSNFP-HXUWFJFHSA-N 2 1 314.517 4.247 20 0 DIADMP C[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C(C1CC1)C1CC1 ZINC001190673022 1048775321 /nfs/dbraw/zinc/77/53/21/1048775321.db2.gz IXBHBZQDYFLBCJ-UHFFFAOYSA-N 2 1 312.501 4.293 20 0 DIADMP FC(F)(F)CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC[NH+]1CCCCC1 ZINC001176702593 1048780593 /nfs/dbraw/zinc/78/05/93/1048780593.db2.gz XIHXSMCOEBHLBD-MQVJKMGUSA-N 2 1 318.427 4.058 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483495367 1048805152 /nfs/dbraw/zinc/80/51/52/1048805152.db2.gz YTOSEDBBLDIPMZ-TYCQWZJGSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483495367 1048805168 /nfs/dbraw/zinc/80/51/68/1048805168.db2.gz YTOSEDBBLDIPMZ-TYCQWZJGSA-N 2 1 308.469 4.317 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1 ZINC001177231601 1048852162 /nfs/dbraw/zinc/85/21/62/1048852162.db2.gz XAJYXGZMGCICDW-VQTJNVASSA-N 2 1 302.506 4.423 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001177245506 1048854536 /nfs/dbraw/zinc/85/45/36/1048854536.db2.gz UCZACFDLGKLDOK-NQIIRXRSSA-N 2 1 314.517 4.383 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001177245506 1048854559 /nfs/dbraw/zinc/85/45/59/1048854559.db2.gz UCZACFDLGKLDOK-NQIIRXRSSA-N 2 1 314.517 4.383 20 0 DIADMP CCC(CC)C[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001177257215 1048856343 /nfs/dbraw/zinc/85/63/43/1048856343.db2.gz RGJBXBSGHTUNHH-QGZVFWFLSA-N 2 1 302.506 4.444 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2sccc2Cl)C1 ZINC001177290783 1048858360 /nfs/dbraw/zinc/85/83/60/1048858360.db2.gz XWXBVLADNLFIGH-OKILXGFUSA-N 2 1 314.926 4.249 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc3ccoc32)C1 ZINC001177298892 1048860130 /nfs/dbraw/zinc/86/01/30/1048860130.db2.gz HPRCGVYSGSMWIC-MRXNPFEDSA-N 2 1 300.446 4.035 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1ccc(F)cc1F ZINC001177299445 1048860910 /nfs/dbraw/zinc/86/09/10/1048860910.db2.gz QUWOEJJDQNJARL-QKIRZYONSA-N 2 1 322.443 4.222 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1ccc(F)cc1F ZINC001177299442 1048862034 /nfs/dbraw/zinc/86/20/34/1048862034.db2.gz QUWOEJJDQNJARL-BVBGJJFLSA-N 2 1 322.443 4.222 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@H](C)[N@@H+]1CCCC[C@@H]1C ZINC001177278365 1048867194 /nfs/dbraw/zinc/86/71/94/1048867194.db2.gz WSZSKBBKKISGQU-QYZOEREBSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC001177278365 1048867208 /nfs/dbraw/zinc/86/72/08/1048867208.db2.gz WSZSKBBKKISGQU-QYZOEREBSA-N 2 1 302.506 4.108 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1cc(F)c(F)c(F)c1)C(C)C ZINC000483867972 1048875527 /nfs/dbraw/zinc/87/55/27/1048875527.db2.gz FWIYWROAJBOQOE-CYBMUJFWSA-N 2 1 316.411 4.263 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@H]1C ZINC001191184319 1048893494 /nfs/dbraw/zinc/89/34/94/1048893494.db2.gz XHIQATGMLACDHP-ROUUACIJSA-N 2 1 300.490 4.293 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)C1 ZINC001177483544 1048897620 /nfs/dbraw/zinc/89/76/20/1048897620.db2.gz WSKVRUPYLQCBGW-FQEVSTJZSA-N 2 1 322.496 4.484 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001191255184 1048897773 /nfs/dbraw/zinc/89/77/73/1048897773.db2.gz CECIOLBAVLARTH-OALUTQOASA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001191255184 1048897780 /nfs/dbraw/zinc/89/77/80/1048897780.db2.gz CECIOLBAVLARTH-OALUTQOASA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c(C)c1 ZINC001191255184 1048897792 /nfs/dbraw/zinc/89/77/92/1048897792.db2.gz CECIOLBAVLARTH-OALUTQOASA-N 2 1 302.506 4.479 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206304589 1048899179 /nfs/dbraw/zinc/89/91/79/1048899179.db2.gz NACIRPCJKCSRSA-SFHVURJKSA-N 2 1 302.487 4.161 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CC[C@H]2CCC[NH+]2C)o1 ZINC001191260078 1048900095 /nfs/dbraw/zinc/90/00/95/1048900095.db2.gz ZFSWUDGQLRVLJI-NUJGCVRESA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[NH+]2CC[C@H]2CCC[N@@H+]2C)o1 ZINC001191260078 1048900110 /nfs/dbraw/zinc/90/01/10/1048900110.db2.gz ZFSWUDGQLRVLJI-NUJGCVRESA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[NH+]2CC[C@H]2CCC[N@H+]2C)o1 ZINC001191260078 1048900120 /nfs/dbraw/zinc/90/01/20/1048900120.db2.gz ZFSWUDGQLRVLJI-NUJGCVRESA-N 2 1 304.478 4.099 20 0 DIADMP C[N@@H+](CCC(C)(C)C1CC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233859 1048907327 /nfs/dbraw/zinc/90/73/27/1048907327.db2.gz QBXVNBYWEHJWKT-IBGZPJMESA-N 2 1 314.517 4.267 20 0 DIADMP C[NH+](CCC(C)(C)C1CC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191233859 1048907343 /nfs/dbraw/zinc/90/73/43/1048907343.db2.gz QBXVNBYWEHJWKT-IBGZPJMESA-N 2 1 314.517 4.267 20 0 DIADMP C[NH+](CCC(C)(C)C1CC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191233859 1048907358 /nfs/dbraw/zinc/90/73/58/1048907358.db2.gz QBXVNBYWEHJWKT-IBGZPJMESA-N 2 1 314.517 4.267 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+]Cc1csc(C(F)(F)F)c1)C(C)(C)C ZINC001177821714 1048943711 /nfs/dbraw/zinc/94/37/11/1048943711.db2.gz CSOAPCJABHTFQI-LBPRGKRZSA-N 2 1 322.440 4.223 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001191381951 1048929593 /nfs/dbraw/zinc/92/95/93/1048929593.db2.gz NOHNIUHBIAQSOT-RQXATKFSSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001191381951 1048929607 /nfs/dbraw/zinc/92/96/07/1048929607.db2.gz NOHNIUHBIAQSOT-RQXATKFSSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001191381951 1048929620 /nfs/dbraw/zinc/92/96/20/1048929620.db2.gz NOHNIUHBIAQSOT-RQXATKFSSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001191381951 1048929631 /nfs/dbraw/zinc/92/96/31/1048929631.db2.gz NOHNIUHBIAQSOT-RQXATKFSSA-N 2 1 312.501 4.017 20 0 DIADMP CC(C)c1ccc(CCC[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001177816435 1048943988 /nfs/dbraw/zinc/94/39/88/1048943988.db2.gz OSQVRDJNXQHEFW-LJQANCHMSA-N 2 1 302.506 4.205 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191521813 1048957889 /nfs/dbraw/zinc/95/78/89/1048957889.db2.gz WEEGCYAYZVZACK-IHPCNDPISA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191521813 1048957904 /nfs/dbraw/zinc/95/79/04/1048957904.db2.gz WEEGCYAYZVZACK-IHPCNDPISA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191521813 1048957916 /nfs/dbraw/zinc/95/79/16/1048957916.db2.gz WEEGCYAYZVZACK-IHPCNDPISA-N 2 1 300.490 4.162 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000194920173 1048967995 /nfs/dbraw/zinc/96/79/95/1048967995.db2.gz BEXLPXQYBUGEGV-AWEZNQCLSA-N 2 1 306.519 4.322 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000194920187 1048968757 /nfs/dbraw/zinc/96/87/57/1048968757.db2.gz BEXLPXQYBUGEGV-CQSZACIVSA-N 2 1 306.519 4.322 20 0 DIADMP C[N@H+]1CCc2ccc(Nc3ccc(C[NH+]4CCCC4)cc3)cc2C1 ZINC001203827379 1049012469 /nfs/dbraw/zinc/01/24/69/1049012469.db2.gz ZOBBJHSBTVHHLH-UHFFFAOYSA-N 2 1 321.468 4.014 20 0 DIADMP CC[N@@H+](c1ccc(N[C@H](C)C2CC[NH+](C)CC2)cc1)C(C)C ZINC000776801794 1049022303 /nfs/dbraw/zinc/02/23/03/1049022303.db2.gz AAVAYPWUGMEAIT-MRXNPFEDSA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@H+](c1ccc(N[C@H](C)C2CC[NH+](C)CC2)cc1)C(C)C ZINC000776801794 1049022315 /nfs/dbraw/zinc/02/23/15/1049022315.db2.gz AAVAYPWUGMEAIT-MRXNPFEDSA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CCN(Cc2cccc(C)c2)CC1 ZINC001203891716 1049023633 /nfs/dbraw/zinc/02/36/33/1049023633.db2.gz HCQZKOXXIRBUJE-UHFFFAOYSA-N 2 1 322.496 4.482 20 0 DIADMP c1ccc(Sc2ccc(C[NH2+]CCC[NH+]3CCC3)cc2)cc1 ZINC001178398554 1049026215 /nfs/dbraw/zinc/02/62/15/1049026215.db2.gz RTUBRJVTBWTJLS-UHFFFAOYSA-N 2 1 312.482 4.023 20 0 DIADMP C[NH+](C)CC1(C[NH2+]Cc2cnc(C3CCCC3)s2)CCCC1 ZINC001178448979 1049033738 /nfs/dbraw/zinc/03/37/38/1049033738.db2.gz GYFHBPHUGOSUAL-UHFFFAOYSA-N 2 1 321.534 4.012 20 0 DIADMP CN(C)c1cc[nH+]cc1C[NH2+]C1CCC2(CCCCC2)CC1 ZINC001178493095 1049039094 /nfs/dbraw/zinc/03/90/94/1049039094.db2.gz SXIXYKHNDOAREX-UHFFFAOYSA-N 2 1 301.478 4.130 20 0 DIADMP C[N@H+](Cc1ccc(Oc2ccccc2)cc1)CC1CC[NH+](C)CC1 ZINC001203947145 1049041935 /nfs/dbraw/zinc/04/19/35/1049041935.db2.gz PWIQXDWGXJQOCG-UHFFFAOYSA-N 2 1 324.468 4.253 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195139139 1049069635 /nfs/dbraw/zinc/06/96/35/1049069635.db2.gz QBFLFKPQAYKRIU-SJLPKXTDSA-N 2 1 314.498 4.229 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@H]1CC[C@H](C)SC1)c1ccccc1 ZINC001204063342 1049076266 /nfs/dbraw/zinc/07/62/66/1049076266.db2.gz DKTPNPPSCQUJNM-WDSOQIARSA-N 2 1 320.546 4.333 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001192326981 1049078151 /nfs/dbraw/zinc/07/81/51/1049078151.db2.gz YRBSMVXUFLAAJZ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001192326981 1049078163 /nfs/dbraw/zinc/07/81/63/1049078163.db2.gz YRBSMVXUFLAAJZ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001192326981 1049078177 /nfs/dbraw/zinc/07/81/77/1049078177.db2.gz YRBSMVXUFLAAJZ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001192326981 1049078191 /nfs/dbraw/zinc/07/81/91/1049078191.db2.gz YRBSMVXUFLAAJZ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192324795 1049079560 /nfs/dbraw/zinc/07/95/60/1049079560.db2.gz LURIUJXBCNIBIK-TZIWHRDSSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192324795 1049079572 /nfs/dbraw/zinc/07/95/72/1049079572.db2.gz LURIUJXBCNIBIK-TZIWHRDSSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192324795 1049079584 /nfs/dbraw/zinc/07/95/84/1049079584.db2.gz LURIUJXBCNIBIK-TZIWHRDSSA-N 2 1 312.501 4.259 20 0 DIADMP C[N@H+](Cc1ccc(F)c(F)c1)C1CC[NH+](C2CCCCC2)CC1 ZINC001204226687 1049083513 /nfs/dbraw/zinc/08/35/13/1049083513.db2.gz LEIAZSSYAOPLHR-UHFFFAOYSA-N 2 1 322.443 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH+](C2CCCCC2)CC1 ZINC001204226687 1049083525 /nfs/dbraw/zinc/08/35/25/1049083525.db2.gz LEIAZSSYAOPLHR-UHFFFAOYSA-N 2 1 322.443 4.194 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccnc2ccccc12 ZINC001204091742 1049083462 /nfs/dbraw/zinc/08/34/62/1049083462.db2.gz RPUJXSTXAJXKII-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccnc2ccccc12 ZINC001204091742 1049083472 /nfs/dbraw/zinc/08/34/72/1049083472.db2.gz RPUJXSTXAJXKII-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccnc2ccccc12 ZINC001204091742 1049083483 /nfs/dbraw/zinc/08/34/83/1049083483.db2.gz RPUJXSTXAJXKII-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP CC[N@@H+](Cc1ccc(OCCC[NH+](C)C)cc1)C1CCCCC1 ZINC001204265534 1049124024 /nfs/dbraw/zinc/12/40/24/1049124024.db2.gz IIBLKFQUQLPOOG-UHFFFAOYSA-N 2 1 318.505 4.172 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC001179159042 1049137614 /nfs/dbraw/zinc/13/76/14/1049137614.db2.gz HRKPYJHFIZDYMS-IBGZPJMESA-N 2 1 308.469 4.175 20 0 DIADMP CC[C@@H](C)[C@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001192909091 1049146235 /nfs/dbraw/zinc/14/62/35/1049146235.db2.gz CGEPDUTZPSNCAP-SJORKVTESA-N 2 1 303.494 4.055 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC[C@H]1CC=CCC1 ZINC001179359567 1049160835 /nfs/dbraw/zinc/16/08/35/1049160835.db2.gz YNDRGFJJKSGSQD-IBGZPJMESA-N 2 1 314.517 4.481 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc2ccccc2n1 ZINC001204505553 1049176958 /nfs/dbraw/zinc/17/69/58/1049176958.db2.gz LPCBYJWOFPSORB-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc2ccccc2n1 ZINC001204505553 1049176963 /nfs/dbraw/zinc/17/69/63/1049176963.db2.gz LPCBYJWOFPSORB-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc2ccccc2n1 ZINC001204505553 1049176967 /nfs/dbraw/zinc/17/69/67/1049176967.db2.gz LPCBYJWOFPSORB-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249989 1049189921 /nfs/dbraw/zinc/18/99/21/1049189921.db2.gz QEHRSKOUKLXZTQ-NVXWUHKLSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249989 1049189930 /nfs/dbraw/zinc/18/99/30/1049189930.db2.gz QEHRSKOUKLXZTQ-NVXWUHKLSA-N 2 1 312.457 4.175 20 0 DIADMP CC(C)(C)[N@H+](Cc1ccccc1)CC1CC2(C1)CC[NH2+]CC2 ZINC001204604195 1049198674 /nfs/dbraw/zinc/19/86/74/1049198674.db2.gz FRZXSULVXWEFPA-UHFFFAOYSA-N 2 1 300.490 4.067 20 0 DIADMP CCSc1cccc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c1 ZINC001204616168 1049199926 /nfs/dbraw/zinc/19/99/26/1049199926.db2.gz PJJKCIDVKFIDTF-QGZVFWFLSA-N 2 1 306.519 4.105 20 0 DIADMP CCSc1cccc(C[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c1 ZINC001204616168 1049199931 /nfs/dbraw/zinc/19/99/31/1049199931.db2.gz PJJKCIDVKFIDTF-QGZVFWFLSA-N 2 1 306.519 4.105 20 0 DIADMP CCSc1cccc(C[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c1 ZINC001204616168 1049199934 /nfs/dbraw/zinc/19/99/34/1049199934.db2.gz PJJKCIDVKFIDTF-QGZVFWFLSA-N 2 1 306.519 4.105 20 0 DIADMP CCSc1cccc(C[NH+](C)CC[C@H]2CCCC[N@H+]2C)c1 ZINC001204616168 1049199939 /nfs/dbraw/zinc/19/99/39/1049199939.db2.gz PJJKCIDVKFIDTF-QGZVFWFLSA-N 2 1 306.519 4.105 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCc2ccc(C)c(C)c2)CC1 ZINC001204650191 1049210969 /nfs/dbraw/zinc/21/09/69/1049210969.db2.gz DBXYQRZERMJLQL-UHFFFAOYSA-N 2 1 316.533 4.290 20 0 DIADMP C[N@@H+](Cc1cccc(C[NH3+])c1)C(c1ccccc1)c1ccccc1 ZINC001204646199 1049211032 /nfs/dbraw/zinc/21/10/32/1049211032.db2.gz MXDNCAXOEURIFG-UHFFFAOYSA-N 2 1 316.448 4.367 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@@H]3CC[C@H]4C[N@H+](C)C[C@@H]43)c2)cc1 ZINC001179815317 1049211156 /nfs/dbraw/zinc/21/11/56/1049211156.db2.gz FXQWNFBTOPEUNU-FDFHNCONSA-N 2 1 320.480 4.092 20 0 DIADMP C[N@@H+](CC[C@H]1CCC[NH2+]C1)C(c1ccccc1)c1ccccc1 ZINC001204646448 1049211811 /nfs/dbraw/zinc/21/18/11/1049211811.db2.gz SIPVRFDGCSKTCK-GOSISDBHSA-N 2 1 308.469 4.098 20 0 DIADMP Cc1cccc([C@H]2CCC[N@H+]2Cc2cc3c(s2)C[NH2+]CC3)c1 ZINC001204848135 1049283926 /nfs/dbraw/zinc/28/39/26/1049283926.db2.gz LBNOVNYTBHSGRO-GOSISDBHSA-N 2 1 312.482 4.039 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc3c(s2)C[NH2+]CC3)c1 ZINC001204848140 1049284373 /nfs/dbraw/zinc/28/43/73/1049284373.db2.gz LBNOVNYTBHSGRO-SFHVURJKSA-N 2 1 312.482 4.039 20 0 DIADMP C[C@@H]1CCC[N@H+]1Cc1ccc(-c2cncc([C@H]3CCC[NH2+]3)c2)cc1 ZINC000906157137 1049293334 /nfs/dbraw/zinc/29/33/34/1049293334.db2.gz CFUQMDONCSVHET-IIBYNOLFSA-N 2 1 321.468 4.157 20 0 DIADMP C[C@@]1([NH3+])CCC[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001204946864 1049319179 /nfs/dbraw/zinc/31/91/79/1049319179.db2.gz UBNSBSLJSBYXJI-LJQANCHMSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001204946864 1049319190 /nfs/dbraw/zinc/31/91/90/1049319190.db2.gz UBNSBSLJSBYXJI-LJQANCHMSA-N 2 1 314.860 4.320 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc(C)c3)cc2)C1 ZINC001205018359 1049343866 /nfs/dbraw/zinc/34/38/66/1049343866.db2.gz TZIFDPMACVQFEY-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2C)C1 ZINC001205018714 1049344462 /nfs/dbraw/zinc/34/44/62/1049344462.db2.gz YKDBCRPTYMKJQC-GOSISDBHSA-N 2 1 324.468 4.219 20 0 DIADMP CC[NH+](CC)C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001180372124 1049354020 /nfs/dbraw/zinc/35/40/20/1049354020.db2.gz KPZPKBIIKKOKHR-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2c(F)cccc2F)CC1 ZINC000485854982 1049355519 /nfs/dbraw/zinc/35/55/19/1049355519.db2.gz LLVVZMQSHXVXPF-INIZCTEOSA-N 2 1 322.443 4.019 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2c(F)cccc2F)CC1 ZINC000485854982 1049355529 /nfs/dbraw/zinc/35/55/29/1049355529.db2.gz LLVVZMQSHXVXPF-INIZCTEOSA-N 2 1 322.443 4.019 20 0 DIADMP Cc1cccc(C[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1C ZINC001205067268 1049359588 /nfs/dbraw/zinc/35/95/88/1049359588.db2.gz OBPCOECQZFCMEC-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1cccc(C[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1C ZINC001205067268 1049359603 /nfs/dbraw/zinc/35/96/03/1049359603.db2.gz OBPCOECQZFCMEC-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2cccc3c4ccccc4sc32)CC1 ZINC001205102618 1049377779 /nfs/dbraw/zinc/37/77/79/1049377779.db2.gz UQUHAHLFJWPDSC-OAHLLOKOSA-N 2 1 310.466 4.368 20 0 DIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CCC[C@H]([NH3+])CC2)cc1 ZINC001205117149 1049384285 /nfs/dbraw/zinc/38/42/85/1049384285.db2.gz LYGADLIBARGQFT-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC001205117916 1049384456 /nfs/dbraw/zinc/38/44/56/1049384456.db2.gz YVTQALXSBRJYEV-LJQANCHMSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2-c2ccccc2Cl)C[C@H]1C[NH3+] ZINC001205141249 1049392731 /nfs/dbraw/zinc/39/27/31/1049392731.db2.gz ZJCQSKSZTBPPFE-GOEBONIOSA-N 2 1 314.860 4.034 20 0 DIADMP c1c(C[N@H+]2CCCC[C@H]2c2ccccc2)sc2c1C[NH2+]CC2 ZINC001205171441 1049401550 /nfs/dbraw/zinc/40/15/50/1049401550.db2.gz QQEOFFMXBIQXPK-SFHVURJKSA-N 2 1 312.482 4.121 20 0 DIADMP CC(C)c1ccc(CC[NH+]2CCC([NH+]3CCCCC3)CC2)cc1 ZINC001205193566 1049409536 /nfs/dbraw/zinc/40/95/36/1049409536.db2.gz SUHHNPPNHBIWDP-UHFFFAOYSA-N 2 1 314.517 4.303 20 0 DIADMP COc1ccc(-c2ccc(C[N@H+]3CCC[C@](C)([NH3+])CC3)cc2)cc1 ZINC001205264791 1049421355 /nfs/dbraw/zinc/42/13/55/1049421355.db2.gz MNEYBICJJQFESK-NRFANRHFSA-N 2 1 324.468 4.066 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccccc2Oc2ccccc2)CC1 ZINC001205272955 1049423748 /nfs/dbraw/zinc/42/37/48/1049423748.db2.gz BHYQGVBKQWCTGU-HXUWFJFHSA-N 2 1 310.441 4.182 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001194754442 1049424773 /nfs/dbraw/zinc/42/47/73/1049424773.db2.gz DQHMYAVNMANHGW-UHFFFAOYSA-N 2 1 322.496 4.444 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001194754442 1049424781 /nfs/dbraw/zinc/42/47/81/1049424781.db2.gz DQHMYAVNMANHGW-UHFFFAOYSA-N 2 1 322.496 4.444 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001205281618 1049426438 /nfs/dbraw/zinc/42/64/38/1049426438.db2.gz VYAVLHHSBJVPHQ-FQEVSTJZSA-N 2 1 312.432 4.196 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCC[C@](C)([NH3+])CC3)c2)cc1 ZINC001205280981 1049426574 /nfs/dbraw/zinc/42/65/74/1049426574.db2.gz NKVSYFWYSMKUGU-NRFANRHFSA-N 2 1 324.468 4.491 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC001205303492 1049432533 /nfs/dbraw/zinc/43/25/33/1049432533.db2.gz GGYRNICQDWUTGR-APWZRJJASA-N 2 1 308.469 4.079 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C[C@@H]1C[NH3+] ZINC001205305901 1049432596 /nfs/dbraw/zinc/43/25/96/1049432596.db2.gz UDYUHPJOARPQMR-ZFWWWQNUSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C[C@H]1C[NH3+] ZINC001205305900 1049432807 /nfs/dbraw/zinc/43/28/07/1049432807.db2.gz UDYUHPJOARPQMR-UKRRQHHQSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C[C@@H]1C[NH3+] ZINC001205304785 1049432931 /nfs/dbraw/zinc/43/29/31/1049432931.db2.gz PQUYSVDVFUFLLP-ZFWWWQNUSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@H]1C[NH3+] ZINC001205306622 1049432982 /nfs/dbraw/zinc/43/29/82/1049432982.db2.gz YIBCUPCVHNTBSV-GOEBONIOSA-N 2 1 308.425 4.003 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cc1 ZINC001205303337 1049433022 /nfs/dbraw/zinc/43/30/22/1049433022.db2.gz CRHZPNCPVHKFQL-IEBWSBKVSA-N 2 1 318.505 4.062 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385394 1049455974 /nfs/dbraw/zinc/45/59/74/1049455974.db2.gz DTZUMTHPBXQNNX-WJFTUGDTSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc2ccccc2[nH]1 ZINC000775622464 1049457352 /nfs/dbraw/zinc/45/73/52/1049457352.db2.gz WCQNHCKDQWBHII-IAGOWNOFSA-N 2 1 313.489 4.473 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000173441669 1049466932 /nfs/dbraw/zinc/46/69/32/1049466932.db2.gz DVHLEHZNXCLJQW-CQSZACIVSA-N 2 1 303.475 4.044 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCC[C@H]1C ZINC001181349610 1049470483 /nfs/dbraw/zinc/47/04/83/1049470483.db2.gz LNIHDQUAUQOQEB-QCFAMHMHSA-N 2 1 314.517 4.313 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc2ccccc2c(OC)c1 ZINC001181514272 1049486450 /nfs/dbraw/zinc/48/64/50/1049486450.db2.gz CRQVIWYZTHJXNG-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc(F)cc1 ZINC001205555065 1049497467 /nfs/dbraw/zinc/49/74/67/1049497467.db2.gz OGFAXVNYDYQMOY-OXQOHEQNSA-N 2 1 318.480 4.316 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC001205571890 1049500403 /nfs/dbraw/zinc/50/04/03/1049500403.db2.gz YVTCUJSMDTYHSH-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC[C@H]1C[NH3+] ZINC001205604443 1049508488 /nfs/dbraw/zinc/50/84/88/1049508488.db2.gz VROGDSQVSUUWDL-HKUYNNGSSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC[C@@H]1C[NH3+] ZINC001205602690 1049508836 /nfs/dbraw/zinc/50/88/36/1049508836.db2.gz LOHRWYFZQORSEJ-DYESRHJHSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC[C@@H]1C[NH3+] ZINC001205625349 1049514420 /nfs/dbraw/zinc/51/44/20/1049514420.db2.gz BBYDDHXRLPSFQG-MAUKXSAKSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CC[C@H]1C[NH3+] ZINC001205626254 1049514695 /nfs/dbraw/zinc/51/46/95/1049514695.db2.gz FBGUKWZBIVYPCM-LPHOPBHVSA-N 2 1 320.480 4.065 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)CC[C@H]1C[NH3+] ZINC001205626735 1049514770 /nfs/dbraw/zinc/51/47/70/1049514770.db2.gz IRQUZQQVTMVZLB-MJGOQNOKSA-N 2 1 308.469 4.160 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205638358 1049517638 /nfs/dbraw/zinc/51/76/38/1049517638.db2.gz MZEGBSMZCSCCNP-UKRRQHHQSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1cc(Cl)c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c(Cl)c1 ZINC001205639445 1049517711 /nfs/dbraw/zinc/51/77/11/1049517711.db2.gz ZAMVSLCNOPTXBY-OLZOCXBDSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c(Cl)c1Cl ZINC001205639087 1049519393 /nfs/dbraw/zinc/51/93/93/1049519393.db2.gz VOOYMEZQFMJVOT-YPMHNXCESA-N 2 1 315.288 4.109 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205651787 1049524210 /nfs/dbraw/zinc/52/42/10/1049524210.db2.gz JWQYRVQKYFUQDO-WCQYABFASA-N 2 1 315.288 4.109 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)C[C@H](C)c1cccc(Cl)c1 ZINC001205685464 1049533187 /nfs/dbraw/zinc/53/31/87/1049533187.db2.gz VRDYOERRJJAMJC-INIZCTEOSA-N 2 1 310.913 4.497 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@@H]1CC1(C)C ZINC000487270532 1049539835 /nfs/dbraw/zinc/53/98/35/1049539835.db2.gz PXKOXCBUWLAWMJ-QBYUYEEZSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)[C@@H]1CC1(C)C ZINC000487270532 1049539845 /nfs/dbraw/zinc/53/98/45/1049539845.db2.gz PXKOXCBUWLAWMJ-QBYUYEEZSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)[C@H]2CC2(C)C)CC1 ZINC000487278377 1049541279 /nfs/dbraw/zinc/54/12/79/1049541279.db2.gz SYYGMSCEKVLEAY-FRQCXROJSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1ccc(CN2CCC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)o1 ZINC001203301134 1049541935 /nfs/dbraw/zinc/54/19/35/1049541935.db2.gz DETCYSHGXWKGKX-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC001181933821 1049548719 /nfs/dbraw/zinc/54/87/19/1049548719.db2.gz QFGLZZUVLSFXMV-APWZRJJASA-N 2 1 306.469 4.029 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(C)c1 ZINC001205757964 1049556077 /nfs/dbraw/zinc/55/60/77/1049556077.db2.gz JLYKKTNFBPYXDE-MCWYWBIJSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(C)c1 ZINC001205757964 1049556088 /nfs/dbraw/zinc/55/60/88/1049556088.db2.gz JLYKKTNFBPYXDE-MCWYWBIJSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC001205757964 1049556099 /nfs/dbraw/zinc/55/60/99/1049556099.db2.gz JLYKKTNFBPYXDE-MCWYWBIJSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC001205757964 1049556113 /nfs/dbraw/zinc/55/61/13/1049556113.db2.gz JLYKKTNFBPYXDE-MCWYWBIJSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@@H](C)CC[C@H]1C[NH3+] ZINC001205826926 1049575887 /nfs/dbraw/zinc/57/58/87/1049575887.db2.gz DMXNXRIUUBAYRI-LPHOPBHVSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1C[C@@H](C)CC[C@H]1C[NH3+] ZINC001205826926 1049575901 /nfs/dbraw/zinc/57/59/01/1049575901.db2.gz DMXNXRIUUBAYRI-LPHOPBHVSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001205901242 1049594328 /nfs/dbraw/zinc/59/43/28/1049594328.db2.gz BZQKNARNCRBSCU-FUHWJXTLSA-N 2 1 310.441 4.038 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@@H](C[NH3+])[C@@H]1C ZINC001205902842 1049595863 /nfs/dbraw/zinc/59/58/63/1049595863.db2.gz LYBDFVRKINKUJY-ROUUACIJSA-N 2 1 318.505 4.205 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC001205903659 1049598203 /nfs/dbraw/zinc/59/82/03/1049598203.db2.gz QPNBRHXQCBNOAM-WMZOPIPTSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205913410 1049600483 /nfs/dbraw/zinc/60/04/83/1049600483.db2.gz ICCVEMMSVBUMIU-WBVHZDCISA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001205915145 1049601889 /nfs/dbraw/zinc/60/18/89/1049601889.db2.gz OONCVWORQORHMX-STQMWFEESA-N 2 1 306.500 4.036 20 0 DIADMP CSCC1CCC([NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)CC1 ZINC001205923710 1049602905 /nfs/dbraw/zinc/60/29/05/1049602905.db2.gz DHKMEHFGLLTNKD-ABHNRTSZSA-N 2 1 312.567 4.008 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)Cc1ccc(Cl)cc1 ZINC001205924032 1049603488 /nfs/dbraw/zinc/60/34/88/1049603488.db2.gz HAWYNCBDUYIGGT-APWZRJJASA-N 2 1 322.924 4.371 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001205923225 1049603551 /nfs/dbraw/zinc/60/35/51/1049603551.db2.gz LGTZDVBXVAQRHG-MAUKXSAKSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1)c1cccc2ccccc21 ZINC001205984675 1049618421 /nfs/dbraw/zinc/61/84/21/1049618421.db2.gz UCBQYDZLFJEACJ-YQVWRLOYSA-N 2 1 310.485 4.250 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001205995486 1049621386 /nfs/dbraw/zinc/62/13/86/1049621386.db2.gz OIYYGTGDKDTUIE-ZFWWWQNUSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CCC[C@H]1C[NH3+] ZINC001205996315 1049622505 /nfs/dbraw/zinc/62/25/05/1049622505.db2.gz WBVVPCVRGVSPAK-HKUYNNGSSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3)cc2)CCC[C@@H]1C[NH3+] ZINC001205996175 1049622517 /nfs/dbraw/zinc/62/25/17/1049622517.db2.gz VSWUNPHHODJHTB-DYESRHJHSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(-c3ccsc3)c2)CCC[C@@H]1C[NH3+] ZINC001206004983 1049625585 /nfs/dbraw/zinc/62/55/85/1049625585.db2.gz WFVAUBQSKDRPKF-MAUKXSAKSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2Oc2ccccc2)CCC[C@H]1C[NH3+] ZINC001206005978 1049627733 /nfs/dbraw/zinc/62/77/33/1049627733.db2.gz ZTLVNYKKSUKHOP-MSOLQXFVSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2-c2ccccc2)CCC[C@H]1C[NH3+] ZINC001206011523 1049629148 /nfs/dbraw/zinc/62/91/48/1049629148.db2.gz DCZOCRYLRLNLRO-MJGOQNOKSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2-c2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206011524 1049629228 /nfs/dbraw/zinc/62/92/28/1049629228.db2.gz DCZOCRYLRLNLRO-PKOBYXMFSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CCC[C@H]1C[NH3+] ZINC001206022090 1049632466 /nfs/dbraw/zinc/63/24/66/1049632466.db2.gz BEZKSNKKPNCPTD-GCJKJVERSA-N 2 1 322.496 4.084 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)cccc1-c1ccccc1 ZINC001206027273 1049632904 /nfs/dbraw/zinc/63/29/04/1049632904.db2.gz VNWMKZOHQMTBIH-YLJYHZDGSA-N 2 1 322.496 4.469 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2cccc3c4ccccc4sc32)C[C@H]1[NH3+] ZINC001206043616 1049639585 /nfs/dbraw/zinc/63/95/85/1049639585.db2.gz NOXGVEKMPHBTOE-CXAGYDPISA-N 2 1 310.466 4.224 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)C[C@H]1[NH3+] ZINC001206043616 1049639590 /nfs/dbraw/zinc/63/95/90/1049639590.db2.gz NOXGVEKMPHBTOE-CXAGYDPISA-N 2 1 310.466 4.224 20 0 DIADMP Fc1ccc([C@H]2CCC[N@@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001206049818 1049641309 /nfs/dbraw/zinc/64/13/09/1049641309.db2.gz RMMWGFRSAJLLFG-LJQANCHMSA-N 2 1 304.453 4.275 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001206049818 1049641310 /nfs/dbraw/zinc/64/13/10/1049641310.db2.gz RMMWGFRSAJLLFG-LJQANCHMSA-N 2 1 304.453 4.275 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)c1 ZINC000488433964 1049653282 /nfs/dbraw/zinc/65/32/82/1049653282.db2.gz RXDXZIGWWRJBFJ-QZTJIDSGSA-N 2 1 320.546 4.148 20 0 DIADMP CC(C)C1CC([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)C1 ZINC000488451002 1049657718 /nfs/dbraw/zinc/65/77/18/1049657718.db2.gz RGZLZJCONUMDJS-YHOLWWCESA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)C1CC([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC000488451002 1049657725 /nfs/dbraw/zinc/65/77/25/1049657725.db2.gz RGZLZJCONUMDJS-YHOLWWCESA-N 2 1 306.519 4.155 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)[C@H]1CC1(C)C ZINC001182542113 1049685364 /nfs/dbraw/zinc/68/53/64/1049685364.db2.gz BENBFFOKQNDEHX-WCIQWLHISA-N 2 1 314.517 4.136 20 0 DIADMP C[C@H]1C[NH2+]CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001206276782 1049696433 /nfs/dbraw/zinc/69/64/33/1049696433.db2.gz JPZUABRCXUXMQN-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001206276046 1049696729 /nfs/dbraw/zinc/69/67/29/1049696729.db2.gz AVTIKKJHAZQKHQ-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001206276046 1049696733 /nfs/dbraw/zinc/69/67/33/1049696733.db2.gz AVTIKKJHAZQKHQ-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[NH2+]C[C@H](C)C2)c1 ZINC001206277968 1049698970 /nfs/dbraw/zinc/69/89/70/1049698970.db2.gz XAJFHJRNTORZCC-INIZCTEOSA-N 2 1 308.469 4.012 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CC[NH2+]C[C@H](C)C2)c1 ZINC001206277968 1049698975 /nfs/dbraw/zinc/69/89/75/1049698975.db2.gz XAJFHJRNTORZCC-INIZCTEOSA-N 2 1 308.469 4.012 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@](C)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001206296796 1049702742 /nfs/dbraw/zinc/70/27/42/1049702742.db2.gz UTTJSWOIJUOMRO-UTKZUKDTSA-N 2 1 310.485 4.394 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001206296984 1049704248 /nfs/dbraw/zinc/70/42/48/1049704248.db2.gz VTYWAPTVKDOQDG-OAQYLSRUSA-N 2 1 308.469 4.305 20 0 DIADMP CC(C)Oc1ccc(Cl)cc1C[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206304351 1049706957 /nfs/dbraw/zinc/70/69/57/1049706957.db2.gz JCSLHFBPPCHROL-GOSISDBHSA-N 2 1 324.896 4.078 20 0 DIADMP CC(C)CCC[NH+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001196961729 1049710134 /nfs/dbraw/zinc/71/01/34/1049710134.db2.gz LLTMGNDNNWNRPX-SFTDATJTSA-N 2 1 314.517 4.267 20 0 DIADMP C[NH+](C)C1(C)CC[NH+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC001196983254 1049710548 /nfs/dbraw/zinc/71/05/48/1049710548.db2.gz VEQRKXFPUOFCTM-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206318906 1049710672 /nfs/dbraw/zinc/71/06/72/1049710672.db2.gz VBQMEPJOENBBLT-INIZCTEOSA-N 2 1 312.910 4.013 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(O)cc3)cc2)CC1 ZINC001206324355 1049712573 /nfs/dbraw/zinc/71/25/73/1049712573.db2.gz AFWMXNCOMIQATE-OAQYLSRUSA-N 2 1 324.468 4.010 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[N@H+]1CC[C@H]1CCC[NH+]1C ZINC001197246446 1049732348 /nfs/dbraw/zinc/73/23/48/1049732348.db2.gz RDXOTRXBWIEPOU-BHIYHBOVSA-N 2 1 300.490 4.127 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[NH+]1CC[C@H]1CCC[N@@H+]1C ZINC001197246446 1049732356 /nfs/dbraw/zinc/73/23/56/1049732356.db2.gz RDXOTRXBWIEPOU-BHIYHBOVSA-N 2 1 300.490 4.127 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](CCSC(C)(C)C)CC1 ZINC001197359503 1049741874 /nfs/dbraw/zinc/74/18/74/1049741874.db2.gz OQBOPYQULSNVKO-UHFFFAOYSA-N 2 1 312.567 4.249 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC001206540515 1049753060 /nfs/dbraw/zinc/75/30/60/1049753060.db2.gz BVVFJHJORCQDSU-JOCHJYFZSA-N 2 1 322.496 4.269 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC001206565504 1049756761 /nfs/dbraw/zinc/75/67/61/1049756761.db2.gz TYRVKNORRYVSSJ-OAQYLSRUSA-N 2 1 308.469 4.305 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCCC[C@@](C)(C[NH3+])C3)cc2)o1 ZINC001206564220 1049757085 /nfs/dbraw/zinc/75/70/85/1049757085.db2.gz NDRUPJNBYZGHFV-FQEVSTJZSA-N 2 1 312.457 4.206 20 0 DIADMP CC(C)[N@@H+](C[C@@H]1C[C@@H]1c1ccc(Cl)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206580128 1049761845 /nfs/dbraw/zinc/76/18/45/1049761845.db2.gz CJKLZRBQRFAZBM-YTQUADARSA-N 2 1 320.908 4.296 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2ccccn2)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206592189 1049763568 /nfs/dbraw/zinc/76/35/68/1049763568.db2.gz YALYMZNBGYUMTH-HXUWFJFHSA-N 2 1 323.484 4.101 20 0 DIADMP CCOc1ccc(Cl)cc1C[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206591324 1049763593 /nfs/dbraw/zinc/76/35/93/1049763593.db2.gz RKAKYJOEZFYVLN-QGZVFWFLSA-N 2 1 324.896 4.091 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@@H]1CCC[NH2+]CC1 ZINC001206591540 1049763965 /nfs/dbraw/zinc/76/39/65/1049763965.db2.gz SNJYYIAFVHHKTA-MRXNPFEDSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2ccccn2)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206592187 1049764613 /nfs/dbraw/zinc/76/46/13/1049764613.db2.gz YALYMZNBGYUMTH-FQEVSTJZSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2ccccc2)nc1)[C@H]1CCC[NH2+]CC1 ZINC001206590412 1049764672 /nfs/dbraw/zinc/76/46/72/1049764672.db2.gz LKMYQIQEGSUGHV-FQEVSTJZSA-N 2 1 323.484 4.101 20 0 DIADMP Cc1cc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc(C)c1Cl ZINC001206598735 1049766004 /nfs/dbraw/zinc/76/60/04/1049766004.db2.gz LWXRKAOZFHFQIO-KRWDZBQOSA-N 2 1 308.897 4.309 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1C ZINC001206599873 1049767124 /nfs/dbraw/zinc/76/71/24/1049767124.db2.gz XYQXQJWBPBRPDN-QGZVFWFLSA-N 2 1 308.897 4.309 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)C1 ZINC001206606537 1049769052 /nfs/dbraw/zinc/76/90/52/1049769052.db2.gz OMLSUZPSCKTSMA-GOSISDBHSA-N 2 1 310.441 4.040 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001206622796 1049771973 /nfs/dbraw/zinc/77/19/73/1049771973.db2.gz HBSNVETVPISYKR-HNNXBMFYSA-N 2 1 308.425 4.147 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC001206624316 1049772206 /nfs/dbraw/zinc/77/22/06/1049772206.db2.gz UEDRIGBGARUCJF-MRXNPFEDSA-N 2 1 308.425 4.147 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCCC[C@@H](C[NH3+])C3)cc2)cc1 ZINC001206624852 1049772322 /nfs/dbraw/zinc/77/23/22/1049772322.db2.gz YZNBQKBWXSFIJD-IBGZPJMESA-N 2 1 308.469 4.223 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2sc(Cl)c3ccccc32)C1 ZINC001206646299 1049774827 /nfs/dbraw/zinc/77/48/27/1049774827.db2.gz AIPBENIRRDHCNI-LBPRGKRZSA-N 2 1 308.878 4.116 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC001206680861 1049778087 /nfs/dbraw/zinc/77/80/87/1049778087.db2.gz VOABZRXUQNXDPG-LJQANCHMSA-N 2 1 322.496 4.140 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001206767814 1049795183 /nfs/dbraw/zinc/79/51/83/1049795183.db2.gz FLLGDWCKABZBCR-UONOGXRCSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001206769710 1049797040 /nfs/dbraw/zinc/79/70/40/1049797040.db2.gz POBNLZHIHNDXRW-IAGOWNOFSA-N 2 1 310.441 4.038 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)[N@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000490046289 1049797495 /nfs/dbraw/zinc/79/74/95/1049797495.db2.gz UJCMTNDHCQOVAY-UYAOXDASSA-N 2 1 300.490 4.049 20 0 DIADMP CC[C@H](C[N@H+]1CCCC[C@H]1[C@H](C)C[NH+](C)C)c1ccccc1 ZINC001206800780 1049802296 /nfs/dbraw/zinc/80/22/96/1049802296.db2.gz MYKZHJDACAQCSD-GGPKGHCWSA-N 2 1 302.506 4.232 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@H]3C)c2)cc1 ZINC001206806542 1049803542 /nfs/dbraw/zinc/80/35/42/1049803542.db2.gz GNBHMYUTKYWETC-IEBWSBKVSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001206811471 1049805754 /nfs/dbraw/zinc/80/57/54/1049805754.db2.gz UZACRYWEYKBJGZ-RDJZCZTQSA-N 2 1 312.432 4.052 20 0 DIADMP CC[NH+](CC)C1CC[NH+](C[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1 ZINC001207182675 1049852364 /nfs/dbraw/zinc/85/23/64/1049852364.db2.gz ABRVGSFHLYLREY-LPHOPBHVSA-N 2 1 320.908 4.250 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)C[C@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001207189374 1049856439 /nfs/dbraw/zinc/85/64/39/1049856439.db2.gz AVMYOBRBDLFTHC-SJLPKXTDSA-N 2 1 308.897 4.107 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001207185615 1049857262 /nfs/dbraw/zinc/85/72/62/1049857262.db2.gz QSTLXLIXIWEPJS-HOCLYGCPSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001207185615 1049857271 /nfs/dbraw/zinc/85/72/71/1049857271.db2.gz QSTLXLIXIWEPJS-HOCLYGCPSA-N 2 1 320.443 4.494 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)C[C@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001207189365 1049857748 /nfs/dbraw/zinc/85/77/48/1049857748.db2.gz AVMYOBRBDLFTHC-AEFFLSMTSA-N 2 1 308.897 4.107 20 0 DIADMP C[C@H]1CCCCC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207291334 1049876006 /nfs/dbraw/zinc/87/60/06/1049876006.db2.gz NUXCVDRGOOUYNP-SFHVURJKSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491061214 1049883417 /nfs/dbraw/zinc/88/34/17/1049883417.db2.gz ZSAYHHWFAHNAFM-ZWKOTPCHSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491061214 1049883422 /nfs/dbraw/zinc/88/34/22/1049883422.db2.gz ZSAYHHWFAHNAFM-ZWKOTPCHSA-N 2 1 318.480 4.475 20 0 DIADMP C[N@H+](CCC1CC[NH+](C)CC1)Cc1c(Cl)cccc1Cl ZINC001207482985 1049896939 /nfs/dbraw/zinc/89/69/39/1049896939.db2.gz BICPTZDQDMDGBC-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C[N@@H+](CCC1CC[NH+](C)CC1)Cc1c(Cl)cccc1Cl ZINC001207482985 1049896942 /nfs/dbraw/zinc/89/69/42/1049896942.db2.gz BICPTZDQDMDGBC-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C[C@H]1C[N@@H+](CCC2CC[NH+](C)CC2)CCc2ccc(Cl)cc21 ZINC001207487751 1049897453 /nfs/dbraw/zinc/89/74/53/1049897453.db2.gz QGQUFUYVEHPZIW-HNNXBMFYSA-N 2 1 320.908 4.034 20 0 DIADMP C[N@@H+](CCC1CC[NH+](C)CC1)Cc1cc(Cl)cc(Cl)c1 ZINC001207489137 1049897535 /nfs/dbraw/zinc/89/75/35/1049897535.db2.gz UTURVINOIXJBTA-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C1=CCC(CC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001207509646 1049900540 /nfs/dbraw/zinc/90/05/40/1049900540.db2.gz NTYLGBGKGRWKSB-TZIWHRDSSA-N 2 1 310.485 4.300 20 0 DIADMP C1=CCC(CC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001207509646 1049900548 /nfs/dbraw/zinc/90/05/48/1049900548.db2.gz NTYLGBGKGRWKSB-TZIWHRDSSA-N 2 1 310.485 4.300 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1ccc(SC(F)(F)F)cc1 ZINC000221790862 1049908922 /nfs/dbraw/zinc/90/89/22/1049908922.db2.gz WFHACQLKNUPTAO-UHFFFAOYSA-N 2 1 320.424 4.118 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(SC(F)(F)F)cc1 ZINC000221790862 1049908928 /nfs/dbraw/zinc/90/89/28/1049908928.db2.gz WFHACQLKNUPTAO-UHFFFAOYSA-N 2 1 320.424 4.118 20 0 DIADMP CC[NH+](CC)C1CC[NH+](CCCc2cccc(Cl)c2)CC1 ZINC001207589052 1049913469 /nfs/dbraw/zinc/91/34/69/1049913469.db2.gz CDBKNFVDXJKLGH-UHFFFAOYSA-N 2 1 308.897 4.079 20 0 DIADMP c1ccc(C2(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)CC2)cc1 ZINC001207838833 1049943775 /nfs/dbraw/zinc/94/37/75/1049943775.db2.gz URALFOGDYRXYRL-FQEVSTJZSA-N 2 1 312.501 4.059 20 0 DIADMP CC(C)(C)Oc1cccc(C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC001207837020 1049943959 /nfs/dbraw/zinc/94/39/59/1049943959.db2.gz KXIBPIKLRRZPSJ-UHFFFAOYSA-N 2 1 318.505 4.216 20 0 DIADMP CC(C)(C)Oc1cccc(C[N@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC001207837020 1049943972 /nfs/dbraw/zinc/94/39/72/1049943972.db2.gz KXIBPIKLRRZPSJ-UHFFFAOYSA-N 2 1 318.505 4.216 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)c1ccccc1 ZINC001207907763 1049952608 /nfs/dbraw/zinc/95/26/08/1049952608.db2.gz XPJZAOKEIDQFGN-UYAOXDASSA-N 2 1 300.490 4.131 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)ccc1F ZINC000571901459 1049970922 /nfs/dbraw/zinc/97/09/22/1049970922.db2.gz FQKHPVKYQJGQKK-UYAOXDASSA-N 2 1 312.432 4.059 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)ccc1F ZINC000571901459 1049970923 /nfs/dbraw/zinc/97/09/23/1049970923.db2.gz FQKHPVKYQJGQKK-UYAOXDASSA-N 2 1 312.432 4.059 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1Cl)CC1(C)CC[NH+](C)CC1 ZINC001208105721 1049973940 /nfs/dbraw/zinc/97/39/40/1049973940.db2.gz BEBDZXMQATVVSX-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001208215666 1049986515 /nfs/dbraw/zinc/98/65/15/1049986515.db2.gz CZPHZALGBYPMSZ-GOSISDBHSA-N 2 1 324.553 4.026 20 0 DIADMP C[C@H](CCc1ccco1)N[C@H](C[NH3+])c1ccc2ccccc2c1 ZINC000572112040 1049994613 /nfs/dbraw/zinc/99/46/13/1049994613.db2.gz AIGHHHBOMIIIKS-FOIQADDNSA-N 2 1 308.425 4.044 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC001208603918 1049997692 /nfs/dbraw/zinc/99/76/92/1049997692.db2.gz IYPGRLQMUSLSFH-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)Cc2cccc(Cl)c2Cl)CC1 ZINC001208597962 1049997755 /nfs/dbraw/zinc/99/77/55/1049997755.db2.gz NWLWFKMOTAMEPE-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccc(F)cc1)C1CCN(C)CC1 ZINC001208734442 1050007346 /nfs/dbraw/zinc/00/73/46/1050007346.db2.gz YKEDTCWUIAGFQB-PLNGDYQASA-N 2 1 304.453 4.078 20 0 DIADMP CC(C)CCC[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001208736381 1050007685 /nfs/dbraw/zinc/00/76/85/1050007685.db2.gz YKSYZKHNVYYGGB-UHFFFAOYSA-N 2 1 304.478 4.004 20 0 DIADMP CC(C)CCC[N@@H+](Cc1ccc(F)cc1)C1CCN(C)CC1 ZINC001208737589 1050008397 /nfs/dbraw/zinc/00/83/97/1050008397.db2.gz RKRIUQLSFHVCGS-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP Fc1ccc(CCC[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001208774033 1050009244 /nfs/dbraw/zinc/00/92/44/1050009244.db2.gz XRHLPNRQTIOEML-FQEVSTJZSA-N 2 1 318.480 4.099 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCC34CCCCC4)C2)cc1 ZINC001208934288 1050026093 /nfs/dbraw/zinc/02/60/93/1050026093.db2.gz YOEVTNJUEWYOTL-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC34CCCCC4)C2)cc1 ZINC001208934288 1050026098 /nfs/dbraw/zinc/02/60/98/1050026098.db2.gz YOEVTNJUEWYOTL-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCC34CCCCC4)C2)cc1 ZINC001208934288 1050026102 /nfs/dbraw/zinc/02/61/02/1050026102.db2.gz YOEVTNJUEWYOTL-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CCC34CCCCC4)C2)cc1 ZINC001208934288 1050026106 /nfs/dbraw/zinc/02/61/06/1050026106.db2.gz YOEVTNJUEWYOTL-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CC4(C3)CCCCC4)C2)cc1 ZINC001208938254 1050026694 /nfs/dbraw/zinc/02/66/94/1050026694.db2.gz AIBCPYJXYUDQIH-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC[C@@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208938163 1050027077 /nfs/dbraw/zinc/02/70/77/1050027077.db2.gz VIBFIHNOEMNUJX-PCCBWWKXSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CC[C@@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208938163 1050027081 /nfs/dbraw/zinc/02/70/81/1050027081.db2.gz VIBFIHNOEMNUJX-PCCBWWKXSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CC[C@@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208938163 1050027083 /nfs/dbraw/zinc/02/70/83/1050027083.db2.gz VIBFIHNOEMNUJX-PCCBWWKXSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H](C[NH+]3C4CCCC3CCC4)C2)cc1 ZINC001208944980 1050027179 /nfs/dbraw/zinc/02/71/79/1050027179.db2.gz QDLLVYDIRKPIKH-QNGMFEMESA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3C4CCCC3CCC4)C2)cc1 ZINC001208944980 1050027184 /nfs/dbraw/zinc/02/71/84/1050027184.db2.gz QDLLVYDIRKPIKH-QNGMFEMESA-N 2 1 312.501 4.306 20 0 DIADMP CC[C@H]1CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208938320 1050027194 /nfs/dbraw/zinc/02/71/94/1050027194.db2.gz ASZZZTXZUVEMMF-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H]1CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208938320 1050027198 /nfs/dbraw/zinc/02/71/98/1050027198.db2.gz ASZZZTXZUVEMMF-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H]1CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208938320 1050027201 /nfs/dbraw/zinc/02/72/01/1050027201.db2.gz ASZZZTXZUVEMMF-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1ccccc1C[N@@H+](C)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208937843 1050028116 /nfs/dbraw/zinc/02/81/16/1050028116.db2.gz VKYHPQRFMVUXGN-OAQYLSRUSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccccc1C[NH+](C)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208937843 1050028123 /nfs/dbraw/zinc/02/81/23/1050028123.db2.gz VKYHPQRFMVUXGN-OAQYLSRUSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccccc1C[NH+](C)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208937843 1050028128 /nfs/dbraw/zinc/02/81/28/1050028128.db2.gz VKYHPQRFMVUXGN-OAQYLSRUSA-N 2 1 322.496 4.339 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC4CCC(CC4)C3)C2)cc1 ZINC001208943587 1050028898 /nfs/dbraw/zinc/02/88/98/1050028898.db2.gz LZAJFIQHVZRBPZ-CBNMVNINSA-N 2 1 312.501 4.021 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3ccc(C)cc23)CC1 ZINC001209499595 1050063495 /nfs/dbraw/zinc/06/34/95/1050063495.db2.gz JAVPMJYZYUSCMI-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP CC(C)Oc1cccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000590786309 1050106670 /nfs/dbraw/zinc/10/66/70/1050106670.db2.gz PILUOYPFBXZJTR-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP CCSCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348068144 1050173675 /nfs/dbraw/zinc/17/36/75/1050173675.db2.gz DTEUZMPEIZFLPP-CABCVRRESA-N 2 1 317.502 4.363 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)c1 ZINC000591692605 1050196532 /nfs/dbraw/zinc/19/65/32/1050196532.db2.gz VUNFFJSWKUWHKD-FGZHOGPDSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)c1 ZINC000591692605 1050196540 /nfs/dbraw/zinc/19/65/40/1050196540.db2.gz VUNFFJSWKUWHKD-FGZHOGPDSA-N 2 1 320.480 4.378 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccnc(Cl)c1 ZINC000157539549 1050230821 /nfs/dbraw/zinc/23/08/21/1050230821.db2.gz MBFIQKGTEMNDAI-AWEZNQCLSA-N 2 1 321.896 4.183 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1cc2ccccc2o1)C(C)(C)C ZINC000498406871 1050265151 /nfs/dbraw/zinc/26/51/51/1050265151.db2.gz DHZLSJFTDBBKFP-SFHVURJKSA-N 2 1 311.429 4.315 20 0 DIADMP C[NH+](C)CC1CC[NH+](c2ccc(NCC3(C)CCC3)cc2)CC1 ZINC000766213139 1050397429 /nfs/dbraw/zinc/39/74/29/1050397429.db2.gz LLMWUBXFQCRFHR-UHFFFAOYSA-N 2 1 315.505 4.067 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000480897098 1050413009 /nfs/dbraw/zinc/41/30/09/1050413009.db2.gz FBAQOGFMQFWEDG-HUUCEWRRSA-N 2 1 323.550 4.348 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171131121 1050455058 /nfs/dbraw/zinc/45/50/58/1050455058.db2.gz VKIRGXMLYFEZBM-LJQANCHMSA-N 2 1 320.908 4.004 20 0 DIADMP C[C@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000574581009 1050496061 /nfs/dbraw/zinc/49/60/61/1050496061.db2.gz LYEXJGNYPZAVOB-QWHCGFSZSA-N 2 1 320.889 4.380 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000738312747 1050530979 /nfs/dbraw/zinc/53/09/79/1050530979.db2.gz VQTQHEJQZLNLIT-LBPRGKRZSA-N 2 1 315.288 4.328 20 0 DIADMP CCc1cccc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c1 ZINC001144321360 1050542725 /nfs/dbraw/zinc/54/27/25/1050542725.db2.gz JCNGFLSNGFPELZ-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP CCc1cccc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c1 ZINC001144321360 1050542731 /nfs/dbraw/zinc/54/27/31/1050542731.db2.gz JCNGFLSNGFPELZ-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(Cl)cc(OC)c2)CC1 ZINC001144495057 1050601353 /nfs/dbraw/zinc/60/13/53/1050601353.db2.gz MRIZLYQBGYGFQO-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(Cl)cc(OC)c2)CC1 ZINC001144495057 1050601359 /nfs/dbraw/zinc/60/13/59/1050601359.db2.gz MRIZLYQBGYGFQO-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP CCSC1(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000595100239 1050608082 /nfs/dbraw/zinc/60/80/82/1050608082.db2.gz QGAVQDXGUYCBMK-AWEZNQCLSA-N 2 1 315.486 4.117 20 0 DIADMP CCSC1(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CC1 ZINC000595100240 1050608293 /nfs/dbraw/zinc/60/82/93/1050608293.db2.gz QGAVQDXGUYCBMK-CQSZACIVSA-N 2 1 315.486 4.117 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H](C)CCCC(C)C)CC1 ZINC001170079373 1050629508 /nfs/dbraw/zinc/62/95/08/1050629508.db2.gz CXBXSHKMCNPOIS-INIZCTEOSA-N 2 1 303.494 4.144 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@@H+]1C ZINC000575171826 1050653104 /nfs/dbraw/zinc/65/31/04/1050653104.db2.gz JFXVCUOPEDQEQM-PXNSSMCTSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@H+]1C ZINC000575171826 1050653115 /nfs/dbraw/zinc/65/31/15/1050653115.db2.gz JFXVCUOPEDQEQM-PXNSSMCTSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171826 1050653126 /nfs/dbraw/zinc/65/31/26/1050653126.db2.gz JFXVCUOPEDQEQM-PXNSSMCTSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171826 1050653135 /nfs/dbraw/zinc/65/31/35/1050653135.db2.gz JFXVCUOPEDQEQM-PXNSSMCTSA-N 2 1 310.485 4.187 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)CC1 ZINC000788480965 1050687172 /nfs/dbraw/zinc/68/71/72/1050687172.db2.gz DFIXMNZAWICPCH-UHFFFAOYSA-N 2 1 322.443 4.051 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3(C)CCC3)C2)s1 ZINC001170085521 1050696988 /nfs/dbraw/zinc/69/69/88/1050696988.db2.gz JSBUZHCWGDFAAB-MRXNPFEDSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3(C)CCC3)C2)s1 ZINC001170085521 1050696993 /nfs/dbraw/zinc/69/69/93/1050696993.db2.gz JSBUZHCWGDFAAB-MRXNPFEDSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3(C)CCC3)C2)s1 ZINC001170085521 1050696996 /nfs/dbraw/zinc/69/69/96/1050696996.db2.gz JSBUZHCWGDFAAB-MRXNPFEDSA-N 2 1 306.519 4.000 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CC([NH2+]C[C@@H]2CC=CCC2)C3)cc1 ZINC000180116553 1050737430 /nfs/dbraw/zinc/73/74/30/1050737430.db2.gz GOOSGWGNBQITPW-LBFURVHYSA-N 2 1 310.485 4.128 20 0 DIADMP Cc1ccc(C[N@H+]([C@H]2CC[C@@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001170119443 1050881908 /nfs/dbraw/zinc/88/19/08/1050881908.db2.gz ASFPUHJHIKSHAB-AFYVEPGGSA-N 2 1 300.490 4.256 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+]([C@H]3CC[C@H](C)C3)C[C@@H]21 ZINC001170145901 1051005340 /nfs/dbraw/zinc/00/53/40/1051005340.db2.gz WVMXJYPONKVETJ-NHUSPQTBSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+]([C@H]3CC[C@H](C)C3)C[C@@H]21 ZINC001170145901 1051005353 /nfs/dbraw/zinc/00/53/53/1051005353.db2.gz WVMXJYPONKVETJ-NHUSPQTBSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+]([C@H]3CC[C@H](C)C3)C[C@@H]21 ZINC001170145901 1051005360 /nfs/dbraw/zinc/00/53/60/1051005360.db2.gz WVMXJYPONKVETJ-NHUSPQTBSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CCC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001170158328 1051072814 /nfs/dbraw/zinc/07/28/14/1051072814.db2.gz NTXAKTYCLNRZIN-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158328 1051072823 /nfs/dbraw/zinc/07/28/23/1051072823.db2.gz NTXAKTYCLNRZIN-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158328 1051072834 /nfs/dbraw/zinc/07/28/34/1051072834.db2.gz NTXAKTYCLNRZIN-GIVPXCGWSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)C1 ZINC001170162985 1051120491 /nfs/dbraw/zinc/12/04/91/1051120491.db2.gz VSXOSXHDJSOKNI-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)CC[C@H]3C2)C1 ZINC001170162985 1051120495 /nfs/dbraw/zinc/12/04/95/1051120495.db2.gz VSXOSXHDJSOKNI-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)C1 ZINC001170162985 1051120499 /nfs/dbraw/zinc/12/04/99/1051120499.db2.gz VSXOSXHDJSOKNI-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP CC(C)C[C@H](C)C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170204963 1051150451 /nfs/dbraw/zinc/15/04/51/1051150451.db2.gz HDJVBILWTHEMFL-FPOVZHCZSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H]1c2ccccc2CC[N@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171632178 1051174486 /nfs/dbraw/zinc/17/44/86/1051174486.db2.gz WFIOZYUGHHAVNJ-HNNXBMFYSA-N 2 1 300.490 4.257 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC000744423885 1051174954 /nfs/dbraw/zinc/17/49/54/1051174954.db2.gz PPFIGBAWEZGEPY-QGZVFWFLSA-N 2 1 322.452 4.360 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC000744423885 1051174960 /nfs/dbraw/zinc/17/49/60/1051174960.db2.gz PPFIGBAWEZGEPY-QGZVFWFLSA-N 2 1 322.452 4.360 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC000744423885 1051174969 /nfs/dbraw/zinc/17/49/69/1051174969.db2.gz PPFIGBAWEZGEPY-QGZVFWFLSA-N 2 1 322.452 4.360 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H](C)Cc2ccccc2Cl)CC1 ZINC001170292268 1051177511 /nfs/dbraw/zinc/17/75/11/1051177511.db2.gz INMLGDLVQWJJTN-INIZCTEOSA-N 2 1 322.924 4.467 20 0 DIADMP CC[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ncccc1C ZINC001171619514 1051178666 /nfs/dbraw/zinc/17/86/66/1051178666.db2.gz NKLZWFVOCQOPRB-MRXNPFEDSA-N 2 1 303.494 4.082 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ccccn1 ZINC001171625300 1051179282 /nfs/dbraw/zinc/17/92/82/1051179282.db2.gz GOSFCPXNFKECIQ-GOSISDBHSA-N 2 1 317.521 4.410 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171667442 1051189551 /nfs/dbraw/zinc/18/95/51/1051189551.db2.gz VRPWMYXIZMHSES-CUWPLCDZSA-N 2 1 314.517 4.441 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@@H](c3cccc(F)c3)C2)CC1(C)C ZINC001171639441 1051195254 /nfs/dbraw/zinc/19/52/54/1051195254.db2.gz JXIOXOFQOVYYPT-MRXNPFEDSA-N 2 1 318.480 4.266 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@H](c3ccccc3F)C2)CC1(C)C ZINC001171636852 1051195389 /nfs/dbraw/zinc/19/53/89/1051195389.db2.gz IGHPRDCYIIPPJO-HNNXBMFYSA-N 2 1 318.480 4.266 20 0 DIADMP C[C@@H]1Cc2ccccc2C[N@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171643944 1051196671 /nfs/dbraw/zinc/19/66/71/1051196671.db2.gz YQIBAFUHHTVTAO-OAHLLOKOSA-N 2 1 300.490 4.085 20 0 DIADMP C[N@@H+](CC/C=C/c1cccnc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642752 1051197641 /nfs/dbraw/zinc/19/76/41/1051197641.db2.gz MEPQXEKLVXHNGK-JXMROGBWSA-N 2 1 315.505 4.068 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@]1(C)Cc1ccccc1Cl ZINC001171900114 1051237141 /nfs/dbraw/zinc/23/71/41/1051237141.db2.gz HIIQSNAMORKZSY-PKOBYXMFSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@]1(C)Cc1ccccc1Cl ZINC001171900114 1051237150 /nfs/dbraw/zinc/23/71/50/1051237150.db2.gz HIIQSNAMORKZSY-PKOBYXMFSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@]1(C)Cc1ccccc1Cl ZINC001171900114 1051237159 /nfs/dbraw/zinc/23/71/59/1051237159.db2.gz HIIQSNAMORKZSY-PKOBYXMFSA-N 2 1 320.908 4.221 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171963054 1051246221 /nfs/dbraw/zinc/24/62/21/1051246221.db2.gz GOKQBUKJHSDXPM-SJORKVTESA-N 2 1 322.443 4.207 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171963706 1051247834 /nfs/dbraw/zinc/24/78/34/1051247834.db2.gz ISQKDUUCTBSSSD-PXNSSMCTSA-N 2 1 323.484 4.175 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCCC[C@H]2F)CC[N@H+]1Cc1ccccc1 ZINC001171966477 1051249822 /nfs/dbraw/zinc/24/98/22/1051249822.db2.gz VAVSZNLPLPFDIV-GUDVDZBRSA-N 2 1 318.480 4.300 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966023 1051250177 /nfs/dbraw/zinc/25/01/77/1051250177.db2.gz SDYBQQRGWBKNDR-YLJYHZDGSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966023 1051250184 /nfs/dbraw/zinc/25/01/84/1051250184.db2.gz SDYBQQRGWBKNDR-YLJYHZDGSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976333 1051265906 /nfs/dbraw/zinc/26/59/06/1051265906.db2.gz KEPOPQUBXSUUFD-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171976089 1051265821 /nfs/dbraw/zinc/26/58/21/1051265821.db2.gz PJCRTPFNPWIXME-RBUKOAKNSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1CCC[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976333 1051265871 /nfs/dbraw/zinc/26/58/71/1051265871.db2.gz KEPOPQUBXSUUFD-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1CCC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976333 1051265884 /nfs/dbraw/zinc/26/58/84/1051265884.db2.gz KEPOPQUBXSUUFD-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976333 1051265895 /nfs/dbraw/zinc/26/58/95/1051265895.db2.gz KEPOPQUBXSUUFD-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)C[C@H]([NH+]2CC3(C2)CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171981369 1051266808 /nfs/dbraw/zinc/26/68/08/1051266808.db2.gz KZNGQXZSOHXZCC-LJQANCHMSA-N 2 1 312.501 4.306 20 0 DIADMP CC1CC([N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977314 1051268292 /nfs/dbraw/zinc/26/82/92/1051268292.db2.gz PYUHMGISESHEEO-AVAKVYKDSA-N 2 1 300.490 4.160 20 0 DIADMP CC1CC([N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977314 1051268296 /nfs/dbraw/zinc/26/82/96/1051268296.db2.gz PYUHMGISESHEEO-AVAKVYKDSA-N 2 1 300.490 4.160 20 0 DIADMP CC1CC([NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977314 1051268307 /nfs/dbraw/zinc/26/83/07/1051268307.db2.gz PYUHMGISESHEEO-AVAKVYKDSA-N 2 1 300.490 4.160 20 0 DIADMP CC1CC([NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977314 1051268312 /nfs/dbraw/zinc/26/83/12/1051268312.db2.gz PYUHMGISESHEEO-AVAKVYKDSA-N 2 1 300.490 4.160 20 0 DIADMP CC1(C)C[C@H]([NH+](CC2CC2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171983851 1051269626 /nfs/dbraw/zinc/26/96/26/1051269626.db2.gz APJPOJIVGOARCP-HXUWFJFHSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@H]([NH+](CC2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001171983851 1051269632 /nfs/dbraw/zinc/26/96/32/1051269632.db2.gz APJPOJIVGOARCP-HXUWFJFHSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@H]([N@H+](CC2CC2)C2CC2)CC[NH+]1Cc1ccccc1 ZINC001171983851 1051269639 /nfs/dbraw/zinc/26/96/39/1051269639.db2.gz APJPOJIVGOARCP-HXUWFJFHSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@H]([N@@H+](CC2CC2)C2CC2)CC[NH+]1Cc1ccccc1 ZINC001171983851 1051269645 /nfs/dbraw/zinc/26/96/45/1051269645.db2.gz APJPOJIVGOARCP-HXUWFJFHSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@H](F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171978527 1051269663 /nfs/dbraw/zinc/26/96/63/1051269663.db2.gz ZBDZDTADZNWUGN-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@H](F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978527 1051269669 /nfs/dbraw/zinc/26/96/69/1051269669.db2.gz ZBDZDTADZNWUGN-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978527 1051269677 /nfs/dbraw/zinc/26/96/77/1051269677.db2.gz ZBDZDTADZNWUGN-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978527 1051269684 /nfs/dbraw/zinc/26/96/84/1051269684.db2.gz ZBDZDTADZNWUGN-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@H](CF)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988247 1051271097 /nfs/dbraw/zinc/27/10/97/1051271097.db2.gz QEFGPYRKMBRLBF-MOPGFXCFSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@H](CF)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988247 1051271110 /nfs/dbraw/zinc/27/11/10/1051271110.db2.gz QEFGPYRKMBRLBF-MOPGFXCFSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988247 1051271121 /nfs/dbraw/zinc/27/11/21/1051271121.db2.gz QEFGPYRKMBRLBF-MOPGFXCFSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988247 1051271134 /nfs/dbraw/zinc/27/11/34/1051271134.db2.gz QEFGPYRKMBRLBF-MOPGFXCFSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172075227 1051275977 /nfs/dbraw/zinc/27/59/77/1051275977.db2.gz DJSDXRQXDNCIQW-VJDPLVQDSA-N 2 1 312.501 4.350 20 0 DIADMP C[N@@H+](CC1CCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075716 1051280079 /nfs/dbraw/zinc/28/00/79/1051280079.db2.gz SLUAMPAZTASQOU-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172075716 1051280092 /nfs/dbraw/zinc/28/00/92/1051280092.db2.gz SLUAMPAZTASQOU-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CC1CCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172075716 1051280103 /nfs/dbraw/zinc/28/01/03/1051280103.db2.gz SLUAMPAZTASQOU-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc3ccccc3s1)C2 ZINC001172100166 1051284667 /nfs/dbraw/zinc/28/46/67/1051284667.db2.gz AAVMTSCRCMFAQZ-MUJYYYPQSA-N 2 1 300.471 4.006 20 0 DIADMP FC1(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC001172064625 1051284859 /nfs/dbraw/zinc/28/48/59/1051284859.db2.gz DOUFCHFWOVCWJX-REPLKXPHSA-N 2 1 316.464 4.054 20 0 DIADMP CC1(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC001172062874 1051285076 /nfs/dbraw/zinc/28/50/76/1051285076.db2.gz ADNAYDFMGIRQHO-OWZKRDHZSA-N 2 1 312.501 4.352 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C(C2CC2)C2CC2)C3)cc1 ZINC001172066890 1051285208 /nfs/dbraw/zinc/28/52/08/1051285208.db2.gz FUFBYNIQKKNTSL-WKCHPHFGSA-N 2 1 324.512 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CC2CCCC2)C3)cc1 ZINC001172064856 1051286018 /nfs/dbraw/zinc/28/60/18/1051286018.db2.gz HJEXQZMYNQRSGW-MZADTFQBSA-N 2 1 312.501 4.352 20 0 DIADMP F[C@@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172064078 1051286192 /nfs/dbraw/zinc/28/61/92/1051286192.db2.gz FJAJGYMDJPZGPF-WAPOTWQKSA-N 2 1 316.464 4.052 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2(CC4CC4)CC2)C3)cc1 ZINC001172070364 1051287929 /nfs/dbraw/zinc/28/79/29/1051287929.db2.gz NNTDSJZFXDNSBD-WKCHPHFGSA-N 2 1 324.512 4.494 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125326 1051288214 /nfs/dbraw/zinc/28/82/14/1051288214.db2.gz PMJKBYIQFIETED-NCOADZHNSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125326 1051288222 /nfs/dbraw/zinc/28/82/22/1051288222.db2.gz PMJKBYIQFIETED-NCOADZHNSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125326 1051288232 /nfs/dbraw/zinc/28/82/32/1051288232.db2.gz PMJKBYIQFIETED-NCOADZHNSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125326 1051288247 /nfs/dbraw/zinc/28/82/47/1051288247.db2.gz PMJKBYIQFIETED-NCOADZHNSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125329 1051289485 /nfs/dbraw/zinc/28/94/85/1051289485.db2.gz PMJKBYIQFIETED-NXOAAHMSSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125329 1051289498 /nfs/dbraw/zinc/28/94/98/1051289498.db2.gz PMJKBYIQFIETED-NXOAAHMSSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125329 1051289510 /nfs/dbraw/zinc/28/95/10/1051289510.db2.gz PMJKBYIQFIETED-NXOAAHMSSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@H](c3ccccc3Cl)C1)C2 ZINC001172125329 1051289525 /nfs/dbraw/zinc/28/95/25/1051289525.db2.gz PMJKBYIQFIETED-NXOAAHMSSA-N 2 1 318.892 4.145 20 0 DIADMP CC(C)[N@H+]([C@@H](C)c1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133629 1051291405 /nfs/dbraw/zinc/29/14/05/1051291405.db2.gz UBHCHFKJUBLQQO-IJXRJRJASA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133629 1051291417 /nfs/dbraw/zinc/29/14/17/1051291417.db2.gz UBHCHFKJUBLQQO-IJXRJRJASA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[NH+]([C@@H](C)c1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172133629 1051291428 /nfs/dbraw/zinc/29/14/28/1051291428.db2.gz UBHCHFKJUBLQQO-IJXRJRJASA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[NH+]([C@@H](C)c1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172133629 1051291440 /nfs/dbraw/zinc/29/14/40/1051291440.db2.gz UBHCHFKJUBLQQO-IJXRJRJASA-N 2 1 300.490 4.473 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130990 1051294003 /nfs/dbraw/zinc/29/40/03/1051294003.db2.gz SRPUEHICLHWENW-BASYENTBSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130990 1051294013 /nfs/dbraw/zinc/29/40/13/1051294013.db2.gz SRPUEHICLHWENW-BASYENTBSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130990 1051294023 /nfs/dbraw/zinc/29/40/23/1051294023.db2.gz SRPUEHICLHWENW-BASYENTBSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130990 1051294032 /nfs/dbraw/zinc/29/40/32/1051294032.db2.gz SRPUEHICLHWENW-BASYENTBSA-N 2 1 320.427 4.117 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(C)c1 ZINC001172108548 1051296710 /nfs/dbraw/zinc/29/67/10/1051296710.db2.gz BGLMSPHUFMLNIQ-BMFAXAFESA-N 2 1 304.453 4.190 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(C)c1 ZINC001172108548 1051296727 /nfs/dbraw/zinc/29/67/27/1051296727.db2.gz BGLMSPHUFMLNIQ-BMFAXAFESA-N 2 1 304.453 4.190 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172110755 1051299174 /nfs/dbraw/zinc/29/91/74/1051299174.db2.gz OROMZSNEXHWZRT-OAFZBRQQSA-N 2 1 304.453 4.272 20 0 DIADMP Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172113905 1051299235 /nfs/dbraw/zinc/29/92/35/1051299235.db2.gz KTIYZENOISBWBO-MXASKKJJSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172113905 1051299244 /nfs/dbraw/zinc/29/92/44/1051299244.db2.gz KTIYZENOISBWBO-MXASKKJJSA-N 2 1 306.881 4.314 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(F)c1 ZINC001172110855 1051300017 /nfs/dbraw/zinc/30/00/17/1051300017.db2.gz QCEOOIKHUQESBW-BASYENTBSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(F)c1 ZINC001172110855 1051300031 /nfs/dbraw/zinc/30/00/31/1051300031.db2.gz QCEOOIKHUQESBW-BASYENTBSA-N 2 1 308.416 4.021 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110082 1051300456 /nfs/dbraw/zinc/30/04/56/1051300456.db2.gz JSSHOBOMICYOJV-NXEZDXNNSA-N 2 1 318.892 4.322 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110082 1051300465 /nfs/dbraw/zinc/30/04/65/1051300465.db2.gz JSSHOBOMICYOJV-NXEZDXNNSA-N 2 1 318.892 4.322 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1c(F)cccc1F ZINC001172110876 1051300912 /nfs/dbraw/zinc/30/09/12/1051300912.db2.gz QHNMWJHEHVMIFN-ZJOBFFGXSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1c(F)cccc1F ZINC001172110876 1051300921 /nfs/dbraw/zinc/30/09/21/1051300921.db2.gz QHNMWJHEHVMIFN-ZJOBFFGXSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)c(C)c1 ZINC001172118274 1051303601 /nfs/dbraw/zinc/30/36/01/1051303601.db2.gz QRQVVMBJJOTBBO-YSTOQKLRSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)c(C)c1 ZINC001172118274 1051303608 /nfs/dbraw/zinc/30/36/08/1051303608.db2.gz QRQVVMBJJOTBBO-YSTOQKLRSA-N 2 1 300.490 4.359 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc(Cl)c3)CCC1)C2 ZINC001172115097 1051304410 /nfs/dbraw/zinc/30/44/10/1051304410.db2.gz QRHATJUTVAUESX-NNZMDNLPSA-N 2 1 318.892 4.324 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc(Cl)c3)CCC1)C2 ZINC001172115097 1051304419 /nfs/dbraw/zinc/30/44/19/1051304419.db2.gz QRHATJUTVAUESX-NNZMDNLPSA-N 2 1 318.892 4.324 20 0 DIADMP CC(C)C[N@H+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172117310 1051304472 /nfs/dbraw/zinc/30/44/72/1051304472.db2.gz GERWJPZQQQTFIE-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172117310 1051304482 /nfs/dbraw/zinc/30/44/82/1051304482.db2.gz GERWJPZQQQTFIE-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172117310 1051304494 /nfs/dbraw/zinc/30/44/94/1051304494.db2.gz GERWJPZQQQTFIE-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172117310 1051304501 /nfs/dbraw/zinc/30/45/01/1051304501.db2.gz GERWJPZQQQTFIE-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001172121565 1051304521 /nfs/dbraw/zinc/30/45/21/1051304521.db2.gz KOSBPJMTMZRVRV-RCJHGTSTSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001172121565 1051304528 /nfs/dbraw/zinc/30/45/28/1051304528.db2.gz KOSBPJMTMZRVRV-RCJHGTSTSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001172121565 1051304537 /nfs/dbraw/zinc/30/45/37/1051304537.db2.gz KOSBPJMTMZRVRV-RCJHGTSTSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115695 1051305171 /nfs/dbraw/zinc/30/51/71/1051305171.db2.gz YXVVMKOTBFORRJ-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115695 1051305177 /nfs/dbraw/zinc/30/51/77/1051305177.db2.gz YXVVMKOTBFORRJ-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115695 1051305186 /nfs/dbraw/zinc/30/51/86/1051305186.db2.gz YXVVMKOTBFORRJ-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115695 1051305191 /nfs/dbraw/zinc/30/51/91/1051305191.db2.gz YXVVMKOTBFORRJ-REPLKXPHSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1csc3ccccc13)C2 ZINC001172115856 1051305790 /nfs/dbraw/zinc/30/57/90/1051305790.db2.gz FRMMOSRFYGBQQA-PHZGNYQRSA-N 2 1 300.471 4.006 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c([C@H]3CCC[NH2+]3)cc3ccccc31)C2 ZINC001172124304 1051307442 /nfs/dbraw/zinc/30/74/42/1051307442.db2.gz KNJSVMBLLARBFS-YDZRNGNQSA-N 2 1 323.484 4.254 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)C1(c2ccccc2)CCCC1 ZINC000186754640 1051348782 /nfs/dbraw/zinc/34/87/82/1051348782.db2.gz LQTBSINKSLNCAQ-DFQSSKMNSA-N 2 1 312.501 4.103 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C[C@@H]1C ZINC001172372810 1051352230 /nfs/dbraw/zinc/35/22/30/1051352230.db2.gz JFTXRHNQOXMVSX-ZIFCJYIRSA-N 2 1 304.522 4.152 20 0 DIADMP CCC(CC)[N@H+]([C@@H](C)CCO[C@H](C)CC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172332235 1051356704 /nfs/dbraw/zinc/35/67/04/1051356704.db2.gz HLFRXJWDYMJIJV-ZMMAXQRCSA-N 2 1 312.542 4.341 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000379882611 1051357577 /nfs/dbraw/zinc/35/75/77/1051357577.db2.gz VSDXRUCPSGIJLK-JOCHJYFZSA-N 2 1 320.480 4.237 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000380956184 1051366517 /nfs/dbraw/zinc/36/65/17/1051366517.db2.gz UOYIRPGFNPCJIP-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)C([NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000381827227 1051375557 /nfs/dbraw/zinc/37/55/57/1051375557.db2.gz HROFUUAYODSIEQ-IEBWSBKVSA-N 2 1 302.506 4.167 20 0 DIADMP CCCCCC[C@H](CCC)[NH+]1CCC2(CC(N(C)C)=[NH+]O2)CC1 ZINC001172387844 1051392123 /nfs/dbraw/zinc/39/21/23/1051392123.db2.gz UMIDSVQFNSQCFG-KRWDZBQOSA-N 2 1 323.525 4.256 20 0 DIADMP CC[C@H](CC(C)C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001172393523 1051396830 /nfs/dbraw/zinc/39/68/30/1051396830.db2.gz ZATVRRBMBPUOON-LJQANCHMSA-N 2 1 302.506 4.108 20 0 DIADMP CC[C@H](CC(C)C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001172399781 1051397559 /nfs/dbraw/zinc/39/75/59/1051397559.db2.gz DFBCKJRYERAKSH-HXUWFJFHSA-N 2 1 314.517 4.334 20 0 DIADMP CC[C@H](CC(C)C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001172399781 1051397567 /nfs/dbraw/zinc/39/75/67/1051397567.db2.gz DFBCKJRYERAKSH-HXUWFJFHSA-N 2 1 314.517 4.334 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001170451065 1051412447 /nfs/dbraw/zinc/41/24/47/1051412447.db2.gz GYGPSIMOOSIHQT-UWJYYQICSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001170451065 1051412457 /nfs/dbraw/zinc/41/24/57/1051412457.db2.gz GYGPSIMOOSIHQT-UWJYYQICSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001170451065 1051412461 /nfs/dbraw/zinc/41/24/61/1051412461.db2.gz GYGPSIMOOSIHQT-UWJYYQICSA-N 2 1 314.517 4.463 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)C2)cc1 ZINC001172554798 1051437117 /nfs/dbraw/zinc/43/71/17/1051437117.db2.gz CERADKAESCMRKY-HSALFYBXSA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)C2)cc1 ZINC001172554798 1051437120 /nfs/dbraw/zinc/43/71/20/1051437120.db2.gz CERADKAESCMRKY-HSALFYBXSA-N 2 1 312.501 4.319 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172556163 1051438700 /nfs/dbraw/zinc/43/87/00/1051438700.db2.gz KJNWHDLEIPZHHX-VURPSTOHSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(C)c(F)c1 ZINC001168824635 1051446295 /nfs/dbraw/zinc/44/62/95/1051446295.db2.gz BTAZDACWKZDKNR-SFHVURJKSA-N 2 1 303.425 4.160 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172534849 1051450203 /nfs/dbraw/zinc/45/02/03/1051450203.db2.gz AXSQBOFKUXUCPN-ONUIULTDSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172534849 1051450208 /nfs/dbraw/zinc/45/02/08/1051450208.db2.gz AXSQBOFKUXUCPN-ONUIULTDSA-N 2 1 312.501 4.318 20 0 DIADMP [NH3+]CC[N@H+](Cc1ccccc1)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538786 1051451681 /nfs/dbraw/zinc/45/16/81/1051451681.db2.gz SVOMFBQICSCISX-RTWAWAEBSA-N 2 1 308.469 4.174 20 0 DIADMP [NH3+]CC[N@@H+](Cc1ccccc1)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538786 1051451690 /nfs/dbraw/zinc/45/16/90/1051451690.db2.gz SVOMFBQICSCISX-RTWAWAEBSA-N 2 1 308.469 4.174 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172546958 1051457123 /nfs/dbraw/zinc/45/71/23/1051457123.db2.gz SWLXRLQXTNNHKD-WLRLJWMZSA-N 2 1 314.517 4.421 20 0 DIADMP c1ccc(C[N@@H+]2CCC3(C2)CC[NH+](CCC2CCC2)CC3)cc1 ZINC001168918215 1051467641 /nfs/dbraw/zinc/46/76/41/1051467641.db2.gz HPLFHPTUPJXUFK-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP CC(C)c1ccc([C@H]2CCC[N@H+]2CC[C@H]2CCC[NH+]2C)cc1 ZINC001168919119 1051468273 /nfs/dbraw/zinc/46/82/73/1051468273.db2.gz VNTVFXUWANWPKP-WOJBJXKFSA-N 2 1 300.490 4.431 20 0 DIADMP CC1(C)CC([N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)CC(C)(C)O1 ZINC001172658284 1051474564 /nfs/dbraw/zinc/47/45/64/1051474564.db2.gz MNLQJRIJFHYDKZ-QGZVFWFLSA-N 2 1 322.537 4.063 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169099670 1051507792 /nfs/dbraw/zinc/50/77/92/1051507792.db2.gz DNEIPIBBZSVGQS-OKYOBFRVSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169100675 1051512267 /nfs/dbraw/zinc/51/22/67/1051512267.db2.gz LFEXHVNDQYHAII-XMTFNYHQSA-N 2 1 304.865 4.006 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001169085549 1051517907 /nfs/dbraw/zinc/51/79/07/1051517907.db2.gz OMDPZTNCRHXBAV-LJQANCHMSA-N 2 1 311.473 4.180 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@@H+](C(C)C)C1CCN(C)CC1 ZINC001169086964 1051520548 /nfs/dbraw/zinc/52/05/48/1051520548.db2.gz ZKLURWPRXKLTOP-NRFANRHFSA-N 2 1 316.533 4.448 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C[C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169125288 1051523042 /nfs/dbraw/zinc/52/30/42/1051523042.db2.gz YHULBRNFUQCDNE-OKYOBFRVSA-N 2 1 318.892 4.048 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142626 1051533093 /nfs/dbraw/zinc/53/30/93/1051533093.db2.gz DRTACHJURWTTNI-XJFOESAGSA-N 2 1 310.894 4.164 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142626 1051533103 /nfs/dbraw/zinc/53/31/03/1051533103.db2.gz DRTACHJURWTTNI-XJFOESAGSA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142626 1051533113 /nfs/dbraw/zinc/53/31/13/1051533113.db2.gz DRTACHJURWTTNI-XJFOESAGSA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142626 1051533119 /nfs/dbraw/zinc/53/31/19/1051533119.db2.gz DRTACHJURWTTNI-XJFOESAGSA-N 2 1 310.894 4.164 20 0 DIADMP Cc1cc([NH2+][C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)ccc1N(C)C ZINC001169150087 1051535802 /nfs/dbraw/zinc/53/58/02/1051535802.db2.gz ASBVLQRZFUMLCW-LPHOPBHVSA-N 2 1 303.494 4.017 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(c3ccccc3Cl)CC1)C2 ZINC001169155399 1051536280 /nfs/dbraw/zinc/53/62/80/1051536280.db2.gz OSRNBVCTRUVDAP-FVQHAEBGSA-N 2 1 318.892 4.145 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155537 1051537290 /nfs/dbraw/zinc/53/72/90/1051537290.db2.gz QMUGCZMNKIXGGG-YSHGAJCASA-N 2 1 308.469 4.458 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+](C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169155537 1051537300 /nfs/dbraw/zinc/53/73/00/1051537300.db2.gz QMUGCZMNKIXGGG-YSHGAJCASA-N 2 1 308.469 4.458 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+](C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169155537 1051537311 /nfs/dbraw/zinc/53/73/11/1051537311.db2.gz QMUGCZMNKIXGGG-YSHGAJCASA-N 2 1 308.469 4.458 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172852740 1051539532 /nfs/dbraw/zinc/53/95/32/1051539532.db2.gz UJINZWLCCPULNQ-ZQDZILKHSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172852740 1051539545 /nfs/dbraw/zinc/53/95/45/1051539545.db2.gz UJINZWLCCPULNQ-ZQDZILKHSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001172856368 1051541360 /nfs/dbraw/zinc/54/13/60/1051541360.db2.gz GNYCISKDLGTYPF-ZDUSSCGKSA-N 2 1 324.871 4.004 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc3oc4ccccc4c3c2)CCC[C@H]1C[NH3+] ZINC001206003860 1051546068 /nfs/dbraw/zinc/54/60/68/1051546068.db2.gz MZFVOQCKEPUECG-RDJZCZTQSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC[C@H]1C[NH3+] ZINC001206004564 1051546472 /nfs/dbraw/zinc/54/64/72/1051546472.db2.gz UBGUUFWCLNVRJJ-APWZRJJASA-N 2 1 320.480 4.065 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234331 1051564901 /nfs/dbraw/zinc/56/49/01/1051564901.db2.gz NULAEJDPPSRDSH-CABCVRRESA-N 2 1 320.527 4.372 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234331 1051564913 /nfs/dbraw/zinc/56/49/13/1051564913.db2.gz NULAEJDPPSRDSH-CABCVRRESA-N 2 1 320.527 4.372 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](c3ccc(F)cc3)C2)CC1 ZINC001173114478 1051611399 /nfs/dbraw/zinc/61/13/99/1051611399.db2.gz MAHMAXAVUJKOHX-KKXNLOMOSA-N 2 1 318.480 4.268 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2Cc3ccccc3C[C@@H]2C)CC1 ZINC001173113507 1051612127 /nfs/dbraw/zinc/61/21/27/1051612127.db2.gz RNXCBGSMBGELDH-DZIBYMRMSA-N 2 1 300.490 4.086 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1CCC3(CCCCC3)CC1)C2 ZINC001173116068 1051613510 /nfs/dbraw/zinc/61/35/10/1051613510.db2.gz OMEUUTFCIAOZKO-REPLKXPHSA-N 2 1 304.522 4.484 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1CCC3(CCCCC3)CC1)C2 ZINC001173116068 1051613517 /nfs/dbraw/zinc/61/35/17/1051613517.db2.gz OMEUUTFCIAOZKO-REPLKXPHSA-N 2 1 304.522 4.484 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](C)C1 ZINC001173204820 1051642816 /nfs/dbraw/zinc/64/28/16/1051642816.db2.gz LNZGAOCJABOCSR-OALUTQOASA-N 2 1 322.496 4.138 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)n1c[nH+]cc1CC[NH3+] ZINC001173209452 1051647035 /nfs/dbraw/zinc/64/70/35/1051647035.db2.gz ZATZMCDKNVGRSQ-QGZVFWFLSA-N 2 1 319.452 4.168 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173249217 1051653387 /nfs/dbraw/zinc/65/33/87/1051653387.db2.gz KHSJWBXTGVQBJR-NSISKUIASA-N 2 1 302.506 4.160 20 0 DIADMP CCCC[C@@H](CC(C)C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173256905 1051658727 /nfs/dbraw/zinc/65/87/27/1051658727.db2.gz OUTMJAGUADQZOJ-BJLQDIEVSA-N 2 1 324.553 4.342 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173265364 1051664953 /nfs/dbraw/zinc/66/49/53/1051664953.db2.gz SSLCWTOHNDBEMO-BWUHRYBWSA-N 2 1 312.501 4.350 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001206014302 1051666744 /nfs/dbraw/zinc/66/67/44/1051666744.db2.gz WJERYCNUZIKRQB-RTBURBONSA-N 2 1 322.496 4.469 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001173296125 1051677414 /nfs/dbraw/zinc/67/74/14/1051677414.db2.gz SHTAGCZPPRCKBH-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001173296125 1051677422 /nfs/dbraw/zinc/67/74/22/1051677422.db2.gz SHTAGCZPPRCKBH-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001173296125 1051677428 /nfs/dbraw/zinc/67/74/28/1051677428.db2.gz SHTAGCZPPRCKBH-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP CCSC[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001173296720 1051678243 /nfs/dbraw/zinc/67/82/43/1051678243.db2.gz VVJCLCWHLZGSKV-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP CCSC[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001173296720 1051678247 /nfs/dbraw/zinc/67/82/47/1051678247.db2.gz VVJCLCWHLZGSKV-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP CCSC[C@@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173298727 1051679661 /nfs/dbraw/zinc/67/96/61/1051679661.db2.gz QKMHWATUHYSQSS-ZTFGCOKTSA-N 2 1 324.509 4.039 20 0 DIADMP Cc1[nH+]c2ccc(NC(C)(C)CC[NH+](C)C)cc2n1C(C)C ZINC001169717570 1051682260 /nfs/dbraw/zinc/68/22/60/1051682260.db2.gz CTCKEUWWRIEJGW-UHFFFAOYSA-N 2 1 302.466 4.068 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291780 1051692792 /nfs/dbraw/zinc/69/27/92/1051692792.db2.gz CLGMSLMYJXKJKH-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291780 1051692799 /nfs/dbraw/zinc/69/27/99/1051692799.db2.gz CLGMSLMYJXKJKH-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC001169782267 1051699076 /nfs/dbraw/zinc/69/90/76/1051699076.db2.gz YODJUSOFXBPDJS-QGZVFWFLSA-N 2 1 312.501 4.044 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342443 1051700331 /nfs/dbraw/zinc/70/03/31/1051700331.db2.gz YHWUWQOWGBPIBN-AKHDSKFASA-N 2 1 304.522 4.484 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342443 1051700339 /nfs/dbraw/zinc/70/03/39/1051700339.db2.gz YHWUWQOWGBPIBN-AKHDSKFASA-N 2 1 304.522 4.484 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccs1 ZINC000183186901 1051709406 /nfs/dbraw/zinc/70/94/06/1051709406.db2.gz BOGHLGJOASQFFH-INMHGKMJSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000183198996 1051709798 /nfs/dbraw/zinc/70/97/98/1051709798.db2.gz UDQGIPUKWJDVFG-JENIJYKNSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(Cl)cc1Cl ZINC001206023594 1051716347 /nfs/dbraw/zinc/71/63/47/1051716347.db2.gz FXSNOVFMDBXDSR-QWHCGFSZSA-N 2 1 315.288 4.109 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000183979129 1051724246 /nfs/dbraw/zinc/72/42/46/1051724246.db2.gz HGVLKBQTJFVDLT-SJLPKXTDSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000183979129 1051724253 /nfs/dbraw/zinc/72/42/53/1051724253.db2.gz HGVLKBQTJFVDLT-SJLPKXTDSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000183979129 1051724267 /nfs/dbraw/zinc/72/42/67/1051724267.db2.gz HGVLKBQTJFVDLT-SJLPKXTDSA-N 2 1 320.427 4.073 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(Cl)c2ccccc21 ZINC000184969007 1051751243 /nfs/dbraw/zinc/75/12/43/1051751243.db2.gz RRTYQBHWSWNXQC-ZDUSSCGKSA-N 2 1 302.849 4.238 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c(C)o1 ZINC000767378803 1051788864 /nfs/dbraw/zinc/78/88/64/1051788864.db2.gz OAJDZMFWGVZEKG-MAUKXSAKSA-N 2 1 318.486 4.131 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(C)o1 ZINC000767378803 1051788869 /nfs/dbraw/zinc/78/88/69/1051788869.db2.gz OAJDZMFWGVZEKG-MAUKXSAKSA-N 2 1 318.486 4.131 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC=C(c2ccc(C)cc2)CC1 ZINC000767360366 1051794658 /nfs/dbraw/zinc/79/46/58/1051794658.db2.gz ISRAFCUARBRIPF-UHFFFAOYSA-N 2 1 309.457 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC=C(c2ccc(C)cc2)CC1 ZINC000767360366 1051794668 /nfs/dbraw/zinc/79/46/68/1051794668.db2.gz ISRAFCUARBRIPF-UHFFFAOYSA-N 2 1 309.457 4.069 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000186341959 1051810260 /nfs/dbraw/zinc/81/02/60/1051810260.db2.gz DNMGDQFTAHNEED-SJORKVTESA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H](NC[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330009 1051873181 /nfs/dbraw/zinc/87/31/81/1051873181.db2.gz GJHSRJXEOOENLT-VQIMIIECSA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccccc1F ZINC000494330009 1051873190 /nfs/dbraw/zinc/87/31/90/1051873190.db2.gz GJHSRJXEOOENLT-VQIMIIECSA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330009 1051873200 /nfs/dbraw/zinc/87/32/00/1051873200.db2.gz GJHSRJXEOOENLT-VQIMIIECSA-N 2 1 306.469 4.234 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCCC3)[C@@H]1c1cccs1 ZINC000189135370 1051883985 /nfs/dbraw/zinc/88/39/85/1051883985.db2.gz CCRGOMZKZVPWHE-KBAYOESNSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC23CCCC3)[C@@H]1c1cccs1 ZINC000189135370 1051883989 /nfs/dbraw/zinc/88/39/89/1051883989.db2.gz CCRGOMZKZVPWHE-KBAYOESNSA-N 2 1 318.530 4.443 20 0 DIADMP C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768265325 1051912304 /nfs/dbraw/zinc/91/23/04/1051912304.db2.gz WXFLQNMXWAEQJZ-HNNXBMFYSA-N 2 1 300.421 4.080 20 0 DIADMP Cc1ccc(N2CCC([NH2+]CC[C@@H](C)c3ccccc3)CC2)[nH+]c1 ZINC000191101437 1051962326 /nfs/dbraw/zinc/96/23/26/1051962326.db2.gz OVQASMLRXUWEPW-GOSISDBHSA-N 2 1 323.484 4.142 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000192708487 1052016799 /nfs/dbraw/zinc/01/67/99/1052016799.db2.gz OERDUJKGDRXOAJ-HFRUMSELSA-N 2 1 312.501 4.333 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000769405309 1052042820 /nfs/dbraw/zinc/04/28/20/1052042820.db2.gz UCAMRCUMEKYNMQ-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000769405309 1052042834 /nfs/dbraw/zinc/04/28/34/1052042834.db2.gz UCAMRCUMEKYNMQ-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCC[C@@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)[C@@H](C)CC ZINC001218292273 1052217806 /nfs/dbraw/zinc/21/78/06/1052217806.db2.gz POBJXJLTQNKEQZ-OXJNMPFZSA-N 2 1 318.505 4.203 20 0 DIADMP CCC[C@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)C(C)(C)C ZINC001218294006 1052219286 /nfs/dbraw/zinc/21/92/86/1052219286.db2.gz QPFSSYRYGOUINU-IBGZPJMESA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)C[C@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)C(C)C ZINC001218295634 1052219401 /nfs/dbraw/zinc/21/94/01/1052219401.db2.gz HOCIYYRKCSHIJE-FQEVSTJZSA-N 2 1 318.505 4.059 20 0 DIADMP CC[C@@H](C)CC[C@@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218356125 1052230857 /nfs/dbraw/zinc/23/08/57/1052230857.db2.gz AELKRYLHYZSRJM-IAGOWNOFSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)C[C@@H](C)C[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309813022 1052250857 /nfs/dbraw/zinc/25/08/57/1052250857.db2.gz NFVBXTNRCWRFHN-UYAOXDASSA-N 2 1 302.506 4.170 20 0 DIADMP CC1(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCCC1 ZINC000310032186 1052253945 /nfs/dbraw/zinc/25/39/45/1052253945.db2.gz YFGRKMDMZQKGPN-HXUWFJFHSA-N 2 1 314.517 4.459 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)c1csc(Cl)c1)C[NH+]1CCCCC1 ZINC000230408185 1052267450 /nfs/dbraw/zinc/26/74/50/1052267450.db2.gz QVHCQNLKTJEZRO-STQMWFEESA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1csc(Cl)c1 ZINC000230407459 1052267870 /nfs/dbraw/zinc/26/78/70/1052267870.db2.gz IPNVRRIOQITRDQ-ZDUSSCGKSA-N 2 1 300.899 4.174 20 0 DIADMP c1ccc(CC2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCCC2)cc1 ZINC000495401273 1052335849 /nfs/dbraw/zinc/33/58/49/1052335849.db2.gz KQJZVEVWTQLXNW-UXHICEINSA-N 2 1 312.501 4.006 20 0 DIADMP CCCCOc1ccc(C[NH2+]C2CC[NH+](CCCC)CC2)cc1 ZINC000236683420 1052428843 /nfs/dbraw/zinc/42/88/43/1052428843.db2.gz LKAQBLXFPYXKJO-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236933334 1052432717 /nfs/dbraw/zinc/43/27/17/1052432717.db2.gz HPZYYBSRGSSLDS-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236933334 1052432722 /nfs/dbraw/zinc/43/27/22/1052432722.db2.gz HPZYYBSRGSSLDS-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP CC[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000237071696 1052434485 /nfs/dbraw/zinc/43/44/85/1052434485.db2.gz PBXCWLLQMDHFLY-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+]C2CCC(C(F)(F)F)CC2)([NH+](C)C)C1 ZINC000237367847 1052440101 /nfs/dbraw/zinc/44/01/01/1052440101.db2.gz FHZOBGMWGZCSCZ-LMPOIIKSSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CCCCC1 ZINC000237532381 1052441802 /nfs/dbraw/zinc/44/18/02/1052441802.db2.gz OYASPRIKAHLSOJ-KRWDZBQOSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000237685465 1052443996 /nfs/dbraw/zinc/44/39/96/1052443996.db2.gz LZAPXWNFDABRAV-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC001222141089 1052449525 /nfs/dbraw/zinc/44/95/25/1052449525.db2.gz DPGIIWDYFCBUIJ-WIYYLYMNSA-N 2 1 314.517 4.064 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222148732 1052450454 /nfs/dbraw/zinc/45/04/54/1052450454.db2.gz SAXDIMXHMQCNIY-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)cc2)c1 ZINC001222148097 1052450661 /nfs/dbraw/zinc/45/06/61/1052450661.db2.gz KBDSNQWVIOWUBN-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222149294 1052451593 /nfs/dbraw/zinc/45/15/93/1052451593.db2.gz XNUABWMOWFHQHI-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP Fc1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1-c1ccccc1 ZINC001222154664 1052453037 /nfs/dbraw/zinc/45/30/37/1052453037.db2.gz PDSYUFPDJUJHFU-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP Fc1ccc(C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1-c1ccccc1 ZINC001222154664 1052453043 /nfs/dbraw/zinc/45/30/43/1052453043.db2.gz PDSYUFPDJUJHFU-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000315842931 1052453491 /nfs/dbraw/zinc/45/34/91/1052453491.db2.gz KVFSYOOEWWFPGN-INIZCTEOSA-N 2 1 300.490 4.307 20 0 DIADMP FC(F)c1ccccc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222160611 1052454244 /nfs/dbraw/zinc/45/42/44/1052454244.db2.gz HBBKZHQSXNTGNE-LJQANCHMSA-N 2 1 322.443 4.370 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@@H+]2CCC[C@]23CCC[NH2+]C3)cc1 ZINC001222249849 1052469463 /nfs/dbraw/zinc/46/94/63/1052469463.db2.gz XHKDARHBICRSNR-NRFANRHFSA-N 2 1 324.443 4.211 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CCC[C@]23CCC[NH2+]C3)cc1 ZINC001222249849 1052469466 /nfs/dbraw/zinc/46/94/66/1052469466.db2.gz XHKDARHBICRSNR-NRFANRHFSA-N 2 1 324.443 4.211 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001222259778 1052470222 /nfs/dbraw/zinc/47/02/22/1052470222.db2.gz ZCKTZWQSDRYKRI-AVRDEDQJSA-N 2 1 322.496 4.409 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)c2ccccc12 ZINC001222265758 1052470814 /nfs/dbraw/zinc/47/08/14/1052470814.db2.gz XKSUSBCKCHBMCL-OAQYLSRUSA-N 2 1 308.469 4.114 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CCC4(CCCC[NH2+]4)CC3)cc2)o1 ZINC001222297957 1052475949 /nfs/dbraw/zinc/47/59/49/1052475949.db2.gz PMFQGCMVNUKHPR-UHFFFAOYSA-N 2 1 324.468 4.363 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222308638 1052478911 /nfs/dbraw/zinc/47/89/11/1052478911.db2.gz KUSSFKFOIXCKIM-QUCCMNQESA-N 2 1 324.553 4.216 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)cc2)o1 ZINC001222316228 1052480785 /nfs/dbraw/zinc/48/07/85/1052480785.db2.gz URGWVTYKJNXSET-NRFANRHFSA-N 2 1 324.468 4.363 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc(C)c1Cl ZINC001222321410 1052481922 /nfs/dbraw/zinc/48/19/22/1052481922.db2.gz VLSOBUUNLXKGMR-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc(C)c1Cl ZINC001222321409 1052482071 /nfs/dbraw/zinc/48/20/71/1052482071.db2.gz VLSOBUUNLXKGMR-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222385930 1052494051 /nfs/dbraw/zinc/49/40/51/1052494051.db2.gz ZZFQAJGQAYCBRG-ICSRJNTNSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222385930 1052494056 /nfs/dbraw/zinc/49/40/56/1052494056.db2.gz ZZFQAJGQAYCBRG-ICSRJNTNSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222385933 1052494099 /nfs/dbraw/zinc/49/40/99/1052494099.db2.gz ZZFQAJGQAYCBRG-UYAOXDASSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222385933 1052494106 /nfs/dbraw/zinc/49/41/06/1052494106.db2.gz ZZFQAJGQAYCBRG-UYAOXDASSA-N 2 1 324.553 4.216 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385020 1052494260 /nfs/dbraw/zinc/49/42/60/1052494260.db2.gz CUFFCVHOWBOCDO-YTQUADARSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385020 1052494261 /nfs/dbraw/zinc/49/42/61/1052494261.db2.gz CUFFCVHOWBOCDO-YTQUADARSA-N 2 1 318.892 4.052 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222390329 1052495203 /nfs/dbraw/zinc/49/52/03/1052495203.db2.gz NHZHDTRSVXRADJ-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222390329 1052495208 /nfs/dbraw/zinc/49/52/08/1052495208.db2.gz NHZHDTRSVXRADJ-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C[C@@H](c2ccccc2)C1 ZINC000322814582 1052496904 /nfs/dbraw/zinc/49/69/04/1052496904.db2.gz ALNJNFXUNUZBQL-OGIKUXIHSA-N 2 1 312.501 4.174 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322914587 1052500335 /nfs/dbraw/zinc/50/03/35/1052500335.db2.gz KINDAMIPKRBWAC-PRTUASRFSA-N 2 1 321.534 4.025 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000322914587 1052500342 /nfs/dbraw/zinc/50/03/42/1052500342.db2.gz KINDAMIPKRBWAC-PRTUASRFSA-N 2 1 321.534 4.025 20 0 DIADMP CC/C=C\CCCCC[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222596218 1052515882 /nfs/dbraw/zinc/51/58/82/1052515882.db2.gz SKMOSNFUBYEDJB-HZQHCPKGSA-N 2 1 312.501 4.202 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@H]3C[NH2+]CC[C@H]32)CC1 ZINC001222614369 1052518298 /nfs/dbraw/zinc/51/82/98/1052518298.db2.gz DLNWDQNBXMWYOW-HSALFYBXSA-N 2 1 302.506 4.143 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@H]3C[NH2+]CC[C@H]32)s1 ZINC001222623457 1052519831 /nfs/dbraw/zinc/51/98/31/1052519831.db2.gz JSIYPBSRHAEEBA-MAUKXSAKSA-N 2 1 306.519 4.055 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001235882476 1052536547 /nfs/dbraw/zinc/53/65/47/1052536547.db2.gz MLFKZPKVOIXXJR-CQSZACIVSA-N 2 1 315.288 4.302 20 0 DIADMP C[C@H](C[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C(C)(C)C ZINC000670267135 1052542631 /nfs/dbraw/zinc/54/26/31/1052542631.db2.gz RTRCPZQOAPEKJH-SJORKVTESA-N 2 1 302.506 4.484 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CC1(C)C ZINC000397769961 1052549468 /nfs/dbraw/zinc/54/94/68/1052549468.db2.gz GWRNFTSTPPWCFG-MNIJEXPFSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1CC1(C)C ZINC000397769963 1052550095 /nfs/dbraw/zinc/55/00/95/1052550095.db2.gz GWRNFTSTPPWCFG-QFMLELGNSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C/C=C\c1ccccc1 ZINC000398007159 1052561793 /nfs/dbraw/zinc/56/17/93/1052561793.db2.gz ZSOFFMWZFURAKI-GRTKDXNDSA-N 2 1 320.480 4.200 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050979 1052563934 /nfs/dbraw/zinc/56/39/34/1052563934.db2.gz XOQITRKPQDLMHJ-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050979 1052563943 /nfs/dbraw/zinc/56/39/43/1052563943.db2.gz XOQITRKPQDLMHJ-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000037140906 1052606056 /nfs/dbraw/zinc/60/60/56/1052606056.db2.gz UVXWQWLIRJROCR-NSHDSACASA-N 2 1 313.272 4.271 20 0 DIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(F)cc1Cl ZINC000037232527 1052615575 /nfs/dbraw/zinc/61/55/75/1052615575.db2.gz XMIPJJOHCKJYMX-NSHDSACASA-N 2 1 312.860 4.439 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(Cl)c(Cl)c1 ZINC000037644463 1052627720 /nfs/dbraw/zinc/62/77/20/1052627720.db2.gz ZBAXFELYDGROSV-LRDDRELGSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(Cl)c(Cl)c1 ZINC000037644466 1052627994 /nfs/dbraw/zinc/62/79/94/1052627994.db2.gz ZBAXFELYDGROSV-MLGOLLRUSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649061 1052628197 /nfs/dbraw/zinc/62/81/97/1052628197.db2.gz XKWFXHLZDUYONE-KSSFIOAISA-N 2 1 306.881 4.255 20 0 DIADMP CSc1ccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1 ZINC000037860292 1052630241 /nfs/dbraw/zinc/63/02/41/1052630241.db2.gz PQUQABXGJRXJJG-UHFFFAOYSA-N 2 1 306.519 4.153 20 0 DIADMP CSc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1 ZINC000037860292 1052630244 /nfs/dbraw/zinc/63/02/44/1052630244.db2.gz PQUQABXGJRXJJG-UHFFFAOYSA-N 2 1 306.519 4.153 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(C2CCCCC2)cc1 ZINC000530407449 1052631651 /nfs/dbraw/zinc/63/16/51/1052631651.db2.gz JCHSJORKAPIVCU-MRXNPFEDSA-N 2 1 311.473 4.361 20 0 DIADMP C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123499437 1052632328 /nfs/dbraw/zinc/63/23/28/1052632328.db2.gz KLDLERGZPORKSF-HNNXBMFYSA-N 2 1 321.509 4.087 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(C)s2)c1 ZINC000123880933 1052635454 /nfs/dbraw/zinc/63/54/54/1052635454.db2.gz LOOPTROSRVXZFC-HNNXBMFYSA-N 2 1 302.487 4.359 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000125416123 1052648437 /nfs/dbraw/zinc/64/84/37/1052648437.db2.gz NMTQVVOXCYNUSL-OAHLLOKOSA-N 2 1 311.429 4.411 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000125416123 1052648440 /nfs/dbraw/zinc/64/84/40/1052648440.db2.gz NMTQVVOXCYNUSL-OAHLLOKOSA-N 2 1 311.429 4.411 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000125476876 1052649491 /nfs/dbraw/zinc/64/94/91/1052649491.db2.gz LZZXUDAEFLQBMN-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000125476876 1052649497 /nfs/dbraw/zinc/64/94/97/1052649497.db2.gz LZZXUDAEFLQBMN-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](CN[C@@H](C)c2cc3ccccc3o2)C1 ZINC000125980511 1052662226 /nfs/dbraw/zinc/66/22/26/1052662226.db2.gz GOIOSDBCAKYPQG-JKSUJKDBSA-N 2 1 300.446 4.204 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3o2)C1 ZINC000125980511 1052662230 /nfs/dbraw/zinc/66/22/30/1052662230.db2.gz GOIOSDBCAKYPQG-JKSUJKDBSA-N 2 1 300.446 4.204 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3o2)C1 ZINC000125980511 1052662234 /nfs/dbraw/zinc/66/22/34/1052662234.db2.gz GOIOSDBCAKYPQG-JKSUJKDBSA-N 2 1 300.446 4.204 20 0 DIADMP Cc1nccn1CCC[N@@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC000127408424 1052694144 /nfs/dbraw/zinc/69/41/44/1052694144.db2.gz GCWXDDGSKLPZNE-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC000127408424 1052694148 /nfs/dbraw/zinc/69/41/48/1052694148.db2.gz GCWXDDGSKLPZNE-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC000127408424 1052694150 /nfs/dbraw/zinc/69/41/50/1052694150.db2.gz GCWXDDGSKLPZNE-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3ccc(C)c(C)c3)CC2)[nH+]1 ZINC000128132166 1052709494 /nfs/dbraw/zinc/70/94/94/1052709494.db2.gz QVZOTNWQGWHIFO-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP c1ccc(-c2ccccc2C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000917395405 1052723970 /nfs/dbraw/zinc/72/39/70/1052723970.db2.gz MVNLZAANGPUTGH-UXHICEINSA-N 2 1 306.453 4.070 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000556060399 1052795570 /nfs/dbraw/zinc/79/55/70/1052795570.db2.gz GQTLYDQLNXAWGU-LPHOPBHVSA-N 2 1 314.498 4.236 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000556060399 1052795573 /nfs/dbraw/zinc/79/55/73/1052795573.db2.gz GQTLYDQLNXAWGU-LPHOPBHVSA-N 2 1 314.498 4.236 20 0 DIADMP CCc1ccccc1C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556093425 1052797447 /nfs/dbraw/zinc/79/74/47/1052797447.db2.gz IBTXPRGPUNBIHW-SFTDATJTSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccccc1C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556093425 1052797450 /nfs/dbraw/zinc/79/74/50/1052797450.db2.gz IBTXPRGPUNBIHW-SFTDATJTSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1C ZINC000322011433 1052800503 /nfs/dbraw/zinc/80/05/03/1052800503.db2.gz PEZJHDLBBUKSOD-DBXWQHBBSA-N 2 1 314.517 4.108 20 0 DIADMP c1ccc([C@@H]2CCCC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000498374844 1052826338 /nfs/dbraw/zinc/82/63/38/1052826338.db2.gz NRNPGPKJRUGETJ-IVAOSVALSA-N 2 1 312.501 4.319 20 0 DIADMP CCCCc1nc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cs1 ZINC000556686545 1052876370 /nfs/dbraw/zinc/87/63/70/1052876370.db2.gz UMCWSYCXJGNQQK-UHFFFAOYSA-N 2 1 323.550 4.038 20 0 DIADMP CCCCc1nc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cs1 ZINC000556686545 1052876375 /nfs/dbraw/zinc/87/63/75/1052876375.db2.gz UMCWSYCXJGNQQK-UHFFFAOYSA-N 2 1 323.550 4.038 20 0 DIADMP CC[N@@H+](CCn1ccnc1C)C(c1ccccc1)c1ccccc1 ZINC000556721431 1052877858 /nfs/dbraw/zinc/87/78/58/1052877858.db2.gz NSYYMTQLUGVKRE-UHFFFAOYSA-N 2 1 319.452 4.303 20 0 DIADMP CC[N@H+](CCn1cc[nH+]c1C)C(c1ccccc1)c1ccccc1 ZINC000556721431 1052877860 /nfs/dbraw/zinc/87/78/60/1052877860.db2.gz NSYYMTQLUGVKRE-UHFFFAOYSA-N 2 1 319.452 4.303 20 0 DIADMP CC[N@@H+](CCn1cc[nH+]c1C)C(c1ccccc1)c1ccccc1 ZINC000556721431 1052877862 /nfs/dbraw/zinc/87/78/62/1052877862.db2.gz NSYYMTQLUGVKRE-UHFFFAOYSA-N 2 1 319.452 4.303 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000322361541 1052882276 /nfs/dbraw/zinc/88/22/76/1052882276.db2.gz HDFQHXQGBYOWBF-QUCCMNQESA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000556867628 1052890228 /nfs/dbraw/zinc/89/02/28/1052890228.db2.gz HFLXBMLZLNQPQO-RNQOJCNYSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000556867628 1052890230 /nfs/dbraw/zinc/89/02/30/1052890230.db2.gz HFLXBMLZLNQPQO-RNQOJCNYSA-N 2 1 300.490 4.064 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@@H]2CCC[C@@H]21 ZINC000556880247 1052893675 /nfs/dbraw/zinc/89/36/75/1052893675.db2.gz XYQARARHDBSPJU-GBBGEASQSA-N 2 1 318.892 4.048 20 0 DIADMP Fc1ccc(-c2cccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)c2)cc1 ZINC001226785434 1052930813 /nfs/dbraw/zinc/93/08/13/1052930813.db2.gz UAMFVVQYVAHTGT-UHFFFAOYSA-N 2 1 324.443 4.211 20 0 DIADMP Cc1cccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000078704762 1052987907 /nfs/dbraw/zinc/98/79/07/1052987907.db2.gz VSVLWAPOGQMAGW-ICSRJNTNSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000078704762 1052987910 /nfs/dbraw/zinc/98/79/10/1052987910.db2.gz VSVLWAPOGQMAGW-ICSRJNTNSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000078704762 1052987914 /nfs/dbraw/zinc/98/79/14/1052987914.db2.gz VSVLWAPOGQMAGW-ICSRJNTNSA-N 2 1 300.490 4.081 20 0 DIADMP C[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C1CCC1 ZINC000179955652 1053037508 /nfs/dbraw/zinc/03/75/08/1053037508.db2.gz TXITVGSDADRKFU-INIZCTEOSA-N 2 1 315.505 4.065 20 0 DIADMP Cc1cccc(-c2ccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)cc2)c1 ZINC001228555621 1053134636 /nfs/dbraw/zinc/13/46/36/1053134636.db2.gz GCQWMGHLVLRMRL-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187326 1053224361 /nfs/dbraw/zinc/22/43/61/1053224361.db2.gz MEVDWFYHSSNVIT-YOEHRIQHSA-N 2 1 324.896 4.121 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187326 1053224372 /nfs/dbraw/zinc/22/43/72/1053224372.db2.gz MEVDWFYHSSNVIT-YOEHRIQHSA-N 2 1 324.896 4.121 20 0 DIADMP CC[N@H+]1CCC[C@H](CN[C@H](C)c2cc(Cl)sc2Cl)C1 ZINC001319383066 1053238883 /nfs/dbraw/zinc/23/88/83/1053238883.db2.gz IZBZPEINSOWNCI-GHMZBOCLSA-N 2 1 321.317 4.437 20 0 DIADMP Fc1ccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)cc1 ZINC000091268636 1053259369 /nfs/dbraw/zinc/25/93/69/1053259369.db2.gz OPXDCVRTDZTXIQ-FQEVSTJZSA-N 2 1 316.464 4.273 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CCN1C ZINC000093644858 1053430852 /nfs/dbraw/zinc/43/08/52/1053430852.db2.gz GDJLPDJWOBEYKR-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644858 1053430855 /nfs/dbraw/zinc/43/08/55/1053430855.db2.gz GDJLPDJWOBEYKR-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644858 1053430857 /nfs/dbraw/zinc/43/08/57/1053430857.db2.gz GDJLPDJWOBEYKR-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644858 1053430859 /nfs/dbraw/zinc/43/08/59/1053430859.db2.gz GDJLPDJWOBEYKR-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644858 1053430862 /nfs/dbraw/zinc/43/08/62/1053430862.db2.gz GDJLPDJWOBEYKR-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644858 1053430864 /nfs/dbraw/zinc/43/08/64/1053430864.db2.gz GDJLPDJWOBEYKR-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644858 1053430867 /nfs/dbraw/zinc/43/08/67/1053430867.db2.gz GDJLPDJWOBEYKR-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+]CC(C)(C)c1ccccc1 ZINC001200254117 1053500418 /nfs/dbraw/zinc/50/04/18/1053500418.db2.gz GIHPBEQYXXHDIZ-LJQANCHMSA-N 2 1 302.506 4.208 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+]CC(C)(C)c1ccccc1 ZINC001200254117 1053500431 /nfs/dbraw/zinc/50/04/31/1053500431.db2.gz GIHPBEQYXXHDIZ-LJQANCHMSA-N 2 1 302.506 4.208 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([NH2+]CC2CC2)CC1 ZINC000261666065 1053521334 /nfs/dbraw/zinc/52/13/34/1053521334.db2.gz GNXADENKKHBQCI-MRXNPFEDSA-N 2 1 308.469 4.365 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000261918032 1053544034 /nfs/dbraw/zinc/54/40/34/1053544034.db2.gz RDPAFPMRYNBPCW-GKCIPKSASA-N 2 1 310.441 4.269 20 0 DIADMP CC[N@@H+](C[C@@H]1CCC[NH2+]C1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000262535919 1053577505 /nfs/dbraw/zinc/57/75/05/1053577505.db2.gz QHVHGAUJFNASPZ-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CCC(C(F)F)CC2)C[C@H]1c1ccccc1 ZINC000414171870 1053672197 /nfs/dbraw/zinc/67/21/97/1053672197.db2.gz DFSVMERBMQZZOZ-FOIPXRHGSA-N 2 1 322.443 4.235 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CCC(C(F)F)CC2)C[C@H]1c1ccccc1 ZINC000414171870 1053672206 /nfs/dbraw/zinc/67/22/06/1053672206.db2.gz DFSVMERBMQZZOZ-FOIPXRHGSA-N 2 1 322.443 4.235 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CCC(C(F)F)CC2)C[C@@H]1c1ccccc1 ZINC000414171874 1053672324 /nfs/dbraw/zinc/67/23/24/1053672324.db2.gz DFSVMERBMQZZOZ-ZGUYJTEBSA-N 2 1 322.443 4.235 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CCC(C(F)F)CC2)C[C@@H]1c1ccccc1 ZINC000414171874 1053672333 /nfs/dbraw/zinc/67/23/33/1053672333.db2.gz DFSVMERBMQZZOZ-ZGUYJTEBSA-N 2 1 322.443 4.235 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2cccc(C)c2)cc1F ZINC000153731615 1053710343 /nfs/dbraw/zinc/71/03/43/1053710343.db2.gz AVYBOICCEAXLHW-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP Cc1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1Cl ZINC001231422695 1053745622 /nfs/dbraw/zinc/74/56/22/1053745622.db2.gz ORFRXPYGBQLIAB-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP CC[N@@H+](Cc1cccc(-c2ccccc2)c1)C1CCN(C)CC1 ZINC001231509764 1053774503 /nfs/dbraw/zinc/77/45/03/1053774503.db2.gz DXEBIVTZBUJMFB-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)C[C@H]1C)c1c(Cl)cccc1Cl ZINC000155946938 1053791610 /nfs/dbraw/zinc/79/16/10/1053791610.db2.gz QIYMWGROPSQQMB-JMSVASOKSA-N 2 1 315.288 4.027 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1c(Cl)cccc1Cl ZINC000155939630 1053792455 /nfs/dbraw/zinc/79/24/55/1053792455.db2.gz PZEXKYFBWYRAJJ-JHJVBQTASA-N 2 1 315.288 4.169 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1c(Cl)cccc1Cl ZINC000155939952 1053792893 /nfs/dbraw/zinc/79/28/93/1053792893.db2.gz PZEXKYFBWYRAJJ-AGIUHOORSA-N 2 1 315.288 4.169 20 0 DIADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(Cl)cc1Cl ZINC000313881970 1053858400 /nfs/dbraw/zinc/85/84/00/1053858400.db2.gz AQJUEGUUKIBPIP-NSHDSACASA-N 2 1 312.244 4.010 20 0 DIADMP CC[C@H]1CC[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001327723090 1053873302 /nfs/dbraw/zinc/87/33/02/1053873302.db2.gz RDXDCYAAEMNDFT-QNXAMLQOSA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)c1ccccc1C[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001231877098 1053902447 /nfs/dbraw/zinc/90/24/47/1053902447.db2.gz VSSPLMRSEURFNX-UHFFFAOYSA-N 2 1 302.506 4.362 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2Cc2cc3c[nH+]ccc3[nH]2)cc1 ZINC001232013549 1053940798 /nfs/dbraw/zinc/94/07/98/1053940798.db2.gz BJVKZZNZOMCLDR-HXUWFJFHSA-N 2 1 321.424 4.299 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2cc3c[nH+]ccc3[nH]2)C2CC2)c1C ZINC001232018895 1053943776 /nfs/dbraw/zinc/94/37/76/1053943776.db2.gz PVTHYENYYJNNCW-UHFFFAOYSA-N 2 1 305.425 4.344 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232150546 1053972330 /nfs/dbraw/zinc/97/23/30/1053972330.db2.gz YSOYQCJOEKFZQN-UHFFFAOYSA-N 2 1 314.448 4.218 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232149325 1053973005 /nfs/dbraw/zinc/97/30/05/1053973005.db2.gz MREAWYAPUGORKI-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2sc(C(C)C)nc2C)CC1 ZINC000164450427 1054058047 /nfs/dbraw/zinc/05/80/47/1054058047.db2.gz CYESOUYDAISDLW-CQSZACIVSA-N 2 1 323.550 4.490 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](Cc1ccc(C)cc1)C(C)C ZINC000164700324 1054061630 /nfs/dbraw/zinc/06/16/30/1054061630.db2.gz HMWBJOCXNCINDZ-FQEVSTJZSA-N 2 1 313.489 4.137 20 0 DIADMP Cc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)o1 ZINC000165010576 1054067989 /nfs/dbraw/zinc/06/79/89/1054067989.db2.gz NCFHAHKTISBUFU-DAYGRLMNSA-N 2 1 318.486 4.383 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCN(C)[C@@H]2c2cccs2)o1 ZINC000165010576 1054068001 /nfs/dbraw/zinc/06/80/01/1054068001.db2.gz NCFHAHKTISBUFU-DAYGRLMNSA-N 2 1 318.486 4.383 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc3ccsc3c2)CC1 ZINC001232610940 1054084006 /nfs/dbraw/zinc/08/40/06/1054084006.db2.gz BTKIZACAWGKCDJ-UHFFFAOYSA-N 2 1 316.514 4.454 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(C3CC3)cc2)CC1 ZINC001232983322 1054167008 /nfs/dbraw/zinc/16/70/08/1054167008.db2.gz LPHAVFPDDYKUDS-UHFFFAOYSA-N 2 1 300.490 4.116 20 0 DIADMP C[N@H+](Cc1ccc(Cc2ccccc2)cc1)CC1CC[NH+](C)CC1 ZINC001233331152 1054234041 /nfs/dbraw/zinc/23/40/41/1054234041.db2.gz JNIVPQYEBZTLCG-UHFFFAOYSA-N 2 1 322.496 4.051 20 0 DIADMP CSc1cccc(Cl)c1CN1CCC(n2ccnc2)CC1 ZINC001233353492 1054248161 /nfs/dbraw/zinc/24/81/61/1054248161.db2.gz YDRFMGRPZFGULA-UHFFFAOYSA-N 2 1 321.877 4.096 20 0 DIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1cccc(Cl)c1 ZINC000173441825 1054484327 /nfs/dbraw/zinc/48/43/27/1054484327.db2.gz JQYCODKLNCUEKJ-QGZVFWFLSA-N 2 1 305.853 4.366 20 0 DIADMP C[NH2+][C@@H](C)CC[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F ZINC001345481547 1054496459 /nfs/dbraw/zinc/49/64/59/1054496459.db2.gz CSIXJUZWOQGHAE-STQMWFEESA-N 2 1 322.399 4.090 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000671294818 1054525610 /nfs/dbraw/zinc/52/56/10/1054525610.db2.gz LQKHKYHIGLIKLS-QXAKKESOSA-N 2 1 316.489 4.143 20 0 DIADMP C[N@@H+](Cc1cc(-n2ccnc2)cs1)C(C)(C)c1ccccc1 ZINC000671309208 1054550279 /nfs/dbraw/zinc/55/02/79/1054550279.db2.gz JPENVGPTVLIXSJ-UHFFFAOYSA-N 2 1 311.454 4.301 20 0 DIADMP CC[C@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419649 1054590232 /nfs/dbraw/zinc/59/02/32/1054590232.db2.gz RHPHDOAYGVHKDB-NEPJUHHUSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419649 1054590241 /nfs/dbraw/zinc/59/02/41/1054590241.db2.gz RHPHDOAYGVHKDB-NEPJUHHUSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419649 1054590251 /nfs/dbraw/zinc/59/02/51/1054590251.db2.gz RHPHDOAYGVHKDB-NEPJUHHUSA-N 2 1 300.899 4.315 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(-c2cccnc2)cc1 ZINC000623439078 1054595214 /nfs/dbraw/zinc/59/52/14/1054595214.db2.gz VAIHHAORRBRFFE-JXFKEZNVSA-N 2 1 323.484 4.272 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485281 1054603661 /nfs/dbraw/zinc/60/36/61/1054603661.db2.gz USAMAMFLXRTOOX-CJNGLKHVSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485281 1054603666 /nfs/dbraw/zinc/60/36/66/1054603666.db2.gz USAMAMFLXRTOOX-CJNGLKHVSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530674 1054614026 /nfs/dbraw/zinc/61/40/26/1054614026.db2.gz HXFYMOPNXXKODV-WCQYABFASA-N 2 1 312.910 4.241 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530674 1054614031 /nfs/dbraw/zinc/61/40/31/1054614031.db2.gz HXFYMOPNXXKODV-WCQYABFASA-N 2 1 312.910 4.241 20 0 DIADMP Fc1ccc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1-c1ccccc1 ZINC001235002050 1054641602 /nfs/dbraw/zinc/64/16/02/1054641602.db2.gz WYGLZYRNYUAFPB-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP Fc1ccc(C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1-c1ccccc1 ZINC001235002050 1054641608 /nfs/dbraw/zinc/64/16/08/1054641608.db2.gz WYGLZYRNYUAFPB-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)c(C)c12 ZINC001235003030 1054642077 /nfs/dbraw/zinc/64/20/77/1054642077.db2.gz ZCVMIJPWVWGUBY-KRWDZBQOSA-N 2 1 320.527 4.155 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)s1 ZINC001235035200 1054642945 /nfs/dbraw/zinc/64/29/45/1054642945.db2.gz CTGRUYCPMHNSIE-SFHVURJKSA-N 2 1 306.519 4.056 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001235047253 1054646569 /nfs/dbraw/zinc/64/65/69/1054646569.db2.gz UKVZLTAEZXOQLV-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP Fc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c2ccccc12 ZINC001235048553 1054647299 /nfs/dbraw/zinc/64/72/99/1054647299.db2.gz YPTPANFSCIDVAH-FQEVSTJZSA-N 2 1 312.432 4.087 20 0 DIADMP C[C@@H](C[N@H+]1CCC2(C1)CC[NH2+]CC2)c1cccc2ccccc21 ZINC001235093887 1054653045 /nfs/dbraw/zinc/65/30/45/1054653045.db2.gz UNNYQLZUMNVPPX-KRWDZBQOSA-N 2 1 308.469 4.019 20 0 DIADMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)s1 ZINC000178706717 1054657722 /nfs/dbraw/zinc/65/77/22/1054657722.db2.gz JRKNYVDFNPALRG-WCQYABFASA-N 2 1 311.882 4.283 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[NH+]3CCC4(CC[NH2+]4)CC3)cc12 ZINC001235111679 1054660588 /nfs/dbraw/zinc/66/05/88/1054660588.db2.gz RZLAXXCLAYXDGL-UHFFFAOYSA-N 2 1 322.477 4.382 20 0 DIADMP c1ccc(C(C[N@@H+]2CCCC[C@]23CC[NH2+]C3)c2ccccc2)cc1 ZINC001235120447 1054661996 /nfs/dbraw/zinc/66/19/96/1054661996.db2.gz BSHZEKBNRKAFNY-JOCHJYFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc(C(C[N@H+]2CCCC[C@]23CC[NH2+]C3)c2ccccc2)cc1 ZINC001235120447 1054662003 /nfs/dbraw/zinc/66/20/03/1054662003.db2.gz BSHZEKBNRKAFNY-JOCHJYFZSA-N 2 1 320.480 4.037 20 0 DIADMP C[C@H](C[N@@H+]1CCCC[C@@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120421 1054662110 /nfs/dbraw/zinc/66/21/10/1054662110.db2.gz BIGCCYRZIJJXMS-UTKZUKDTSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120421 1054662119 /nfs/dbraw/zinc/66/21/19/1054662119.db2.gz BIGCCYRZIJJXMS-UTKZUKDTSA-N 2 1 308.469 4.161 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235118623 1054662542 /nfs/dbraw/zinc/66/25/42/1054662542.db2.gz GLLFMUYUXCSOSJ-NRFANRHFSA-N 2 1 320.436 4.304 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235118623 1054662546 /nfs/dbraw/zinc/66/25/46/1054662546.db2.gz GLLFMUYUXCSOSJ-NRFANRHFSA-N 2 1 320.436 4.304 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCCC23CC[NH2+]CC3)cc1 ZINC001235141789 1054665298 /nfs/dbraw/zinc/66/52/98/1054665298.db2.gz YXBAXMJHTUPGJD-SFHVURJKSA-N 2 1 314.517 4.207 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1F ZINC001235154647 1054667434 /nfs/dbraw/zinc/66/74/34/1054667434.db2.gz JLXLOHRUBGRUGB-QGZVFWFLSA-N 2 1 324.871 4.142 20 0 DIADMP Clc1cccc(CCC[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1 ZINC001235152382 1054667638 /nfs/dbraw/zinc/66/76/38/1054667638.db2.gz MNLCDYWOEVTDLR-IBGZPJMESA-N 2 1 320.908 4.127 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1 ZINC001235155356 1054667849 /nfs/dbraw/zinc/66/78/49/1054667849.db2.gz CZJAPQDUMRRUCM-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1F ZINC001235156859 1054668043 /nfs/dbraw/zinc/66/80/43/1054668043.db2.gz RUBBNFNWGWXYTO-QGZVFWFLSA-N 2 1 324.871 4.142 20 0 DIADMP c1cc2ccc(C[N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)cc2s1 ZINC001235157491 1054668054 /nfs/dbraw/zinc/66/80/54/1054668054.db2.gz JFXHPVDZNXOZRJ-SFHVURJKSA-N 2 1 314.498 4.255 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001235160582 1054670401 /nfs/dbraw/zinc/67/04/01/1054670401.db2.gz YBCVNXXZKZRAQV-HXUWFJFHSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001235160578 1054670528 /nfs/dbraw/zinc/67/05/28/1054670528.db2.gz YBCVNXXZKZRAQV-FQEVSTJZSA-N 2 1 300.490 4.164 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@@H]4C[NH2+]C[C@H]4C3)cc12 ZINC001235184882 1054678140 /nfs/dbraw/zinc/67/81/40/1054678140.db2.gz QTWSXMAHDJOZKZ-CVEARBPZSA-N 2 1 322.477 4.096 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235192097 1054681753 /nfs/dbraw/zinc/68/17/53/1054681753.db2.gz WNTLNRBGQZCNDJ-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cccc(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1C ZINC001235249591 1054691333 /nfs/dbraw/zinc/69/13/33/1054691333.db2.gz SUQQVIZYZJPKHQ-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1cccc(C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1C ZINC001235249591 1054691338 /nfs/dbraw/zinc/69/13/38/1054691338.db2.gz SUQQVIZYZJPKHQ-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c(C)c1 ZINC001235249201 1054692147 /nfs/dbraw/zinc/69/21/47/1054692147.db2.gz LWDMSNDUWHBNQO-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c(C)c1 ZINC001235249201 1054692155 /nfs/dbraw/zinc/69/21/55/1054692155.db2.gz LWDMSNDUWHBNQO-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)CC1 ZINC001235255481 1054694124 /nfs/dbraw/zinc/69/41/24/1054694124.db2.gz NEHSZYQXIWTHGN-XUVXKRRUSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)CC1 ZINC001235255481 1054694130 /nfs/dbraw/zinc/69/41/30/1054694130.db2.gz NEHSZYQXIWTHGN-XUVXKRRUSA-N 2 1 302.506 4.143 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)cc12 ZINC001235274123 1054697623 /nfs/dbraw/zinc/69/76/23/1054697623.db2.gz UUZMJAGTTWBEIB-YJBOKZPZSA-N 2 1 322.477 4.238 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)cc12 ZINC001235274123 1054697635 /nfs/dbraw/zinc/69/76/35/1054697635.db2.gz UUZMJAGTTWBEIB-YJBOKZPZSA-N 2 1 322.477 4.238 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@H](C3C[NH2+]C3)C2)CC1 ZINC001235337919 1054704587 /nfs/dbraw/zinc/70/45/87/1054704587.db2.gz LXBJOOVGEQVOHQ-RTBURBONSA-N 2 1 302.506 4.001 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@@H](C2C[NH2+]C2)C1 ZINC001235341509 1054704777 /nfs/dbraw/zinc/70/47/77/1054704777.db2.gz PUTLONXICGFQFS-CQSZACIVSA-N 2 1 322.477 4.096 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235348104 1054705723 /nfs/dbraw/zinc/70/57/23/1054705723.db2.gz AAUQAUXURIWSEM-ZHHKINOHSA-N 2 1 324.512 4.058 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235377116 1054709032 /nfs/dbraw/zinc/70/90/32/1054709032.db2.gz AAUQAUXURIWSEM-PDGJWGCVSA-N 2 1 324.512 4.058 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235377115 1054710115 /nfs/dbraw/zinc/71/01/15/1054710115.db2.gz AAUQAUXURIWSEM-NMIHRBCNSA-N 2 1 324.512 4.058 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)s1 ZINC001235425895 1054715410 /nfs/dbraw/zinc/71/54/10/1054715410.db2.gz JSQQIGIVFPCDIL-HOTGVXAUSA-N 2 1 314.498 4.113 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](C)CC2CC[NH2+]CC2)cc1 ZINC001235433509 1054717324 /nfs/dbraw/zinc/71/73/24/1054717324.db2.gz KQMIYXXPFYOCJD-UHFFFAOYSA-N 2 1 318.505 4.077 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235431728 1054717708 /nfs/dbraw/zinc/71/77/08/1054717708.db2.gz VRHUEKAPRUJWNO-MOPGFXCFSA-N 2 1 324.468 4.158 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)CC1CC[NH2+]CC1 ZINC001235432966 1054717789 /nfs/dbraw/zinc/71/77/89/1054717789.db2.gz BLJVLXYJSLABTO-UHFFFAOYSA-N 2 1 318.848 4.031 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+](C)CC3CC[NH2+]CC3)c2)cc1 ZINC001235433787 1054718084 /nfs/dbraw/zinc/71/80/84/1054718084.db2.gz QITTXVNKLWUDOE-UHFFFAOYSA-N 2 1 324.468 4.219 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1C ZINC001235427779 1054718564 /nfs/dbraw/zinc/71/85/64/1054718564.db2.gz OEMCENPMYFGDAL-FUHWJXTLSA-N 2 1 320.908 4.168 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](C)CC1CC[NH2+]CC1 ZINC001235433771 1054718633 /nfs/dbraw/zinc/71/86/33/1054718633.db2.gz PHQQBPXQYWGAIP-UHFFFAOYSA-N 2 1 318.505 4.077 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1C ZINC001235427783 1054718711 /nfs/dbraw/zinc/71/87/11/1054718711.db2.gz OEMCENPMYFGDAL-SJLPKXTDSA-N 2 1 320.908 4.168 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc2c(s1)CC[NH2+]C2 ZINC001235445844 1054721686 /nfs/dbraw/zinc/72/16/86/1054721686.db2.gz VAOZXUWCPABHBI-SFHVURJKSA-N 2 1 312.482 4.039 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)cc1 ZINC001235673458 1054767238 /nfs/dbraw/zinc/76/72/38/1054767238.db2.gz IFFWVHFXEXWKQG-IBGZPJMESA-N 2 1 312.844 4.280 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001235674465 1054772359 /nfs/dbraw/zinc/77/23/59/1054772359.db2.gz GHKRHFJMLLCBGP-INIZCTEOSA-N 2 1 314.860 4.178 20 0 DIADMP C[NH2+]CC1CC[NH+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001235679243 1054773070 /nfs/dbraw/zinc/77/30/70/1054773070.db2.gz QQRDRLIFYIYJPP-UHFFFAOYSA-N 2 1 321.679 4.078 20 0 DIADMP C[NH2+]CC1CC[NH+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC001235680231 1054773934 /nfs/dbraw/zinc/77/39/34/1054773934.db2.gz SATXIQAUVIMJHD-UHFFFAOYSA-N 2 1 321.679 4.078 20 0 DIADMP Fc1cccc([C@H]2CCC[N@@H+]2CCC[NH2+]C2CCCCC2)c1 ZINC001235713636 1054784368 /nfs/dbraw/zinc/78/43/68/1054784368.db2.gz DKJJGMLKJDPZQC-LJQANCHMSA-N 2 1 304.453 4.275 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)c1 ZINC001235713636 1054784379 /nfs/dbraw/zinc/78/43/79/1054784379.db2.gz DKJJGMLKJDPZQC-LJQANCHMSA-N 2 1 304.453 4.275 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CCCC3(C[NH2+]C3)C2)CC1 ZINC001235710808 1054786429 /nfs/dbraw/zinc/78/64/29/1054786429.db2.gz GCMKHFHGEXRVLF-IBGZPJMESA-N 2 1 302.506 4.145 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)CCC3CC[NH2+]CC3)c(C)c12 ZINC001235717681 1054790263 /nfs/dbraw/zinc/79/02/63/1054790263.db2.gz YNJVTFHTJDZSRI-UHFFFAOYSA-N 2 1 322.543 4.401 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccc(C3CCCCC3)cc2)CC1 ZINC001235723519 1054790556 /nfs/dbraw/zinc/79/05/56/1054790556.db2.gz DOLTTWMGPRFRSA-UHFFFAOYSA-N 2 1 300.490 4.308 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001235727612 1054793360 /nfs/dbraw/zinc/79/33/60/1054793360.db2.gz ZRTBDBUTWNTKSF-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2ccc(C)cc2)cc1)C1CC[NH2+]CC1 ZINC001235759886 1054800761 /nfs/dbraw/zinc/80/07/61/1054800761.db2.gz DLUMIVQNEVUZSL-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP CC[N@@H+](Cc1ccccc1-c1ccccc1C)C1CC[NH2+]CC1 ZINC001235760587 1054801233 /nfs/dbraw/zinc/80/12/33/1054801233.db2.gz FZJHJOPVBIWTMX-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](CC)C2CC[NH2+]CC2)cc1 ZINC001235762985 1054801638 /nfs/dbraw/zinc/80/16/38/1054801638.db2.gz YVTPORBAFZBDAS-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CC[N@@H+](Cc1cccc2c3ccccc3oc21)C1CC[NH2+]CC1 ZINC001235762943 1054802174 /nfs/dbraw/zinc/80/21/74/1054802174.db2.gz WVARRABUPOBEDD-UHFFFAOYSA-N 2 1 308.425 4.160 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2ccc(-c3ccccc3Cl)cc2)CC1 ZINC001235788468 1054807170 /nfs/dbraw/zinc/80/71/70/1054807170.db2.gz GQGORNOYRHXUMK-UHFFFAOYSA-N 2 1 314.860 4.191 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2ccc3sc4ccccc4c3c2)CC1 ZINC001235791745 1054807565 /nfs/dbraw/zinc/80/75/65/1054807565.db2.gz CJMJXFWBDWTFLV-UHFFFAOYSA-N 2 1 310.466 4.238 20 0 DIADMP [NH3+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001235808303 1054808587 /nfs/dbraw/zinc/80/85/87/1054808587.db2.gz ALQBWMRJHYHBAG-MUJYYYPQSA-N 2 1 316.832 4.054 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH3+])C2 ZINC001235809770 1054811548 /nfs/dbraw/zinc/81/15/48/1054811548.db2.gz JBBMCVGQBQRLMP-REPLKXPHSA-N 2 1 316.489 4.100 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2CC2CC3(C2)CC[NH2+]CC3)s1 ZINC001235839041 1054817806 /nfs/dbraw/zinc/81/78/06/1054817806.db2.gz HOQOCDREDZSDMU-AWEZNQCLSA-N 2 1 324.921 4.318 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(Cl)cc2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001235841364 1054818514 /nfs/dbraw/zinc/81/85/14/1054818514.db2.gz DQLPLLQTYUOLGK-MRXNPFEDSA-N 2 1 314.860 4.048 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@@H](c2cccc(Cl)c2Cl)C1 ZINC001235884948 1054831617 /nfs/dbraw/zinc/83/16/17/1054831617.db2.gz NIYHIVGIQYQIPA-CYBMUJFWSA-N 2 1 315.288 4.302 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902390 1054840609 /nfs/dbraw/zinc/84/06/09/1054840609.db2.gz FKWKJCBQICNOOW-KBXCAEBGSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902390 1054840622 /nfs/dbraw/zinc/84/06/22/1054840622.db2.gz FKWKJCBQICNOOW-KBXCAEBGSA-N 2 1 314.860 4.319 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC001235919111 1054846582 /nfs/dbraw/zinc/84/65/82/1054846582.db2.gz TYANWSSBLQHVEH-HNNXBMFYSA-N 2 1 314.395 4.014 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)CC1 ZINC001235929574 1054855229 /nfs/dbraw/zinc/85/52/29/1054855229.db2.gz RODHHFMPAAPKQL-ZCNNSNEGSA-N 2 1 302.506 4.001 20 0 DIADMP c1ccc(CC[N@H+](CC[C@H]2CCC[NH2+]C2)Cc2ccccc2)cc1 ZINC001235948661 1054863871 /nfs/dbraw/zinc/86/38/71/1054863871.db2.gz RZKIDAZJQHHTBE-OAQYLSRUSA-N 2 1 322.496 4.121 20 0 DIADMP CCC[C@@H](C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)OCC ZINC000624049278 1054866913 /nfs/dbraw/zinc/86/69/13/1054866913.db2.gz CTJCEEYICRHFMD-KXBFYZLASA-N 2 1 315.461 4.037 20 0 DIADMP CCC[C@H](C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)OCC ZINC000624049276 1054867321 /nfs/dbraw/zinc/86/73/21/1054867321.db2.gz CTJCEEYICRHFMD-DNVCBOLYSA-N 2 1 315.461 4.037 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001235956302 1054869045 /nfs/dbraw/zinc/86/90/45/1054869045.db2.gz CCYBHYKLNMOPBC-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001235957651 1054869790 /nfs/dbraw/zinc/86/97/90/1054869790.db2.gz RBTHFCFUELZUFJ-SFHVURJKSA-N 2 1 324.468 4.219 20 0 DIADMP CCCCCCc1ccc(C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)s1 ZINC001235960491 1054872666 /nfs/dbraw/zinc/87/26/66/1054872666.db2.gz XPPKGUAEYVXTFI-MRXNPFEDSA-N 2 1 308.535 4.302 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000624122488 1054883332 /nfs/dbraw/zinc/88/33/32/1054883332.db2.gz SGMUULPPBNPZMO-OXQOHEQNSA-N 2 1 316.464 4.083 20 0 DIADMP Cc1ccc2cc([C@@H](C)NC[C@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123928 1054884831 /nfs/dbraw/zinc/88/48/31/1054884831.db2.gz TZSRRHSOQXNNAD-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]C[C@H]3CCCC[N@H+](C)C3)oc2c1 ZINC000624123928 1054884842 /nfs/dbraw/zinc/88/48/42/1054884842.db2.gz TZSRRHSOQXNNAD-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123928 1054884849 /nfs/dbraw/zinc/88/48/49/1054884849.db2.gz TZSRRHSOQXNNAD-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+](Cc1cccc2c3ccccc3oc21)[C@@H]1CCC[NH2+]C1 ZINC001236005817 1054891013 /nfs/dbraw/zinc/89/10/13/1054891013.db2.gz FPPVSDYSJJBGHS-MRXNPFEDSA-N 2 1 308.425 4.160 20 0 DIADMP CC[N@@H+](Cc1cccc2c3ccccc3oc21)[C@@H]1CCC[NH2+]C1 ZINC001236005817 1054891020 /nfs/dbraw/zinc/89/10/20/1054891020.db2.gz FPPVSDYSJJBGHS-MRXNPFEDSA-N 2 1 308.425 4.160 20 0 DIADMP C[C@@H]1C[NH2+]CC(F)(F)[C@@H]1C[N@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009836 1054894022 /nfs/dbraw/zinc/89/40/22/1054894022.db2.gz XYBDWBSPJMDMNJ-PRLABOORSA-N 2 1 316.480 4.014 20 0 DIADMP C[C@@H]1C[NH2+]CC(F)(F)[C@@H]1C[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009836 1054894039 /nfs/dbraw/zinc/89/40/39/1054894039.db2.gz XYBDWBSPJMDMNJ-PRLABOORSA-N 2 1 316.480 4.014 20 0 DIADMP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236066441 1054921652 /nfs/dbraw/zinc/92/16/52/1054921652.db2.gz HBMSRWCQFVTCQZ-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236066441 1054921667 /nfs/dbraw/zinc/92/16/67/1054921667.db2.gz HBMSRWCQFVTCQZ-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)Cc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182078570 1054958867 /nfs/dbraw/zinc/95/88/67/1054958867.db2.gz SOAFFUZRXIYMSS-NLWGTHIKSA-N 2 1 314.517 4.108 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccc(Oc2ccc(Cl)cc2)cc1 ZINC001236140947 1054966694 /nfs/dbraw/zinc/96/66/94/1054966694.db2.gz BGTRGULXKGEEON-UHFFFAOYSA-N 2 1 318.848 4.303 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000182234950 1054972194 /nfs/dbraw/zinc/97/21/94/1054972194.db2.gz WSCLOSRFNJAOBX-KRWDZBQOSA-N 2 1 322.880 4.018 20 0 DIADMP CCC[N@@H+](Cc1cc(C)cnc1-c1ccccc1)C1CC[NH2+]CC1 ZINC001236185143 1054984886 /nfs/dbraw/zinc/98/48/86/1054984886.db2.gz XPDTUAATLVEPPB-UHFFFAOYSA-N 2 1 323.484 4.021 20 0 DIADMP CCC[N@@H+](Cc1c(C)cc(OC(C)C)cc1C)C1CC[NH2+]CC1 ZINC001236185133 1054985832 /nfs/dbraw/zinc/98/58/32/1054985832.db2.gz XEHYPTHZVCNLNI-UHFFFAOYSA-N 2 1 318.505 4.055 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(C)cnc2-c2ccccc2)CC1 ZINC001236215277 1055001248 /nfs/dbraw/zinc/00/12/48/1055001248.db2.gz MSYIQVYDCHPYHC-UHFFFAOYSA-N 2 1 323.484 4.019 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(Cl)ccc2OC(C)C)CC1 ZINC001236212547 1055002923 /nfs/dbraw/zinc/00/29/23/1055002923.db2.gz GXWGINKMBCQQKC-UHFFFAOYSA-N 2 1 324.896 4.090 20 0 DIADMP C[N@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236215989 1055004861 /nfs/dbraw/zinc/00/48/61/1055004861.db2.gz JLFOTJUDENNFCQ-UXHICEINSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236215989 1055004868 /nfs/dbraw/zinc/00/48/68/1055004868.db2.gz JLFOTJUDENNFCQ-UXHICEINSA-N 2 1 312.432 4.194 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])c1 ZINC001236215400 1055005973 /nfs/dbraw/zinc/00/59/73/1055005973.db2.gz HVBJAPFINJRSPR-LEWJYISDSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])c1 ZINC001236215400 1055005988 /nfs/dbraw/zinc/00/59/88/1055005988.db2.gz HVBJAPFINJRSPR-LEWJYISDSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236215991 1055006995 /nfs/dbraw/zinc/00/69/95/1055006995.db2.gz JLFOTJUDENNFCQ-VQTJNVASSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236215991 1055007010 /nfs/dbraw/zinc/00/70/10/1055007010.db2.gz JLFOTJUDENNFCQ-VQTJNVASSA-N 2 1 312.432 4.194 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(C)sc3ccccc32)CC1 ZINC001236215514 1055007303 /nfs/dbraw/zinc/00/73/03/1055007303.db2.gz OKXKARQUJOEOBJ-UHFFFAOYSA-N 2 1 302.487 4.172 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccs2)cc1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236219480 1055008895 /nfs/dbraw/zinc/00/88/95/1055008895.db2.gz WUDULGHFYNOPQT-SJORKVTESA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccs2)cc1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236219480 1055008907 /nfs/dbraw/zinc/00/89/07/1055008907.db2.gz WUDULGHFYNOPQT-SJORKVTESA-N 2 1 300.471 4.117 20 0 DIADMP Cc1c(C[N@@H+](C)[C@@H]2CCCC[C@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219385 1055009058 /nfs/dbraw/zinc/00/90/58/1055009058.db2.gz VOEHMPRZTZGJKZ-NHCUHLMSSA-N 2 1 308.469 4.364 20 0 DIADMP Cc1c(C[N@H+](C)[C@@H]2CCCC[C@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219385 1055009081 /nfs/dbraw/zinc/00/90/81/1055009081.db2.gz VOEHMPRZTZGJKZ-NHCUHLMSSA-N 2 1 308.469 4.364 20 0 DIADMP Cc1c(C[N@@H+](C)[C@H]2CCCC[C@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219387 1055010243 /nfs/dbraw/zinc/01/02/43/1055010243.db2.gz VOEHMPRZTZGJKZ-RTWAWAEBSA-N 2 1 308.469 4.364 20 0 DIADMP Cc1c(C[N@H+](C)[C@H]2CCCC[C@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219387 1055010257 /nfs/dbraw/zinc/01/02/57/1055010257.db2.gz VOEHMPRZTZGJKZ-RTWAWAEBSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236218774 1055010445 /nfs/dbraw/zinc/01/04/45/1055010445.db2.gz UBMUKUBMDRLYAO-ZWKOTPCHSA-N 2 1 308.425 4.288 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236218485 1055010762 /nfs/dbraw/zinc/01/07/62/1055010762.db2.gz SGNDGOCHEXMAOC-LEWJYISDSA-N 2 1 308.469 4.364 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])ccc21 ZINC001236219199 1055010848 /nfs/dbraw/zinc/01/08/48/1055010848.db2.gz VQCGSDUNJHUGOA-GHTZIAJQSA-N 2 1 321.468 4.033 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])ccc21 ZINC001236219199 1055010866 /nfs/dbraw/zinc/01/08/66/1055010866.db2.gz VQCGSDUNJHUGOA-GHTZIAJQSA-N 2 1 321.468 4.033 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222141 1055013307 /nfs/dbraw/zinc/01/33/07/1055013307.db2.gz LIPIUSBCGAXYFZ-NSISKUIASA-N 2 1 316.533 4.364 20 0 DIADMP C[N@@H+](CCCc1ccc(Cl)c(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224483 1055014262 /nfs/dbraw/zinc/01/42/62/1055014262.db2.gz UWZQLJQAYXSXNP-HDJSIYSDSA-N 2 1 315.288 4.128 20 0 DIADMP COc1ccc(-c2ccccc2)cc1C[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223470 1055015816 /nfs/dbraw/zinc/01/58/16/1055015816.db2.gz PVMRRKJNXVAMNR-MXVIHJGJSA-N 2 1 324.468 4.064 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)C1(C)CC[NH2+]CC1 ZINC001236227016 1055016857 /nfs/dbraw/zinc/01/68/57/1055016857.db2.gz XKGPDQZLHYPNAM-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP Cc1ccsc1C[N@@H+](Cc1ccccc1)C1CCC([NH3+])CC1 ZINC001236227305 1055018320 /nfs/dbraw/zinc/01/83/20/1055018320.db2.gz BPIPDJRPRWLXKG-UHFFFAOYSA-N 2 1 314.498 4.329 20 0 DIADMP Cc1sccc1C[N@@H+](Cc1ccccc1)C1CCC([NH3+])CC1 ZINC001236229704 1055020075 /nfs/dbraw/zinc/02/00/75/1055020075.db2.gz COZCJWUXXYPMJB-UHFFFAOYSA-N 2 1 314.498 4.329 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H]2C[NH3+])cc(C)c1-c1ccc(F)cc1 ZINC001236252005 1055035823 /nfs/dbraw/zinc/03/58/23/1055035823.db2.gz BRTSUJFUYVGJGK-LJQANCHMSA-N 2 1 312.432 4.033 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H]2C[NH3+])cc(C)c1-c1ccc(F)cc1 ZINC001236252005 1055035836 /nfs/dbraw/zinc/03/58/36/1055035836.db2.gz BRTSUJFUYVGJGK-LJQANCHMSA-N 2 1 312.432 4.033 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(F)c2F)c1 ZINC000183257949 1055037655 /nfs/dbraw/zinc/03/76/55/1055037655.db2.gz DYEJGLQIDRWNON-CQSZACIVSA-N 2 1 318.411 4.267 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2cc(C)cc(C)c2)C1 ZINC000183465947 1055045430 /nfs/dbraw/zinc/04/54/30/1055045430.db2.gz VFJRGDWHBSSSQH-LJQANCHMSA-N 2 1 311.473 4.078 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2cc(C)cc(C)c2)C1 ZINC000183465947 1055045443 /nfs/dbraw/zinc/04/54/43/1055045443.db2.gz VFJRGDWHBSSSQH-LJQANCHMSA-N 2 1 311.473 4.078 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH3+])cc1)Cc1ccc(Cl)cc1Cl ZINC001236265813 1055045677 /nfs/dbraw/zinc/04/56/77/1055045677.db2.gz NHXZHUFRLGGMSL-UHFFFAOYSA-N 2 1 323.267 4.474 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH3+])cc1)Cc1ccc(Cl)cc1Cl ZINC001236265813 1055045690 /nfs/dbraw/zinc/04/56/90/1055045690.db2.gz NHXZHUFRLGGMSL-UHFFFAOYSA-N 2 1 323.267 4.474 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CC1 ZINC001236285245 1055048824 /nfs/dbraw/zinc/04/88/24/1055048824.db2.gz DTBYXRWROVNFHA-QUCCMNQESA-N 2 1 312.501 4.233 20 0 DIADMP Cc1cc(C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)c(C)s1 ZINC001236300177 1055049482 /nfs/dbraw/zinc/04/94/82/1055049482.db2.gz MYHOKABHFIRADV-UHFFFAOYSA-N 2 1 314.498 4.119 20 0 DIADMP Cc1cc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c(C)s1 ZINC001236300177 1055049493 /nfs/dbraw/zinc/04/94/93/1055049493.db2.gz MYHOKABHFIRADV-UHFFFAOYSA-N 2 1 314.498 4.119 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)c1 ZINC001236322082 1055056807 /nfs/dbraw/zinc/05/68/07/1055056807.db2.gz VSADJWNZNVSDSJ-HDICACEKSA-N 2 1 320.546 4.302 20 0 DIADMP CC(C)C[C@@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccccn1 ZINC000184500722 1055076967 /nfs/dbraw/zinc/07/69/67/1055076967.db2.gz VZXAOHBUYXSLQX-IEBWSBKVSA-N 2 1 303.494 4.023 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1ccc2ccccc2n1)[NH+]1CCCCC1 ZINC000184500531 1055077431 /nfs/dbraw/zinc/07/74/31/1055077431.db2.gz CBMBFGZPQKYHMG-SJORKVTESA-N 2 1 311.473 4.150 20 0 DIADMP FC(F)c1ccccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236372145 1055078513 /nfs/dbraw/zinc/07/85/13/1055078513.db2.gz AYZCPSPJKAADAB-HNNXBMFYSA-N 2 1 322.443 4.368 20 0 DIADMP Clc1ccsc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374020 1055079142 /nfs/dbraw/zinc/07/91/42/1055079142.db2.gz OCDNGTBKHWFGLF-CYBMUJFWSA-N 2 1 312.910 4.146 20 0 DIADMP Clc1ccsc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374020 1055079155 /nfs/dbraw/zinc/07/91/55/1055079155.db2.gz OCDNGTBKHWFGLF-CYBMUJFWSA-N 2 1 312.910 4.146 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374091 1055080449 /nfs/dbraw/zinc/08/04/49/1055080449.db2.gz OYGWJNFUADJXOF-SFHVURJKSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374121 1055080618 /nfs/dbraw/zinc/08/06/18/1055080618.db2.gz PDZNHOLGPMLFCU-GOSISDBHSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374636 1055081828 /nfs/dbraw/zinc/08/18/28/1055081828.db2.gz FREHAKYCYSXLRJ-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236375965 1055082052 /nfs/dbraw/zinc/08/20/52/1055082052.db2.gz OJGJKPQILGAPOW-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1ccc(Cl)cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374859 1055082254 /nfs/dbraw/zinc/08/22/54/1055082254.db2.gz FWMLOPAQHWWQQO-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP Clc1sccc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374585 1055082358 /nfs/dbraw/zinc/08/23/58/1055082358.db2.gz FLWWLIFWOSKQST-CYBMUJFWSA-N 2 1 312.910 4.146 20 0 DIADMP Clc1sccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374585 1055082368 /nfs/dbraw/zinc/08/23/68/1055082368.db2.gz FLWWLIFWOSKQST-CYBMUJFWSA-N 2 1 312.910 4.146 20 0 DIADMP Fc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)ccc1Cl ZINC001236375052 1055082505 /nfs/dbraw/zinc/08/25/05/1055082505.db2.gz UVNYSCCKIPXPRO-HNNXBMFYSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1Cl ZINC001236376916 1055083228 /nfs/dbraw/zinc/08/32/28/1055083228.db2.gz VXTSYSZDERESLN-QGZVFWFLSA-N 2 1 320.908 4.393 20 0 DIADMP Clc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cs1 ZINC001236375270 1055083528 /nfs/dbraw/zinc/08/35/28/1055083528.db2.gz IQHZKVNPTXOMLY-ZDUSSCGKSA-N 2 1 312.910 4.146 20 0 DIADMP Clc1sccc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374586 1055083949 /nfs/dbraw/zinc/08/39/49/1055083949.db2.gz FLWWLIFWOSKQST-ZDUSSCGKSA-N 2 1 312.910 4.146 20 0 DIADMP Clc1sccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374586 1055083961 /nfs/dbraw/zinc/08/39/61/1055083961.db2.gz FLWWLIFWOSKQST-ZDUSSCGKSA-N 2 1 312.910 4.146 20 0 DIADMP CC(C)CCC[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001236379638 1055084438 /nfs/dbraw/zinc/08/44/38/1055084438.db2.gz DKBPQSGZQHXFCD-UHFFFAOYSA-N 2 1 306.469 4.064 20 0 DIADMP CCC[C@H](C)C[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001236381914 1055086374 /nfs/dbraw/zinc/08/63/74/1055086374.db2.gz NXKWIXJUGINAHX-INIZCTEOSA-N 2 1 306.469 4.064 20 0 DIADMP CCCCCC[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001236381887 1055087108 /nfs/dbraw/zinc/08/71/08/1055087108.db2.gz NVGZSDXQMFBGAK-UHFFFAOYSA-N 2 1 306.469 4.208 20 0 DIADMP Fc1ccc(C[N@@H+](CC2CCCCC2)CC2CC[NH2+]CC2)cc1 ZINC001236384275 1055088234 /nfs/dbraw/zinc/08/82/34/1055088234.db2.gz ZFXVUFZLIYCOEW-UHFFFAOYSA-N 2 1 318.480 4.208 20 0 DIADMP C[C@H]([NH2+]CCSc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185681805 1055095998 /nfs/dbraw/zinc/09/59/98/1055095998.db2.gz SNQRUZMWXUMVIR-IRXDYDNUSA-N 2 1 318.530 4.021 20 0 DIADMP CC[N@@H+](C[C@H]1CC[NH2+]C1)C[C@H]1CC=C(CCC=C(C)C)CC1 ZINC001236409092 1055100393 /nfs/dbraw/zinc/10/03/93/1055100393.db2.gz XDFIWRGPKWZOGS-PMACEKPBSA-N 2 1 304.522 4.391 20 0 DIADMP CC[N@H+](Cc1cccc(-c2c(C)cccc2C)c1)C[C@H]1CC[NH2+]C1 ZINC001236409491 1055100453 /nfs/dbraw/zinc/10/04/53/1055100453.db2.gz BDXUULRLODFLRT-FQEVSTJZSA-N 2 1 322.496 4.402 20 0 DIADMP CC[N@H+](Cc1ccc(Oc2ccccc2)c(C)c1)C[C@H]1CC[NH2+]C1 ZINC001236411029 1055102046 /nfs/dbraw/zinc/10/20/46/1055102046.db2.gz LTUMUSRJHQAAQI-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP CC[N@H+](Cc1cccc(Oc2ccc(C)cc2)c1)C[C@@H]1CC[NH2+]C1 ZINC001236410324 1055102673 /nfs/dbraw/zinc/10/26/73/1055102673.db2.gz YSVULHKFPIEWAE-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP CC[N@H+](Cc1cccc(-c2ccccc2)c1C)C[C@@H]1CC[NH2+]C1 ZINC001236412786 1055103701 /nfs/dbraw/zinc/10/37/01/1055103701.db2.gz YKAVPKFRQSJIAZ-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419171 1055104871 /nfs/dbraw/zinc/10/48/71/1055104871.db2.gz HBXFWYBPMLLPMA-KXBFYZLASA-N 2 1 319.452 4.147 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419171 1055104879 /nfs/dbraw/zinc/10/48/79/1055104879.db2.gz HBXFWYBPMLLPMA-KXBFYZLASA-N 2 1 319.452 4.147 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421969 1055106687 /nfs/dbraw/zinc/10/66/87/1055106687.db2.gz UZKXOXGQPJVLTK-LIRRHRJNSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421969 1055106691 /nfs/dbraw/zinc/10/66/91/1055106691.db2.gz UZKXOXGQPJVLTK-LIRRHRJNSA-N 2 1 314.860 4.319 20 0 DIADMP CC(C)(C)C[N@@H+](CCCc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236454463 1055122275 /nfs/dbraw/zinc/12/22/75/1055122275.db2.gz LKAPHKVRKGQKAI-UHFFFAOYSA-N 2 1 322.924 4.373 20 0 DIADMP CCCOc1ccccc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236457419 1055123986 /nfs/dbraw/zinc/12/39/86/1055123986.db2.gz KMGCHMITDQMNBI-UHFFFAOYSA-N 2 1 318.505 4.076 20 0 DIADMP CSc1ccccc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236456694 1055124150 /nfs/dbraw/zinc/12/41/50/1055124150.db2.gz FDBOALGSJRWOMJ-UHFFFAOYSA-N 2 1 306.519 4.009 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(Cl)c(F)c1)C1CC[NH2+]CC1 ZINC001236456732 1055124765 /nfs/dbraw/zinc/12/47/65/1055124765.db2.gz GIDIVFAZZLZZDE-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP Cc1c2ccccc2[nH]c1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236457479 1055124965 /nfs/dbraw/zinc/12/49/65/1055124965.db2.gz LPHOPSCUSHQKDW-UHFFFAOYSA-N 2 1 313.489 4.076 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(F)c2ccoc21)C1CC[NH2+]CC1 ZINC001236459561 1055127401 /nfs/dbraw/zinc/12/74/01/1055127401.db2.gz VABRDYIDMZKDOQ-UHFFFAOYSA-N 2 1 318.436 4.172 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236459429 1055127453 /nfs/dbraw/zinc/12/74/53/1055127453.db2.gz OAFGBDJRFQYHIK-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP [NH3+]CCc1cccc(C2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001236475206 1055135821 /nfs/dbraw/zinc/13/58/21/1055135821.db2.gz MZBNQAXKQSSQOL-YADHBBJMSA-N 2 1 318.464 4.008 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@@H](C4CC4)C3)C2)cc1 ZINC000380958122 1055141517 /nfs/dbraw/zinc/14/15/17/1055141517.db2.gz VMQMTJIKALGLIG-NRSPTQNISA-N 2 1 312.501 4.067 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CC=CCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236489613 1055143671 /nfs/dbraw/zinc/14/36/71/1055143671.db2.gz POGRHLWVHCPUKE-QGZVFWFLSA-N 2 1 316.464 4.044 20 0 DIADMP CCCCCC[N@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236489915 1055143950 /nfs/dbraw/zinc/14/39/50/1055143950.db2.gz ZHPGCRPGFVVHDH-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP CCCCCC[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236489915 1055143954 /nfs/dbraw/zinc/14/39/54/1055143954.db2.gz ZHPGCRPGFVVHDH-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236509158 1055152156 /nfs/dbraw/zinc/15/21/56/1055152156.db2.gz IIFSLKVHMRCHIF-PLNGDYQASA-N 2 1 304.453 4.044 20 0 DIADMP CS[C@H](C)CC[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236533951 1055165050 /nfs/dbraw/zinc/16/50/50/1055165050.db2.gz LCZPVAHCHUGGJK-DJIMGWMZSA-N 2 1 324.509 4.039 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2C2CC2)CC2CCC2)CC1 ZINC001236542167 1055171143 /nfs/dbraw/zinc/17/11/43/1055171143.db2.gz ORQRAVDARUJGDA-MXVIHJGJSA-N 2 1 312.501 4.436 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCCc2ccccc2)CC2CCC2)CC1 ZINC001236541605 1055171170 /nfs/dbraw/zinc/17/11/70/1055171170.db2.gz NDXZRESIXHVUAC-MEMLXQNLSA-N 2 1 314.517 4.381 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Cl)cc2F)CC2CCC2)CC1 ZINC001236543033 1055172421 /nfs/dbraw/zinc/17/24/21/1055172421.db2.gz ZRDBGUXYDRPVJY-QAQDUYKDSA-N 2 1 324.871 4.351 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2coc3ccccc23)CC2CCC2)CC1 ZINC001236542505 1055172908 /nfs/dbraw/zinc/17/29/08/1055172908.db2.gz RPWDGPPFSUKHPA-IYARVYRRSA-N 2 1 312.457 4.305 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236542359 1055172971 /nfs/dbraw/zinc/17/29/71/1055172971.db2.gz TZIDFTOIFYLEAG-MXVIHJGJSA-N 2 1 300.490 4.175 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2csc(Cl)c2)CC2CCC2)CC1 ZINC001236542912 1055173226 /nfs/dbraw/zinc/17/32/26/1055173226.db2.gz XDPMUOSSMWYCOE-SHTZXODSSA-N 2 1 312.910 4.274 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc(C)c1F ZINC001236543022 1055173239 /nfs/dbraw/zinc/17/32/39/1055173239.db2.gz ZETZSHSJIYYPSA-WGSAOQKQSA-N 2 1 318.480 4.315 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236543326 1055173296 /nfs/dbraw/zinc/17/32/96/1055173296.db2.gz PEZWTQGKOSPXBL-WDSOQIARSA-N 2 1 318.505 4.203 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)c3ccoc32)CC2CC2)CC1 ZINC001236550562 1055177555 /nfs/dbraw/zinc/17/75/55/1055177555.db2.gz KHGBBLQKSCLKDP-WKILWMFISA-N 2 1 316.420 4.054 20 0 DIADMP CC(C)C[N@@H+](Cc1sccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550157 1055177746 /nfs/dbraw/zinc/17/77/46/1055177746.db2.gz HNJXCRNEOXFRDS-JOCQHMNTSA-N 2 1 300.899 4.129 20 0 DIADMP CC(C)C[N@@H+](CCc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236549888 1055177803 /nfs/dbraw/zinc/17/78/03/1055177803.db2.gz FQABBMZUHBTAGC-IYARVYRRSA-N 2 1 308.897 4.110 20 0 DIADMP Cc1csc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236550202 1055178371 /nfs/dbraw/zinc/17/83/71/1055178371.db2.gz IKMDZHWBBDKGJW-HDJSIYSDSA-N 2 1 314.926 4.438 20 0 DIADMP CC(C)C[N@@H+](Cc1cccc(C(F)F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236549726 1055178475 /nfs/dbraw/zinc/17/84/75/1055178475.db2.gz ABIOMQCTOFTCAO-QAQDUYKDSA-N 2 1 310.432 4.352 20 0 DIADMP Cc1cccc2c(C[N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)c[nH]c21 ZINC001236549784 1055178544 /nfs/dbraw/zinc/17/85/44/1055178544.db2.gz CGGAYBGWRNXMKY-IYARVYRRSA-N 2 1 313.489 4.204 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3sccc32)CC2CC2)CC1 ZINC001236551076 1055179695 /nfs/dbraw/zinc/17/96/95/1055179695.db2.gz KOUPBIFLTHAHOE-QAQDUYKDSA-N 2 1 314.498 4.383 20 0 DIADMP Cc1cc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc1Cl ZINC001236552335 1055180235 /nfs/dbraw/zinc/18/02/35/1055180235.db2.gz PAADSPOJOSAINK-QAQDUYKDSA-N 2 1 308.897 4.376 20 0 DIADMP Cc1cc(C)c(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236554346 1055181142 /nfs/dbraw/zinc/18/11/42/1055181142.db2.gz ZHVYRLQPKGMOHE-MXVIHJGJSA-N 2 1 300.490 4.094 20 0 DIADMP CC(C)C[N@@H+](Cc1cc(C(C)(C)C)c[nH]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554591 1055181302 /nfs/dbraw/zinc/18/13/02/1055181302.db2.gz MGVGPIRDNRZAKV-SAABIXHNSA-N 2 1 305.510 4.040 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2coc3ccc(F)cc23)CC2CC2)CC1 ZINC001236553810 1055181410 /nfs/dbraw/zinc/18/14/10/1055181410.db2.gz UHGBKHTXVHEFCE-QAQDUYKDSA-N 2 1 316.420 4.054 20 0 DIADMP CC(C)C[N@@H+](Cc1cccc2ccoc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554825 1055182214 /nfs/dbraw/zinc/18/22/14/1055182214.db2.gz XDPCDBVUWXUVDW-IYARVYRRSA-N 2 1 300.446 4.161 20 0 DIADMP Cc1ccccc1C[N@@H+](CCc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554513 1055182395 /nfs/dbraw/zinc/18/23/95/1055182395.db2.gz ITJDYQQWGFGDLO-HZCBDIJESA-N 2 1 322.496 4.310 20 0 DIADMP CNc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236565585 1055185426 /nfs/dbraw/zinc/18/54/26/1055185426.db2.gz HMRQNHMPZJXHRR-IRJFHVNHSA-N 2 1 315.505 4.133 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)o2)C2CCCCC2)CC1 ZINC001236565737 1055185535 /nfs/dbraw/zinc/18/55/35/1055185535.db2.gz KDPNTKQKGNWCCN-CTYIDZIISA-N 2 1 310.869 4.338 20 0 DIADMP Cc1cccc(CC[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236565937 1055185711 /nfs/dbraw/zinc/18/57/11/1055185711.db2.gz SLPYRGQVJQEAQL-XUTJKUGGSA-N 2 1 314.517 4.442 20 0 DIADMP Cc1csc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236565241 1055185755 /nfs/dbraw/zinc/18/57/55/1055185755.db2.gz ASDIEEGDCOKTQI-JCNLHEQBSA-N 2 1 306.519 4.461 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2F)C2CCCCC2)CC1 ZINC001236565873 1055186212 /nfs/dbraw/zinc/18/62/12/1055186212.db2.gz QNXZVBMCCMSAQK-JCNLHEQBSA-N 2 1 322.443 4.369 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3[nH]ccc3c2)C2CCCC2)CC1 ZINC001236566861 1055187785 /nfs/dbraw/zinc/18/77/85/1055187785.db2.gz NQONKKSQFSNPIH-UAPYVXQJSA-N 2 1 311.473 4.182 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3cccnc3c2)C2CCCC2)CC1 ZINC001236570782 1055191965 /nfs/dbraw/zinc/19/19/65/1055191965.db2.gz BBQLTMZICDSOHO-KESTWPANSA-N 2 1 323.484 4.249 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(Cl)ccc2F)C2CCC2)CC1 ZINC001236572147 1055192787 /nfs/dbraw/zinc/19/27/87/1055192787.db2.gz MUXOOHJRJXDGER-KOMQPUFPSA-N 2 1 310.844 4.104 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc3ccccc3o2)C2CCCC2)CC1 ZINC001236571942 1055193429 /nfs/dbraw/zinc/19/34/29/1055193429.db2.gz NKJJWNPROWIARB-SAABIXHNSA-N 2 1 312.457 4.447 20 0 DIADMP Cc1ccc2[nH]cc(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)c2c1 ZINC001236572494 1055193498 /nfs/dbraw/zinc/19/34/98/1055193498.db2.gz QIOWXURKLZSPPE-SAABIXHNSA-N 2 1 311.473 4.101 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571611 1055193789 /nfs/dbraw/zinc/19/37/89/1055193789.db2.gz KSRTYFPXEMMBIV-UAPYVXQJSA-N 2 1 304.453 4.149 20 0 DIADMP CCCc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236571762 1055193804 /nfs/dbraw/zinc/19/38/04/1055193804.db2.gz CHNPUSFGOZQNCO-KESTWPANSA-N 2 1 300.490 4.264 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(-n3cccc3)cc2)C2CCC2)CC1 ZINC001236573086 1055195283 /nfs/dbraw/zinc/19/52/83/1055195283.db2.gz VRGMFKISSJLROT-XGAFWQRZSA-N 2 1 323.484 4.102 20 0 DIADMP Cc1ccc2[nH]c(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)cc2c1 ZINC001236573253 1055195538 /nfs/dbraw/zinc/19/55/38/1055195538.db2.gz ZYRNYTFBAFVJKL-RUCARUNLSA-N 2 1 311.473 4.101 20 0 DIADMP CCSc1ccccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236576078 1055196710 /nfs/dbraw/zinc/19/67/10/1055196710.db2.gz AJFMWFWVGFSLMQ-SAABIXHNSA-N 2 1 318.530 4.423 20 0 DIADMP Cc1c(Cl)ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236576168 1055196837 /nfs/dbraw/zinc/19/68/37/1055196837.db2.gz CSWQWQKERDFQQQ-KOMQPUFPSA-N 2 1 324.871 4.412 20 0 DIADMP Cc1cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)cc1Cl ZINC001236576245 1055196933 /nfs/dbraw/zinc/19/69/33/1055196933.db2.gz FZXBPVNMUOJOTL-KOMQPUFPSA-N 2 1 324.871 4.412 20 0 DIADMP COc1ccc(C)c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236574860 1055197443 /nfs/dbraw/zinc/19/74/43/1055197443.db2.gz VSQMHXZUXJEKQS-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP Cc1ccnc2cccc(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)c12 ZINC001236576326 1055197634 /nfs/dbraw/zinc/19/76/34/1055197634.db2.gz JKDRRYOACDBJRN-UAPYVXQJSA-N 2 1 323.484 4.168 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236606876 1055203527 /nfs/dbraw/zinc/20/35/27/1055203527.db2.gz XHBZPWIFFNVJHS-ZDUSSCGKSA-N 2 1 324.921 4.026 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236606876 1055203537 /nfs/dbraw/zinc/20/35/37/1055203537.db2.gz XHBZPWIFFNVJHS-ZDUSSCGKSA-N 2 1 324.921 4.026 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236699658 1055232787 /nfs/dbraw/zinc/23/27/87/1055232787.db2.gz DBQBWQLQBNBYMA-WGSAOQKQSA-N 2 1 318.505 4.203 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)o2)Cc2ccccc2)CC1 ZINC001236695610 1055233022 /nfs/dbraw/zinc/23/30/22/1055233022.db2.gz ZEJSAPYAFBPDLD-WKILWMFISA-N 2 1 318.848 4.205 20 0 DIADMP CCCCCC[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236700654 1055233630 /nfs/dbraw/zinc/23/36/30/1055233630.db2.gz NXROPQOVFSVGSQ-WGSAOQKQSA-N 2 1 318.505 4.347 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236714263 1055238203 /nfs/dbraw/zinc/23/82/03/1055238203.db2.gz LLFWGZOAICCNMV-MNVIUDHYSA-N 2 1 324.512 4.279 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cccc3ccoc32)CC1 ZINC001236743182 1055247161 /nfs/dbraw/zinc/24/71/61/1055247161.db2.gz PHXRUKAHNFTOOA-UHFFFAOYSA-N 2 1 300.446 4.129 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)C[C@@H]2CC=CCC2)CC1 ZINC001236741686 1055248505 /nfs/dbraw/zinc/24/85/05/1055248505.db2.gz IDCICNXAOXHFKB-NSISKUIASA-N 2 1 316.464 4.254 20 0 DIADMP COc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236767532 1055250507 /nfs/dbraw/zinc/25/05/07/1055250507.db2.gz IYPHZYQGWMXZNG-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCC(F)(F)F)CC2CCCCC2)CC1 ZINC001236754034 1055252076 /nfs/dbraw/zinc/25/20/76/1055252076.db2.gz BLPBWWSNGRCMSM-WKILWMFISA-N 2 1 320.443 4.481 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)C[C@H]2CC=CCC2)CC1 ZINC001236755855 1055252543 /nfs/dbraw/zinc/25/25/43/1055252543.db2.gz RIXFIWNBVIUQQV-IHPCNDPISA-N 2 1 304.522 4.495 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236780480 1055253832 /nfs/dbraw/zinc/25/38/32/1055253832.db2.gz RYEMOCOOIHZFRS-WKILWMFISA-N 2 1 324.459 4.391 20 0 DIADMP Cc1cc(F)c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1 ZINC001236780365 1055254404 /nfs/dbraw/zinc/25/44/04/1055254404.db2.gz QFRISQNBPMFRDD-SHTZXODSSA-N 2 1 324.459 4.391 20 0 DIADMP CCOc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236769666 1055254647 /nfs/dbraw/zinc/25/46/47/1055254647.db2.gz YSVUYCXKJYCPLS-IYARVYRRSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(Cl)c(O)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236779297 1055256107 /nfs/dbraw/zinc/25/61/07/1055256107.db2.gz HJKCWRGCNHRRRG-SHTZXODSSA-N 2 1 324.896 4.164 20 0 DIADMP CCC(CC)[N@@H+](CC1(c2ccccc2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782895 1055257057 /nfs/dbraw/zinc/25/70/57/1055257057.db2.gz MAGNXDINQIJOFK-KESTWPANSA-N 2 1 314.517 4.479 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(OC)ccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783039 1055258011 /nfs/dbraw/zinc/25/80/11/1055258011.db2.gz YJYJMIDLMMWBGV-JCNLHEQBSA-N 2 1 322.468 4.095 20 0 DIADMP CCC(CC)[N@@H+](CC1Cc2ccccc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782924 1055259267 /nfs/dbraw/zinc/25/92/67/1055259267.db2.gz MTMGUWPOYMSSLT-XUTJKUGGSA-N 2 1 314.517 4.162 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)cc(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790015 1055259426 /nfs/dbraw/zinc/25/94/26/1055259426.db2.gz FQUCKVPWMHJTKV-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP CCC(CC)[N@@H+](Cc1cnc(Cl)cc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782548 1055259726 /nfs/dbraw/zinc/25/97/26/1055259726.db2.gz UFEVRCWGJVUHLK-JCNLHEQBSA-N 2 1 323.912 4.304 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(SC)nc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790877 1055261329 /nfs/dbraw/zinc/26/13/29/1055261329.db2.gz LZGFAKLWULMBBQ-JCNLHEQBSA-N 2 1 321.534 4.064 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(C)nc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236791660 1055261629 /nfs/dbraw/zinc/26/16/29/1055261629.db2.gz XYKVJQNMIKJLST-JCNLHEQBSA-N 2 1 323.912 4.304 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(Cl)cc(C)n1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790927 1055262118 /nfs/dbraw/zinc/26/21/18/1055262118.db2.gz MXNMAPBRCREXIF-RZDIXWSQSA-N 2 1 323.912 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)c2ccccc21 ZINC000383287365 1055262319 /nfs/dbraw/zinc/26/23/19/1055262319.db2.gz MGYUYAQOQFQTQF-VGOFRKELSA-N 2 1 320.480 4.489 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383436555 1055275905 /nfs/dbraw/zinc/27/59/05/1055275905.db2.gz FKLQRLCYCSHUAD-DENIHFKCSA-N 2 1 322.496 4.119 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)CC1 ZINC001236821966 1055276030 /nfs/dbraw/zinc/27/60/30/1055276030.db2.gz XBMYIHBQFCXBRD-LWYYNNOASA-N 2 1 302.506 4.128 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc4sc5ccccc5c4c3)C[C@@H]12 ZINC001236827864 1055278896 /nfs/dbraw/zinc/27/88/96/1055278896.db2.gz HCXKJVSXXSUTDG-BMGDILEWSA-N 2 1 322.477 4.224 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)s1 ZINC001236828986 1055281575 /nfs/dbraw/zinc/28/15/75/1055281575.db2.gz JTWNWSUQFPLHLA-JCGIZDLHSA-N 2 1 306.519 4.040 20 0 DIADMP CCC[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@@H]1CC[NH2+]C1 ZINC001236836489 1055284448 /nfs/dbraw/zinc/28/44/48/1055284448.db2.gz WHONKIOZXXHAJM-QGZVFWFLSA-N 2 1 322.452 4.408 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2ccccc2)s1)C[C@@H]1CC[NH2+]C1 ZINC001236833441 1055285136 /nfs/dbraw/zinc/28/51/36/1055285136.db2.gz BHUPLIOZUDJHNE-MRXNPFEDSA-N 2 1 314.498 4.237 20 0 DIADMP CCC[N@H+](Cc1ccc2c(c1)Cc1ccccc1-2)C[C@H]1CC[NH2+]C1 ZINC001236835961 1055285929 /nfs/dbraw/zinc/28/59/29/1055285929.db2.gz RHNGRWJEHXREBC-SFHVURJKSA-N 2 1 320.480 4.079 20 0 DIADMP CCC[N@H+](Cc1ccc(Oc2ccccc2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236836883 1055287298 /nfs/dbraw/zinc/28/72/98/1055287298.db2.gz YXRYWWCHAQDJDI-LJQANCHMSA-N 2 1 324.468 4.300 20 0 DIADMP CCC[N@H+](Cc1ccc(Cl)c(C(C)C)c1)C[C@H]1CC[NH2+]C1 ZINC001236842373 1055288175 /nfs/dbraw/zinc/28/81/75/1055288175.db2.gz FLISSHLHCNAVMC-INIZCTEOSA-N 2 1 308.897 4.285 20 0 DIADMP CCC[N@H+](Cc1cc(Cl)c(Cl)cc1C)C[C@H]1CC[NH2+]C1 ZINC001236843451 1055289041 /nfs/dbraw/zinc/28/90/41/1055289041.db2.gz OIXZFWBSAQISDB-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP CCC[N@@H+](Cc1cc(C)c(Cl)cc1Cl)C[C@H]1CC[NH2+]C1 ZINC001236843877 1055289228 /nfs/dbraw/zinc/28/92/28/1055289228.db2.gz RXPNOJACIPOJPG-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP CCC[N@H+](Cc1cc(C)c(Cl)cc1Cl)C[C@H]1CC[NH2+]C1 ZINC001236843877 1055289244 /nfs/dbraw/zinc/28/92/44/1055289244.db2.gz RXPNOJACIPOJPG-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP Clc1cc(C[N@H+]2CC[C@@H]3CCC[C@@H]3C2)ccc1-n1ccnc1 ZINC001236906744 1055311634 /nfs/dbraw/zinc/31/16/34/1055311634.db2.gz MNJOLOKDWMBBTD-JKSUJKDBSA-N 2 1 315.848 4.148 20 0 DIADMP Clc1cc(-n2ccnc2)ccc1C[N@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001236915054 1055315320 /nfs/dbraw/zinc/31/53/20/1055315320.db2.gz BDBKFMRCALFJSH-CABCVRRESA-N 2 1 315.848 4.148 20 0 DIADMP C[N@@H+](Cc1ccsc1)Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236914912 1055317999 /nfs/dbraw/zinc/31/79/99/1055317999.db2.gz XCMHSFCDMGMQMW-UHFFFAOYSA-N 2 1 317.845 4.219 20 0 DIADMP CN(Cc1ccsc1)Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236914912 1055318017 /nfs/dbraw/zinc/31/80/17/1055318017.db2.gz XCMHSFCDMGMQMW-UHFFFAOYSA-N 2 1 317.845 4.219 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)s2)C1 ZINC001237056838 1055353486 /nfs/dbraw/zinc/35/34/86/1055353486.db2.gz KBDDXZLBBYADAJ-INIZCTEOSA-N 2 1 306.500 4.037 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCC[C@@](C)(C[NH3+])C3)c2)cc1 ZINC001237056146 1055354303 /nfs/dbraw/zinc/35/43/03/1055354303.db2.gz GTEGJNPNWRMXHK-NRFANRHFSA-N 2 1 324.468 4.348 20 0 DIADMP C[C@H]([NH2+]CCC1=CCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000385187805 1055359297 /nfs/dbraw/zinc/35/92/97/1055359297.db2.gz OBTZUECHYRARJR-RXVVDRJESA-N 2 1 312.501 4.377 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC[C@](C)(C[NH3+])C1 ZINC001237080619 1055362147 /nfs/dbraw/zinc/36/21/47/1055362147.db2.gz HEIXCHBXPNEOSZ-OAQYLSRUSA-N 2 1 324.468 4.348 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+](Cc2sc(Cl)c3ccccc32)C1 ZINC001237081225 1055364281 /nfs/dbraw/zinc/36/42/81/1055364281.db2.gz JKNUOWAJPWSPLJ-INIZCTEOSA-N 2 1 308.878 4.116 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2sc(Cl)c3ccccc32)C1 ZINC001237081225 1055364295 /nfs/dbraw/zinc/36/42/95/1055364295.db2.gz JKNUOWAJPWSPLJ-INIZCTEOSA-N 2 1 308.878 4.116 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001237080156 1055364640 /nfs/dbraw/zinc/36/46/40/1055364640.db2.gz DETDTSHZPZCESR-HXUWFJFHSA-N 2 1 300.490 4.295 20 0 DIADMP c1ccc2c(c1)CC[NH2+]C21CC[NH+](CCCC2CCCC2)CC1 ZINC001237277306 1055415314 /nfs/dbraw/zinc/41/53/14/1055415314.db2.gz ZATALBXHWBUYDG-UHFFFAOYSA-N 2 1 312.501 4.094 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001237300907 1055421294 /nfs/dbraw/zinc/42/12/94/1055421294.db2.gz QTQNAZRPILRWCE-KRWDZBQOSA-N 2 1 300.490 4.297 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001237359893 1055439632 /nfs/dbraw/zinc/43/96/32/1055439632.db2.gz RIZMPBTXOOXLAL-KRWDZBQOSA-N 2 1 300.490 4.297 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@H]2[NH2+]CCC[C@@H]2C1)c1cccc2ccccc21 ZINC001237380723 1055444323 /nfs/dbraw/zinc/44/43/23/1055444323.db2.gz HCVANNYESFRZEB-BLIXFSHQSA-N 2 1 308.469 4.017 20 0 DIADMP Cc1c(C[N@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cccc1-c1ccccc1 ZINC001237410951 1055450840 /nfs/dbraw/zinc/45/08/40/1055450840.db2.gz DYGIPLRZTZVKAN-IRLDBZIGSA-N 2 1 320.480 4.236 20 0 DIADMP CC(C)(C[NH2+]C1CC[NH+](C2CC2)CC1)c1ccc2ccccc2c1 ZINC000624268937 1055499907 /nfs/dbraw/zinc/49/99/07/1055499907.db2.gz OYERLBMZQHMQQB-UHFFFAOYSA-N 2 1 322.496 4.334 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cccc(Cl)c2C)CC1 ZINC001237731762 1055515915 /nfs/dbraw/zinc/51/59/15/1055515915.db2.gz FSZDSVONDBOUQD-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cccc(Cl)c2C)CC1 ZINC001237731762 1055515926 /nfs/dbraw/zinc/51/59/26/1055515926.db2.gz FSZDSVONDBOUQD-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001237738528 1055517733 /nfs/dbraw/zinc/51/77/33/1055517733.db2.gz QSPPMINLLPDMQZ-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001620898634 1055522767 /nfs/dbraw/zinc/52/27/67/1055522767.db2.gz ZQVPPEDQVZZXGN-HNNXBMFYSA-N 2 1 306.494 4.240 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)CC2 ZINC001620910382 1055532754 /nfs/dbraw/zinc/53/27/54/1055532754.db2.gz PUKBMODOEPKXGT-PKOBYXMFSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCCC[C@@](C)(F)C3)cc21 ZINC001237880510 1055547582 /nfs/dbraw/zinc/54/75/82/1055547582.db2.gz GQLVWIFUBYZRHJ-HXUWFJFHSA-N 2 1 316.464 4.402 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@](C)(F)CC3)cc21 ZINC001237880705 1055547658 /nfs/dbraw/zinc/54/76/58/1055547658.db2.gz JDWZUZQDVXAKMM-FQEVSTJZSA-N 2 1 316.464 4.402 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+](C)Cc3cccs3)cc21 ZINC001237877621 1055549294 /nfs/dbraw/zinc/54/92/94/1055549294.db2.gz AXYAOAAXUQVUSN-UHFFFAOYSA-N 2 1 312.482 4.381 20 0 DIADMP c1[nH+]cn2c1cccc2C[NH+]1CCC(Sc2ccccc2)CC1 ZINC001238111915 1055608221 /nfs/dbraw/zinc/60/82/21/1055608221.db2.gz YUBUPNTVBDPFRQ-UHFFFAOYSA-N 2 1 323.465 4.091 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](C2CCCC2)C2CCN(C)CC2)c1 ZINC001238566641 1055689171 /nfs/dbraw/zinc/68/91/71/1055689171.db2.gz MXYQZPOPBRSQLV-UHFFFAOYSA-N 2 1 320.908 4.487 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[N@@H+]2CCCC2(C)C)C[C@@H](c2ccccc2)C1 ZINC001620967787 1055716292 /nfs/dbraw/zinc/71/62/92/1055716292.db2.gz ZQSGCTAXAJSPFX-IHPCNDPISA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[N@H+]2CCCC2(C)C)C[C@@H](c2ccccc2)C1 ZINC001620967787 1055716300 /nfs/dbraw/zinc/71/63/00/1055716300.db2.gz ZQSGCTAXAJSPFX-IHPCNDPISA-N 2 1 314.517 4.423 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1(C)C ZINC001620974594 1055816658 /nfs/dbraw/zinc/81/66/58/1055816658.db2.gz RGLJCZFIFWVWQA-SZMVWBNQSA-N 2 1 320.908 4.439 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1(C)C ZINC001620974591 1055816764 /nfs/dbraw/zinc/81/67/64/1055816764.db2.gz RGLJCZFIFWVWQA-JQHSSLGASA-N 2 1 320.908 4.439 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1(C)C ZINC001620974593 1055817198 /nfs/dbraw/zinc/81/71/98/1055817198.db2.gz RGLJCZFIFWVWQA-NXHRZFHOSA-N 2 1 320.908 4.439 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000126656559 1055842010 /nfs/dbraw/zinc/84/20/10/1055842010.db2.gz SWXQSGZUCOJHST-RTBURBONSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000126656559 1055842018 /nfs/dbraw/zinc/84/20/18/1055842018.db2.gz SWXQSGZUCOJHST-RTBURBONSA-N 2 1 322.452 4.195 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H](c2ccccc2)C2CCCC2)CC1(C)C ZINC001620751332 1055925714 /nfs/dbraw/zinc/92/57/14/1055925714.db2.gz JNNLDKWTAAAHIY-RTBURBONSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H](c2ccccc2)C2CCCC2)CC1(C)C ZINC001620751329 1055925773 /nfs/dbraw/zinc/92/57/73/1055925773.db2.gz JNNLDKWTAAAHIY-MOPGFXCFSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[N@H+](CC)CCCc1c[nH+]cn1C ZINC001615645443 1055928807 /nfs/dbraw/zinc/92/88/07/1055928807.db2.gz YRKVCWVLNCIELX-LJQANCHMSA-N 2 1 313.489 4.004 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)CCCc1c[nH+]cn1C ZINC001615645443 1055928809 /nfs/dbraw/zinc/92/88/09/1055928809.db2.gz YRKVCWVLNCIELX-LJQANCHMSA-N 2 1 313.489 4.004 20 0 DIADMP FC1(F)CCC([NH2+]C[C@@H]2CCC[N@H+]2CC2CCCCC2)CC1 ZINC001620770556 1055939569 /nfs/dbraw/zinc/93/95/69/1055939569.db2.gz VRFQGAFDNMILDX-KRWDZBQOSA-N 2 1 314.464 4.199 20 0 DIADMP C[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000671743759 1055940350 /nfs/dbraw/zinc/94/03/50/1055940350.db2.gz RYJDBGWJMYQJEE-DZIBYMRMSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@@H+](CCCNCc1cccc(F)c1F)C1CCCCC1 ZINC001620996258 1055965961 /nfs/dbraw/zinc/96/59/61/1055965961.db2.gz OTKWBWQXRMDMTC-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCC[C@@H](SC)C2)C1 ZINC001620791723 1055969415 /nfs/dbraw/zinc/96/94/15/1055969415.db2.gz WFKWGGPHXNQKBK-IXDOHACOSA-N 2 1 312.567 4.151 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCC[C@@H](SC)C2)C1 ZINC001620791723 1055969426 /nfs/dbraw/zinc/96/94/26/1055969426.db2.gz WFKWGGPHXNQKBK-IXDOHACOSA-N 2 1 312.567 4.151 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CCCC3CCC3)CC23CC3)cc1 ZINC001621008792 1055976448 /nfs/dbraw/zinc/97/64/48/1055976448.db2.gz HZFDWYZZEAXJLF-HXUWFJFHSA-N 2 1 312.501 4.354 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CCCC3CCC3)CC23CC3)cc1 ZINC001621008792 1055976457 /nfs/dbraw/zinc/97/64/57/1055976457.db2.gz HZFDWYZZEAXJLF-HXUWFJFHSA-N 2 1 312.501 4.354 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c(C)c1 ZINC001620724904 1055986954 /nfs/dbraw/zinc/98/69/54/1055986954.db2.gz OACOQKWLJNABSW-INIZCTEOSA-N 2 1 302.506 4.214 20 0 DIADMP CC(C)c1cccc(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001620724320 1055987305 /nfs/dbraw/zinc/98/73/05/1055987305.db2.gz RPXOIRIFVTXXNE-HDICACEKSA-N 2 1 302.506 4.268 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccccc2C[NH+](C)C)nc1 ZINC001239684069 1056026429 /nfs/dbraw/zinc/02/64/29/1056026429.db2.gz YCXUVVUBHVUFMI-QGZVFWFLSA-N 2 1 323.484 4.185 20 0 DIADMP CCC(CC)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)C(F)(F)F ZINC000903211196 1056200266 /nfs/dbraw/zinc/20/02/66/1056200266.db2.gz DWSCYTTUDJRMMX-LQDVMPOASA-N 2 1 318.427 4.103 20 0 DIADMP CC(C)[NH+](CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)C(C)C ZINC000474473459 1056318202 /nfs/dbraw/zinc/31/82/02/1056318202.db2.gz PUAFUXKDKZHCFU-FHERZECASA-N 2 1 322.459 4.452 20 0 DIADMP C[C@@H]([NH2+]CC[N@H+](C)C1CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000474728968 1056344266 /nfs/dbraw/zinc/34/42/66/1056344266.db2.gz VHJQWZHLHJSXRR-WLYUNCDWSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]([NH2+]CC[N@@H+](C)C1CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000474728968 1056344282 /nfs/dbraw/zinc/34/42/82/1056344282.db2.gz VHJQWZHLHJSXRR-WLYUNCDWSA-N 2 1 320.443 4.208 20 0 DIADMP CC(C)([NH3+])c1cccc(C2=CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC001240388785 1056471040 /nfs/dbraw/zinc/47/10/40/1056471040.db2.gz LLGJHYRVQLFIFV-UHFFFAOYSA-N 2 1 306.453 4.170 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC001615539901 1056529215 /nfs/dbraw/zinc/52/92/15/1056529215.db2.gz MDQKQPYKGCKDRU-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615539901 1056529225 /nfs/dbraw/zinc/52/92/25/1056529225.db2.gz MDQKQPYKGCKDRU-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1ccc(C)c(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615539901 1056529239 /nfs/dbraw/zinc/52/92/39/1056529239.db2.gz MDQKQPYKGCKDRU-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC001615557918 1056533172 /nfs/dbraw/zinc/53/31/72/1056533172.db2.gz AJUOUEASMPVSSR-LJQANCHMSA-N 2 1 300.490 4.118 20 0 DIADMP Clc1cccc(CCCC[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC001615596306 1056543009 /nfs/dbraw/zinc/54/30/09/1056543009.db2.gz YAZDKAIAWVQGAY-SFHVURJKSA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+](C[C@H]1CCC[NH+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634865 1056549855 /nfs/dbraw/zinc/54/98/55/1056549855.db2.gz KEFNPXIKWADEQY-INIZCTEOSA-N 2 1 306.453 4.030 20 0 DIADMP C[N@@H+](C[C@H]1CCC[NH+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634865 1056549857 /nfs/dbraw/zinc/54/98/57/1056549857.db2.gz KEFNPXIKWADEQY-INIZCTEOSA-N 2 1 306.453 4.030 20 0 DIADMP C[NH+](C[C@H]1CCC[N@H+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634865 1056549871 /nfs/dbraw/zinc/54/98/71/1056549871.db2.gz KEFNPXIKWADEQY-INIZCTEOSA-N 2 1 306.453 4.030 20 0 DIADMP C[NH+](C[C@H]1CCC[N@@H+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634865 1056549889 /nfs/dbraw/zinc/54/98/89/1056549889.db2.gz KEFNPXIKWADEQY-INIZCTEOSA-N 2 1 306.453 4.030 20 0 DIADMP C[C@@H]1CC[C@H](C)[N@@H+]1CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001616222827 1056620609 /nfs/dbraw/zinc/62/06/09/1056620609.db2.gz XIZWZMJQFVMHBP-KDURUIRLSA-N 2 1 314.517 4.204 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC001616382372 1056646735 /nfs/dbraw/zinc/64/67/35/1056646735.db2.gz KJDVDABZAPZJNF-UXHICEINSA-N 2 1 300.490 4.382 20 0 DIADMP COc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001620831097 1056650951 /nfs/dbraw/zinc/65/09/51/1056650951.db2.gz JGGLKKHSPXLHFM-AEFFLSMTSA-N 2 1 318.505 4.245 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2CCC(C)(C)O2)CC1)CC(C)C ZINC001616561260 1056677882 /nfs/dbraw/zinc/67/78/82/1056677882.db2.gz UFZNDAONPPDWRJ-LJQANCHMSA-N 2 1 324.553 4.024 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC001616622536 1056689224 /nfs/dbraw/zinc/68/92/24/1056689224.db2.gz JEPRWJVHASVXAA-APWZRJJASA-N 2 1 304.453 4.131 20 0 DIADMP CC(C)COc1ccc(C(C)(C)[NH2+]CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001616787028 1056717248 /nfs/dbraw/zinc/71/72/48/1056717248.db2.gz SCAAFTYJQAMDDB-SFHVURJKSA-N 2 1 318.505 4.030 20 0 DIADMP CC[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Cl)s1 ZINC001617089164 1056773444 /nfs/dbraw/zinc/77/34/44/1056773444.db2.gz SCMFBTFZFXEVFD-CYBMUJFWSA-N 2 1 300.899 4.318 20 0 DIADMP Cc1cc(C)cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000065976497 1056818151 /nfs/dbraw/zinc/81/81/51/1056818151.db2.gz FVOBDWPHEWLLLO-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP CC(C)CCC[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001617868894 1056893613 /nfs/dbraw/zinc/89/36/13/1056893613.db2.gz WNGBYOBTKJAKFR-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CCC[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001617868894 1056893625 /nfs/dbraw/zinc/89/36/25/1056893625.db2.gz WNGBYOBTKJAKFR-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CCC[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001617868894 1056893631 /nfs/dbraw/zinc/89/36/31/1056893631.db2.gz WNGBYOBTKJAKFR-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1ccccc1[C@H](C)[N@H+](CC[C@@H]1CCC[NH+]1C)CC(C)C ZINC001617888630 1056897924 /nfs/dbraw/zinc/89/79/24/1056897924.db2.gz UTMLCPFRZNFBCA-OALUTQOASA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@H](C)[NH+](CC[C@@H]1CCC[N@@H+]1C)CC(C)C ZINC001617888630 1056897934 /nfs/dbraw/zinc/89/79/34/1056897934.db2.gz UTMLCPFRZNFBCA-OALUTQOASA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@H](C)[NH+](CC[C@@H]1CCC[N@H+]1C)CC(C)C ZINC001617888630 1056897944 /nfs/dbraw/zinc/89/79/44/1056897944.db2.gz UTMLCPFRZNFBCA-OALUTQOASA-N 2 1 302.506 4.498 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CCSc2c(Cl)cccc21)C[NH+]1CCCC1 ZINC000360440985 1057022891 /nfs/dbraw/zinc/02/28/91/1057022891.db2.gz DOTBTBTWEHDDNR-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000674698856 1057274958 /nfs/dbraw/zinc/27/49/58/1057274958.db2.gz GFCRMKYOTJSIMN-GOSISDBHSA-N 2 1 315.848 4.008 20 0 DIADMP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319472 1057370110 /nfs/dbraw/zinc/37/01/10/1057370110.db2.gz BYUDITMRDQNNNM-PXNSSMCTSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319472 1057370115 /nfs/dbraw/zinc/37/01/15/1057370115.db2.gz BYUDITMRDQNNNM-PXNSSMCTSA-N 2 1 324.468 4.233 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(c2ccc(F)c(F)c2)CC1 ZINC000675495257 1057384031 /nfs/dbraw/zinc/38/40/31/1057384031.db2.gz FXVABHFHGPAONY-KRWDZBQOSA-N 2 1 322.443 4.019 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000675777562 1057412334 /nfs/dbraw/zinc/41/23/34/1057412334.db2.gz YHIQOTZGDPEXEA-GOSISDBHSA-N 2 1 322.496 4.359 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000675777252 1057412621 /nfs/dbraw/zinc/41/26/21/1057412621.db2.gz PPVFQQPBTOYTMR-KGVIQGDOSA-N 2 1 322.496 4.357 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000675777252 1057412626 /nfs/dbraw/zinc/41/26/26/1057412626.db2.gz PPVFQQPBTOYTMR-KGVIQGDOSA-N 2 1 322.496 4.357 20 0 DIADMP C[N@H+]1CC[C@@H](c2ccc(C3=CC[C@H]([NH+]4CCCC4)CC3)cc2)C1 ZINC001242697523 1057452140 /nfs/dbraw/zinc/45/21/40/1057452140.db2.gz SQMWZKGYOHHROE-RTWAWAEBSA-N 2 1 310.485 4.137 20 0 DIADMP C[N@H+]1CC[C@H](c2ccc(C3=CC[C@H]([NH+]4CCCC4)CC3)cc2)C1 ZINC001242697524 1057452149 /nfs/dbraw/zinc/45/21/49/1057452149.db2.gz SQMWZKGYOHHROE-SFTDATJTSA-N 2 1 310.485 4.137 20 0 DIADMP Cc1nc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)s1 ZINC000676488428 1057479364 /nfs/dbraw/zinc/47/93/64/1057479364.db2.gz GEAMYILFESFNRD-ZNMIVQPWSA-N 2 1 323.550 4.169 20 0 DIADMP C[NH+](C)Cc1cnc(C[N@@H+]2CCC[C@H]2CCC2CCCC2)s1 ZINC000347912639 1057529880 /nfs/dbraw/zinc/52/98/80/1057529880.db2.gz MEMQDMXLDKRGLD-INIZCTEOSA-N 2 1 321.534 4.140 20 0 DIADMP C[NH+](C)Cc1cnc(C[N@H+]2CCC[C@H]2CCC2CCCC2)s1 ZINC000347912639 1057529892 /nfs/dbraw/zinc/52/98/92/1057529892.db2.gz MEMQDMXLDKRGLD-INIZCTEOSA-N 2 1 321.534 4.140 20 0 DIADMP C[NH+]1CCC([NH2+]Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000073798626 1057560193 /nfs/dbraw/zinc/56/01/93/1057560193.db2.gz HRJNEDDBJJBZTI-UHFFFAOYSA-N 2 1 320.889 4.252 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000161626604 1057598037 /nfs/dbraw/zinc/59/80/37/1057598037.db2.gz GUSKSCKZQXYCHI-CGTJXYLNSA-N 2 1 318.530 4.465 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-c2cccnc2)cc1 ZINC000166765769 1057676693 /nfs/dbraw/zinc/67/66/93/1057676693.db2.gz SZNPAZASGGRJSQ-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166840679 1057677985 /nfs/dbraw/zinc/67/79/85/1057677985.db2.gz CTDUJNHRLRDCEJ-RKVPGOIHSA-N 2 1 308.416 4.022 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166840679 1057677987 /nfs/dbraw/zinc/67/79/87/1057677987.db2.gz CTDUJNHRLRDCEJ-RKVPGOIHSA-N 2 1 308.416 4.022 20 0 DIADMP c1ccc(-c2cccc(CC[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000166850749 1057678828 /nfs/dbraw/zinc/67/88/28/1057678828.db2.gz NKUAGEGYBRNWMX-FCHUYYIVSA-N 2 1 320.480 4.113 20 0 DIADMP Cc1cc(C2CC2)cc(F)c1-c1ccc2c(C3C[NH2+]C3)[nH+]cn2c1 ZINC001244124960 1057878056 /nfs/dbraw/zinc/87/80/56/1057878056.db2.gz WLPJKTAWSNLDCV-UHFFFAOYSA-N 2 1 321.399 4.013 20 0 DIADMP C1=CC[C@@H](C[N@H+]2CCC[C@]3(CC[NH+](C4CCCC4)C3)C2)CC1 ZINC001278386354 1058023154 /nfs/dbraw/zinc/02/31/54/1058023154.db2.gz PBXCJVYODMPJPZ-QUCCMNQESA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@@H](C[NH+]2CCC[C@]3(CC[N@@H+](C4CCCC4)C3)C2)CC1 ZINC001278386354 1058023158 /nfs/dbraw/zinc/02/31/58/1058023158.db2.gz PBXCJVYODMPJPZ-QUCCMNQESA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@@H](C[NH+]2CCC[C@]3(CC[N@H+](C4CCCC4)C3)C2)CC1 ZINC001278386354 1058023160 /nfs/dbraw/zinc/02/31/60/1058023160.db2.gz PBXCJVYODMPJPZ-QUCCMNQESA-N 2 1 302.506 4.073 20 0 DIADMP [NH3+]C1CC[NH+](Cc2cccc(-c3cc4c(cccc4F)o3)c2)CC1 ZINC001244928839 1058073529 /nfs/dbraw/zinc/07/35/29/1058073529.db2.gz LRBYPTZICKXMJV-UHFFFAOYSA-N 2 1 324.399 4.162 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2-c2cc(F)ccc2Cl)CC1 ZINC001245136404 1058119455 /nfs/dbraw/zinc/11/94/55/1058119455.db2.gz GPFMTOTZDBRCAJ-UHFFFAOYSA-N 2 1 318.823 4.069 20 0 DIADMP CC[N@H+]1CCc2cc(-c3ccc(C4CC[NH2+]CC4)cc3)ccc2C1 ZINC001245523799 1058197916 /nfs/dbraw/zinc/19/79/16/1058197916.db2.gz JMBRXGKKKHRZIA-UHFFFAOYSA-N 2 1 320.480 4.199 20 0 DIADMP CCOC(=[NH2+])c1cccc(-c2ccc(C3CC[NH2+]CC3)cc2)c1 ZINC001245525172 1058199931 /nfs/dbraw/zinc/19/99/31/1058199931.db2.gz CRDFMUUMFXXZAB-UHFFFAOYSA-N 2 1 308.425 4.182 20 0 DIADMP Cc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1CC[C@H](c2[nH+]ccn2C)C1 ZINC001550520307 1058341513 /nfs/dbraw/zinc/34/15/13/1058341513.db2.gz NJGZAPAZUUDBDO-FCEWJHQRSA-N 2 1 309.457 4.032 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC23CCCCC3)C1 ZINC001550515576 1058343233 /nfs/dbraw/zinc/34/32/33/1058343233.db2.gz QKMYOFVCCYTRKE-IXDOHACOSA-N 2 1 301.478 4.149 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC001246065842 1058660585 /nfs/dbraw/zinc/66/05/85/1058660585.db2.gz NGKXNBIPTDQBRT-MJGOQNOKSA-N 2 1 304.453 4.097 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[NH2+]1 ZINC001246065921 1058660701 /nfs/dbraw/zinc/66/07/01/1058660701.db2.gz OZERWMBDQRERMD-PKOBYXMFSA-N 2 1 304.453 4.240 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246070753 1058663806 /nfs/dbraw/zinc/66/38/06/1058663806.db2.gz FFUBJPYODICYQZ-VQTJNVASSA-N 2 1 308.469 4.142 20 0 DIADMP Clc1ccc(C2([NH2+][C@H]3CC[NH2+]C4(CCCCC4)C3)CC2)cc1 ZINC001246075713 1058666677 /nfs/dbraw/zinc/66/66/77/1058666677.db2.gz KFFICYMLVFLZBS-KRWDZBQOSA-N 2 1 318.892 4.374 20 0 DIADMP Fc1cc(Cl)cc(C[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246081189 1058670954 /nfs/dbraw/zinc/67/09/54/1058670954.db2.gz QVMSGAOSCIAUEU-MRXNPFEDSA-N 2 1 310.844 4.024 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC001246081321 1058671033 /nfs/dbraw/zinc/67/10/33/1058671033.db2.gz MSMNFXKEQDIARA-SJLPKXTDSA-N 2 1 304.453 4.097 20 0 DIADMP Fc1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)ccc1Cl ZINC001246085799 1058671373 /nfs/dbraw/zinc/67/13/73/1058671373.db2.gz IZLLNEKXBNRZKM-CQSZACIVSA-N 2 1 310.844 4.024 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(Cl)c2F)CC[NH2+]1 ZINC001246104444 1058677725 /nfs/dbraw/zinc/67/77/25/1058677725.db2.gz JRNHYSYUSMAQLV-MCIONIFRSA-N 2 1 312.860 4.441 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(Cl)c2F)CC[NH2+]1 ZINC001246104445 1058678310 /nfs/dbraw/zinc/67/83/10/1058678310.db2.gz JRNHYSYUSMAQLV-MGPQQGTHSA-N 2 1 312.860 4.441 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1C[NH2+]CC[C@H]1C ZINC001246100882 1058678489 /nfs/dbraw/zinc/67/84/89/1058678489.db2.gz XYBUIWYEHOGWSK-FGSXEWAUSA-N 2 1 322.496 4.185 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccs2)CC[NH2+]1 ZINC001246114550 1058683621 /nfs/dbraw/zinc/68/36/21/1058683621.db2.gz NNRWIRNLTUAKSM-LXZKKBNFSA-N 2 1 318.461 4.340 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2Cl)C[C@H](CC)[NH2+]1 ZINC001246179199 1058721924 /nfs/dbraw/zinc/72/19/24/1058721924.db2.gz DHAYKIQSIGMMGF-FICVDOATSA-N 2 1 315.288 4.392 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]C34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246178550 1058722748 /nfs/dbraw/zinc/72/27/48/1058722748.db2.gz IYFUPGLSLJEMII-BVZWOAMPSA-N 2 1 310.485 4.038 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC001246177625 1058724462 /nfs/dbraw/zinc/72/44/62/1058724462.db2.gz CJGJSAXMAKZCSL-PAFQEJSVSA-N 2 1 324.443 4.230 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccc(F)cc1F ZINC001246188103 1058731914 /nfs/dbraw/zinc/73/19/14/1058731914.db2.gz QWSMJWZJFXRPRQ-DZGCQCFKSA-N 2 1 308.416 4.070 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@]1(C)CCC[NH2+]C1 ZINC001246190759 1058733124 /nfs/dbraw/zinc/73/31/24/1058733124.db2.gz SEWUUSPNKPRLEO-AVRDEDQJSA-N 2 1 322.496 4.329 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246197506 1058738866 /nfs/dbraw/zinc/73/88/66/1058738866.db2.gz KXRSVGNGDFLRFQ-CYBMUJFWSA-N 2 1 313.272 4.066 20 0 DIADMP Cc1cc(F)cc(C)c1C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246201066 1058740689 /nfs/dbraw/zinc/74/06/89/1058740689.db2.gz UKLOTLWBZMTELK-ICSRJNTNSA-N 2 1 312.432 4.025 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+]C[C@]1(C)CC[NH2+]CC1(F)F ZINC001246221899 1058747116 /nfs/dbraw/zinc/74/71/16/1058747116.db2.gz PEOQSUZWUADONS-MSOLQXFVSA-N 2 1 324.459 4.012 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246214365 1058747947 /nfs/dbraw/zinc/74/79/47/1058747947.db2.gz ZTQYMYOGAHDYKS-NRDMVMEKSA-N 2 1 324.443 4.073 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H](C)CCC(C)C)CC[NH2+]1 ZINC001246230853 1058753519 /nfs/dbraw/zinc/75/35/19/1058753519.db2.gz UBEMFJSDSNTTBJ-AYBZRNKSSA-N 2 1 306.469 4.342 20 0 DIADMP COc1ccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246230514 1058753676 /nfs/dbraw/zinc/75/36/76/1058753676.db2.gz BUCKFALNRAHUKJ-QUCCMNQESA-N 2 1 324.468 4.013 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246229886 1058754375 /nfs/dbraw/zinc/75/43/75/1058754375.db2.gz MUBVEESJBGITSV-AZBIJLPYSA-N 2 1 316.464 4.096 20 0 DIADMP C=Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)cc1 ZINC001246233824 1058757979 /nfs/dbraw/zinc/75/79/79/1058757979.db2.gz FFSKCOSSVKZZET-TZIWHRDSSA-N 2 1 324.443 4.360 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CCCC2CCCC2)CC[NH2+]1 ZINC001246237918 1058761214 /nfs/dbraw/zinc/76/12/14/1058761214.db2.gz JYBIZJLXWROTBT-AZUAARDMSA-N 2 1 318.480 4.487 20 0 DIADMP CCCOc1cccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246243810 1058764900 /nfs/dbraw/zinc/76/49/00/1058764900.db2.gz NABBEBHYTGMYED-FPOVZHCZSA-N 2 1 324.468 4.058 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CC(C)(C)C1 ZINC001246250521 1058768388 /nfs/dbraw/zinc/76/83/88/1058768388.db2.gz QAGDARUUWLHZSW-YSHGAJCASA-N 2 1 300.490 4.284 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246253443 1058771624 /nfs/dbraw/zinc/77/16/24/1058771624.db2.gz MAOLCMVSYQDLMG-VQISRLSMSA-N 2 1 301.261 4.175 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246262006 1058778811 /nfs/dbraw/zinc/77/88/11/1058778811.db2.gz GQEBVPHVIGGHPE-MOPGFXCFSA-N 2 1 312.432 4.144 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246266193 1058779176 /nfs/dbraw/zinc/77/91/76/1058779176.db2.gz FYVIRSCYLRAPJV-OLZOCXBDSA-N 2 1 315.288 4.349 20 0 DIADMP c1oc2ccccc2c1CC[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246261894 1058779765 /nfs/dbraw/zinc/77/97/65/1058779765.db2.gz ONULXGTWKSZJQI-QUCCMNQESA-N 2 1 320.436 4.058 20 0 DIADMP c1oc2ccccc2c1CC[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246261895 1058782202 /nfs/dbraw/zinc/78/22/02/1058782202.db2.gz ONULXGTWKSZJQI-UYAOXDASSA-N 2 1 320.436 4.058 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@@H](C)C2CCCC2)CC[NH2+]1 ZINC001246268911 1058783259 /nfs/dbraw/zinc/78/32/59/1058783259.db2.gz JYHAVBYGLWPVJS-UCLAIMLFSA-N 2 1 304.453 4.096 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001246266789 1058783806 /nfs/dbraw/zinc/78/38/06/1058783806.db2.gz YCGNSVVEBPPSAE-DYVFJYSZSA-N 2 1 308.416 4.070 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H](CC)[NH2+][C@@H](CC)C1)c1cc(F)ccc1F ZINC001246270030 1058784267 /nfs/dbraw/zinc/78/42/67/1058784267.db2.gz SSYKCGIWMWSHBE-DEYYWGMASA-N 2 1 310.432 4.315 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CC2CCCCCC2)CC[NH2+]1 ZINC001246273968 1058787114 /nfs/dbraw/zinc/78/71/14/1058787114.db2.gz TVUBRCPSENFMQI-AZUAARDMSA-N 2 1 318.480 4.487 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246279432 1058794213 /nfs/dbraw/zinc/79/42/13/1058794213.db2.gz KESYFXPVONKETK-AYOQOUSVSA-N 2 1 318.480 4.423 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246279439 1058796594 /nfs/dbraw/zinc/79/65/94/1058796594.db2.gz KESYFXPVONKETK-SNRMKQJTSA-N 2 1 318.480 4.423 20 0 DIADMP CCOc1cccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246294711 1058808714 /nfs/dbraw/zinc/80/87/14/1058808714.db2.gz HOMRITRQNVHFAO-OZOXKJRCSA-N 2 1 324.468 4.229 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246309840 1058814551 /nfs/dbraw/zinc/81/45/51/1058814551.db2.gz OOYXGRDSBRBGKM-IEBWSBKVSA-N 2 1 318.480 4.486 20 0 DIADMP CC[C@H]1CC([NH2+][C@@H](c2ccccc2F)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246308385 1058814750 /nfs/dbraw/zinc/81/47/50/1058814750.db2.gz QTBQMXYUXBETKO-YZVOILCLSA-N 2 1 304.453 4.176 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246309843 1058815672 /nfs/dbraw/zinc/81/56/72/1058815672.db2.gz OOYXGRDSBRBGKM-PKOBYXMFSA-N 2 1 318.480 4.486 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C2CC2)cc1 ZINC001246313088 1058822041 /nfs/dbraw/zinc/82/20/41/1058822041.db2.gz IUOMOKRXZVODLP-NJDAHSKKSA-N 2 1 324.443 4.360 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccc(F)cc1F ZINC001246319356 1058829166 /nfs/dbraw/zinc/82/91/66/1058829166.db2.gz WUSJASIICKWGJW-KBRIMQKVSA-N 2 1 310.432 4.172 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1OC ZINC001246317171 1058831653 /nfs/dbraw/zinc/83/16/53/1058831653.db2.gz LRWUEHVSEIPSGB-AEFFLSMTSA-N 2 1 316.489 4.191 20 0 DIADMP CCCC1CCC([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246331773 1058840773 /nfs/dbraw/zinc/84/07/73/1058840773.db2.gz CGNVCSBBGWSWLK-DXBWTPJFSA-N 2 1 300.490 4.428 20 0 DIADMP c1cc2ccc(C[NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)cc2o1 ZINC001246330866 1058844838 /nfs/dbraw/zinc/84/48/38/1058844838.db2.gz ZAFGTVDTPSTEKD-MOPGFXCFSA-N 2 1 306.409 4.016 20 0 DIADMP CCCCCC[C@H](CCC)[NH2+][C@H]1CC[NH2+]C[C@@H]1C(F)(F)F ZINC001246344431 1058855832 /nfs/dbraw/zinc/85/58/32/1058855832.db2.gz ZCFSDDXEBBUATB-KKUMJFAQSA-N 2 1 308.432 4.256 20 0 DIADMP Cc1ccc(F)cc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246347507 1058863510 /nfs/dbraw/zinc/86/35/10/1058863510.db2.gz HETVLSOTFCPMDX-ZAAXVRCTSA-N 2 1 312.432 4.278 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360308 1058868093 /nfs/dbraw/zinc/86/80/93/1058868093.db2.gz FFIXGEIEJPPTFP-PBHICJAKSA-N 2 1 306.881 4.085 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CCCNc4ccccc43)CC[NH2+]2)cc1 ZINC001246358401 1058868565 /nfs/dbraw/zinc/86/85/65/1058868565.db2.gz PBASCIGZQHQVLF-WMQCIHAUSA-N 2 1 321.468 4.016 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@@H](C)CC2)CC[NH2+]1 ZINC001246363640 1058869693 /nfs/dbraw/zinc/86/96/93/1058869693.db2.gz QYOLWRVKKXHAFU-CZANMRCUSA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360839 1058870494 /nfs/dbraw/zinc/87/04/94/1058870494.db2.gz IQKJTZLDAZLSCM-PBHICJAKSA-N 2 1 320.908 4.476 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246370684 1058876188 /nfs/dbraw/zinc/87/61/88/1058876188.db2.gz FXISSSARWNASDW-TYCQWZJGSA-N 2 1 308.469 4.393 20 0 DIADMP COc1ccccc1C1([NH2+][C@@H](C)CCCC(C)C)CC[NH2+]CC1 ZINC001246378379 1058884681 /nfs/dbraw/zinc/88/46/81/1058884681.db2.gz XNJUKLBUGSNRRK-KRWDZBQOSA-N 2 1 318.505 4.078 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C1 ZINC001246379618 1058885623 /nfs/dbraw/zinc/88/56/23/1058885623.db2.gz ZRAJXNCKODDBHV-CABCVRRESA-N 2 1 306.881 4.087 20 0 DIADMP CCCC1([NH2+][C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CCC1 ZINC001246386799 1058894034 /nfs/dbraw/zinc/89/40/34/1058894034.db2.gz PJXPDDCPUKSBJQ-AEFFLSMTSA-N 2 1 304.453 4.240 20 0 DIADMP CCCC1([NH2+][C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CCC1 ZINC001246386808 1058894687 /nfs/dbraw/zinc/89/46/87/1058894687.db2.gz PJXPDDCPUKSBJQ-WMZOPIPTSA-N 2 1 304.453 4.240 20 0 DIADMP Cc1cccc(C2([NH2+][C@@H]3CCCC[NH2+]C3)CCC(F)(F)CC2)c1 ZINC001246405304 1058907753 /nfs/dbraw/zinc/90/77/53/1058907753.db2.gz LSJLYHCVJHYVCX-QGZVFWFLSA-N 2 1 322.443 4.131 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246406685 1058909193 /nfs/dbraw/zinc/90/91/93/1058909193.db2.gz RGJPTULNZAYMQP-MDZRGWNJSA-N 2 1 304.453 4.177 20 0 DIADMP Fc1ccccc1[C@H](CC1CCC1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246408668 1058911620 /nfs/dbraw/zinc/91/16/20/1058911620.db2.gz VSBUOPSCWFAENM-APWZRJJASA-N 2 1 316.464 4.321 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CC(C)(C)CC2CC2)CC[NH2+]1 ZINC001246430068 1058922262 /nfs/dbraw/zinc/92/22/62/1058922262.db2.gz FMCDXEMECSWTCG-IEBWSBKVSA-N 2 1 318.480 4.343 20 0 DIADMP C[C@H]1[C@H]2C[C@@H](C[C@H]1[NH2+][C@H]1CC[NH2+][C@H](c3ccccc3)C1)C2(C)C ZINC001246443638 1058933867 /nfs/dbraw/zinc/93/38/67/1058933867.db2.gz NUGTXWOEZSRGAR-QYEVSOCMSA-N 2 1 312.501 4.140 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C1C[C@H](CC)[NH2+][C@@H](CC)C1 ZINC001246453232 1058940877 /nfs/dbraw/zinc/94/08/77/1058940877.db2.gz AYONPBZRAQNVMJ-JYJNAYRXSA-N 2 1 304.478 4.045 20 0 DIADMP Cc1ccccc1C1([NH2+][C@H]2CC[C@H](C)[NH2+]C2)CCC(F)(F)CC1 ZINC001246462470 1058947820 /nfs/dbraw/zinc/94/78/20/1058947820.db2.gz ZHVDFDTVOIVPTP-HOTGVXAUSA-N 2 1 322.443 4.130 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](c2ccc(Cl)cn2)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246462487 1058948129 /nfs/dbraw/zinc/94/81/29/1058948129.db2.gz ZKWDLZLRYIXWDO-RKVPGOIHSA-N 2 1 321.896 4.085 20 0 DIADMP Cc1ccccc1C1([NH2+][C@@H]2CC[C@H](C)[NH2+]C2)CCC(F)(F)CC1 ZINC001246462473 1058950044 /nfs/dbraw/zinc/95/00/44/1058950044.db2.gz ZHVDFDTVOIVPTP-JKSUJKDBSA-N 2 1 322.443 4.130 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@H](CC)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246463422 1058951189 /nfs/dbraw/zinc/95/11/89/1058951189.db2.gz RTLZXYYCMZXLTN-OKZBNKHCSA-N 2 1 310.432 4.316 20 0 DIADMP CC[C@H]1CC([NH2+][C@H](c2ccccc2OC)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246466855 1058952191 /nfs/dbraw/zinc/95/21/91/1058952191.db2.gz BKXLJRAUBUNSLO-FTRWYGJKSA-N 2 1 316.489 4.045 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]CC[C@H]1CC[NH2+]CC1(F)F ZINC001246483101 1058962204 /nfs/dbraw/zinc/96/22/04/1058962204.db2.gz RHGUOBJVADRYPL-QZTJIDSGSA-N 2 1 324.459 4.012 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246491016 1058966756 /nfs/dbraw/zinc/96/67/56/1058966756.db2.gz RLYWEBNSIMGIQY-HLAWJBBLSA-N 2 1 306.453 4.065 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccc(C(F)(F)F)c(Cl)c1 ZINC001246493102 1058968881 /nfs/dbraw/zinc/96/88/81/1058968881.db2.gz YKUQDMRGVHSJJO-UMNHJUIQSA-N 2 1 320.786 4.150 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H]1CCc2cccc(Cl)c2C1 ZINC001246495361 1058969508 /nfs/dbraw/zinc/96/95/08/1058969508.db2.gz JSESTXVIBHOAKJ-OAHLLOKOSA-N 2 1 308.897 4.085 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(C(F)(F)F)c(Cl)c1 ZINC001246493093 1058971491 /nfs/dbraw/zinc/97/14/91/1058971491.db2.gz YKUQDMRGVHSJJO-CKYFFXLPSA-N 2 1 320.786 4.150 20 0 DIADMP Fc1cccc2c1CCC[C@H]2[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246500164 1058974313 /nfs/dbraw/zinc/97/43/13/1058974313.db2.gz PHRCZRKKBSFXBG-HBGVWJBISA-N 2 1 324.443 4.286 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H]2CCOc3ccc(Cl)cc32)C[C@H](CC)[NH2+]1 ZINC001246511597 1058979153 /nfs/dbraw/zinc/97/91/53/1058979153.db2.gz JXLLVJXFZJNFGV-JYYAWHABSA-N 2 1 322.880 4.062 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@@H+](Cc2ccccc2)C(C)(C)C)CC[NH2+]1 ZINC001246518635 1058982165 /nfs/dbraw/zinc/98/21/65/1058982165.db2.gz HOJZGRATIYJFIL-QZTJIDSGSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@@H+](Cc2ccccc2)C(C)(C)C)CC[NH2+]1 ZINC001246518638 1058983878 /nfs/dbraw/zinc/98/38/78/1058983878.db2.gz HOJZGRATIYJFIL-ZWKOTPCHSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@@H]([NH3+])[C@H]1C ZINC001246544233 1058991570 /nfs/dbraw/zinc/99/15/70/1058991570.db2.gz PRTQWNMOLHAAKL-CBGDNZLLSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H]([NH3+])CC1 ZINC001246542518 1058992669 /nfs/dbraw/zinc/99/26/69/1058992669.db2.gz PUPASPDXWBKVIT-OCCSQVGLSA-N 2 1 315.288 4.128 20 0 DIADMP CC(C)(C)C1CC[NH+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246540607 1058993291 /nfs/dbraw/zinc/99/32/91/1058993291.db2.gz BQJYOTDNHGHXSW-MOPGFXCFSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@H]1CC[N@H+](C2CCC(Cc3ccccc3)CC2)CC[C@@H]1C[NH3+] ZINC001246561432 1059003179 /nfs/dbraw/zinc/00/31/79/1059003179.db2.gz SNPRLJSNRPUSEK-RCKXYERXSA-N 2 1 314.517 4.095 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246562264 1059004628 /nfs/dbraw/zinc/00/46/28/1059004628.db2.gz XKLRZRPIHAPGBH-RTBURBONSA-N 2 1 302.506 4.311 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246563027 1059005293 /nfs/dbraw/zinc/00/52/93/1059005293.db2.gz NXSGVOUQYGXREV-IOJLRTSASA-N 2 1 316.464 4.275 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246561221 1059006476 /nfs/dbraw/zinc/00/64/76/1059006476.db2.gz JMAPEFPRSRMLRT-BZSNNMDCSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CCC[C@@H]1C[NH3+] ZINC001246561710 1059006676 /nfs/dbraw/zinc/00/66/76/1059006676.db2.gz KFWMZLXNSOOJHZ-VBSBHUPXSA-N 2 1 300.490 4.020 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@@H]1CC[NH2+][C@@H](c3ccc(F)cc3C)C1)C2 ZINC001246568877 1059007805 /nfs/dbraw/zinc/00/78/05/1059007805.db2.gz SLZUPTNMQGKYQT-WIYYLYMNSA-N 2 1 324.443 4.251 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@@H]1CC[NH2+][C@@H](c3ccc(F)cc3C)C1)C2 ZINC001246568877 1059007823 /nfs/dbraw/zinc/00/78/23/1059007823.db2.gz SLZUPTNMQGKYQT-WIYYLYMNSA-N 2 1 324.443 4.251 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)CC2)CC[NH2+]1 ZINC001246584619 1059009419 /nfs/dbraw/zinc/00/94/19/1059009419.db2.gz BROKJFXWOKESED-YJLNNSPDSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H](C)CC2)CC[NH2+]1 ZINC001246584619 1059009439 /nfs/dbraw/zinc/00/94/39/1059009439.db2.gz BROKJFXWOKESED-YJLNNSPDSA-N 2 1 304.453 4.049 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001246575549 1059011607 /nfs/dbraw/zinc/01/16/07/1059011607.db2.gz JRRNTHRGELMOEM-AQNXPRMDSA-N 2 1 300.490 4.164 20 0 DIADMP C[C@H]1C[N@@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596854 1059015133 /nfs/dbraw/zinc/01/51/33/1059015133.db2.gz KKNPDDGZTFHTFF-NBHGPNQESA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1C[N@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596854 1059015153 /nfs/dbraw/zinc/01/51/53/1059015153.db2.gz KKNPDDGZTFHTFF-NBHGPNQESA-N 2 1 306.453 4.099 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1ccc(Cl)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001246590677 1059015346 /nfs/dbraw/zinc/01/53/46/1059015346.db2.gz HQXIBRLCHGPFNJ-MAUKXSAKSA-N 2 1 308.897 4.124 20 0 DIADMP C[C@H]1C[N@@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596857 1059016036 /nfs/dbraw/zinc/01/60/36/1059016036.db2.gz KKNPDDGZTFHTFF-SCWSEQNSSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1C[N@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596857 1059016058 /nfs/dbraw/zinc/01/60/58/1059016058.db2.gz KKNPDDGZTFHTFF-SCWSEQNSSA-N 2 1 306.453 4.099 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001246593423 1059016853 /nfs/dbraw/zinc/01/68/53/1059016853.db2.gz MUVZXMZIOLRUAK-UXHICEINSA-N 2 1 302.506 4.250 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001246593424 1059017013 /nfs/dbraw/zinc/01/70/13/1059017013.db2.gz MUVZXMZIOLRUAK-VQTJNVASSA-N 2 1 302.506 4.250 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC[NH2+]1 ZINC001246593169 1059018450 /nfs/dbraw/zinc/01/84/50/1059018450.db2.gz ANBSTMMBMDYRJV-QUCCMNQESA-N 2 1 300.490 4.352 20 0 DIADMP CC1(C)C[C@@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC[NH2+]1 ZINC001246593241 1059018636 /nfs/dbraw/zinc/01/86/36/1059018636.db2.gz AYOMRUZULFQYJW-IBGZPJMESA-N 2 1 300.490 4.352 20 0 DIADMP C[NH2+]C1CCC([N@@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001246595050 1059020279 /nfs/dbraw/zinc/02/02/79/1059020279.db2.gz HISNIIPORUKABK-UHFFFAOYSA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246604623 1059020885 /nfs/dbraw/zinc/02/08/85/1059020885.db2.gz HPWOWKPGKYWMBV-LEWJYISDSA-N 2 1 314.517 4.396 20 0 DIADMP C1CCC2(CC1)CCC[C@@H]([NH+]1CCC3(CCCC[NH2+]3)CC1)C2 ZINC001246610228 1059026863 /nfs/dbraw/zinc/02/68/63/1059026863.db2.gz LVCCIUHOQUZHNN-GOSISDBHSA-N 2 1 304.522 4.488 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246608633 1059027248 /nfs/dbraw/zinc/02/72/48/1059027248.db2.gz USPQPGRSATYXNM-KDOFPFPSSA-N 2 1 324.871 4.018 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CCC[C@]4(CC[NH2+]4)C3)CC2)cc1 ZINC001246610254 1059027608 /nfs/dbraw/zinc/02/76/08/1059027608.db2.gz MBMIELMLCJUXDV-KVZIAJEVSA-N 2 1 318.892 4.194 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CCC[C@]4(CC[NH2+]4)C3)CC2)cc1 ZINC001246610254 1059027631 /nfs/dbraw/zinc/02/76/31/1059027631.db2.gz MBMIELMLCJUXDV-KVZIAJEVSA-N 2 1 318.892 4.194 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@H+]3CCC[C@@]4(CCC[NH2+]C4)C3)C2)cc1 ZINC001246610643 1059028233 /nfs/dbraw/zinc/02/82/33/1059028233.db2.gz QSMTZDDAIMYWJT-QHAWAJNXSA-N 2 1 312.501 4.178 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001246609077 1059028321 /nfs/dbraw/zinc/02/83/21/1059028321.db2.gz KPDFJDKXQOWRCM-LEWJYISDSA-N 2 1 314.517 4.254 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@@H+]3CCC[C@]34CCC[NH2+]CC4)C2)cc1 ZINC001246608687 1059029154 /nfs/dbraw/zinc/02/91/54/1059029154.db2.gz VBOLUJNPKYJPSC-HKBOAZHASA-N 2 1 312.501 4.321 20 0 DIADMP c1ccc(C[C@@H]2C[C@H]([N@H+]3CCCC4(CCCC4)C3)CC[NH2+]2)cc1 ZINC001246614683 1059034189 /nfs/dbraw/zinc/03/41/89/1059034189.db2.gz PABWAVMLSQHAAF-WOJBJXKFSA-N 2 1 312.501 4.006 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@]4(CCC[NH2+]4)C3)CC2)cc1 ZINC001246614586 1059035569 /nfs/dbraw/zinc/03/55/69/1059035569.db2.gz OUQJKAPXTHGCDD-NKELODKYSA-N 2 1 318.892 4.194 20 0 DIADMP CCCCC[C@H](CC)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625695 1059039716 /nfs/dbraw/zinc/03/97/16/1059039716.db2.gz RZJUREOZOOKECD-RBUKOAKNSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246646182 1059047180 /nfs/dbraw/zinc/04/71/80/1059047180.db2.gz OVZYGTZFJDJCDB-DNVCBOLYSA-N 2 1 320.908 4.125 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246642922 1059049451 /nfs/dbraw/zinc/04/94/51/1059049451.db2.gz FQODWZSOKNQIOW-NHCUHLMSSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246644714 1059050526 /nfs/dbraw/zinc/05/05/26/1059050526.db2.gz LKNPBNARFCJGAP-BEFAXECRSA-N 2 1 320.908 4.125 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@H]2C[C@@]2([NH3+])C1 ZINC001246656588 1059053514 /nfs/dbraw/zinc/05/35/14/1059053514.db2.gz NPTYVZAWNLFNEK-PIPMEXSNSA-N 2 1 320.480 4.020 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001246657684 1059054242 /nfs/dbraw/zinc/05/42/42/1059054242.db2.gz PIIMPOLOUZVEKP-UTKZUKDTSA-N 2 1 314.517 4.034 20 0 DIADMP CC1(C)CCC[C@H]([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C1 ZINC001246674953 1059059056 /nfs/dbraw/zinc/05/90/56/1059059056.db2.gz PHDWJWRGUOUUHC-QKNQBKEWSA-N 2 1 312.501 4.177 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2C)C[C@H](CC)[NH2+]1 ZINC001246682573 1059061508 /nfs/dbraw/zinc/06/15/08/1059061508.db2.gz WDOBBRCLISVURK-XFKSJGNHSA-N 2 1 300.490 4.441 20 0 DIADMP CC(C)CC[C@@H](C)[N@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1 ZINC001246679109 1059062203 /nfs/dbraw/zinc/06/22/03/1059062203.db2.gz YSUCYDAOLGCCFY-MISYRCLQSA-N 2 1 300.490 4.033 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001246678041 1059063320 /nfs/dbraw/zinc/06/33/20/1059063320.db2.gz MBIPSYQJYZKXBG-PCCBWWKXSA-N 2 1 314.517 4.109 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246682341 1059063486 /nfs/dbraw/zinc/06/34/86/1059063486.db2.gz BQWODRXYFVZAID-WLRLJWMZSA-N 2 1 314.517 4.280 20 0 DIADMP CCCC[C@H](CC)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246682287 1059064705 /nfs/dbraw/zinc/06/47/05/1059064705.db2.gz BKXHYHIOZIZUJR-ZCNNSNEGSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)C1CC[NH2+]CC1 ZINC001246698009 1059067610 /nfs/dbraw/zinc/06/76/10/1059067610.db2.gz VTZCPQIYQFPBSY-GOSISDBHSA-N 2 1 322.496 4.281 20 0 DIADMP C[N@H+](Cc1cccc(Cl)c1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246769390 1059073552 /nfs/dbraw/zinc/07/35/52/1059073552.db2.gz JROGNRMJSWIAQC-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246769390 1059073573 /nfs/dbraw/zinc/07/35/73/1059073573.db2.gz JROGNRMJSWIAQC-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246773826 1059075421 /nfs/dbraw/zinc/07/54/21/1059075421.db2.gz CUWUQKOPQFUDMK-LJQANCHMSA-N 2 1 300.490 4.354 20 0 DIADMP Cc1ccc([C@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246783084 1059079428 /nfs/dbraw/zinc/07/94/28/1059079428.db2.gz WEALDFYNMDTOTH-NYLDSWQDSA-N 2 1 312.501 4.444 20 0 DIADMP C[N@@H+]([C@@H]1CCN[C@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783518 1059080405 /nfs/dbraw/zinc/08/04/05/1059080405.db2.gz ONUNQJCSNMQWTP-DAYNZGEJSA-N 2 1 324.512 4.380 20 0 DIADMP C[N@H+]([C@@H]1CC[NH2+][C@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783518 1059080429 /nfs/dbraw/zinc/08/04/29/1059080429.db2.gz ONUNQJCSNMQWTP-DAYNZGEJSA-N 2 1 324.512 4.380 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783518 1059080451 /nfs/dbraw/zinc/08/04/51/1059080451.db2.gz ONUNQJCSNMQWTP-DAYNZGEJSA-N 2 1 324.512 4.380 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H](Cc3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246776771 1059080821 /nfs/dbraw/zinc/08/08/21/1059080821.db2.gz PBJXJCCXALZFOF-UWHLTILDSA-N 2 1 314.517 4.250 20 0 DIADMP C[N@@H+](CCCc1ccccc1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246775712 1059080853 /nfs/dbraw/zinc/08/08/53/1059080853.db2.gz KTVCFXBYSNNWTH-IBGZPJMESA-N 2 1 300.490 4.006 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H](Cc3ccccc3)C2)C[C@@H](CC)[NH2+]1 ZINC001246776773 1059081146 /nfs/dbraw/zinc/08/11/46/1059081146.db2.gz PBJXJCCXALZFOF-XUVXKRRUSA-N 2 1 314.517 4.250 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)cc1 ZINC001246783571 1059082420 /nfs/dbraw/zinc/08/24/20/1059082420.db2.gz CHMZLIGMSWTXQD-JLAWEPINSA-N 2 1 318.892 4.399 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC[NH2+]1 ZINC001246783814 1059083578 /nfs/dbraw/zinc/08/35/78/1059083578.db2.gz FBBQKRLCLXAHIL-BZSNNMDCSA-N 2 1 306.881 4.254 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246784697 1059085027 /nfs/dbraw/zinc/08/50/27/1059085027.db2.gz IKGAKRLWTSTPLT-LSTHTHJFSA-N 2 1 316.464 4.275 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246787351 1059087478 /nfs/dbraw/zinc/08/74/78/1059087478.db2.gz PHLWNOQIEWWJRU-QFBILLFUSA-N 2 1 316.464 4.275 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)[C@@H]2C)CC[NH2+]1 ZINC001246786931 1059087658 /nfs/dbraw/zinc/08/76/58/1059087658.db2.gz BFNDGEHZMNLAFC-PBYMTVQHSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@@H]2C)CC[NH2+]1 ZINC001246786931 1059087679 /nfs/dbraw/zinc/08/76/79/1059087679.db2.gz BFNDGEHZMNLAFC-PBYMTVQHSA-N 2 1 304.453 4.048 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001246784146 1059087712 /nfs/dbraw/zinc/08/77/12/1059087712.db2.gz FEHYXBZOVGJUGK-ZWKOTPCHSA-N 2 1 318.892 4.399 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2Cl)CC[NH2+]1 ZINC001246788950 1059089458 /nfs/dbraw/zinc/08/94/58/1059089458.db2.gz IHRQTTYNWAUOFV-JLSDUUJJSA-N 2 1 306.881 4.254 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2OC)CC[NH2+]1 ZINC001246790891 1059090970 /nfs/dbraw/zinc/09/09/70/1059090970.db2.gz IERNEZWKEYEETR-LMMKCTJWSA-N 2 1 316.489 4.143 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2Cl)CC[NH2+]1 ZINC001246788949 1059091169 /nfs/dbraw/zinc/09/11/69/1059091169.db2.gz IHRQTTYNWAUOFV-JCGIZDLHSA-N 2 1 306.881 4.254 20 0 DIADMP c1ccc(C[C@@H]2CC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246791530 1059092142 /nfs/dbraw/zinc/09/21/42/1059092142.db2.gz LBDKVMGXRNMWLZ-PMACEKPBSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc(C[C@H]2CC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246791531 1059092659 /nfs/dbraw/zinc/09/26/59/1059092659.db2.gz LBDKVMGXRNMWLZ-UXHICEINSA-N 2 1 312.501 4.006 20 0 DIADMP Fc1ccc(F)c([C@@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246792141 1059094107 /nfs/dbraw/zinc/09/41/07/1059094107.db2.gz NPKAIGXILJVJCM-YJBOKZPZSA-N 2 1 320.427 4.024 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792154 1059095205 /nfs/dbraw/zinc/09/52/05/1059095205.db2.gz OBVIZPPCRGLPKY-YYAJDYIMSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792154 1059095225 /nfs/dbraw/zinc/09/52/25/1059095225.db2.gz OBVIZPPCRGLPKY-YYAJDYIMSA-N 2 1 322.443 4.411 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246794219 1059096325 /nfs/dbraw/zinc/09/63/25/1059096325.db2.gz XKGPKYQAAREALB-LDDOYCOJSA-N 2 1 304.865 4.150 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246793637 1059098510 /nfs/dbraw/zinc/09/85/10/1059098510.db2.gz VAUAGRSWODSCOU-XUVXKRRUSA-N 2 1 300.490 4.004 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+]2CCSC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246807470 1059101108 /nfs/dbraw/zinc/10/11/08/1059101108.db2.gz KCJZOOQTDZGMTL-CEXWTWQISA-N 2 1 318.530 4.087 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCSC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246807470 1059101115 /nfs/dbraw/zinc/10/11/15/1059101115.db2.gz KCJZOOQTDZGMTL-CEXWTWQISA-N 2 1 318.530 4.087 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801525 1059103156 /nfs/dbraw/zinc/10/31/56/1059103156.db2.gz IKJGOLGGPVUAOB-MJGOQNOKSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801525 1059103159 /nfs/dbraw/zinc/10/31/59/1059103159.db2.gz IKJGOLGGPVUAOB-MJGOQNOKSA-N 2 1 316.464 4.193 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+](C2CCC3(CC[NH2+]C3)CC2)C1 ZINC001246811083 1059105291 /nfs/dbraw/zinc/10/52/91/1059105291.db2.gz RNHPZCCKXKTACW-MDCZIUGASA-N 2 1 318.892 4.052 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+](C)CCc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246815351 1059106470 /nfs/dbraw/zinc/10/64/70/1059106470.db2.gz YECJMANULPPJBM-ROUUACIJSA-N 2 1 308.897 4.125 20 0 DIADMP C[N@@H+](CCc1cccc(Cl)c1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246824726 1059109015 /nfs/dbraw/zinc/10/90/15/1059109015.db2.gz RHLRRZZHBCYZHK-UHFFFAOYSA-N 2 1 320.908 4.127 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821823 1059109952 /nfs/dbraw/zinc/10/99/52/1059109952.db2.gz JMXYHCTWXKPTPS-CRWXNKLISA-N 2 1 310.894 4.212 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821823 1059109961 /nfs/dbraw/zinc/10/99/61/1059109961.db2.gz JMXYHCTWXKPTPS-CRWXNKLISA-N 2 1 310.894 4.212 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+](C)CCc2cccc(Cl)c2)CC[NH2+]1 ZINC001246822592 1059110171 /nfs/dbraw/zinc/11/01/71/1059110171.db2.gz LZJUUBCUWJUSEC-ZWKOTPCHSA-N 2 1 308.897 4.125 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](C)CCc2cccc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246822372 1059112261 /nfs/dbraw/zinc/11/22/61/1059112261.db2.gz KPDFZRJWUQHENC-BCDXTJNWSA-N 2 1 308.897 4.124 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H]3CCC[C@H]32)CCN1 ZINC001246818225 1059112383 /nfs/dbraw/zinc/11/23/83/1059112383.db2.gz AOSNHAPNNDLTNZ-WSTLGDPDSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H]3CCC[C@H]32)CC[NH2+]1 ZINC001246818225 1059112390 /nfs/dbraw/zinc/11/23/90/1059112390.db2.gz AOSNHAPNNDLTNZ-WSTLGDPDSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H]3CCC[C@H]32)CC[NH2+]1 ZINC001246818225 1059112392 /nfs/dbraw/zinc/11/23/92/1059112392.db2.gz AOSNHAPNNDLTNZ-WSTLGDPDSA-N 2 1 316.464 4.192 20 0 DIADMP CCCCCC[C@@H](CCC)[N@@H+](CCCOC)C1CC[NH2+]CC1 ZINC001246835297 1059114858 /nfs/dbraw/zinc/11/48/58/1059114858.db2.gz INKIJHAGRMAVSS-GOSISDBHSA-N 2 1 312.542 4.216 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)s1 ZINC001246826919 1059115168 /nfs/dbraw/zinc/11/51/68/1059115168.db2.gz ZMQZXILHRIQLOW-UUCFBXCCSA-N 2 1 324.921 4.461 20 0 DIADMP CCC(CC)[N@H+](CC)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246839471 1059117082 /nfs/dbraw/zinc/11/70/82/1059117082.db2.gz IVBBEBFNTLBYOH-HKUYNNGSSA-N 2 1 306.469 4.438 20 0 DIADMP CCC(CC)[N@@H+](CC)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246839471 1059117091 /nfs/dbraw/zinc/11/70/91/1059117091.db2.gz IVBBEBFNTLBYOH-HKUYNNGSSA-N 2 1 306.469 4.438 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246840369 1059117953 /nfs/dbraw/zinc/11/79/53/1059117953.db2.gz NLRBZXHVPOVPCQ-SFHVURJKSA-N 2 1 304.453 4.103 20 0 DIADMP COc1ccccc1[C@H](C)[N@@H+](C)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246838462 1059118279 /nfs/dbraw/zinc/11/82/79/1059118279.db2.gz CBEJZNGLGZYWCP-VXESANQCSA-N 2 1 316.489 4.000 20 0 DIADMP COc1ccccc1[C@@H](C)[N@@H+](C)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246838464 1059118728 /nfs/dbraw/zinc/11/87/28/1059118728.db2.gz CBEJZNGLGZYWCP-ZRZPHAQCSA-N 2 1 316.489 4.000 20 0 DIADMP CC1(C)C[C@@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC[NH2+]1 ZINC001246842700 1059120560 /nfs/dbraw/zinc/12/05/60/1059120560.db2.gz UUMDGBWNGLNEAU-NRFANRHFSA-N 2 1 322.496 4.262 20 0 DIADMP c1ccc(CC[N@@H+](Cc2ccccc2)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246841415 1059120602 /nfs/dbraw/zinc/12/06/02/1059120602.db2.gz RGOIZLXNAHGALO-CBQGHPETSA-N 2 1 320.480 4.014 20 0 DIADMP C[C@@H]1CC([N@@H+](CCc2ccccc2)Cc2ccccc2)C[C@@H](C)[NH2+]1 ZINC001246844449 1059123044 /nfs/dbraw/zinc/12/30/44/1059123044.db2.gz YWYGWPYLNBHKEQ-RTBURBONSA-N 2 1 322.496 4.260 20 0 DIADMP C[N@@H+](Cc1sc2ccccc2c1Cl)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246843516 1059124646 /nfs/dbraw/zinc/12/46/46/1059124646.db2.gz WODIPGKJJNNUHY-LBPRGKRZSA-N 2 1 320.889 4.129 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@@H]3CCC[C@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC001246847544 1059128757 /nfs/dbraw/zinc/12/87/57/1059128757.db2.gz UBAKEFXYYRLPNH-NJYVYQBISA-N 2 1 312.501 4.178 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)C[C@H](CC)[NH2+]1 ZINC001246848779 1059130016 /nfs/dbraw/zinc/13/00/16/1059130016.db2.gz DZTDJYQBXHXWNL-KANFNMMFSA-N 2 1 320.908 4.439 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246855356 1059131866 /nfs/dbraw/zinc/13/18/66/1059131866.db2.gz XLJVKAUSEIAWPA-NJAFHUGGSA-N 2 1 320.908 4.296 20 0 DIADMP C[N@@H+]([C@@H]1CCC2(C1)CC[NH2+]CC2)C1CCC(C(C)(C)C)CC1 ZINC001246851825 1059132317 /nfs/dbraw/zinc/13/23/17/1059132317.db2.gz AFJBDPFNDPFHEF-DAWZGUTISA-N 2 1 306.538 4.445 20 0 DIADMP FC1CC2(C1)CCC[N@@H+]([C@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246852869 1059134275 /nfs/dbraw/zinc/13/42/75/1059134275.db2.gz LCWOKIDHOYTKPG-FUFFSDJGSA-N 2 1 316.464 4.084 20 0 DIADMP FC1CC2(C1)CCC[N@H+]([C@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246852869 1059134287 /nfs/dbraw/zinc/13/42/87/1059134287.db2.gz LCWOKIDHOYTKPG-FUFFSDJGSA-N 2 1 316.464 4.084 20 0 DIADMP c1ccc(C2=CC[N@@H+](C3CCC4(CCC[NH2+]C4)CC3)CC2)cc1 ZINC001246862035 1059136287 /nfs/dbraw/zinc/13/62/87/1059136287.db2.gz UXWOTQWSZMCQKE-UHFFFAOYSA-N 2 1 310.485 4.088 20 0 DIADMP CCCC[C@@H](CC)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246859179 1059137255 /nfs/dbraw/zinc/13/72/55/1059137255.db2.gz IVUZDOXMVFGKOO-GOSISDBHSA-N 2 1 300.490 4.092 20 0 DIADMP C1C[C@@H](C2CCCCC2)[N@H+]([C@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246867482 1059140911 /nfs/dbraw/zinc/14/09/11/1059140911.db2.gz XYQGUUWGYUOTOR-OALUTQOASA-N 2 1 304.522 4.486 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3C[C@H]4CC[C@@H](C3)[NH2+]C4)CC2)cc1 ZINC001246868390 1059141579 /nfs/dbraw/zinc/14/15/79/1059141579.db2.gz SKONROMSLOIKDR-YXXBGZSLSA-N 2 1 318.892 4.050 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246879879 1059145084 /nfs/dbraw/zinc/14/50/84/1059145084.db2.gz PXOFYWJCBKOVKG-KSSFIOAISA-N 2 1 324.871 4.223 20 0 DIADMP CC[N@H+](Cc1ccc(OC)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246876075 1059145506 /nfs/dbraw/zinc/14/55/06/1059145506.db2.gz AQZOWKLBRXPDNM-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1ccc(OC)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246876075 1059145511 /nfs/dbraw/zinc/14/55/11/1059145511.db2.gz AQZOWKLBRXPDNM-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2CC3CCC(CC3)C2)CC[NH2+]1 ZINC001246882871 1059149608 /nfs/dbraw/zinc/14/96/08/1059149608.db2.gz OWDZYXSGUYQWCE-AURQOUSISA-N 2 1 316.464 4.049 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884559 1059150956 /nfs/dbraw/zinc/15/09/56/1059150956.db2.gz BLJZKEGRAWTCTQ-MKSNKDDYSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884559 1059150975 /nfs/dbraw/zinc/15/09/75/1059150975.db2.gz BLJZKEGRAWTCTQ-MKSNKDDYSA-N 2 1 322.443 4.411 20 0 DIADMP C[NH2+]C1CCC([N@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001246890139 1059152844 /nfs/dbraw/zinc/15/28/44/1059152844.db2.gz ROTMGFLXLSELAP-DQPZFDDXSA-N 2 1 304.503 4.076 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1CCC2(C[NH2+]C2)CC1 ZINC001246889512 1059153018 /nfs/dbraw/zinc/15/30/18/1059153018.db2.gz QQRMYLIJLPQXRL-KRWDZBQOSA-N 2 1 316.514 4.078 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246890364 1059154652 /nfs/dbraw/zinc/15/46/52/1059154652.db2.gz UBVPQZSZOAXQIL-NXHRZFHOSA-N 2 1 318.530 4.322 20 0 DIADMP C[N@@H+](C1CCC2(CC[NH2+]CC2)CC1)C(C)(C)Cc1ccccc1 ZINC001246891329 1059155183 /nfs/dbraw/zinc/15/51/83/1059155183.db2.gz KNVNGXCZNYKSPR-UHFFFAOYSA-N 2 1 314.517 4.252 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246890227 1059155408 /nfs/dbraw/zinc/15/54/08/1059155408.db2.gz SOQXPUGPXDTBJI-NVXWUHKLSA-N 2 1 316.514 4.220 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246889555 1059155488 /nfs/dbraw/zinc/15/54/88/1059155488.db2.gz QXWPFAPEQMYUNG-KYHPRHEASA-N 2 1 316.514 4.219 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](C)C(C)(C)Cc2ccccc2)C[C@H](CC)[NH2+]1 ZINC001246892940 1059156149 /nfs/dbraw/zinc/15/61/49/1059156149.db2.gz PKWIMSWOHAIJGO-REPLKXPHSA-N 2 1 302.506 4.249 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246887418 1059156194 /nfs/dbraw/zinc/15/61/94/1059156194.db2.gz NQJGLHPROROLJU-MSOLQXFVSA-N 2 1 318.892 4.399 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246887423 1059156213 /nfs/dbraw/zinc/15/62/13/1059156213.db2.gz NQJGLHPROROLJU-ZWKOTPCHSA-N 2 1 318.892 4.399 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246889558 1059156470 /nfs/dbraw/zinc/15/64/70/1059156470.db2.gz QXWPFAPEQMYUNG-LHHMISFZSA-N 2 1 316.514 4.219 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)c1 ZINC001246888027 1059156684 /nfs/dbraw/zinc/15/66/84/1059156684.db2.gz QFQDCSWGSFEUDW-MLHJIOFPSA-N 2 1 304.865 4.150 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246893112 1059158923 /nfs/dbraw/zinc/15/89/23/1059158923.db2.gz HNNLYHMXCKQRBI-WOJBJXKFSA-N 2 1 310.485 4.438 20 0 DIADMP Fc1ccc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246896376 1059160800 /nfs/dbraw/zinc/16/08/00/1059160800.db2.gz XOIGMZCMAXRNQW-QHAWAJNXSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246896376 1059160809 /nfs/dbraw/zinc/16/08/09/1059160809.db2.gz XOIGMZCMAXRNQW-QHAWAJNXSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246900506 1059161000 /nfs/dbraw/zinc/16/10/00/1059161000.db2.gz RYWNWEGPHVZHCC-NJDAHSKKSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246900506 1059161013 /nfs/dbraw/zinc/16/10/13/1059161013.db2.gz RYWNWEGPHVZHCC-NJDAHSKKSA-N 2 1 324.443 4.456 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246900946 1059162468 /nfs/dbraw/zinc/16/24/68/1059162468.db2.gz JOEYUDSJZWVPHQ-KRWDZBQOSA-N 2 1 306.881 4.084 20 0 DIADMP C[C@@H]1CC([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)C[C@@H](C)[NH2+]1 ZINC001246904896 1059163233 /nfs/dbraw/zinc/16/32/33/1059163233.db2.gz JORGWPACZMHGDO-IAGOWNOFSA-N 2 1 324.468 4.440 20 0 DIADMP Fc1cccc(F)c1[C@@H]1CCC[N@H+]1[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246902758 1059163448 /nfs/dbraw/zinc/16/34/48/1059163448.db2.gz UIDIRYKGOATXOK-LJHODMEESA-N 2 1 320.427 4.024 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246903315 1059164227 /nfs/dbraw/zinc/16/42/27/1059164227.db2.gz JXPRVZOAUBDJDC-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246903568 1059164315 /nfs/dbraw/zinc/16/43/15/1059164315.db2.gz ZBFDOGSYNGMNJE-OXQOHEQNSA-N 2 1 323.484 4.227 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](CC)Cc2cccc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246902213 1059164497 /nfs/dbraw/zinc/16/44/97/1059164497.db2.gz BSSRYWCPZWEARB-PIIMJCKOSA-N 2 1 308.897 4.471 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246905298 1059164901 /nfs/dbraw/zinc/16/49/01/1059164901.db2.gz CUTRCTNWWSZTOM-ACBHZAAOSA-N 2 1 300.490 4.337 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC001246907812 1059167414 /nfs/dbraw/zinc/16/74/14/1059167414.db2.gz JVBDWSMBKMGIBX-LEWJYISDSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC001246907812 1059167422 /nfs/dbraw/zinc/16/74/22/1059167422.db2.gz JVBDWSMBKMGIBX-LEWJYISDSA-N 2 1 308.469 4.229 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246905711 1059168807 /nfs/dbraw/zinc/16/88/07/1059168807.db2.gz AZAZIVRUAIHFCM-MOPGFXCFSA-N 2 1 302.506 4.292 20 0 DIADMP CCC[N@H+](CC(C)C)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246910728 1059170899 /nfs/dbraw/zinc/17/08/99/1059170899.db2.gz KTVUSIQEUHVMIK-MJGOQNOKSA-N 2 1 306.469 4.295 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246910728 1059170914 /nfs/dbraw/zinc/17/09/14/1059170914.db2.gz KTVUSIQEUHVMIK-MJGOQNOKSA-N 2 1 306.469 4.295 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](CC)Cc2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC001246916406 1059174498 /nfs/dbraw/zinc/17/44/98/1059174498.db2.gz SDDJVOYXVXMGCY-HOTGVXAUSA-N 2 1 314.395 4.058 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC001246917415 1059174774 /nfs/dbraw/zinc/17/47/74/1059174774.db2.gz CUANCDHSVHRJEA-WMZOPIPTSA-N 2 1 320.546 4.161 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC001246917415 1059174791 /nfs/dbraw/zinc/17/47/91/1059174791.db2.gz CUANCDHSVHRJEA-WMZOPIPTSA-N 2 1 320.546 4.161 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](C)C1CCC([NH2+]C)CC1 ZINC001246919715 1059176201 /nfs/dbraw/zinc/17/62/01/1059176201.db2.gz OCKFBJXXANITMI-SOAGJPPSSA-N 2 1 302.506 4.250 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246913368 1059176319 /nfs/dbraw/zinc/17/63/19/1059176319.db2.gz INMHNCRBOYQCDC-MRXNPFEDSA-N 2 1 320.546 4.161 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](CC)Cc2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC001246916408 1059176652 /nfs/dbraw/zinc/17/66/52/1059176652.db2.gz SDDJVOYXVXMGCY-HZPDHXFCSA-N 2 1 314.395 4.058 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)[C@@H](Cc2ccccc2)CC(C)C)CC1 ZINC001246914455 1059176773 /nfs/dbraw/zinc/17/67/73/1059176773.db2.gz CGYOJSONDHDQIX-SOAGJPPSSA-N 2 1 302.506 4.106 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC001246912162 1059177255 /nfs/dbraw/zinc/17/72/55/1059177255.db2.gz DMJDENTWDFHKKT-YRWFTTLQSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@@H+](C[C@H]1CC[NH2+]C1)[C@@H](C)CC(C)(C)SCc1ccco1 ZINC001246934361 1059183204 /nfs/dbraw/zinc/18/32/04/1059183204.db2.gz CPSBWNRPZGVDKD-HOTGVXAUSA-N 2 1 324.534 4.001 20 0 DIADMP CC1(C)CCC([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)CC1 ZINC001246935329 1059183683 /nfs/dbraw/zinc/18/36/83/1059183683.db2.gz GRMDHCWXWWCLBC-UHFFFAOYSA-N 2 1 318.480 4.349 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246937859 1059183964 /nfs/dbraw/zinc/18/39/64/1059183964.db2.gz NDZUPLFFUPKWLG-FUHWJXTLSA-N 2 1 318.480 4.001 20 0 DIADMP CCCC[C@H](C)[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001246936397 1059185747 /nfs/dbraw/zinc/18/57/47/1059185747.db2.gz IIDRXBWNBNMFIH-INIZCTEOSA-N 2 1 306.469 4.206 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C[C@@H]1C ZINC001246936333 1059186077 /nfs/dbraw/zinc/18/60/77/1059186077.db2.gz IZZQHCLQCDLVEG-GQIGUUNPSA-N 2 1 318.480 4.204 20 0 DIADMP Cc1ccc(C[C@H](C)[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001246934029 1059186545 /nfs/dbraw/zinc/18/65/45/1059186545.db2.gz NBPZSKRREPPGAM-AZUAARDMSA-N 2 1 314.517 4.170 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246934038 1059186689 /nfs/dbraw/zinc/18/66/89/1059186689.db2.gz NCIUUBNIRVUWQP-MRXNPFEDSA-N 2 1 306.469 4.349 20 0 DIADMP CCC[C@H](CC)[N@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1 ZINC001246941882 1059188379 /nfs/dbraw/zinc/18/83/79/1059188379.db2.gz IUOWBVNTENXIPH-IBGZPJMESA-N 2 1 306.469 4.206 20 0 DIADMP CC1(C)CC[C@@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246943355 1059188959 /nfs/dbraw/zinc/18/89/59/1059188959.db2.gz RFCYEUSNDYNDPM-LJQANCHMSA-N 2 1 318.480 4.206 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246942089 1059190560 /nfs/dbraw/zinc/19/05/60/1059190560.db2.gz MUYGZIIQTNQYKJ-SFHVURJKSA-N 2 1 306.469 4.204 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001246947730 1059193497 /nfs/dbraw/zinc/19/34/97/1059193497.db2.gz XHNCCHVCXDTAJC-QGZVFWFLSA-N 2 1 302.506 4.026 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246954864 1059198728 /nfs/dbraw/zinc/19/87/28/1059198728.db2.gz JFGZZHGNXPVSJX-INIZCTEOSA-N 2 1 322.443 4.098 20 0 DIADMP CCCCC(CCCC)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246953183 1059198805 /nfs/dbraw/zinc/19/88/05/1059198805.db2.gz MLIOXKNKKUUOAM-UHFFFAOYSA-N 2 1 317.521 4.385 20 0 DIADMP CCCC[C@H](CC(C)C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246953175 1059200421 /nfs/dbraw/zinc/20/04/21/1059200421.db2.gz MDEKMRGJKTVYMB-HXUWFJFHSA-N 2 1 317.521 4.241 20 0 DIADMP CCCC[C@H](C)[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246955832 1059201178 /nfs/dbraw/zinc/20/11/78/1059201178.db2.gz UDBRZTVZOUSULY-HNNXBMFYSA-N 2 1 308.897 4.473 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246955832 1059201198 /nfs/dbraw/zinc/20/11/98/1059201198.db2.gz UDBRZTVZOUSULY-HNNXBMFYSA-N 2 1 308.897 4.473 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccc(C)cc2F)C2CC[NH2+]CC2)C1 ZINC001246954225 1059201446 /nfs/dbraw/zinc/20/14/46/1059201446.db2.gz FPNMMNJIQLEVAH-QFBILLFUSA-N 2 1 318.480 4.267 20 0 DIADMP Cc1ccc(C[N@@H+]([C@H]2CCC(C)(C)C2)C2CC[NH2+]CC2)c(F)c1 ZINC001246954815 1059202039 /nfs/dbraw/zinc/20/20/39/1059202039.db2.gz HFXGJWPTGBEOQF-SFHVURJKSA-N 2 1 318.480 4.267 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955962 1059202100 /nfs/dbraw/zinc/20/21/00/1059202100.db2.gz OQFPDDOGJBBANL-RDTXWAMCSA-N 2 1 322.443 4.098 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246962548 1059204343 /nfs/dbraw/zinc/20/43/43/1059204343.db2.gz KEHSIPCXVFBFNP-MOPGFXCFSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CC[C@H](C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246958373 1059205310 /nfs/dbraw/zinc/20/53/10/1059205310.db2.gz QNSVKFLVJDKHRE-HNNXBMFYSA-N 2 1 324.459 4.344 20 0 DIADMP Fc1ccc(C[N@@H+](C2CC[NH2+]CC2)C2CCCCCC2)c(F)c1 ZINC001246956419 1059205632 /nfs/dbraw/zinc/20/56/32/1059205632.db2.gz SSTGRVMCPNDEKW-UHFFFAOYSA-N 2 1 322.443 4.242 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956830 1059206280 /nfs/dbraw/zinc/20/62/80/1059206280.db2.gz WAYMSGBJTBBSAX-WMLDXEAASA-N 2 1 322.443 4.098 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246956961 1059206476 /nfs/dbraw/zinc/20/64/76/1059206476.db2.gz BKVGGMHNTLGCDC-UYAOXDASSA-N 2 1 300.490 4.352 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c1C ZINC001246965302 1059209550 /nfs/dbraw/zinc/20/95/50/1059209550.db2.gz HAMHQLPIFUAPKU-SFTDATJTSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1ccc(C[N@@H+](C2CC[NH2+]CC2)C2CCCCCC2)c(F)c1 ZINC001246965472 1059211398 /nfs/dbraw/zinc/21/13/98/1059211398.db2.gz VMWYMAWMOFVALR-UHFFFAOYSA-N 2 1 318.480 4.411 20 0 DIADMP CC[C@@H](CC(C)C)[N@H+](Cc1c(F)cccc1F)C1CC[NH2+]CC1 ZINC001246964541 1059212815 /nfs/dbraw/zinc/21/28/15/1059212815.db2.gz LIMWYHMHXBONIX-HNNXBMFYSA-N 2 1 324.459 4.344 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](Cc1c(F)cccc1F)C1CC[NH2+]CC1 ZINC001246964541 1059212835 /nfs/dbraw/zinc/21/28/35/1059212835.db2.gz LIMWYHMHXBONIX-HNNXBMFYSA-N 2 1 324.459 4.344 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1ccc(OC)cc1)C1CC[NH2+]CC1 ZINC001246964576 1059213982 /nfs/dbraw/zinc/21/39/82/1059213982.db2.gz NSZNFKOTBJJXJG-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CC[NH2+][C@H](C(C)(C)C)C2)c1C ZINC001246970200 1059214404 /nfs/dbraw/zinc/21/44/04/1059214404.db2.gz XYUWFIRFHYMXGK-UXHICEINSA-N 2 1 314.517 4.435 20 0 DIADMP C([C@@H]1CCC[NH2+]C1)[N@@H+](C1CC1)[C@@H]1CCCC2(CCCCC2)C1 ZINC001246971890 1059217404 /nfs/dbraw/zinc/21/74/04/1059217404.db2.gz ISVVNHHDBLVTLV-IEBWSBKVSA-N 2 1 304.522 4.344 20 0 DIADMP c1ccc(CC[C@H]2CCC[N@H+]([C@H]3C[C@H]4CCC[C@@H](C3)[NH2+]4)C2)cc1 ZINC001246981450 1059224035 /nfs/dbraw/zinc/22/40/35/1059224035.db2.gz WMEQOJVOLLOKPE-CGXNFDGLSA-N 2 1 312.501 4.004 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H](CCc3ccccc3)C2)CC[NH2+]1 ZINC001246980674 1059224731 /nfs/dbraw/zinc/22/47/31/1059224731.db2.gz RJICDHTUKNXQGQ-HBMCJLEFSA-N 2 1 314.517 4.108 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)cc1 ZINC001246999328 1059226245 /nfs/dbraw/zinc/22/62/45/1059226245.db2.gz AYCSJQDUMBWOMO-GOSISDBHSA-N 2 1 320.480 4.021 20 0 DIADMP CCC[N@@H+](C[C@H]1CC[NH2+]C1)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246985721 1059228758 /nfs/dbraw/zinc/22/87/58/1059228758.db2.gz CECCWWYTTAMZET-DFQSSKMNSA-N 2 1 300.490 4.034 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2Cc2ccc(F)cc2)C[C@@H](CC)[NH2+]1 ZINC001246998176 1059230186 /nfs/dbraw/zinc/23/01/86/1059230186.db2.gz BALAGPVWKNZMPJ-QRVBRYPASA-N 2 1 318.480 4.142 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001247005822 1059231372 /nfs/dbraw/zinc/23/13/72/1059231372.db2.gz BXRPUVDDIIWNLY-FQEVSTJZSA-N 2 1 320.480 4.102 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001781 1059234783 /nfs/dbraw/zinc/23/47/83/1059234783.db2.gz LEYAHJZYZJDYEF-GBESFXJTSA-N 2 1 322.443 4.413 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247001781 1059234801 /nfs/dbraw/zinc/23/48/01/1059234801.db2.gz LEYAHJZYZJDYEF-GBESFXJTSA-N 2 1 322.443 4.413 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2Cc3ccccc3C23CC[NH2+]CC3)CC(C)(C)C1 ZINC001247013546 1059244609 /nfs/dbraw/zinc/24/46/09/1059244609.db2.gz ZUOWRJWDUXOQRA-AEFFLSMTSA-N 2 1 312.501 4.296 20 0 DIADMP CCCCC[C@H](CC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247013075 1059244836 /nfs/dbraw/zinc/24/48/36/1059244836.db2.gz FKRWCOVDVFLEQD-SFHVURJKSA-N 2 1 300.490 4.440 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2CC(C)(C)OC2(C)C)CC1 ZINC001559489220 1059264572 /nfs/dbraw/zinc/26/45/72/1059264572.db2.gz JQWGNQBWZVKKFN-GOSISDBHSA-N 2 1 324.553 4.024 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCc2cccc(C)c2)CC1 ZINC001559489013 1059265501 /nfs/dbraw/zinc/26/55/01/1059265501.db2.gz BGMXYBJOPFWXCJ-UHFFFAOYSA-N 2 1 316.533 4.372 20 0 DIADMP C[C@H]1CC[C@H](C)[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001559560585 1059381729 /nfs/dbraw/zinc/38/17/29/1059381729.db2.gz NQSQVLKXXAPLLP-ROUUACIJSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CC=C(Cl)Cl)CC1 ZINC001559596706 1059431131 /nfs/dbraw/zinc/43/11/31/1059431131.db2.gz XSKLILZZQMXLNP-AWEZNQCLSA-N 2 1 319.320 4.282 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CC=C(Cl)Cl)CC1 ZINC001559596706 1059431138 /nfs/dbraw/zinc/43/11/38/1059431138.db2.gz XSKLILZZQMXLNP-AWEZNQCLSA-N 2 1 319.320 4.282 20 0 DIADMP CC1(C)C[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001559581470 1059415484 /nfs/dbraw/zinc/41/54/84/1059415484.db2.gz IEQWVRKYXHKEPI-UHFFFAOYSA-N 2 1 300.490 4.293 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CC4CCCC4)CC[C@H]32)cc1 ZINC001559594753 1059428955 /nfs/dbraw/zinc/42/89/55/1059428955.db2.gz TVRDHPIFMPZJNT-LEWJYISDSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CC4CCCC4)CC[C@H]32)cc1 ZINC001559594753 1059428961 /nfs/dbraw/zinc/42/89/61/1059428961.db2.gz TVRDHPIFMPZJNT-LEWJYISDSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CC4CCCC4)CC[C@H]32)cc1 ZINC001559594753 1059428964 /nfs/dbraw/zinc/42/89/64/1059428964.db2.gz TVRDHPIFMPZJNT-LEWJYISDSA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)(C)CC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594632 1059429084 /nfs/dbraw/zinc/42/90/84/1059429084.db2.gz RXQOYLCICASASE-PMACEKPBSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594632 1059429091 /nfs/dbraw/zinc/42/90/91/1059429091.db2.gz RXQOYLCICASASE-PMACEKPBSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594632 1059429096 /nfs/dbraw/zinc/42/90/96/1059429096.db2.gz RXQOYLCICASASE-PMACEKPBSA-N 2 1 314.517 4.409 20 0 DIADMP CC[C@@H]1C[C@H]1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594328 1059429132 /nfs/dbraw/zinc/42/91/32/1059429132.db2.gz MZVBUROPSTWRHI-IVAOSVALSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594328 1059429140 /nfs/dbraw/zinc/42/91/40/1059429140.db2.gz MZVBUROPSTWRHI-IVAOSVALSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594328 1059429148 /nfs/dbraw/zinc/42/91/48/1059429148.db2.gz MZVBUROPSTWRHI-IVAOSVALSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccccc2F)CC1 ZINC001559596412 1059431734 /nfs/dbraw/zinc/43/17/34/1059431734.db2.gz SHHCIPPRGZSHEI-KRWDZBQOSA-N 2 1 318.480 4.302 20 0 DIADMP CCCc1ccc([C@H]([NH2+]CC[C@H]2CCC[N@H+]2C)C(C)C)cc1 ZINC001559670014 1059495468 /nfs/dbraw/zinc/49/54/68/1059495468.db2.gz XTBBZRCKNPBGCI-WOJBJXKFSA-N 2 1 302.506 4.410 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C1CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737908 1059570345 /nfs/dbraw/zinc/57/03/45/1059570345.db2.gz QIPNTJZMFKXSPG-APWZRJJASA-N 2 1 312.501 4.307 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(Cl)c1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737044 1059571304 /nfs/dbraw/zinc/57/13/04/1059571304.db2.gz FRQIOQCTVLKQBL-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(Cl)c1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737044 1059571317 /nfs/dbraw/zinc/57/13/17/1059571317.db2.gz FRQIOQCTVLKQBL-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC001559775108 1059612902 /nfs/dbraw/zinc/61/29/02/1059612902.db2.gz HWTBCUGIQWZCLI-YLJXDBKYSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC001559775107 1059613132 /nfs/dbraw/zinc/61/31/32/1059613132.db2.gz HWTBCUGIQWZCLI-QXWDQEIOSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@]1(c2ccccc2)CCC[N@@H+](CCC[NH+]2CCCCC2)CC1 ZINC001559831477 1059664947 /nfs/dbraw/zinc/66/49/47/1059664947.db2.gz UIEQLFROPCWXFI-OAQYLSRUSA-N 2 1 314.517 4.306 20 0 DIADMP Cc1ccc2c(c1)C[N@H+](CCC[NH+]1CCCCC1)C(C)(C)C2 ZINC001559860856 1059684477 /nfs/dbraw/zinc/68/44/77/1059684477.db2.gz QRWPSBAYAWJKPG-UHFFFAOYSA-N 2 1 300.490 4.008 20 0 DIADMP CC1(C)C[C@H](c2ccccc2)[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001559932002 1059745076 /nfs/dbraw/zinc/74/50/76/1059745076.db2.gz UXGHMBDHUGQLMH-LJQANCHMSA-N 2 1 300.490 4.336 20 0 DIADMP Cc1cccc(C)c1C[N@H+](CC[C@H]1CCC[NH+]1C)CC(C)C ZINC001559935518 1059750831 /nfs/dbraw/zinc/75/08/31/1059750831.db2.gz MEAYCYDPEKPCTD-LJQANCHMSA-N 2 1 302.506 4.246 20 0 DIADMP Cc1cccc(C)c1C[NH+](CC[C@H]1CCC[N@@H+]1C)CC(C)C ZINC001559935518 1059750851 /nfs/dbraw/zinc/75/08/51/1059750851.db2.gz MEAYCYDPEKPCTD-LJQANCHMSA-N 2 1 302.506 4.246 20 0 DIADMP Cc1cccc(C)c1C[NH+](CC[C@H]1CCC[N@H+]1C)CC(C)C ZINC001559935518 1059750867 /nfs/dbraw/zinc/75/08/67/1059750867.db2.gz MEAYCYDPEKPCTD-LJQANCHMSA-N 2 1 302.506 4.246 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC001560050668 1059869592 /nfs/dbraw/zinc/86/95/92/1059869592.db2.gz HDOFYQZBOSJTMC-UHFFFAOYSA-N 2 1 312.501 4.404 20 0 DIADMP CC1(C[NH+]2C[C@@]3(C)C[NH+](Cc4ccccc4)C[C@]3(C)C2)CCC1 ZINC001560071711 1059885740 /nfs/dbraw/zinc/88/57/40/1059885740.db2.gz FGTLPIQYQTYAJY-NHCUHLMSSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[N@@H+](CC1CCCC1)C2 ZINC001560072937 1059888596 /nfs/dbraw/zinc/88/85/96/1059888596.db2.gz WZRCGPWMFWTWOD-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[N@H+](CC1CCCC1)C2 ZINC001560072937 1059888616 /nfs/dbraw/zinc/88/86/16/1059888616.db2.gz WZRCGPWMFWTWOD-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP C[C@]12C[NH+](CC3CCCC3)C[C@@]1(C)C[N@H+](Cc1ccccc1)C2 ZINC001560072937 1059888642 /nfs/dbraw/zinc/88/86/42/1059888642.db2.gz WZRCGPWMFWTWOD-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP C[C@]12C[NH+](CC3CCCC3)C[C@@]1(C)C[N@@H+](Cc1ccccc1)C2 ZINC001560072937 1059888668 /nfs/dbraw/zinc/88/86/68/1059888668.db2.gz WZRCGPWMFWTWOD-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@H](c1c(F)cccc1F)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC001560099444 1059908523 /nfs/dbraw/zinc/90/85/23/1059908523.db2.gz LKXNYZXLRUBHCB-HNNXBMFYSA-N 2 1 310.432 4.224 20 0 DIADMP C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001560099444 1059908540 /nfs/dbraw/zinc/90/85/40/1059908540.db2.gz LKXNYZXLRUBHCB-HNNXBMFYSA-N 2 1 310.432 4.224 20 0 DIADMP CC(C)c1ccc(C[N@H+]2C[C@H]3C[NH+](C)C[C@@]3(C)C2)c(C(C)C)c1 ZINC001560186282 1059969632 /nfs/dbraw/zinc/96/96/32/1059969632.db2.gz CSIDMQLHJNLZJG-CTNGQTDRSA-N 2 1 314.517 4.317 20 0 DIADMP CC(C)c1ccc(C[NH+]2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)c(C(C)C)c1 ZINC001560186282 1059969652 /nfs/dbraw/zinc/96/96/52/1059969652.db2.gz CSIDMQLHJNLZJG-CTNGQTDRSA-N 2 1 314.517 4.317 20 0 DIADMP CC(C)c1ccc(C[NH+]2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)c(C(C)C)c1 ZINC001560186282 1059969670 /nfs/dbraw/zinc/96/96/70/1059969670.db2.gz CSIDMQLHJNLZJG-CTNGQTDRSA-N 2 1 314.517 4.317 20 0 DIADMP CC[NH+](CC)[C@H](C[NH2+]C1CCc2ccccc2CC1)CC(C)C ZINC001560260617 1060029869 /nfs/dbraw/zinc/02/98/69/1060029869.db2.gz NAQNHMVGFKUTIK-NRFANRHFSA-N 2 1 316.533 4.280 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1C ZINC001560270380 1060044199 /nfs/dbraw/zinc/04/41/99/1060044199.db2.gz RONTXQHWZPXAQP-IYBDPMFKSA-N 2 1 302.506 4.069 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1ccc(F)cc1 ZINC001560271179 1060045144 /nfs/dbraw/zinc/04/51/44/1060045144.db2.gz YHIACGXYXBIHLB-BQLWYNFJSA-N 2 1 304.453 4.083 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001560272231 1060047686 /nfs/dbraw/zinc/04/76/86/1060047686.db2.gz ZTMXDIYPIBCSTI-GDBMZVCRSA-N 2 1 304.478 4.064 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC001560272231 1060047705 /nfs/dbraw/zinc/04/77/05/1060047705.db2.gz ZTMXDIYPIBCSTI-GDBMZVCRSA-N 2 1 304.478 4.064 20 0 DIADMP CC[N@H+](CC[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1)C(C)C ZINC001560306313 1060091177 /nfs/dbraw/zinc/09/11/77/1060091177.db2.gz BFIHVDLMPMITNW-UXHICEINSA-N 2 1 302.506 4.423 20 0 DIADMP CC[N@@H+](CC[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1)C(C)C ZINC001560306313 1060091197 /nfs/dbraw/zinc/09/11/97/1060091197.db2.gz BFIHVDLMPMITNW-UXHICEINSA-N 2 1 302.506 4.423 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C[C@H]2CCCC(C)(C)C2)c1 ZINC001560320058 1060107775 /nfs/dbraw/zinc/10/77/75/1060107775.db2.gz KBLIOVCEIAGSMK-IBGZPJMESA-N 2 1 302.506 4.444 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(C(C)C)c2)C1 ZINC001560406503 1060190249 /nfs/dbraw/zinc/19/02/49/1060190249.db2.gz IULDCTQWAAYUTI-LJQANCHMSA-N 2 1 302.506 4.268 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001560435569 1060222927 /nfs/dbraw/zinc/22/29/27/1060222927.db2.gz TYGHDVKKVGCCMR-RTBURBONSA-N 2 1 314.517 4.354 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560482749 1060271813 /nfs/dbraw/zinc/27/18/13/1060271813.db2.gz ADCLJYSZLLRKCB-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560482749 1060271829 /nfs/dbraw/zinc/27/18/29/1060271829.db2.gz ADCLJYSZLLRKCB-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP CCCCC/C(=C\c1ccccc1)C[NH2+]CCc1c[nH+]cn1C ZINC001560546851 1060354501 /nfs/dbraw/zinc/35/45/01/1060354501.db2.gz LDDPZHMQWGKUFQ-XMHGGMMESA-N 2 1 311.473 4.216 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001560552468 1060364493 /nfs/dbraw/zinc/36/44/93/1060364493.db2.gz FCPXYMABOFWNSS-QNDFHXLGSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001560552468 1060364515 /nfs/dbraw/zinc/36/45/15/1060364515.db2.gz FCPXYMABOFWNSS-QNDFHXLGSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572896 1060384073 /nfs/dbraw/zinc/38/40/73/1060384073.db2.gz HOYZAFSASFWSAJ-UYAOXDASSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572896 1060384082 /nfs/dbraw/zinc/38/40/82/1060384082.db2.gz HOYZAFSASFWSAJ-UYAOXDASSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560610177 1060424012 /nfs/dbraw/zinc/42/40/12/1060424012.db2.gz MCXNJTYHFPQNFM-FUHWJXTLSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560610177 1060424024 /nfs/dbraw/zinc/42/40/24/1060424024.db2.gz MCXNJTYHFPQNFM-FUHWJXTLSA-N 2 1 314.517 4.454 20 0 DIADMP CCC(CC)C[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001560616323 1060429868 /nfs/dbraw/zinc/42/98/68/1060429868.db2.gz YUPRSVUZHADNRI-QHAWAJNXSA-N 2 1 314.517 4.313 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560668785 1060496496 /nfs/dbraw/zinc/49/64/96/1060496496.db2.gz UWVIYICFVKVLBU-NJDAHSKKSA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560668785 1060496504 /nfs/dbraw/zinc/49/65/04/1060496504.db2.gz UWVIYICFVKVLBU-NJDAHSKKSA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560668785 1060496515 /nfs/dbraw/zinc/49/65/15/1060496515.db2.gz UWVIYICFVKVLBU-NJDAHSKKSA-N 2 1 314.517 4.303 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560668787 1060497973 /nfs/dbraw/zinc/49/79/73/1060497973.db2.gz UWVIYICFVKVLBU-QHAWAJNXSA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560668787 1060497983 /nfs/dbraw/zinc/49/79/83/1060497983.db2.gz UWVIYICFVKVLBU-QHAWAJNXSA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560668787 1060497994 /nfs/dbraw/zinc/49/79/94/1060497994.db2.gz UWVIYICFVKVLBU-QHAWAJNXSA-N 2 1 314.517 4.303 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001560704055 1060561415 /nfs/dbraw/zinc/56/14/15/1060561415.db2.gz WFPCYNMBBPOMEU-SDZDHKAXSA-N 2 1 312.501 4.065 20 0 DIADMP C([NH2+][C@@H]1CCCC[C@@H]1C1CC1)[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791760 1060651195 /nfs/dbraw/zinc/65/11/95/1060651195.db2.gz QEBHZLVHEFEFKT-VAMGGRTRSA-N 2 1 304.522 4.342 20 0 DIADMP Cc1cc(C)cc(CC[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)c1 ZINC001560799870 1060660612 /nfs/dbraw/zinc/66/06/12/1060660612.db2.gz ACJIHZJKZFUNBV-UHFFFAOYSA-N 2 1 324.468 4.093 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001560804273 1060664356 /nfs/dbraw/zinc/66/43/56/1060664356.db2.gz XYXSYVOMLHFUSE-FHLIZLRMSA-N 2 1 308.897 4.296 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c(C)c1 ZINC001560814512 1060674261 /nfs/dbraw/zinc/67/42/61/1060674261.db2.gz ZTTBASPIZBQFGE-MFUKYNBTSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c(C)c1 ZINC001560814512 1060674265 /nfs/dbraw/zinc/67/42/65/1060674265.db2.gz ZTTBASPIZBQFGE-MFUKYNBTSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c(C)c1 ZINC001560814512 1060674270 /nfs/dbraw/zinc/67/42/70/1060674270.db2.gz ZTTBASPIZBQFGE-MFUKYNBTSA-N 2 1 312.501 4.041 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC001560844821 1060699599 /nfs/dbraw/zinc/69/95/99/1060699599.db2.gz BUIWDGXNXDLKCH-HBMCJLEFSA-N 2 1 314.517 4.423 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)Cc1ccccc1Cl ZINC001560845180 1060703135 /nfs/dbraw/zinc/70/31/35/1060703135.db2.gz IDRMFMDPMQUGGA-WMZOPIPTSA-N 2 1 322.924 4.371 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H](CC)Cc1ccc(Cl)cc1 ZINC001560861534 1060720138 /nfs/dbraw/zinc/72/01/38/1060720138.db2.gz QGQPCUNQOVYFHF-CRAIPNDOSA-N 2 1 310.913 4.371 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H](CC)Cc1ccc(Cl)cc1 ZINC001560861534 1060720152 /nfs/dbraw/zinc/72/01/52/1060720152.db2.gz QGQPCUNQOVYFHF-CRAIPNDOSA-N 2 1 310.913 4.371 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560864106 1060723865 /nfs/dbraw/zinc/72/38/65/1060723865.db2.gz NRBKAWGRDVGTCJ-HOJAQTOUSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560864106 1060723878 /nfs/dbraw/zinc/72/38/78/1060723878.db2.gz NRBKAWGRDVGTCJ-HOJAQTOUSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560869403 1060730569 /nfs/dbraw/zinc/73/05/69/1060730569.db2.gz GRVOWEKUOVMRFB-YSIASYRMSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560869403 1060730589 /nfs/dbraw/zinc/73/05/89/1060730589.db2.gz GRVOWEKUOVMRFB-YSIASYRMSA-N 2 1 302.506 4.207 20 0 DIADMP CC[C@H]1CCCC[C@H]1C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901147 1060765798 /nfs/dbraw/zinc/76/57/98/1060765798.db2.gz MEVDVEMKMNWOFD-WJMWBRGCSA-N 2 1 314.517 4.138 20 0 DIADMP CC(C)(C)[C@@]1(C[NH2+][C@@H]2C=CCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001560922331 1060786650 /nfs/dbraw/zinc/78/66/50/1060786650.db2.gz RIJSJARKXUMRIO-TZIWHRDSSA-N 2 1 312.501 4.233 20 0 DIADMP CC(C)(C)[C@]1(C[NH2+][C@@H]2C=CCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001560922328 1060787242 /nfs/dbraw/zinc/78/72/42/1060787242.db2.gz RIJSJARKXUMRIO-CTNGQTDRSA-N 2 1 312.501 4.233 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC001560932792 1060795546 /nfs/dbraw/zinc/79/55/46/1060795546.db2.gz TYZOSKZVTCSQCH-QHGAOEGBSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1C[C@@H](C)c1cccc(Cl)c1 ZINC001560948290 1060813515 /nfs/dbraw/zinc/81/35/15/1060813515.db2.gz SSHSTDNUBPMAMZ-GPMSIDNRSA-N 2 1 322.924 4.496 20 0 DIADMP Cc1cc(C)cc(CC[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001560973576 1060837199 /nfs/dbraw/zinc/83/71/99/1060837199.db2.gz YFQDBHXUJDFOEM-OAQYLSRUSA-N 2 1 314.517 4.233 20 0 DIADMP Cc1cc(C)cc(CC[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001560973576 1060837208 /nfs/dbraw/zinc/83/72/08/1060837208.db2.gz YFQDBHXUJDFOEM-OAQYLSRUSA-N 2 1 314.517 4.233 20 0 DIADMP C([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001560973521 1060838853 /nfs/dbraw/zinc/83/88/53/1060838853.db2.gz WSWTUDMNDWSASX-QWFCFKBJSA-N 2 1 304.522 4.342 20 0 DIADMP C([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001560973521 1060838868 /nfs/dbraw/zinc/83/88/68/1060838868.db2.gz WSWTUDMNDWSASX-QWFCFKBJSA-N 2 1 304.522 4.342 20 0 DIADMP C[C@H]([NH2+]CC1CCC=CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001561017715 1060875385 /nfs/dbraw/zinc/87/53/85/1060875385.db2.gz FUTOZKINHHOLMJ-GHTZIAJQSA-N 2 1 312.501 4.233 20 0 DIADMP C[C@H](C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1)c1cccc(Cl)c1 ZINC001561052232 1060900992 /nfs/dbraw/zinc/90/09/92/1060900992.db2.gz VUAQSZSQQHUHGY-CQSZACIVSA-N 2 1 308.897 4.296 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]CC1CCC2(CCCCC2)CC1 ZINC001462144444 1060964449 /nfs/dbraw/zinc/96/44/49/1060964449.db2.gz DYFNGRMCXFNOFN-UHFFFAOYSA-N 2 1 303.494 4.312 20 0 DIADMP CC[C@@H](C)C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473204022 1060971213 /nfs/dbraw/zinc/97/12/13/1060971213.db2.gz WYKLMEUGDTVMLG-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H](C)C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473204022 1060971227 /nfs/dbraw/zinc/97/12/27/1060971227.db2.gz WYKLMEUGDTVMLG-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H](C)C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473204022 1060971243 /nfs/dbraw/zinc/97/12/43/1060971243.db2.gz WYKLMEUGDTVMLG-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCC2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001473206208 1060974903 /nfs/dbraw/zinc/97/49/03/1060974903.db2.gz PZPZGRROXXBZOM-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCC2CCC2)CC[N@H+]1Cc1ccccc1 ZINC001473206208 1060974922 /nfs/dbraw/zinc/97/49/22/1060974922.db2.gz PZPZGRROXXBZOM-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206208 1060974939 /nfs/dbraw/zinc/97/49/39/1060974939.db2.gz PZPZGRROXXBZOM-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206208 1060974959 /nfs/dbraw/zinc/97/49/59/1060974959.db2.gz PZPZGRROXXBZOM-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220225 1060993982 /nfs/dbraw/zinc/99/39/82/1060993982.db2.gz SGHGRISCKYMWRR-HKBOAZHASA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220225 1060994002 /nfs/dbraw/zinc/99/40/02/1060994002.db2.gz SGHGRISCKYMWRR-HKBOAZHASA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220225 1060994027 /nfs/dbraw/zinc/99/40/27/1060994027.db2.gz SGHGRISCKYMWRR-HKBOAZHASA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220225 1060994044 /nfs/dbraw/zinc/99/40/44/1060994044.db2.gz SGHGRISCKYMWRR-HKBOAZHASA-N 2 1 310.485 4.082 20 0 DIADMP CC[C@@H]1CCC[C@@H](C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001462192390 1061015436 /nfs/dbraw/zinc/01/54/36/1061015436.db2.gz OAIHPOSWDWEWGA-YLJYHZDGSA-N 2 1 302.506 4.396 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl ZINC001462223424 1061037882 /nfs/dbraw/zinc/03/78/82/1061037882.db2.gz PLTPGIKVEJYQIY-IEZWGBDMSA-N 2 1 320.908 4.440 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl ZINC001462223424 1061037898 /nfs/dbraw/zinc/03/78/98/1061037898.db2.gz PLTPGIKVEJYQIY-IEZWGBDMSA-N 2 1 320.908 4.440 20 0 DIADMP CC[C@H](CCc1ccccc1)[NH2+][C@@H](CC(C)C)C[NH+]1CCCC1 ZINC001462270730 1061064067 /nfs/dbraw/zinc/06/40/67/1061064067.db2.gz XNVWWGBOFNDDIB-RTWAWAEBSA-N 2 1 316.533 4.498 20 0 DIADMP C[N@H+]1CCC[C@]2(CC[NH+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC001462278202 1061071992 /nfs/dbraw/zinc/07/19/92/1061071992.db2.gz LDJTYAGMBBTZKF-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC001462278202 1061072008 /nfs/dbraw/zinc/07/20/08/1061072008.db2.gz LDJTYAGMBBTZKF-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC001462278202 1061072020 /nfs/dbraw/zinc/07/20/20/1061072020.db2.gz LDJTYAGMBBTZKF-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462301042 1061088356 /nfs/dbraw/zinc/08/83/56/1061088356.db2.gz YOUMUNDMYKTCJQ-HOJAQTOUSA-N 2 1 302.506 4.341 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462301042 1061088366 /nfs/dbraw/zinc/08/83/66/1061088366.db2.gz YOUMUNDMYKTCJQ-HOJAQTOUSA-N 2 1 302.506 4.341 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC001462303007 1061090599 /nfs/dbraw/zinc/09/05/99/1061090599.db2.gz DGTVQBMGIRMJFQ-ZDUSSCGKSA-N 2 1 317.304 4.246 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC001462303007 1061090608 /nfs/dbraw/zinc/09/06/08/1061090608.db2.gz DGTVQBMGIRMJFQ-ZDUSSCGKSA-N 2 1 317.304 4.246 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1)C1CC1 ZINC001462311139 1061098831 /nfs/dbraw/zinc/09/88/31/1061098831.db2.gz QJMOFHIZHDRPEW-RTBURBONSA-N 2 1 320.908 4.440 20 0 DIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC001462333886 1061111267 /nfs/dbraw/zinc/11/12/67/1061111267.db2.gz PEBMBEPCQNTLQE-QGZVFWFLSA-N 2 1 318.505 4.165 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+](C)CCC[NH+]2CCCC2)cc1 ZINC001473425298 1061155184 /nfs/dbraw/zinc/15/51/84/1061155184.db2.gz GNAUDRAONYYCDT-UHFFFAOYSA-N 2 1 302.506 4.292 20 0 DIADMP CCC(C)(C)c1ccc(C[N@@H+](C)CCC[NH+]2CCCC2)cc1 ZINC001473425298 1061155190 /nfs/dbraw/zinc/15/51/90/1061155190.db2.gz GNAUDRAONYYCDT-UHFFFAOYSA-N 2 1 302.506 4.292 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCC3CCCC3)C2)s1 ZINC001473456260 1061169633 /nfs/dbraw/zinc/16/96/33/1061169633.db2.gz YSRSBXKNTWANIL-SFHVURJKSA-N 2 1 320.546 4.391 20 0 DIADMP CCC(C)(C)[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001462430429 1061170158 /nfs/dbraw/zinc/17/01/58/1061170158.db2.gz TVPDLXZQWUAYCK-JENIJYKNSA-N 2 1 302.506 4.311 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001462451953 1061181020 /nfs/dbraw/zinc/18/10/20/1061181020.db2.gz JDYOMRMRHVECLO-ICSRJNTNSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001462451953 1061181028 /nfs/dbraw/zinc/18/10/28/1061181028.db2.gz JDYOMRMRHVECLO-ICSRJNTNSA-N 2 1 302.506 4.207 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC001473501641 1061197332 /nfs/dbraw/zinc/19/73/32/1061197332.db2.gz LTIODYWTKQIUJX-QFIPXVFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC001473501641 1061197341 /nfs/dbraw/zinc/19/73/41/1061197341.db2.gz LTIODYWTKQIUJX-QFIPXVFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC001473501641 1061197351 /nfs/dbraw/zinc/19/73/51/1061197351.db2.gz LTIODYWTKQIUJX-QFIPXVFZSA-N 2 1 322.496 4.320 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)c(C(C)C)c1 ZINC001473507776 1061200821 /nfs/dbraw/zinc/20/08/21/1061200821.db2.gz KHBDSOXQYYIUSE-NRFANRHFSA-N 2 1 314.517 4.461 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)c(C(C)C)c1 ZINC001473507776 1061200839 /nfs/dbraw/zinc/20/08/39/1061200839.db2.gz KHBDSOXQYYIUSE-NRFANRHFSA-N 2 1 314.517 4.461 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)c(C(C)C)c1 ZINC001473507776 1061200858 /nfs/dbraw/zinc/20/08/58/1061200858.db2.gz KHBDSOXQYYIUSE-NRFANRHFSA-N 2 1 314.517 4.461 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](Cc2ccc(F)c3ccccc23)CC1 ZINC001462485320 1061202656 /nfs/dbraw/zinc/20/26/56/1061202656.db2.gz OLPMRBJHAVHWCK-UHFFFAOYSA-N 2 1 314.448 4.285 20 0 DIADMP C[C@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001462521222 1061228793 /nfs/dbraw/zinc/22/87/93/1061228793.db2.gz YVFKQLKGRMKOMC-VQIMIIECSA-N 2 1 320.546 4.456 20 0 DIADMP C[C@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001462521222 1061228817 /nfs/dbraw/zinc/22/88/17/1061228817.db2.gz YVFKQLKGRMKOMC-VQIMIIECSA-N 2 1 320.546 4.456 20 0 DIADMP C[C@@H]1CC(C)(C)C[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001473554255 1061240334 /nfs/dbraw/zinc/24/03/34/1061240334.db2.gz AXCQRPZFHXQANF-QGZVFWFLSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462654819 1061320897 /nfs/dbraw/zinc/32/08/97/1061320897.db2.gz MUCSSAFRTZUWAR-KRZXBLKESA-N 2 1 310.485 4.299 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462654819 1061320913 /nfs/dbraw/zinc/32/09/13/1061320913.db2.gz MUCSSAFRTZUWAR-KRZXBLKESA-N 2 1 310.485 4.299 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccc(Cl)cc1F ZINC001473750648 1061392115 /nfs/dbraw/zinc/39/21/15/1061392115.db2.gz XIXZRFCYHRIHKS-UHFFFAOYSA-N 2 1 312.860 4.177 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC001473759938 1061395220 /nfs/dbraw/zinc/39/52/20/1061395220.db2.gz SJANJUWOHPZHDN-HUUCEWRRSA-N 2 1 315.848 4.007 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CCN(c3cc[nH+]cc3)C[C@H]2C)c(C)c1 ZINC001473809772 1061416608 /nfs/dbraw/zinc/41/66/08/1061416608.db2.gz QNVNPZMTZWBGPQ-MOPGFXCFSA-N 2 1 323.484 4.279 20 0 DIADMP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001473933544 1061479420 /nfs/dbraw/zinc/47/94/20/1061479420.db2.gz KJIVOBWJWCMOOV-NYUBLWNDSA-N 2 1 314.517 4.443 20 0 DIADMP CC(C)[C@H](C[NH2+]CC[N@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962669 1061504113 /nfs/dbraw/zinc/50/41/13/1061504113.db2.gz QGUAFYACBMYPLO-FQEVSTJZSA-N 2 1 302.506 4.280 20 0 DIADMP CC(C)[C@H](C[NH2+]CC[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962669 1061504133 /nfs/dbraw/zinc/50/41/33/1061504133.db2.gz QGUAFYACBMYPLO-FQEVSTJZSA-N 2 1 302.506 4.280 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]C2CCC(C3CCCCC3)CC2)C1 ZINC001473964837 1061506870 /nfs/dbraw/zinc/50/68/70/1061506870.db2.gz OFLFDEBWTNFKJU-QHGAOEGBSA-N 2 1 306.538 4.447 20 0 DIADMP C[C@@H]1C[N@H+](CCCC[NH2+]C2CC(C)(C)CC(C)(C)C2)C[C@H](C)O1 ZINC001474015927 1061557358 /nfs/dbraw/zinc/55/73/58/1061557358.db2.gz HNZPNMFSDXWHDX-CALCHBBNSA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001474175855 1061721631 /nfs/dbraw/zinc/72/16/31/1061721631.db2.gz PLOBFGXHENBGOD-RTBURBONSA-N 2 1 302.506 4.169 20 0 DIADMP CC[C@@H](C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC001474190085 1061738884 /nfs/dbraw/zinc/73/88/84/1061738884.db2.gz ZTFAKPWPAMWWFW-BWAGFHJFSA-N 2 1 322.496 4.115 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001474189818 1061740420 /nfs/dbraw/zinc/74/04/20/1061740420.db2.gz UFMXOLHZEHTCAK-BFPURBSMSA-N 2 1 320.480 4.025 20 0 DIADMP CC[N@@H+](CCC[NH2+]C/C=C/c1ccc(F)cc1)C1CCCCC1 ZINC001474200653 1061750461 /nfs/dbraw/zinc/75/04/61/1061750461.db2.gz HDKRDUWFORSSLW-SOFGYWHQSA-N 2 1 318.480 4.473 20 0 DIADMP CC(C)(C)c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC001474223278 1061782708 /nfs/dbraw/zinc/78/27/08/1061782708.db2.gz FIRAQSHCSMSWAP-INIZCTEOSA-N 2 1 320.546 4.257 20 0 DIADMP CCC(C)(C)CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001474232166 1061794794 /nfs/dbraw/zinc/79/47/94/1061794794.db2.gz TYWNUEJLUPOQNS-UHFFFAOYSA-N 2 1 302.506 4.109 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC001253094561 1061797698 /nfs/dbraw/zinc/79/76/98/1061797698.db2.gz FFYSAOGFGTVYCW-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@@H]32)cc1 ZINC001474320310 1061897681 /nfs/dbraw/zinc/89/76/81/1061897681.db2.gz CFMDCTZEHWNPPJ-BVSLBCMMSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]32)cc1 ZINC001474320310 1061897691 /nfs/dbraw/zinc/89/76/91/1061897691.db2.gz CFMDCTZEHWNPPJ-BVSLBCMMSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]32)cc1 ZINC001474320310 1061897704 /nfs/dbraw/zinc/89/77/04/1061897704.db2.gz CFMDCTZEHWNPPJ-BVSLBCMMSA-N 2 1 324.512 4.329 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC001474348413 1061957483 /nfs/dbraw/zinc/95/74/83/1061957483.db2.gz HPHQGJFIUZRAEV-HXUWFJFHSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(CC[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC001474348413 1061957500 /nfs/dbraw/zinc/95/75/00/1061957500.db2.gz HPHQGJFIUZRAEV-HXUWFJFHSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(CC[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1 ZINC001474348413 1061957519 /nfs/dbraw/zinc/95/75/19/1061957519.db2.gz HPHQGJFIUZRAEV-HXUWFJFHSA-N 2 1 314.517 4.016 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCCC2)C2CCC(F)(F)CC2)CC1 ZINC001254214149 1062050113 /nfs/dbraw/zinc/05/01/13/1062050113.db2.gz ASTMQJACOVTLKU-KOMQPUFPSA-N 2 1 314.464 4.469 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+]2CCC(c3cccc(Cl)c3)CC2)CC1 ZINC001254518955 1062156638 /nfs/dbraw/zinc/15/66/38/1062156638.db2.gz FQTYGZITUNRSJU-GOSISDBHSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254524977 1062158967 /nfs/dbraw/zinc/15/89/67/1062158967.db2.gz FKZCOALFPTYPIA-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CCC[N@H+](C)CC1 ZINC001254524977 1062159005 /nfs/dbraw/zinc/15/90/05/1062159005.db2.gz FKZCOALFPTYPIA-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CCC[N@@H+](C)CC1 ZINC001254524977 1062159024 /nfs/dbraw/zinc/15/90/24/1062159024.db2.gz FKZCOALFPTYPIA-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CCC[NH+](C)CC1 ZINC001254529140 1062159805 /nfs/dbraw/zinc/15/98/05/1062159805.db2.gz KILIHRSFDJFWJB-DOTOQJQBSA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@H]1CCC[N@H+](C)CC1 ZINC001254529140 1062159813 /nfs/dbraw/zinc/15/98/13/1062159813.db2.gz KILIHRSFDJFWJB-DOTOQJQBSA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@H]1CCC[N@@H+](C)CC1 ZINC001254529140 1062159825 /nfs/dbraw/zinc/15/98/25/1062159825.db2.gz KILIHRSFDJFWJB-DOTOQJQBSA-N 2 1 304.503 4.030 20 0 DIADMP CCSc1ccccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001459509514 1062173832 /nfs/dbraw/zinc/17/38/32/1062173832.db2.gz OOARXBLEDOHLKB-KRWDZBQOSA-N 2 1 318.530 4.106 20 0 DIADMP CCSc1ccccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001459509514 1062173837 /nfs/dbraw/zinc/17/38/37/1062173837.db2.gz OOARXBLEDOHLKB-KRWDZBQOSA-N 2 1 318.530 4.106 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@@H+]2CCCc2c[nH+]cn2C)o1 ZINC001459537146 1062194240 /nfs/dbraw/zinc/19/42/40/1062194240.db2.gz UXNJVPKBLZZIDE-GOSISDBHSA-N 2 1 315.461 4.125 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@H+]2CCCc2c[nH+]cn2C)o1 ZINC001459537146 1062194253 /nfs/dbraw/zinc/19/42/53/1062194253.db2.gz UXNJVPKBLZZIDE-GOSISDBHSA-N 2 1 315.461 4.125 20 0 DIADMP CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CCC[NH+](CC)CC)o1 ZINC001459567012 1062216689 /nfs/dbraw/zinc/21/66/89/1062216689.db2.gz AODWFLPFMQQHNJ-FUHWJXTLSA-N 2 1 306.494 4.347 20 0 DIADMP CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CCC[NH+](CC)CC)o1 ZINC001459567012 1062216705 /nfs/dbraw/zinc/21/67/05/1062216705.db2.gz AODWFLPFMQQHNJ-FUHWJXTLSA-N 2 1 306.494 4.347 20 0 DIADMP C[C@@H](C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583509 1062224822 /nfs/dbraw/zinc/22/48/22/1062224822.db2.gz VLNQBBNELMFCLK-HKUYNNGSSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@@H](C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583509 1062224839 /nfs/dbraw/zinc/22/48/39/1062224839.db2.gz VLNQBBNELMFCLK-HKUYNNGSSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@@H](C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583509 1062224849 /nfs/dbraw/zinc/22/48/49/1062224849.db2.gz VLNQBBNELMFCLK-HKUYNNGSSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@H](C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583513 1062226723 /nfs/dbraw/zinc/22/67/23/1062226723.db2.gz VLNQBBNELMFCLK-IEBWSBKVSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@H](C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583513 1062226741 /nfs/dbraw/zinc/22/67/41/1062226741.db2.gz VLNQBBNELMFCLK-IEBWSBKVSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@H](C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583513 1062226774 /nfs/dbraw/zinc/22/67/74/1062226774.db2.gz VLNQBBNELMFCLK-IEBWSBKVSA-N 2 1 302.506 4.123 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@@H](C[NH2+][C@@H]3C[C@@H]4CCC[C@H]34)C2)cc1 ZINC001474565023 1062271910 /nfs/dbraw/zinc/27/19/10/1062271910.db2.gz PHTJEFQBNCLJPU-XSDIEEQYSA-N 2 1 312.501 4.067 20 0 DIADMP CC(C)SCC[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC001459664507 1062285330 /nfs/dbraw/zinc/28/53/30/1062285330.db2.gz AEKAXTQUEJPPDB-KRWDZBQOSA-N 2 1 312.567 4.105 20 0 DIADMP C[C@H]([NH3+])c1cn([C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001255109311 1062319000 /nfs/dbraw/zinc/31/90/00/1062319000.db2.gz QMPLAOITDBNEKD-WMZOPIPTSA-N 2 1 319.452 4.108 20 0 DIADMP C[C@H]1CCCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255135359 1062325503 /nfs/dbraw/zinc/32/55/03/1062325503.db2.gz ALKNQHLLJLNFIK-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255135359 1062325530 /nfs/dbraw/zinc/32/55/30/1062325530.db2.gz ALKNQHLLJLNFIK-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255135359 1062325554 /nfs/dbraw/zinc/32/55/54/1062325554.db2.gz ALKNQHLLJLNFIK-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(F)CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255135923 1062326574 /nfs/dbraw/zinc/32/65/74/1062326574.db2.gz GDDLYANGLXOSQH-REPLKXPHSA-N 2 1 316.464 4.006 20 0 DIADMP C[N@@H+](Cc1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136684 1062327388 /nfs/dbraw/zinc/32/73/88/1062327388.db2.gz MYZQYGVIIQTORA-ZBYYUNFXSA-N 2 1 320.480 4.314 20 0 DIADMP C[NH+](Cc1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136684 1062327410 /nfs/dbraw/zinc/32/74/10/1062327410.db2.gz MYZQYGVIIQTORA-ZBYYUNFXSA-N 2 1 320.480 4.314 20 0 DIADMP C[NH+](Cc1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136684 1062327435 /nfs/dbraw/zinc/32/74/35/1062327435.db2.gz MYZQYGVIIQTORA-ZBYYUNFXSA-N 2 1 320.480 4.314 20 0 DIADMP C[C@H]1CCCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255135364 1062328074 /nfs/dbraw/zinc/32/80/74/1062328074.db2.gz ALKNQHLLJLNFIK-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255135364 1062328092 /nfs/dbraw/zinc/32/80/92/1062328092.db2.gz ALKNQHLLJLNFIK-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255135364 1062328114 /nfs/dbraw/zinc/32/81/14/1062328114.db2.gz ALKNQHLLJLNFIK-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP CCCC[N@@H+](CC)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255135752 1062328728 /nfs/dbraw/zinc/32/87/28/1062328728.db2.gz FJOYGHMGEYAFBA-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](CC)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255135752 1062328750 /nfs/dbraw/zinc/32/87/50/1062328750.db2.gz FJOYGHMGEYAFBA-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](CC)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135752 1062328774 /nfs/dbraw/zinc/32/87/74/1062328774.db2.gz FJOYGHMGEYAFBA-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135356 1062330182 /nfs/dbraw/zinc/33/01/82/1062330182.db2.gz JHVVJXZCNYOSPH-BDUQCRIQSA-N 2 1 312.501 4.206 20 0 DIADMP CCC[NH+](CCC)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255137729 1062331978 /nfs/dbraw/zinc/33/19/78/1062331978.db2.gz WQUPLPXECLAFGB-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H]1C ZINC001255143027 1062333533 /nfs/dbraw/zinc/33/35/33/1062333533.db2.gz IVUFSZGVWDFFQL-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H]1C ZINC001255143027 1062333554 /nfs/dbraw/zinc/33/35/54/1062333554.db2.gz IVUFSZGVWDFFQL-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H]1C ZINC001255143027 1062333576 /nfs/dbraw/zinc/33/35/76/1062333576.db2.gz IVUFSZGVWDFFQL-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@@H]1C ZINC001255143027 1062333599 /nfs/dbraw/zinc/33/35/99/1062333599.db2.gz IVUFSZGVWDFFQL-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CC4(C2)CCCCC4)C3)cc1 ZINC001255146119 1062333903 /nfs/dbraw/zinc/33/39/03/1062333903.db2.gz CPDJYXLTKKFKGK-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC4(CCC4)CC2)C3)cc1 ZINC001255142017 1062336911 /nfs/dbraw/zinc/33/69/11/1062336911.db2.gz PGNXBTUDCTUUIY-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142605 1062337568 /nfs/dbraw/zinc/33/75/68/1062337568.db2.gz DVNNKXSKKWWTRD-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142605 1062337591 /nfs/dbraw/zinc/33/75/91/1062337591.db2.gz DVNNKXSKKWWTRD-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142605 1062337612 /nfs/dbraw/zinc/33/76/12/1062337612.db2.gz DVNNKXSKKWWTRD-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@@H](C)C1 ZINC001255142605 1062337631 /nfs/dbraw/zinc/33/76/31/1062337631.db2.gz DVNNKXSKKWWTRD-RKNHFHLDSA-N 2 1 312.501 4.302 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146332 1062338308 /nfs/dbraw/zinc/33/83/08/1062338308.db2.gz FRJWUJQDIUQWSO-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146332 1062338329 /nfs/dbraw/zinc/33/83/29/1062338329.db2.gz FRJWUJQDIUQWSO-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146332 1062338353 /nfs/dbraw/zinc/33/83/53/1062338353.db2.gz FRJWUJQDIUQWSO-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146332 1062338377 /nfs/dbraw/zinc/33/83/77/1062338377.db2.gz FRJWUJQDIUQWSO-MXEMCNAFSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H](C)c1ccc([C@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC001459730092 1062340830 /nfs/dbraw/zinc/34/08/30/1062340830.db2.gz KDAJQJHPDCGVAP-OXJNMPFZSA-N 2 1 313.489 4.463 20 0 DIADMP C[N@@H+](C[C@@H]1CC1(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146259 1062341777 /nfs/dbraw/zinc/34/17/77/1062341777.db2.gz FEKVYBGWKGRFQI-HAGHYFMRSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146259 1062341797 /nfs/dbraw/zinc/34/17/97/1062341797.db2.gz FEKVYBGWKGRFQI-HAGHYFMRSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146259 1062341814 /nfs/dbraw/zinc/34/18/14/1062341814.db2.gz FEKVYBGWKGRFQI-HAGHYFMRSA-N 2 1 312.501 4.160 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC001459751357 1062363630 /nfs/dbraw/zinc/36/36/30/1062363630.db2.gz ZXAONUGSAUCGRY-SFTDATJTSA-N 2 1 308.469 4.044 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001474644811 1062370763 /nfs/dbraw/zinc/37/07/63/1062370763.db2.gz CAHVDHJYFCKHGK-LEWJYISDSA-N 2 1 314.517 4.109 20 0 DIADMP CC1(C)CCC([NH+]2C[C@H]3C[NH+](Cc4cccs4)C[C@@H]3C2)CC1 ZINC001255302758 1062384418 /nfs/dbraw/zinc/38/44/18/1062384418.db2.gz JLUGYPPEFROANR-HZPDHXFCSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC([N@@H+](Cc2cccnc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001255301362 1062385381 /nfs/dbraw/zinc/38/53/81/1062385381.db2.gz PLEYIXUZDTVUHZ-IYARVYRRSA-N 2 1 315.505 4.122 20 0 DIADMP CC1(C)CCC([NH+]2C[C@@H]3C[NH+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001255302757 1062385862 /nfs/dbraw/zinc/38/58/62/1062385862.db2.gz JLUGYPPEFROANR-HOTGVXAUSA-N 2 1 318.530 4.081 20 0 DIADMP CCCC[C@@H](C)[NH2+][C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1[NH3+] ZINC001255315108 1062392169 /nfs/dbraw/zinc/39/21/69/1062392169.db2.gz CPMCKGQUBDTMMH-DGXAPEILSA-N 2 1 320.480 4.142 20 0 DIADMP CCCC[C@@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001255329799 1062406866 /nfs/dbraw/zinc/40/68/66/1062406866.db2.gz POFLXFZMGMCLOC-GOSISDBHSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(F)cc1)C1CCN(C)CC1 ZINC001255334447 1062409580 /nfs/dbraw/zinc/40/95/80/1062409580.db2.gz RDFOHIIJVMKUIA-INIZCTEOSA-N 2 1 306.469 4.301 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCC(C)(C)C[C@@H]2c2ccccc2)CC1 ZINC001474680843 1062414401 /nfs/dbraw/zinc/41/44/01/1062414401.db2.gz WSCOFFKIPMJUDJ-RTBURBONSA-N 2 1 300.490 4.033 20 0 DIADMP CC1(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCCC1 ZINC001255377055 1062421001 /nfs/dbraw/zinc/42/10/01/1062421001.db2.gz DVERIFQHJFFJRW-LJQANCHMSA-N 2 1 300.490 4.211 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH2+]CCC3CCCC3)CC2)cc1 ZINC001255383926 1062422908 /nfs/dbraw/zinc/42/29/08/1062422908.db2.gz PZVHPUIBFMDGSF-FQEVSTJZSA-N 2 1 300.490 4.211 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383028 1062422944 /nfs/dbraw/zinc/42/29/44/1062422944.db2.gz YTQFZUOYELWNFD-YZGWKJHDSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1C ZINC001255380084 1062423995 /nfs/dbraw/zinc/42/39/95/1062423995.db2.gz HJBBFXLXEJGBJG-QFIPXVFZSA-N 2 1 322.496 4.448 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]([NH2+]CC3(CC4CC4)CC3)CC2)cc1 ZINC001255392222 1062427348 /nfs/dbraw/zinc/42/73/48/1062427348.db2.gz HFYNOIKMXKJAHW-HXUWFJFHSA-N 2 1 312.501 4.211 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255393763 1062427521 /nfs/dbraw/zinc/42/75/21/1062427521.db2.gz QGKHYGQNVDNMCX-IHPCNDPISA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC001255392783 1062428585 /nfs/dbraw/zinc/42/85/85/1062428585.db2.gz IFOOQAYJNADVCQ-FDFHNCONSA-N 2 1 320.480 4.187 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCCC(C)(F)F)CC1)CC1CC1 ZINC001459821129 1062428497 /nfs/dbraw/zinc/42/84/97/1062428497.db2.gz UHIMGRJCZNXBQC-UHFFFAOYSA-N 2 1 316.480 4.256 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)n1 ZINC001255393369 1062428622 /nfs/dbraw/zinc/42/86/22/1062428622.db2.gz NLOFKQYTVWXDEC-UYAOXDASSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)n1 ZINC001255393369 1062428629 /nfs/dbraw/zinc/42/86/29/1062428629.db2.gz NLOFKQYTVWXDEC-UYAOXDASSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)nc1 ZINC001255393239 1062428669 /nfs/dbraw/zinc/42/86/69/1062428669.db2.gz MSUHUVPHQQRIMP-ICSRJNTNSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)nc1 ZINC001255393239 1062428675 /nfs/dbraw/zinc/42/86/75/1062428675.db2.gz MSUHUVPHQQRIMP-ICSRJNTNSA-N 2 1 323.484 4.095 20 0 DIADMP C[C@]1(F)CCCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398955 1062431589 /nfs/dbraw/zinc/43/15/89/1062431589.db2.gz NJNGCEWDNQDVFJ-UXHICEINSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398955 1062431595 /nfs/dbraw/zinc/43/15/95/1062431595.db2.gz NJNGCEWDNQDVFJ-UXHICEINSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398955 1062431601 /nfs/dbraw/zinc/43/16/01/1062431601.db2.gz NJNGCEWDNQDVFJ-UXHICEINSA-N 2 1 318.480 4.255 20 0 DIADMP Cc1cccc(C[N@H+](C)[C@H]2CCC[NH+](Cc3ccccc3)CC2)c1 ZINC001255397821 1062431692 /nfs/dbraw/zinc/43/16/92/1062431692.db2.gz HMRVSQCWIQYNCJ-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1cccc(C[NH+](C)[C@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255397821 1062431701 /nfs/dbraw/zinc/43/17/01/1062431701.db2.gz HMRVSQCWIQYNCJ-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1cccc(C[NH+](C)[C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255397821 1062431709 /nfs/dbraw/zinc/43/17/09/1062431709.db2.gz HMRVSQCWIQYNCJ-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP C[C@@]1(F)CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255399799 1062434104 /nfs/dbraw/zinc/43/41/04/1062434104.db2.gz ZWCBRJUBSIFQTC-VQTJNVASSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255399799 1062434110 /nfs/dbraw/zinc/43/41/10/1062434110.db2.gz ZWCBRJUBSIFQTC-VQTJNVASSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255399799 1062434115 /nfs/dbraw/zinc/43/41/15/1062434115.db2.gz ZWCBRJUBSIFQTC-VQTJNVASSA-N 2 1 318.480 4.255 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255408461 1062438395 /nfs/dbraw/zinc/43/83/95/1062438395.db2.gz MSLRNTYDEWWXPC-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255408461 1062438400 /nfs/dbraw/zinc/43/84/00/1062438400.db2.gz MSLRNTYDEWWXPC-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255408461 1062438409 /nfs/dbraw/zinc/43/84/09/1062438409.db2.gz MSLRNTYDEWWXPC-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407263 1062440563 /nfs/dbraw/zinc/44/05/63/1062440563.db2.gz YAVQOTCUWUDTRY-WOJBJXKFSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255407263 1062440574 /nfs/dbraw/zinc/44/05/74/1062440574.db2.gz YAVQOTCUWUDTRY-WOJBJXKFSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255407263 1062440586 /nfs/dbraw/zinc/44/05/86/1062440586.db2.gz YAVQOTCUWUDTRY-WOJBJXKFSA-N 2 1 300.490 4.306 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCC4(CCCC4)C3)CC2)cc1 ZINC001255406983 1062440889 /nfs/dbraw/zinc/44/08/89/1062440889.db2.gz VHEOGLIWOKDFAS-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCC4(CCCC4)C3)CC2)cc1 ZINC001255406983 1062440895 /nfs/dbraw/zinc/44/08/95/1062440895.db2.gz VHEOGLIWOKDFAS-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCC4(CCCC4)C3)CC2)cc1 ZINC001255406983 1062440903 /nfs/dbraw/zinc/44/09/03/1062440903.db2.gz VHEOGLIWOKDFAS-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP C[C@H](c1ccc2c(c1)CCC2)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001459871917 1062460800 /nfs/dbraw/zinc/46/08/00/1062460800.db2.gz CILHUUMPNIWOQK-QGZVFWFLSA-N 2 1 322.496 4.430 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CC[C@@H]2CCc3ccccc32)cc1 ZINC001459872887 1062463460 /nfs/dbraw/zinc/46/34/60/1062463460.db2.gz IJONDQGKOTYROC-NRFANRHFSA-N 2 1 322.496 4.300 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001459879701 1062469983 /nfs/dbraw/zinc/46/99/83/1062469983.db2.gz UNYJJAYZYRIJJT-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CCC[NH+](CC)CC)oc21 ZINC001459902832 1062485636 /nfs/dbraw/zinc/48/56/36/1062485636.db2.gz UNNZKZDNBXWHSV-OAHLLOKOSA-N 2 1 318.461 4.214 20 0 DIADMP C[C@@H](CC(F)(F)F)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255644910 1062494683 /nfs/dbraw/zinc/49/46/83/1062494683.db2.gz WMIGZOMSCZIGBH-QEJZJMRPSA-N 2 1 306.416 4.089 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001459925703 1062502322 /nfs/dbraw/zinc/50/23/22/1062502322.db2.gz SPIIIRJSUOTVOW-ZIAGYGMSSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925703 1062502342 /nfs/dbraw/zinc/50/23/42/1062502342.db2.gz SPIIIRJSUOTVOW-ZIAGYGMSSA-N 2 1 324.871 4.222 20 0 DIADMP CCCCc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001255665946 1062504615 /nfs/dbraw/zinc/50/46/15/1062504615.db2.gz NKQRXDBUCMCYQV-IHWFROFDSA-N 2 1 300.490 4.134 20 0 DIADMP CC(C)C[N@H+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255673840 1062510558 /nfs/dbraw/zinc/51/05/58/1062510558.db2.gz GERWJPZQQQTFIE-YOFSQIOKSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255673840 1062510576 /nfs/dbraw/zinc/51/05/76/1062510576.db2.gz GERWJPZQQQTFIE-YOFSQIOKSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255673840 1062510595 /nfs/dbraw/zinc/51/05/95/1062510595.db2.gz GERWJPZQQQTFIE-YOFSQIOKSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255673840 1062510612 /nfs/dbraw/zinc/51/06/12/1062510612.db2.gz GERWJPZQQQTFIE-YOFSQIOKSA-N 2 1 300.490 4.160 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255701215 1062525248 /nfs/dbraw/zinc/52/52/48/1062525248.db2.gz SJKXSHMKAMPQSI-XOUADPBQSA-N 2 1 318.427 4.232 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255701291 1062526352 /nfs/dbraw/zinc/52/63/52/1062526352.db2.gz UHUUZATWMHFEPB-AJNGGQMLSA-N 2 1 306.416 4.088 20 0 DIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC001255703027 1062528567 /nfs/dbraw/zinc/52/85/67/1062528567.db2.gz ZKNHMPVLBADYBL-YHUYYLMFSA-N 2 1 320.443 4.335 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255711966 1062534990 /nfs/dbraw/zinc/53/49/90/1062534990.db2.gz GJGCMGZYVQYMOM-CVEARBPZSA-N 2 1 320.443 4.160 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC001459981322 1062543651 /nfs/dbraw/zinc/54/36/51/1062543651.db2.gz YDVZEDKAMIIOQB-NJDAHSKKSA-N 2 1 314.517 4.377 20 0 DIADMP CC[C@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@H]1C ZINC001459985642 1062548374 /nfs/dbraw/zinc/54/83/74/1062548374.db2.gz NSAYRDHHEZNYON-PXNSSMCTSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@@H](CSc1ccc(F)cc1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001255737561 1062560621 /nfs/dbraw/zinc/56/06/21/1062560621.db2.gz IULVZWQRDRNHMK-JKSUJKDBSA-N 2 1 324.509 4.147 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)CCC[NH+]1CCCC1 ZINC001460016014 1062571799 /nfs/dbraw/zinc/57/17/99/1062571799.db2.gz JGRKLVXCSDOWAY-UHFFFAOYSA-N 2 1 310.485 4.320 20 0 DIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1ccc(-c2ccsc2)cc1 ZINC001460015917 1062572454 /nfs/dbraw/zinc/57/24/54/1062572454.db2.gz IWSQLRIBSYGBFB-UHFFFAOYSA-N 2 1 314.498 4.333 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(-c2ccsc2)cc1 ZINC001460015917 1062572471 /nfs/dbraw/zinc/57/24/71/1062572471.db2.gz IWSQLRIBSYGBFB-UHFFFAOYSA-N 2 1 314.498 4.333 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001255855345 1062630682 /nfs/dbraw/zinc/63/06/82/1062630682.db2.gz WOHBLGUZWDRVAI-NEWSRXKRSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255855345 1062630692 /nfs/dbraw/zinc/63/06/92/1062630692.db2.gz WOHBLGUZWDRVAI-NEWSRXKRSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001255855345 1062630705 /nfs/dbraw/zinc/63/07/05/1062630705.db2.gz WOHBLGUZWDRVAI-NEWSRXKRSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255862196 1062640949 /nfs/dbraw/zinc/64/09/49/1062640949.db2.gz MKPRIUNGUNYIJU-SNRMKQJTSA-N 2 1 320.496 4.375 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001255878195 1062650802 /nfs/dbraw/zinc/65/08/02/1062650802.db2.gz MTAKZYMMEIQGEI-FFZOFVMBSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255878195 1062650826 /nfs/dbraw/zinc/65/08/26/1062650826.db2.gz MTAKZYMMEIQGEI-FFZOFVMBSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001255878195 1062650837 /nfs/dbraw/zinc/65/08/37/1062650837.db2.gz MTAKZYMMEIQGEI-FFZOFVMBSA-N 2 1 318.480 4.096 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+](C2CCCCCC2)CC1 ZINC001255891574 1062659273 /nfs/dbraw/zinc/65/92/73/1062659273.db2.gz ZOSJSXPEBGPNCM-UHFFFAOYSA-N 2 1 300.490 4.306 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CCCCCC1 ZINC001255892299 1062659538 /nfs/dbraw/zinc/65/95/38/1062659538.db2.gz GKEKVXAWEZUELG-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC001255892299 1062659546 /nfs/dbraw/zinc/65/95/46/1062659546.db2.gz GKEKVXAWEZUELG-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC001255892299 1062659552 /nfs/dbraw/zinc/65/95/52/1062659552.db2.gz GKEKVXAWEZUELG-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C4CCCCCC4)C[C@@H]3C2)cc1 ZINC001255893292 1062660375 /nfs/dbraw/zinc/66/03/75/1062660375.db2.gz HQZYRLMLXCUFDH-PMACEKPBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@@H+](C4CCCCCC4)C[C@@H]3C2)cc1 ZINC001255893292 1062660385 /nfs/dbraw/zinc/66/03/85/1062660385.db2.gz HQZYRLMLXCUFDH-PMACEKPBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@H+](C4CCCCCC4)C[C@@H]3C2)cc1 ZINC001255893292 1062660393 /nfs/dbraw/zinc/66/03/93/1062660393.db2.gz HQZYRLMLXCUFDH-PMACEKPBSA-N 2 1 312.501 4.163 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@H]1CCCc2c(F)cc(F)cc21 ZINC001255954909 1062668587 /nfs/dbraw/zinc/66/85/87/1062668587.db2.gz KLSPWAXORDGGSL-UGSOOPFHSA-N 2 1 310.432 4.052 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(-c2nccs2)cc1 ZINC001255947995 1062669828 /nfs/dbraw/zinc/66/98/28/1062669828.db2.gz CATYDBMXBFULJF-HNNXBMFYSA-N 2 1 317.502 4.020 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](C)c1cc(F)cc(Cl)c1 ZINC001255955203 1062670794 /nfs/dbraw/zinc/67/07/94/1062670794.db2.gz QDHXSVMXIAGFKF-QWHCGFSZSA-N 2 1 300.849 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001255967840 1062672504 /nfs/dbraw/zinc/67/25/04/1062672504.db2.gz TZMHKIUKGWELTB-RDJZCZTQSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@H](Sc2ccc(F)cc2)C1 ZINC001255971745 1062673176 /nfs/dbraw/zinc/67/31/76/1062673176.db2.gz KMFHCMNTRWVFJV-YJBOKZPZSA-N 2 1 324.509 4.113 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CC[C@H](Sc2ccc(F)cc2)C1 ZINC001255971745 1062673189 /nfs/dbraw/zinc/67/31/89/1062673189.db2.gz KMFHCMNTRWVFJV-YJBOKZPZSA-N 2 1 324.509 4.113 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001255963700 1062674037 /nfs/dbraw/zinc/67/40/37/1062674037.db2.gz JQOZVOHWMCPUDH-HZPDHXFCSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001255963700 1062674045 /nfs/dbraw/zinc/67/40/45/1062674045.db2.gz JQOZVOHWMCPUDH-HZPDHXFCSA-N 2 1 308.897 4.250 20 0 DIADMP c1ccc(C2(C[NH2+]C3CC[NH+](C4CC4)CC3)CCCCC2)cc1 ZINC001256066994 1062691798 /nfs/dbraw/zinc/69/17/98/1062691798.db2.gz CHMWMZAFZHOTKY-UHFFFAOYSA-N 2 1 312.501 4.105 20 0 DIADMP Fc1ccccc1[C@H](CC1CCC1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001256072002 1062694644 /nfs/dbraw/zinc/69/46/44/1062694644.db2.gz UROCUMCHYPNCBA-FQEVSTJZSA-N 2 1 316.464 4.273 20 0 DIADMP [NH3+]CC[N@H+](Cc1ccccc1)[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001256107080 1062706879 /nfs/dbraw/zinc/70/68/79/1062706879.db2.gz SVOMFBQICSCISX-LEWJYISDSA-N 2 1 308.469 4.174 20 0 DIADMP [NH3+]CC[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001256107080 1062706899 /nfs/dbraw/zinc/70/68/99/1062706899.db2.gz SVOMFBQICSCISX-LEWJYISDSA-N 2 1 308.469 4.174 20 0 DIADMP C[NH+]1CCC2(CC[N@H+]([C@H]3CCC[C@H](c4ccccc4)C3)C2)CC1 ZINC001256120606 1062721551 /nfs/dbraw/zinc/72/15/51/1062721551.db2.gz HKZVCQCZOQWHGX-PMACEKPBSA-N 2 1 312.501 4.131 20 0 DIADMP Cc1ccccc1C1([NH2+]C2CC[NH+](C)CC2)CCC(F)(F)CC1 ZINC001256201942 1062747375 /nfs/dbraw/zinc/74/73/75/1062747375.db2.gz UIQNWSXEUCGPRO-UHFFFAOYSA-N 2 1 322.443 4.083 20 0 DIADMP C[NH+]1CCC([NH+]2CCC(c3csc4ccccc34)CC2)CC1 ZINC001256208765 1062750609 /nfs/dbraw/zinc/75/06/09/1062750609.db2.gz HTBOQZBOSSLQPM-UHFFFAOYSA-N 2 1 314.498 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256519705 1062841347 /nfs/dbraw/zinc/84/13/47/1062841347.db2.gz CJONQGWOGAIFFP-IEBWSBKVSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256519705 1062841379 /nfs/dbraw/zinc/84/13/79/1062841379.db2.gz CJONQGWOGAIFFP-IEBWSBKVSA-N 2 1 300.490 4.352 20 0 DIADMP C=Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001256527178 1062846100 /nfs/dbraw/zinc/84/61/00/1062846100.db2.gz QQOREEMCGAWGGK-PGRDOPGGSA-N 2 1 320.480 4.472 20 0 DIADMP C=Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001256527178 1062846126 /nfs/dbraw/zinc/84/61/26/1062846126.db2.gz QQOREEMCGAWGGK-PGRDOPGGSA-N 2 1 320.480 4.472 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(F)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256524411 1062849023 /nfs/dbraw/zinc/84/90/23/1062849023.db2.gz UILHUWPADYFNGI-IEBWSBKVSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(F)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256524411 1062849048 /nfs/dbraw/zinc/84/90/48/1062849048.db2.gz UILHUWPADYFNGI-IEBWSBKVSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@@H+]1Cc1ccccc1 ZINC001256528333 1062851017 /nfs/dbraw/zinc/85/10/17/1062851017.db2.gz ZUMIMXSORHXOEW-VLQCVTHLSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC001256528333 1062851044 /nfs/dbraw/zinc/85/10/44/1062851044.db2.gz ZUMIMXSORHXOEW-VLQCVTHLSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256529446 1062856236 /nfs/dbraw/zinc/85/62/36/1062856236.db2.gz BZKCHQGGRLDMAV-AGOPTVSRSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256529446 1062856261 /nfs/dbraw/zinc/85/62/61/1062856261.db2.gz BZKCHQGGRLDMAV-AGOPTVSRSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC3(CCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256542953 1062860187 /nfs/dbraw/zinc/86/01/87/1062860187.db2.gz RHMHJROQOYYMQB-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP Cc1cccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538668 1062861213 /nfs/dbraw/zinc/86/12/13/1062861213.db2.gz UZQKEQNVACIMAO-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538668 1062861243 /nfs/dbraw/zinc/86/12/43/1062861243.db2.gz UZQKEQNVACIMAO-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538668 1062861265 /nfs/dbraw/zinc/86/12/65/1062861265.db2.gz UZQKEQNVACIMAO-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538668 1062861289 /nfs/dbraw/zinc/86/12/89/1062861289.db2.gz UZQKEQNVACIMAO-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP CCC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256541495 1062863195 /nfs/dbraw/zinc/86/31/95/1062863195.db2.gz MBXOEXORHYDGEQ-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP CCC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256541495 1062863204 /nfs/dbraw/zinc/86/32/04/1062863204.db2.gz MBXOEXORHYDGEQ-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256541170 1062864451 /nfs/dbraw/zinc/86/44/51/1062864451.db2.gz LEQYZYFHBWFZHQ-NUJGCVRESA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256541170 1062864464 /nfs/dbraw/zinc/86/44/64/1062864464.db2.gz LEQYZYFHBWFZHQ-NUJGCVRESA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC(F)(F)[C@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541170 1062864479 /nfs/dbraw/zinc/86/44/79/1062864479.db2.gz LEQYZYFHBWFZHQ-NUJGCVRESA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC(F)(F)[C@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541170 1062864491 /nfs/dbraw/zinc/86/44/91/1062864491.db2.gz LEQYZYFHBWFZHQ-NUJGCVRESA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@@H]1C ZINC001256549502 1062866266 /nfs/dbraw/zinc/86/62/66/1062866266.db2.gz HTCVIANLOTYUBY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@@H]1C ZINC001256549502 1062866287 /nfs/dbraw/zinc/86/62/87/1062866287.db2.gz HTCVIANLOTYUBY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[C@@H]1C ZINC001256549502 1062866301 /nfs/dbraw/zinc/86/63/01/1062866301.db2.gz HTCVIANLOTYUBY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)[C@@H]1C ZINC001256549502 1062866315 /nfs/dbraw/zinc/86/63/15/1062866315.db2.gz HTCVIANLOTYUBY-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256543946 1062866746 /nfs/dbraw/zinc/86/67/46/1062866746.db2.gz WAPBXEWJLSDUHC-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256543946 1062866773 /nfs/dbraw/zinc/86/67/73/1062866773.db2.gz WAPBXEWJLSDUHC-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543946 1062866796 /nfs/dbraw/zinc/86/67/96/1062866796.db2.gz WAPBXEWJLSDUHC-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](C)CC2)CC[NH+]1Cc1ccccc1 ZINC001256543946 1062866829 /nfs/dbraw/zinc/86/68/29/1062866829.db2.gz WAPBXEWJLSDUHC-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256553836 1062872773 /nfs/dbraw/zinc/87/27/73/1062872773.db2.gz LALJGDQKNHFJPR-UYAOXDASSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256553836 1062872786 /nfs/dbraw/zinc/87/27/86/1062872786.db2.gz LALJGDQKNHFJPR-UYAOXDASSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256552864 1062874889 /nfs/dbraw/zinc/87/48/89/1062874889.db2.gz FEZMYFLRWWIKCE-NXHRZFHOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256552864 1062874894 /nfs/dbraw/zinc/87/48/94/1062874894.db2.gz FEZMYFLRWWIKCE-NXHRZFHOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552864 1062874923 /nfs/dbraw/zinc/87/49/23/1062874923.db2.gz FEZMYFLRWWIKCE-NXHRZFHOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552864 1062874940 /nfs/dbraw/zinc/87/49/40/1062874940.db2.gz FEZMYFLRWWIKCE-NXHRZFHOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256552573 1062875698 /nfs/dbraw/zinc/87/56/98/1062875698.db2.gz COVOKMUQVSQGFB-MAUKXSAKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256552573 1062875717 /nfs/dbraw/zinc/87/57/17/1062875717.db2.gz COVOKMUQVSQGFB-MAUKXSAKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256552857 1062877132 /nfs/dbraw/zinc/87/71/32/1062877132.db2.gz FEZMYFLRWWIKCE-BPQIPLTHSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256552857 1062877149 /nfs/dbraw/zinc/87/71/49/1062877149.db2.gz FEZMYFLRWWIKCE-BPQIPLTHSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552857 1062877162 /nfs/dbraw/zinc/87/71/62/1062877162.db2.gz FEZMYFLRWWIKCE-BPQIPLTHSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552857 1062877174 /nfs/dbraw/zinc/87/71/74/1062877174.db2.gz FEZMYFLRWWIKCE-BPQIPLTHSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556312 1062881638 /nfs/dbraw/zinc/88/16/38/1062881638.db2.gz YSTUBSQZZKETHA-AJYBTWMASA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556312 1062881659 /nfs/dbraw/zinc/88/16/59/1062881659.db2.gz YSTUBSQZZKETHA-AJYBTWMASA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556312 1062881679 /nfs/dbraw/zinc/88/16/79/1062881679.db2.gz YSTUBSQZZKETHA-AJYBTWMASA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556312 1062881703 /nfs/dbraw/zinc/88/17/03/1062881703.db2.gz YSTUBSQZZKETHA-AJYBTWMASA-N 2 1 300.490 4.017 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CC3CCC(CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256560896 1062885473 /nfs/dbraw/zinc/88/54/73/1062885473.db2.gz UJVMXQPXZWZNHH-VWEINGBSSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556318 1062886355 /nfs/dbraw/zinc/88/63/55/1062886355.db2.gz YSTUBSQZZKETHA-RMJJICAUSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556318 1062886360 /nfs/dbraw/zinc/88/63/60/1062886360.db2.gz YSTUBSQZZKETHA-RMJJICAUSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556318 1062886361 /nfs/dbraw/zinc/88/63/61/1062886361.db2.gz YSTUBSQZZKETHA-RMJJICAUSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256556318 1062886373 /nfs/dbraw/zinc/88/63/73/1062886373.db2.gz YSTUBSQZZKETHA-RMJJICAUSA-N 2 1 300.490 4.017 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H](c2ccccc2F)C2CC2)CC1 ZINC001256563816 1062889068 /nfs/dbraw/zinc/88/90/68/1062889068.db2.gz HBGKIEFPGCIJOJ-GOSISDBHSA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CCCC[C@H]2c2ccccc2)CC1 ZINC001256569017 1062894567 /nfs/dbraw/zinc/89/45/67/1062894567.db2.gz NVWKKVCGXANANQ-IBGZPJMESA-N 2 1 300.490 4.477 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC001256575222 1062901579 /nfs/dbraw/zinc/90/15/79/1062901579.db2.gz IZRKZGJMNSRUNX-INIZCTEOSA-N 2 1 320.908 4.392 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CCC[C@H]4CCCC[C@H]43)CC2)cc1 ZINC001256611712 1062920022 /nfs/dbraw/zinc/92/00/22/1062920022.db2.gz ULYGJOXMERUVQB-TZIWHRDSSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CCC[C@H]4CCCC[C@H]43)CC2)cc1 ZINC001256611712 1062920053 /nfs/dbraw/zinc/92/00/53/1062920053.db2.gz ULYGJOXMERUVQB-TZIWHRDSSA-N 2 1 312.501 4.306 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](CCOC2CCCCCC2)CC1 ZINC001460578633 1062920909 /nfs/dbraw/zinc/92/09/09/1062920909.db2.gz NCPVRWSLCLIBEI-UHFFFAOYSA-N 2 1 322.537 4.066 20 0 DIADMP Cc1ccc([C@@H]2CCCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC001256629955 1062921622 /nfs/dbraw/zinc/92/16/22/1062921622.db2.gz XNBCIQCDSVPYMW-JKWVGCSGSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001256629955 1062921646 /nfs/dbraw/zinc/92/16/46/1062921646.db2.gz XNBCIQCDSVPYMW-JKWVGCSGSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001256629955 1062921672 /nfs/dbraw/zinc/92/16/72/1062921672.db2.gz XNBCIQCDSVPYMW-JKWVGCSGSA-N 2 1 312.501 4.456 20 0 DIADMP c1ccc([C@@H]2CSCCC[N@@H+]2CCC[NH+]2CCCCC2)cc1 ZINC001460710384 1063003178 /nfs/dbraw/zinc/00/31/78/1063003178.db2.gz OWDLBMWTTUFFOC-IBGZPJMESA-N 2 1 318.530 4.043 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1C1CCN(c2cc[nH+]cc2)CC1 ZINC001256856363 1063020023 /nfs/dbraw/zinc/02/00/23/1063020023.db2.gz GNDJANFGNGXJRV-OAQYLSRUSA-N 2 1 321.468 4.196 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1C1CCN(c2cc[nH+]cc2)CC1 ZINC001256856362 1063020520 /nfs/dbraw/zinc/02/05/20/1063020520.db2.gz GNDJANFGNGXJRV-NRFANRHFSA-N 2 1 321.468 4.196 20 0 DIADMP c1cc(N2CCC([N@@H+]3CCC[C@H]3C3CCCCC3)CC2)cc[nH+]1 ZINC001256862567 1063020564 /nfs/dbraw/zinc/02/05/64/1063020564.db2.gz OKRQVOOORJYYHM-FQEVSTJZSA-N 2 1 313.489 4.095 20 0 DIADMP CC(C)C[C@H](C)C[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460749756 1063037056 /nfs/dbraw/zinc/03/70/56/1063037056.db2.gz RWBOSAQVRIVHBP-SESVDKBCSA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)C[C@H](C)C[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460749756 1063037069 /nfs/dbraw/zinc/03/70/69/1063037069.db2.gz RWBOSAQVRIVHBP-SESVDKBCSA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)C[C@H](C)C[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460749756 1063037090 /nfs/dbraw/zinc/03/70/90/1063037090.db2.gz RWBOSAQVRIVHBP-SESVDKBCSA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)(Cc1ccccc1F)[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256906256 1063039541 /nfs/dbraw/zinc/03/95/41/1063039541.db2.gz YXZKVZJFWDBEMN-QGZVFWFLSA-N 2 1 318.480 4.143 20 0 DIADMP CC(C)(Cc1ccccc1F)[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256906256 1063039564 /nfs/dbraw/zinc/03/95/64/1063039564.db2.gz YXZKVZJFWDBEMN-QGZVFWFLSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256905839 1063041388 /nfs/dbraw/zinc/04/13/88/1063041388.db2.gz UQASDKSLZPDIKX-YJBOKZPZSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256905839 1063041414 /nfs/dbraw/zinc/04/14/14/1063041414.db2.gz UQASDKSLZPDIKX-YJBOKZPZSA-N 2 1 320.908 4.268 20 0 DIADMP c1ccc(CC2(C[NH2+][C@@H]3CCC[N@@H+](C4CCCC4)C3)CC2)cc1 ZINC001256906692 1063042862 /nfs/dbraw/zinc/04/28/62/1063042862.db2.gz UFIUFNIIKDYSEQ-LJQANCHMSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc(CC2(C[NH2+][C@@H]3CCC[N@H+](C4CCCC4)C3)CC2)cc1 ZINC001256906692 1063042875 /nfs/dbraw/zinc/04/28/75/1063042875.db2.gz UFIUFNIIKDYSEQ-LJQANCHMSA-N 2 1 312.501 4.006 20 0 DIADMP CCC1([NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904520 1063044452 /nfs/dbraw/zinc/04/44/52/1063044452.db2.gz IKAGYEVZTCUUBO-HNNXBMFYSA-N 2 1 314.464 4.341 20 0 DIADMP CCC1([NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904520 1063044474 /nfs/dbraw/zinc/04/44/74/1063044474.db2.gz IKAGYEVZTCUUBO-HNNXBMFYSA-N 2 1 314.464 4.341 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CC[C@@H]3CCc4ccccc43)CC2)[nH+]c1C ZINC001460790463 1063060786 /nfs/dbraw/zinc/06/07/86/1063060786.db2.gz QCRJMCCDDWPANN-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP C1=C(C[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)CCC1 ZINC001460853580 1063102087 /nfs/dbraw/zinc/10/20/87/1063102087.db2.gz YPNPTHFLTCINKO-UHFFFAOYSA-N 2 1 310.485 4.184 20 0 DIADMP CCC(CC)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001257295665 1063187643 /nfs/dbraw/zinc/18/76/43/1063187643.db2.gz AFABBTOCCRZGBA-SFHVURJKSA-N 2 1 304.478 4.145 20 0 DIADMP CCCC1CCC([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001461040740 1063207865 /nfs/dbraw/zinc/20/78/65/1063207865.db2.gz RAHOMHDOZADFQJ-UHFFFAOYSA-N 2 1 314.517 4.383 20 0 DIADMP CCCC1CCC([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001461040740 1063207885 /nfs/dbraw/zinc/20/78/85/1063207885.db2.gz RAHOMHDOZADFQJ-UHFFFAOYSA-N 2 1 314.517 4.383 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257331145 1063213406 /nfs/dbraw/zinc/21/34/06/1063213406.db2.gz AJQFAJHKXJGCIT-UAPYVXQJSA-N 2 1 303.494 4.122 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@@H]2[C@H](CCN2Cc2nccs2)C1 ZINC001257337152 1063215290 /nfs/dbraw/zinc/21/52/90/1063215290.db2.gz RYHNAZBNQFEPNW-NVXWUHKLSA-N 2 1 321.534 4.008 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC001461052607 1063218265 /nfs/dbraw/zinc/21/82/65/1063218265.db2.gz QXYFTPFUTWPKJQ-INIZCTEOSA-N 2 1 314.473 4.485 20 0 DIADMP c1ccc(C[NH+]2CCC3(CCC[N@H+](C4CCCC4)C3)CC2)cc1 ZINC001257355458 1063223175 /nfs/dbraw/zinc/22/31/75/1063223175.db2.gz UXPXXGGIFORHFA-UHFFFAOYSA-N 2 1 312.501 4.307 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)c2)cc1 ZINC001461057577 1063224764 /nfs/dbraw/zinc/22/47/64/1063224764.db2.gz HDYVUDSUHLLNMX-VXKWHMMOSA-N 2 1 320.480 4.378 20 0 DIADMP CCCCCC[C@@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257359280 1063227126 /nfs/dbraw/zinc/22/71/26/1063227126.db2.gz NQNNKYAYTCNDPD-KZNAEPCWSA-N 2 1 310.526 4.096 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257424079 1063267296 /nfs/dbraw/zinc/26/72/96/1063267296.db2.gz AFRDFXGDMIXQMP-VQTJNVASSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@@H](CC)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257424079 1063267313 /nfs/dbraw/zinc/26/73/13/1063267313.db2.gz AFRDFXGDMIXQMP-VQTJNVASSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@@H](CC)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257424079 1063267331 /nfs/dbraw/zinc/26/73/31/1063267331.db2.gz AFRDFXGDMIXQMP-VQTJNVASSA-N 2 1 302.506 4.409 20 0 DIADMP CC[C@H](C)[NH+]1CCC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1 ZINC001257447835 1063282220 /nfs/dbraw/zinc/28/22/20/1063282220.db2.gz MAVUWFNSXFTPEO-ZDUSSCGKSA-N 2 1 314.395 4.058 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](C3CCCCC3)C[C@@H]21 ZINC001257457592 1063283582 /nfs/dbraw/zinc/28/35/82/1063283582.db2.gz LFQGYUNQGFALSZ-ACRUOGEOSA-N 2 1 312.501 4.430 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+](C3CCCCC3)C[C@@H]21 ZINC001257457592 1063283599 /nfs/dbraw/zinc/28/35/99/1063283599.db2.gz LFQGYUNQGFALSZ-ACRUOGEOSA-N 2 1 312.501 4.430 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](C3CCCCC3)C[C@@H]21 ZINC001257457592 1063283614 /nfs/dbraw/zinc/28/36/14/1063283614.db2.gz LFQGYUNQGFALSZ-ACRUOGEOSA-N 2 1 312.501 4.430 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]3C[NH+](C4CCCCC4)CC[C@@H]3C2)cc1 ZINC001257466746 1063289549 /nfs/dbraw/zinc/28/95/49/1063289549.db2.gz PAQWTKUKAKOCJV-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](C4CCCCC4)CC[C@@H]3C2)cc1 ZINC001257466746 1063289572 /nfs/dbraw/zinc/28/95/72/1063289572.db2.gz PAQWTKUKAKOCJV-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@H+](C4CCCCC4)CC[C@@H]3C2)cc1 ZINC001257466746 1063289592 /nfs/dbraw/zinc/28/95/92/1063289592.db2.gz PAQWTKUKAKOCJV-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257505436 1063314405 /nfs/dbraw/zinc/31/44/05/1063314405.db2.gz VRDQRNUOPRXSRA-WDSOQIARSA-N 2 1 303.494 4.122 20 0 DIADMP Cc1ccc(-c2ccccc2C[NH2+]C[C@@H]2CCC[N@H+](C)C2)c(C)c1 ZINC001461183545 1063316351 /nfs/dbraw/zinc/31/63/51/1063316351.db2.gz UMMJOLINWJVKJU-IBGZPJMESA-N 2 1 322.496 4.402 20 0 DIADMP Cc1ccc(-c2ccccc2C[NH2+]C[C@H]2CCC[N@H+](C)C2)c(C)c1 ZINC001461183550 1063317883 /nfs/dbraw/zinc/31/78/83/1063317883.db2.gz UMMJOLINWJVKJU-LJQANCHMSA-N 2 1 322.496 4.402 20 0 DIADMP CCC[N@@H+](CCC[NH+]1CCCCC1)[C@@H](C)c1ccccc1OC ZINC001473126018 1063429113 /nfs/dbraw/zinc/42/91/13/1063429113.db2.gz AMEYCBUGXBWMQR-SFHVURJKSA-N 2 1 318.505 4.344 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC001257990017 1063453101 /nfs/dbraw/zinc/45/31/01/1063453101.db2.gz YUBGJZLPMKEMQK-KKXNLOMOSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C[C@@H](c2ccccc2)C(C)C)C1 ZINC001461373846 1063453755 /nfs/dbraw/zinc/45/37/55/1063453755.db2.gz VAHZPFVFOFFCBI-PZJWPPBQSA-N 2 1 316.533 4.384 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+]C2(c3ccc(Cl)cc3)CC2)CC1 ZINC001258001133 1063459097 /nfs/dbraw/zinc/45/90/97/1063459097.db2.gz FDJQENQRQMMNGV-UHFFFAOYSA-N 2 1 306.881 4.039 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccc(F)c(F)c1 ZINC001258008654 1063462562 /nfs/dbraw/zinc/46/25/62/1063462562.db2.gz BIXBPNGZSXVLNK-GOSISDBHSA-N 2 1 310.432 4.126 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001258014016 1063463474 /nfs/dbraw/zinc/46/34/74/1063463474.db2.gz CJAMFHNCYHUROS-HXUWFJFHSA-N 2 1 318.480 4.473 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001258014016 1063463489 /nfs/dbraw/zinc/46/34/89/1063463489.db2.gz CJAMFHNCYHUROS-HXUWFJFHSA-N 2 1 318.480 4.473 20 0 DIADMP CC(C)C[NH+]1CCC([NH+]2CCC(c3ccccc3F)CC2)CC1 ZINC001258014837 1063466887 /nfs/dbraw/zinc/46/68/87/1063466887.db2.gz UXPPUNQEAXOFIN-UHFFFAOYSA-N 2 1 318.480 4.126 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC001258017727 1063467231 /nfs/dbraw/zinc/46/72/31/1063467231.db2.gz NEFKRSQRMMBZOI-FQEVSTJZSA-N 2 1 314.517 4.377 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](Cc2ccccc2)C2CCC2)CC1 ZINC001258018293 1063467482 /nfs/dbraw/zinc/46/74/82/1063467482.db2.gz KIFLKIXXXBUTFB-UHFFFAOYSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001258017305 1063468035 /nfs/dbraw/zinc/46/80/35/1063468035.db2.gz ZYFFJSJZNVCNDP-MRXNPFEDSA-N 2 1 320.908 4.250 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001258017305 1063468048 /nfs/dbraw/zinc/46/80/48/1063468048.db2.gz ZYFFJSJZNVCNDP-MRXNPFEDSA-N 2 1 320.908 4.250 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC001473178063 1063486748 /nfs/dbraw/zinc/48/67/48/1063486748.db2.gz VNABJVHKVXKWMW-SFHVURJKSA-N 2 1 322.496 4.320 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H](C)C[C@H](C)CC(C)C)CC1 ZINC001258061923 1063489854 /nfs/dbraw/zinc/48/98/54/1063489854.db2.gz AMIWCHMQNUEWFG-SJORKVTESA-N 2 1 317.521 4.390 20 0 DIADMP C[C@H]([NH2+]C/C=C/c1cccc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001461426271 1063494790 /nfs/dbraw/zinc/49/47/90/1063494790.db2.gz NKEBIPHZMNPXKQ-VCUNKILJSA-N 2 1 316.464 4.082 20 0 DIADMP CC(C)C[C@@H](C)C[C@@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001258074008 1063500040 /nfs/dbraw/zinc/50/00/40/1063500040.db2.gz HJRJYUHWMGPYKF-QZTJIDSGSA-N 2 1 324.553 4.022 20 0 DIADMP CC(C)=CCC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258085443 1063507784 /nfs/dbraw/zinc/50/77/84/1063507784.db2.gz KCOOEWDVHRSNPJ-INIZCTEOSA-N 2 1 304.453 4.210 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)CCC2)cc1C ZINC001461473554 1063527837 /nfs/dbraw/zinc/52/78/37/1063527837.db2.gz PRSSSXVDMPTHIB-LJQANCHMSA-N 2 1 314.517 4.188 20 0 DIADMP CC(C)([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC001258131908 1063529701 /nfs/dbraw/zinc/52/97/01/1063529701.db2.gz QZCYZQGIRIBJQM-UHFFFAOYSA-N 2 1 322.496 4.218 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC001461485287 1063530778 /nfs/dbraw/zinc/53/07/78/1063530778.db2.gz NJPQRQFMTADDOG-PMXSJFBMSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC001461485287 1063530790 /nfs/dbraw/zinc/53/07/90/1063530790.db2.gz NJPQRQFMTADDOG-PMXSJFBMSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+]([C@@H](C)CC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258140969 1063533011 /nfs/dbraw/zinc/53/30/11/1063533011.db2.gz PXRKEGSWGZJJAV-SFHVURJKSA-N 2 1 302.506 4.204 20 0 DIADMP CCC[N@@H+]([C@@H](C)CC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258140969 1063533025 /nfs/dbraw/zinc/53/30/25/1063533025.db2.gz PXRKEGSWGZJJAV-SFHVURJKSA-N 2 1 302.506 4.204 20 0 DIADMP CSCC[C@H](C)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258209431 1063559662 /nfs/dbraw/zinc/55/96/62/1063559662.db2.gz PWXGWXJGKNYTJV-SZMVWBNQSA-N 2 1 312.567 4.280 20 0 DIADMP C(C1CC1)[N@H+]1CCCC12CC[NH+](C1CCCCCCC1)CC2 ZINC001258239550 1063576751 /nfs/dbraw/zinc/57/67/51/1063576751.db2.gz IEOHYERHQRUVKU-UHFFFAOYSA-N 2 1 304.522 4.440 20 0 DIADMP CC(C)[N@@H+](CCC[NH3+])[C@@H](C)CC(C)(C)SCc1ccco1 ZINC001258295646 1063592436 /nfs/dbraw/zinc/59/24/36/1063592436.db2.gz PMOQCSFTVFZEAR-HNNXBMFYSA-N 2 1 312.523 4.129 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)[C@H]1CC1(C)C ZINC001461587708 1063597306 /nfs/dbraw/zinc/59/73/06/1063597306.db2.gz JDHTUIHPSGQNLJ-UXHICEINSA-N 2 1 314.517 4.108 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CC1(C)C ZINC001461587712 1063597483 /nfs/dbraw/zinc/59/74/83/1063597483.db2.gz JDHTUIHPSGQNLJ-VQTJNVASSA-N 2 1 314.517 4.108 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)[C@H]1CC1(C)C ZINC001461587715 1063598076 /nfs/dbraw/zinc/59/80/76/1063598076.db2.gz JDHTUIHPSGQNLJ-WOJBJXKFSA-N 2 1 314.517 4.108 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CC1(C)C ZINC001461587706 1063598133 /nfs/dbraw/zinc/59/81/33/1063598133.db2.gz JDHTUIHPSGQNLJ-PMACEKPBSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)n1cc[nH+]c1CCC[NH3+] ZINC001258307625 1063602457 /nfs/dbraw/zinc/60/24/57/1063602457.db2.gz ZEYCTDBMUNCNNQ-CQSZACIVSA-N 2 1 321.490 4.031 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H](C)CC(C)(C)SC)CC1 ZINC001258349585 1063621573 /nfs/dbraw/zinc/62/15/73/1063621573.db2.gz NUVWBYSSJYJPDE-HNNXBMFYSA-N 2 1 300.556 4.103 20 0 DIADMP CCCCC(CCCC)[NH+]1CCC([NH3+])(c2cccnc2)CC1 ZINC001258382986 1063626695 /nfs/dbraw/zinc/62/66/95/1063626695.db2.gz HSOAWVSWFNZCHX-UHFFFAOYSA-N 2 1 303.494 4.080 20 0 DIADMP c1cc(C2CCC2)ccc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461665725 1063644592 /nfs/dbraw/zinc/64/45/92/1063644592.db2.gz UQEJFCUHZHGHPS-IBGZPJMESA-N 2 1 312.501 4.166 20 0 DIADMP CCCCC[C@H](CC)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258440334 1063653954 /nfs/dbraw/zinc/65/39/54/1063653954.db2.gz PIOLCOUWGMYZOD-ROUUACIJSA-N 2 1 324.553 4.357 20 0 DIADMP CCCCC[C@@H](CC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258442383 1063655920 /nfs/dbraw/zinc/65/59/20/1063655920.db2.gz DUONWSYZPGRAHJ-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP C[C@@H](CC1CC1)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258455971 1063662899 /nfs/dbraw/zinc/66/28/99/1063662899.db2.gz GEZTZZVEYIJOHR-JVPBZIDWSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@@H](CC1CC1)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001258471267 1063668691 /nfs/dbraw/zinc/66/86/91/1063668691.db2.gz XNZRTBTUFYXCAX-GHTZIAJQSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258471267 1063668695 /nfs/dbraw/zinc/66/86/95/1063668695.db2.gz XNZRTBTUFYXCAX-GHTZIAJQSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258471267 1063668698 /nfs/dbraw/zinc/66/86/98/1063668698.db2.gz XNZRTBTUFYXCAX-GHTZIAJQSA-N 2 1 312.501 4.163 20 0 DIADMP C1=C[C@H](CCC[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC001461726177 1063679717 /nfs/dbraw/zinc/67/97/17/1063679717.db2.gz BGABPIDNNFWCGS-IBGZPJMESA-N 2 1 312.501 4.030 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001461752769 1063697262 /nfs/dbraw/zinc/69/72/62/1063697262.db2.gz HXKRAUMVNARHEX-OALUTQOASA-N 2 1 308.469 4.119 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001461752761 1063697464 /nfs/dbraw/zinc/69/74/64/1063697464.db2.gz HXKRAUMVNARHEX-MOPGFXCFSA-N 2 1 308.469 4.119 20 0 DIADMP CN1CCC([N@@H+](Cc2ccc(F)cc2)[C@@H]2CCC(C)(C)C2)CC1 ZINC001258608598 1063707852 /nfs/dbraw/zinc/70/78/52/1063707852.db2.gz LRIDKKNZIMXOBF-LJQANCHMSA-N 2 1 318.480 4.301 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001258654174 1063727726 /nfs/dbraw/zinc/72/77/26/1063727726.db2.gz ITKVCOSILDJXRF-RLLQIKCJSA-N 2 1 302.506 4.106 20 0 DIADMP CCCCC[C@@H](CCC)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001258671259 1063736923 /nfs/dbraw/zinc/73/69/23/1063736923.db2.gz MLUGBYIDJAVOGV-QUCCMNQESA-N 2 1 324.553 4.311 20 0 DIADMP CCCCC[C@H](CCC)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001258671257 1063738791 /nfs/dbraw/zinc/73/87/91/1063738791.db2.gz MLUGBYIDJAVOGV-AZUAARDMSA-N 2 1 324.553 4.311 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1Cl)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001258674812 1063742420 /nfs/dbraw/zinc/74/24/20/1063742420.db2.gz GUYVQIMJZCYDIB-QGLTVNCISA-N 2 1 315.288 4.126 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC(C)(C)C1 ZINC001258691690 1063755435 /nfs/dbraw/zinc/75/54/35/1063755435.db2.gz HFMBENMWRCCZRV-HOTGVXAUSA-N 2 1 318.480 4.290 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001461863443 1063756637 /nfs/dbraw/zinc/75/66/37/1063756637.db2.gz OOQNOJMLTNHWKD-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001461863443 1063756644 /nfs/dbraw/zinc/75/66/44/1063756644.db2.gz OOQNOJMLTNHWKD-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001461863443 1063756653 /nfs/dbraw/zinc/75/66/53/1063756653.db2.gz OOQNOJMLTNHWKD-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001461863443 1063756662 /nfs/dbraw/zinc/75/66/62/1063756662.db2.gz OOQNOJMLTNHWKD-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001258702105 1063759407 /nfs/dbraw/zinc/75/94/07/1063759407.db2.gz QLMIEXDHKJPJGJ-YSTOQKLRSA-N 2 1 300.490 4.003 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001258711425 1063767885 /nfs/dbraw/zinc/76/78/85/1063767885.db2.gz AVXLIVXNTVRFDZ-IBGZPJMESA-N 2 1 311.473 4.324 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001258713303 1063769920 /nfs/dbraw/zinc/76/99/20/1063769920.db2.gz FMBLHUVTCHQQEN-FQEVSTJZSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC001258738399 1063787258 /nfs/dbraw/zinc/78/72/58/1063787258.db2.gz RGCNVMOIKCQHJF-JKSUJKDBSA-N 2 1 308.897 4.125 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258740857 1063790196 /nfs/dbraw/zinc/79/01/96/1063790196.db2.gz BKTVPTOIDYHOMK-NIKGAXFTSA-N 2 1 320.908 4.253 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001258745021 1063794234 /nfs/dbraw/zinc/79/42/34/1063794234.db2.gz XJAUCHXRZWFRQS-HOTGVXAUSA-N 2 1 308.897 4.112 20 0 DIADMP CCCC[C@@H](CCC)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258753028 1063800455 /nfs/dbraw/zinc/80/04/55/1063800455.db2.gz PKXIFCGZGLQNBG-VQTJNVASSA-N 2 1 302.506 4.457 20 0 DIADMP CCCC[C@@H](CCC)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258753029 1063800597 /nfs/dbraw/zinc/80/05/97/1063800597.db2.gz PKXIFCGZGLQNBG-WOJBJXKFSA-N 2 1 302.506 4.457 20 0 DIADMP C[C@H](c1nccc2ccccc21)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001461921455 1063805874 /nfs/dbraw/zinc/80/58/74/1063805874.db2.gz OTHUZALDSIHHEE-SJLPKXTDSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@H](c1nccc2ccccc21)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001461921455 1063805886 /nfs/dbraw/zinc/80/58/86/1063805886.db2.gz OTHUZALDSIHHEE-SJLPKXTDSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@H](c1nccc2ccccc21)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC001461921455 1063805891 /nfs/dbraw/zinc/80/58/91/1063805891.db2.gz OTHUZALDSIHHEE-SJLPKXTDSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@H](c1nccc2ccccc21)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC001461921455 1063805898 /nfs/dbraw/zinc/80/58/98/1063805898.db2.gz OTHUZALDSIHHEE-SJLPKXTDSA-N 2 1 311.473 4.102 20 0 DIADMP CCCC[C@H](CCC)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258762536 1063806781 /nfs/dbraw/zinc/80/67/81/1063806781.db2.gz YHBDCVYBULPPLQ-ZWKOTPCHSA-N 2 1 324.553 4.357 20 0 DIADMP CCC[NH+]1CCC([N@H+](Cc2ccccn2)C2CCCCC2)CC1 ZINC001258776038 1063814863 /nfs/dbraw/zinc/81/48/63/1063814863.db2.gz QCYZCYQPRTZIBW-UHFFFAOYSA-N 2 1 315.505 4.091 20 0 DIADMP CCC[NH+]1CCC([N@@H+](Cc2ccccn2)C2CCCCC2)CC1 ZINC001258776038 1063814882 /nfs/dbraw/zinc/81/48/82/1063814882.db2.gz QCYZCYQPRTZIBW-UHFFFAOYSA-N 2 1 315.505 4.091 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001258776132 1063816463 /nfs/dbraw/zinc/81/64/63/1063816463.db2.gz UTTFGXZJCMWGNH-SFHVURJKSA-N 2 1 318.530 4.420 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001258776132 1063816474 /nfs/dbraw/zinc/81/64/74/1063816474.db2.gz UTTFGXZJCMWGNH-SFHVURJKSA-N 2 1 318.530 4.420 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC001258776256 1063817698 /nfs/dbraw/zinc/81/76/98/1063817698.db2.gz ZUTVVLYXSPKSHU-IBGZPJMESA-N 2 1 300.490 4.131 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258784702 1063820662 /nfs/dbraw/zinc/82/06/62/1063820662.db2.gz BIVLKXKLZLCOCM-CRAIPNDOSA-N 2 1 306.469 4.290 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258791542 1063827825 /nfs/dbraw/zinc/82/78/25/1063827825.db2.gz BYHWMGWXDGRRMW-RDJZCZTQSA-N 2 1 303.494 4.144 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813282 1063843434 /nfs/dbraw/zinc/84/34/34/1063843434.db2.gz JRENUTPMHGXWRW-WNHJNPCNSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@]2(C)CCCS2)CC1 ZINC001461966287 1063845746 /nfs/dbraw/zinc/84/57/46/1063845746.db2.gz QBJFUJULRMKQCW-HKUYNNGSSA-N 2 1 324.578 4.249 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258827001 1063850553 /nfs/dbraw/zinc/85/05/53/1063850553.db2.gz NYOOVQVMFBEHNT-UWJYYQICSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258827001 1063850568 /nfs/dbraw/zinc/85/05/68/1063850568.db2.gz NYOOVQVMFBEHNT-UWJYYQICSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828385 1063854575 /nfs/dbraw/zinc/85/45/75/1063854575.db2.gz MHJXQTRMDVJHFO-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828385 1063854586 /nfs/dbraw/zinc/85/45/86/1063854586.db2.gz MHJXQTRMDVJHFO-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP CC(C)CC(CC(C)C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001258835992 1063858600 /nfs/dbraw/zinc/85/86/00/1063858600.db2.gz ISSLBJUVROGLKU-UHFFFAOYSA-N 2 1 324.553 4.022 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001258848497 1063864419 /nfs/dbraw/zinc/86/44/19/1063864419.db2.gz GDKRWNFRFGUKSE-RTWAWAEBSA-N 2 1 314.517 4.348 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@H](C)c2cc3ccccc3o2)CC1 ZINC001462036308 1063893087 /nfs/dbraw/zinc/89/30/87/1063893087.db2.gz MBVPJOJKTHDKJL-OAHLLOKOSA-N 2 1 300.446 4.158 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C2CC3(CC3(F)F)C2)cc1 ZINC001261603801 1063940284 /nfs/dbraw/zinc/94/02/84/1063940284.db2.gz XWHCEKCBNZSZDG-OLJMKKDRSA-N 2 1 317.383 4.019 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000378895593 1063979630 /nfs/dbraw/zinc/97/96/30/1063979630.db2.gz ABHZUSSPNFUOMP-NRFANRHFSA-N 2 1 308.469 4.044 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379637606 1063985442 /nfs/dbraw/zinc/98/54/42/1063985442.db2.gz SPAFRROPEFXBAH-ARXXEPJESA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379637606 1063985449 /nfs/dbraw/zinc/98/54/49/1063985449.db2.gz SPAFRROPEFXBAH-ARXXEPJESA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc2cc[nH]c2c1)[N@@H+](C)Cc1ccccc1 ZINC000379652945 1063986812 /nfs/dbraw/zinc/98/68/12/1063986812.db2.gz YMWPDQPAPDRXEA-KRWDZBQOSA-N 2 1 321.468 4.168 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380944339 1063989286 /nfs/dbraw/zinc/98/92/86/1063989286.db2.gz NYQMSHRAMSSRNW-KOUHRCEDSA-N 2 1 314.517 4.313 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000381776087 1063991870 /nfs/dbraw/zinc/99/18/70/1063991870.db2.gz CYABKXIPQZSVFI-DJXZGCLFSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000381810946 1063994288 /nfs/dbraw/zinc/99/42/88/1063994288.db2.gz ZSOFQPQFINGWNB-OBJCFNGXSA-N 2 1 312.501 4.065 20 0 DIADMP CSC(C)(C)CC[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000385253578 1064010048 /nfs/dbraw/zinc/01/00/48/1064010048.db2.gz SVTWJGKCYRSHLM-IBGZPJMESA-N 2 1 320.546 4.020 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1c(F)cccc1Cl ZINC000387002296 1064062463 /nfs/dbraw/zinc/06/24/63/1064062463.db2.gz FNYLAZMFGVFOOI-FUDCBSFHSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1c(F)cccc1Cl ZINC000387002296 1064062468 /nfs/dbraw/zinc/06/24/68/1064062468.db2.gz FNYLAZMFGVFOOI-FUDCBSFHSA-N 2 1 310.844 4.145 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+]CC3CCCCCC3)CC2)cc1 ZINC000389473652 1064129427 /nfs/dbraw/zinc/12/94/27/1064129427.db2.gz MYHGSPUKSDUAOQ-UHFFFAOYSA-N 2 1 314.517 4.254 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517337 1064161291 /nfs/dbraw/zinc/16/12/91/1064161291.db2.gz ARXGCIACZBYXNK-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517337 1064161300 /nfs/dbraw/zinc/16/13/00/1064161300.db2.gz ARXGCIACZBYXNK-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660908 1064166164 /nfs/dbraw/zinc/16/61/64/1064166164.db2.gz PRUIYQBLHFQQSW-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660908 1064166168 /nfs/dbraw/zinc/16/61/68/1064166168.db2.gz PRUIYQBLHFQQSW-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP CCCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390717785 1064167795 /nfs/dbraw/zinc/16/77/95/1064167795.db2.gz YOMRJMYMLWCROF-PKOBYXMFSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390717785 1064167802 /nfs/dbraw/zinc/16/78/02/1064167802.db2.gz YOMRJMYMLWCROF-PKOBYXMFSA-N 2 1 302.506 4.455 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000390800142 1064170250 /nfs/dbraw/zinc/17/02/50/1064170250.db2.gz XOEBGYKCLAEXKQ-MJGOQNOKSA-N 2 1 302.506 4.455 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000390800140 1064170513 /nfs/dbraw/zinc/17/05/13/1064170513.db2.gz XOEBGYKCLAEXKQ-IEBWSBKVSA-N 2 1 302.506 4.455 20 0 DIADMP c1ccc(C2CCC([N@H+]3CCC[C@]4(CCC[NH2+]C4)C3)CC2)cc1 ZINC000391011231 1064178030 /nfs/dbraw/zinc/17/80/30/1064178030.db2.gz XAUUPVCJHGTKBW-CBNMVNINSA-N 2 1 312.501 4.178 20 0 DIADMP C[N@H+]1CCC2(C1)CC[NH+](CCC13CC4CC(CC(C4)C1)C3)CC2 ZINC001279275695 1064338449 /nfs/dbraw/zinc/33/84/49/1064338449.db2.gz YVLSMSMCLQSXDY-UHFFFAOYSA-N 2 1 316.533 4.011 20 0 DIADMP FC(F)(F)CCC[N@H+]1CCC2(C1)CC[NH+](C1CCCC1)CC2 ZINC001280180011 1064385211 /nfs/dbraw/zinc/38/52/11/1064385211.db2.gz RNPJWQLDEZIKQN-UHFFFAOYSA-N 2 1 318.427 4.059 20 0 DIADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(-c2ccccc2)cc1 ZINC000653597667 1064721034 /nfs/dbraw/zinc/72/10/34/1064721034.db2.gz YYQWOXRUYAEDNW-KRWDZBQOSA-N 2 1 319.452 4.371 20 0 DIADMP CC(C)C[C@H](C)C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001307496413 1065439481 /nfs/dbraw/zinc/43/94/81/1065439481.db2.gz LMQVIDDPLUUGSA-ICSRJNTNSA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@H](C)C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001307496413 1065439486 /nfs/dbraw/zinc/43/94/86/1065439486.db2.gz LMQVIDDPLUUGSA-ICSRJNTNSA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@H](C)C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001307496413 1065439490 /nfs/dbraw/zinc/43/94/90/1065439490.db2.gz LMQVIDDPLUUGSA-ICSRJNTNSA-N 2 1 302.506 4.123 20 0 DIADMP C[N@@H+](CCCC1CCCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001307495818 1065440065 /nfs/dbraw/zinc/44/00/65/1065440065.db2.gz GWEWAAISAYXGNW-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCCC1CCCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001307495818 1065440078 /nfs/dbraw/zinc/44/00/78/1065440078.db2.gz GWEWAAISAYXGNW-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCCC1CCCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001307495818 1065440089 /nfs/dbraw/zinc/44/00/89/1065440089.db2.gz GWEWAAISAYXGNW-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C1CCC1 ZINC001307528679 1065467038 /nfs/dbraw/zinc/46/70/38/1065467038.db2.gz KHQHIQXUZPGRNY-UHFFFAOYSA-N 2 1 300.490 4.435 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC001307628307 1065526088 /nfs/dbraw/zinc/52/60/88/1065526088.db2.gz HERCSQBENOXXCE-ROUUACIJSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C1CCCCC1 ZINC001307670006 1065553256 /nfs/dbraw/zinc/55/32/56/1065553256.db2.gz OXQMRPXTUVULGV-ZIFCJYIRSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CCC[NH+]1CCCC1 ZINC001307725682 1065588099 /nfs/dbraw/zinc/58/80/99/1065588099.db2.gz RDLIDUUCAJFZEC-ZDUSSCGKSA-N 2 1 315.288 4.472 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCC[NH+]1CCCC1 ZINC001307725682 1065588105 /nfs/dbraw/zinc/58/81/05/1065588105.db2.gz RDLIDUUCAJFZEC-ZDUSSCGKSA-N 2 1 315.288 4.472 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001307764743 1065612087 /nfs/dbraw/zinc/61/20/87/1065612087.db2.gz ZGUGKUFYRNINAG-UGKGYDQZSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001307764743 1065612097 /nfs/dbraw/zinc/61/20/97/1065612097.db2.gz ZGUGKUFYRNINAG-UGKGYDQZSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001307764743 1065612108 /nfs/dbraw/zinc/61/21/08/1065612108.db2.gz ZGUGKUFYRNINAG-UGKGYDQZSA-N 2 1 320.480 4.346 20 0 DIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001307875380 1065664937 /nfs/dbraw/zinc/66/49/37/1065664937.db2.gz ZNAIDMREOPARBX-SFTDATJTSA-N 2 1 312.501 4.437 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2C[C@]3(C)C[NH+](C)C[C@@]3(C)C2)cc1 ZINC001307979328 1065709184 /nfs/dbraw/zinc/70/91/84/1065709184.db2.gz WVBKUUJKJFGWCU-VDGAXYAQSA-N 2 1 300.490 4.145 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2ccc(C)c(C)c2)CC1 ZINC001307984388 1065711720 /nfs/dbraw/zinc/71/17/20/1065711720.db2.gz ZLWSUMGNGHZOPO-UHFFFAOYSA-N 2 1 300.490 4.144 20 0 DIADMP C[C@@H](C[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1)C(C)(C)C ZINC001308057934 1065744926 /nfs/dbraw/zinc/74/49/26/1065744926.db2.gz AIKQVAZPWYAWJG-HFSMHLIXSA-N 2 1 314.517 4.123 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC[C@H](c2ccc(Cl)cc2)C1(C)C ZINC001308098783 1065763452 /nfs/dbraw/zinc/76/34/52/1065763452.db2.gz RNPDGXGMCUJVAL-QZTJIDSGSA-N 2 1 320.908 4.392 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)CC1 ZINC001308206399 1065815428 /nfs/dbraw/zinc/81/54/28/1065815428.db2.gz XYXNUFLIQSNGFR-PLMTUMEDSA-N 2 1 314.517 4.374 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC1(C)C ZINC001308238623 1065845829 /nfs/dbraw/zinc/84/58/29/1065845829.db2.gz WCIUQFFVQHNCHF-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC1(C)C ZINC001308238623 1065845835 /nfs/dbraw/zinc/84/58/35/1065845835.db2.gz WCIUQFFVQHNCHF-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP CC(C)CC[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC001308302971 1065898517 /nfs/dbraw/zinc/89/85/17/1065898517.db2.gz BRXQKMGVWRQAPT-UYAOXDASSA-N 2 1 324.553 4.070 20 0 DIADMP C[C@H]1CC[C@@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001308393369 1065958943 /nfs/dbraw/zinc/95/89/43/1065958943.db2.gz UACDDLLLGRODCC-PKOBYXMFSA-N 2 1 302.506 4.170 20 0 DIADMP CC[N@@H+](CCC[NH2+]C1CCC(F)(F)CC1)C1CCCCC1 ZINC001308455020 1065999076 /nfs/dbraw/zinc/99/90/76/1065999076.db2.gz APLGMPJFRHZHRH-UHFFFAOYSA-N 2 1 302.453 4.199 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCS1 ZINC001308539245 1066056288 /nfs/dbraw/zinc/05/62/88/1066056288.db2.gz CJQKVVMNQGOJAB-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2CCCc2ccccc2)CC1 ZINC001308562773 1066071709 /nfs/dbraw/zinc/07/17/09/1066071709.db2.gz PRUNFOQYVJSNGT-NRFANRHFSA-N 2 1 314.517 4.206 20 0 DIADMP CC(C)[C@@H](C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1ccccc1 ZINC001308597514 1066108892 /nfs/dbraw/zinc/10/88/92/1066108892.db2.gz CHGHOZBUFBGCKH-TZIWHRDSSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@@H](C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597514 1066108896 /nfs/dbraw/zinc/10/88/96/1066108896.db2.gz CHGHOZBUFBGCKH-TZIWHRDSSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@@H](C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597514 1066108897 /nfs/dbraw/zinc/10/88/97/1066108897.db2.gz CHGHOZBUFBGCKH-TZIWHRDSSA-N 2 1 314.517 4.090 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCC[C@@H]2CCCc2ccccc2)CC1 ZINC001308604449 1066112803 /nfs/dbraw/zinc/11/28/03/1066112803.db2.gz YWXLFSWZFUHXKU-OAQYLSRUSA-N 2 1 314.517 4.206 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C/c2cccc(F)c2)CC1 ZINC001308605164 1066113074 /nfs/dbraw/zinc/11/30/74/1066113074.db2.gz GPWYSPDOOUMAGP-SOFGYWHQSA-N 2 1 318.480 4.283 20 0 DIADMP C[C@]1(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)C[C@@H]1c1ccccc1 ZINC001308612029 1066117674 /nfs/dbraw/zinc/11/76/74/1066117674.db2.gz VHVFVNRRQONWEA-NJDAHSKKSA-N 2 1 312.501 4.131 20 0 DIADMP C[C@@H]([NH2+]C1CCC2(CCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001308682049 1066154058 /nfs/dbraw/zinc/15/40/58/1066154058.db2.gz KCQDSAZLUSFWTQ-SJORKVTESA-N 2 1 304.522 4.342 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001308729124 1066203951 /nfs/dbraw/zinc/20/39/51/1066203951.db2.gz DMSDWTFDZFJYRL-FPOVZHCZSA-N 2 1 322.496 4.210 20 0 DIADMP CCCC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308730541 1066206695 /nfs/dbraw/zinc/20/66/95/1066206695.db2.gz UTOSVACEXKKQRK-BJLQDIEVSA-N 2 1 302.506 4.313 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H](C)Cc1ccc(F)cc1Cl ZINC001308794634 1066270776 /nfs/dbraw/zinc/27/07/76/1066270776.db2.gz ADPJQHNBUMIKDZ-KBPBESRZSA-N 2 1 314.876 4.120 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H](C)Cc1ccc(F)cc1Cl ZINC001308794634 1066270781 /nfs/dbraw/zinc/27/07/81/1066270781.db2.gz ADPJQHNBUMIKDZ-KBPBESRZSA-N 2 1 314.876 4.120 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001308795581 1066272049 /nfs/dbraw/zinc/27/20/49/1066272049.db2.gz JKGJHNWTQMCPEG-NXVRBGIVSA-N 2 1 308.897 4.296 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001308795581 1066272060 /nfs/dbraw/zinc/27/20/60/1066272060.db2.gz JKGJHNWTQMCPEG-NXVRBGIVSA-N 2 1 308.897 4.296 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001308816009 1066291699 /nfs/dbraw/zinc/29/16/99/1066291699.db2.gz UBKOJTIVXSQMFK-RBUKOAKNSA-N 2 1 300.490 4.095 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001308816009 1066291707 /nfs/dbraw/zinc/29/17/07/1066291707.db2.gz UBKOJTIVXSQMFK-RBUKOAKNSA-N 2 1 300.490 4.095 20 0 DIADMP CC[C@@H](CC1CCCCC1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308882893 1066363507 /nfs/dbraw/zinc/36/35/07/1066363507.db2.gz BYPGSOJFPFLPPS-PMACEKPBSA-N 2 1 306.538 4.447 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](Cc2cccc(-c3ccccn3)c2)CC1 ZINC001308891150 1066373656 /nfs/dbraw/zinc/37/36/56/1066373656.db2.gz MBMMRGJFSRPQIQ-UHFFFAOYSA-N 2 1 323.484 4.055 20 0 DIADMP CCCc1cccc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)c1 ZINC001308909773 1066387175 /nfs/dbraw/zinc/38/71/75/1066387175.db2.gz LKSBVTYJGTVPKA-UHFFFAOYSA-N 2 1 316.533 4.439 20 0 DIADMP CCCc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)s1 ZINC001308915307 1066395159 /nfs/dbraw/zinc/39/51/59/1066395159.db2.gz VFDHKIAPDHUXQG-UHFFFAOYSA-N 2 1 308.535 4.399 20 0 DIADMP CC(C)O[C@@H](C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1 ZINC001308985197 1066433448 /nfs/dbraw/zinc/43/34/48/1066433448.db2.gz XLVZKITUFXSFJH-SFHVURJKSA-N 2 1 318.505 4.005 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000021510261 182276836 /nfs/dbraw/zinc/27/68/36/182276836.db2.gz ORFQWBMMJQHMIO-LLVKDONJSA-N 2 1 301.261 4.128 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)oc2cc1C ZINC000152399339 335056549 /nfs/dbraw/zinc/05/65/49/335056549.db2.gz YRZWUYVOQHRULU-JKSUJKDBSA-N 2 1 312.457 4.185 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)oc2cc1C ZINC000152399339 335056551 /nfs/dbraw/zinc/05/65/51/335056551.db2.gz YRZWUYVOQHRULU-JKSUJKDBSA-N 2 1 312.457 4.185 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(F)c2ccccc21 ZINC000340190882 131074905 /nfs/dbraw/zinc/07/49/05/131074905.db2.gz JFBOSPJMBCYTTD-AWEZNQCLSA-N 2 1 311.404 4.225 20 0 DIADMP CN(Cc1cccc(Cl)c1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285525363 131178006 /nfs/dbraw/zinc/17/80/06/131178006.db2.gz OQZIAOPZEAASAN-PBWFPOADSA-N 2 1 313.272 4.050 20 0 DIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccccn1 ZINC000285809018 131203538 /nfs/dbraw/zinc/20/35/38/131203538.db2.gz VRFXSLHLDNHDPY-QHGAOEGBSA-N 2 1 323.484 4.175 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCc2c3ccccc3[nH]c21 ZINC000289222916 131367183 /nfs/dbraw/zinc/36/71/83/131367183.db2.gz LJGKTEYQRRUKEQ-IBGZPJMESA-N 2 1 322.456 4.120 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c2ccccc21 ZINC000298324160 132056634 /nfs/dbraw/zinc/05/66/34/132056634.db2.gz IMHSMPNUEXVTGP-CYBMUJFWSA-N 2 1 313.832 4.120 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000530513165 331508337 /nfs/dbraw/zinc/50/83/37/331508337.db2.gz MTGMDMHNSWABIT-INIZCTEOSA-N 2 1 324.255 4.010 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000518270006 332003481 /nfs/dbraw/zinc/00/34/81/332003481.db2.gz POSHODDHZKRQIR-QGZVFWFLSA-N 2 1 312.457 4.301 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000518270006 332003482 /nfs/dbraw/zinc/00/34/82/332003482.db2.gz POSHODDHZKRQIR-QGZVFWFLSA-N 2 1 312.457 4.301 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000130250715 332023586 /nfs/dbraw/zinc/02/35/86/332023586.db2.gz ATAPEOYKROYVEQ-GOEBONIOSA-N 2 1 324.559 4.385 20 0 DIADMP C[C@H](C[NH2+][C@@H]1C[C@H](C)Sc2sccc21)C[NH+]1CCCCC1 ZINC000130371123 332024270 /nfs/dbraw/zinc/02/42/70/332024270.db2.gz LKYQFWROZYGJBH-IJEWVQPXSA-N 2 1 324.559 4.385 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C/C=C\c2ccccc2)C[C@H]1c1ccccc1 ZINC000518407646 332027360 /nfs/dbraw/zinc/02/73/60/332027360.db2.gz HONSJOIAGSPZEK-AFUAKYECSA-N 2 1 306.453 4.125 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C/C=C\c2ccccc2)C[C@H]1c1ccccc1 ZINC000518407646 332027361 /nfs/dbraw/zinc/02/73/61/332027361.db2.gz HONSJOIAGSPZEK-AFUAKYECSA-N 2 1 306.453 4.125 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000559740472 332278226 /nfs/dbraw/zinc/27/82/26/332278226.db2.gz FXDXYYDPTCHRPU-FGZHOGPDSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000559740472 332278227 /nfs/dbraw/zinc/27/82/27/332278227.db2.gz FXDXYYDPTCHRPU-FGZHOGPDSA-N 2 1 322.496 4.271 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000559735757 332278639 /nfs/dbraw/zinc/27/86/39/332278639.db2.gz NDGZVKYROJPFBV-JRGCBEDISA-N 2 1 308.469 4.215 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000559735757 332278640 /nfs/dbraw/zinc/27/86/40/332278640.db2.gz NDGZVKYROJPFBV-JRGCBEDISA-N 2 1 308.469 4.215 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)C1 ZINC000560247873 332323454 /nfs/dbraw/zinc/32/34/54/332323454.db2.gz GIOANAMGFGYWLA-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)cs1 ZINC000394531971 333032600 /nfs/dbraw/zinc/03/26/00/333032600.db2.gz RDMTXVQCWAYQLA-MRXNPFEDSA-N 2 1 302.487 4.229 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245607 333040232 /nfs/dbraw/zinc/04/02/32/333040232.db2.gz WKTMGCYSUDKIMQ-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245607 333040234 /nfs/dbraw/zinc/04/02/34/333040234.db2.gz WKTMGCYSUDKIMQ-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245607 333040235 /nfs/dbraw/zinc/04/02/35/333040235.db2.gz WKTMGCYSUDKIMQ-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245607 333040237 /nfs/dbraw/zinc/04/02/37/333040237.db2.gz WKTMGCYSUDKIMQ-UWJYYQICSA-N 2 1 308.469 4.126 20 0 DIADMP c1ccc(C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000378922283 333065057 /nfs/dbraw/zinc/06/50/57/333065057.db2.gz QBBLDKPBXWYPMK-BDTNDASRSA-N 2 1 320.480 4.187 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000379037409 333098507 /nfs/dbraw/zinc/09/85/07/333098507.db2.gz DDDUOQBLCXTERI-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccc2c(C)cc(N3CC[C@H](C4CC[NH+](C)CC4)C3)[nH+]c2c1 ZINC000460948408 333119040 /nfs/dbraw/zinc/11/90/40/333119040.db2.gz VXESRMWMHWQMPQ-SFHVURJKSA-N 2 1 323.484 4.020 20 0 DIADMP CC(C)c1ccc(C[C@H]2CC[NH+](CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC000460986015 333177927 /nfs/dbraw/zinc/17/79/27/333177927.db2.gz YZOBISKPSQUIGN-TZIWHRDSSA-N 2 1 314.517 4.159 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497518137 333258740 /nfs/dbraw/zinc/25/87/40/333258740.db2.gz KTIHRCOYVSPXGD-OXQOHEQNSA-N 2 1 316.464 4.083 20 0 DIADMP C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000582112645 333272489 /nfs/dbraw/zinc/27/24/89/333272489.db2.gz OJXWSTIUGLVPMD-OVZGMEQFSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSc2ccccc21 ZINC000019993195 333295959 /nfs/dbraw/zinc/29/59/59/333295959.db2.gz FNUPIFJQSVZZOV-NVXWUHKLSA-N 2 1 304.503 4.078 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCSc2ccccc21 ZINC000019993195 333295961 /nfs/dbraw/zinc/29/59/61/333295961.db2.gz FNUPIFJQSVZZOV-NVXWUHKLSA-N 2 1 304.503 4.078 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCC3)[C@@H]1c1cccs1 ZINC000502465323 333298228 /nfs/dbraw/zinc/29/82/28/333298228.db2.gz VBICHGKDLHZANO-HYVNUMGLSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCC3)[C@@H]1c1cccs1 ZINC000502465323 333298229 /nfs/dbraw/zinc/29/82/29/333298229.db2.gz VBICHGKDLHZANO-HYVNUMGLSA-N 2 1 304.503 4.053 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497843056 333300369 /nfs/dbraw/zinc/30/03/69/333300369.db2.gz MVENSFBRYHFZAZ-QGZVFWFLSA-N 2 1 320.480 4.466 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497843056 333300370 /nfs/dbraw/zinc/30/03/70/333300370.db2.gz MVENSFBRYHFZAZ-QGZVFWFLSA-N 2 1 320.480 4.466 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cn1 ZINC000497851906 333301587 /nfs/dbraw/zinc/30/15/87/333301587.db2.gz HPSLGVMAFIIPRM-QFBILLFUSA-N 2 1 321.484 4.020 20 0 DIADMP CC(C)C1CC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000390587008 333304051 /nfs/dbraw/zinc/30/40/51/333304051.db2.gz FRTSZLHIPXSWCE-AFQACZAZSA-N 2 1 312.501 4.206 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCCC1 ZINC000390666919 333312790 /nfs/dbraw/zinc/31/27/90/333312790.db2.gz RDBGIQWEJLMLTG-IBGZPJMESA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCCC1 ZINC000390666919 333312791 /nfs/dbraw/zinc/31/27/91/333312791.db2.gz RDBGIQWEJLMLTG-IBGZPJMESA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390681189 333314621 /nfs/dbraw/zinc/31/46/21/333314621.db2.gz VWRLHOJUUKMUIQ-QNXAMLQOSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H](CC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390685944 333314874 /nfs/dbraw/zinc/31/48/74/333314874.db2.gz XXIVDAPZEZFRSY-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H](CC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390685944 333314876 /nfs/dbraw/zinc/31/48/76/333314876.db2.gz XXIVDAPZEZFRSY-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]CCC1CCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390801615 333394244 /nfs/dbraw/zinc/39/42/44/333394244.db2.gz PMCRZYSUKQPQLW-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]CCCn2cc[nH+]c2C)cc1 ZINC000338021612 333467978 /nfs/dbraw/zinc/46/79/78/333467978.db2.gz WSLMIEYLRRXANW-AWEZNQCLSA-N 2 1 303.475 4.044 20 0 DIADMP Cc1ccc2oc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)cc2c1 ZINC000152088968 333601224 /nfs/dbraw/zinc/60/12/24/333601224.db2.gz HSYIPHDHPWPNJL-UHFFFAOYSA-N 2 1 300.446 4.094 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000414062060 333889158 /nfs/dbraw/zinc/88/91/58/333889158.db2.gz CFRAADIPOABJNF-FUHWJXTLSA-N 2 1 317.864 4.161 20 0 DIADMP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)cc1 ZINC000414810126 334105206 /nfs/dbraw/zinc/10/52/06/334105206.db2.gz NNOIZHWLPJLMNY-NSHDSACASA-N 2 1 309.240 4.303 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000280344739 334116645 /nfs/dbraw/zinc/11/66/45/334116645.db2.gz RRKGYHRKXAKOOH-YLJYHZDGSA-N 2 1 315.505 4.167 20 0 DIADMP C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(Cl)c1)[C@H]1CC[NH2+]C1 ZINC000415082667 334272189 /nfs/dbraw/zinc/27/21/89/334272189.db2.gz DOVDTWFLFAGDQY-FNHZYXHNSA-N 2 1 314.860 4.017 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)Cc1cccs1 ZINC000415090299 334279888 /nfs/dbraw/zinc/27/98/88/334279888.db2.gz YXJVESSPOCNNKR-KVSKMBFKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccccc1C(C)(C)C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415092649 334280278 /nfs/dbraw/zinc/28/02/78/334280278.db2.gz UBLXOLLSZXPFLR-PZJWPPBQSA-N 2 1 322.496 4.356 20 0 DIADMP CC[C@H]1CCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2C)CC1 ZINC000531955081 334306386 /nfs/dbraw/zinc/30/63/86/334306386.db2.gz CXQNLCBQRLPEER-FXAWDEMLSA-N 2 1 300.490 4.128 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2)C1 ZINC000531970664 334331296 /nfs/dbraw/zinc/33/12/96/334331296.db2.gz DWHSDABLJDZOJF-RBBKRZOGSA-N 2 1 322.496 4.292 20 0 DIADMP c1ccc(C[N@H+]2CCC3(C2)CC[NH+]([C@H]2C=CCCC2)CC3)cc1 ZINC000534966842 334350752 /nfs/dbraw/zinc/35/07/52/334350752.db2.gz HATZKFQWOVTKSE-FQEVSTJZSA-N 2 1 310.485 4.083 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1csc2ccccc12 ZINC000049943318 334359691 /nfs/dbraw/zinc/35/96/91/334359691.db2.gz FWJLUERQNFVTEU-HNNXBMFYSA-N 2 1 302.487 4.255 20 0 DIADMP Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1cccc(F)c1 ZINC000535204317 334380335 /nfs/dbraw/zinc/38/03/35/334380335.db2.gz BBTBJRBVCZAZPO-SFHVURJKSA-N 2 1 323.415 4.148 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ccccc2)cc1 ZINC000342485246 334546764 /nfs/dbraw/zinc/54/67/64/334546764.db2.gz VXHXDJLFUUFQRV-INIZCTEOSA-N 2 1 305.425 4.074 20 0 DIADMP Cc1[nH+]ccn1CCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000342861031 334583595 /nfs/dbraw/zinc/58/35/95/334583595.db2.gz VAKFEPSJVFFSTK-UHFFFAOYSA-N 2 1 319.452 4.284 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000344169741 335227002 /nfs/dbraw/zinc/22/70/02/335227002.db2.gz MOJCAGOJERCWSY-UZLBHIALSA-N 2 1 311.473 4.349 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000345283791 335313558 /nfs/dbraw/zinc/31/35/58/335313558.db2.gz BLCZVFVILVNPOV-JEBQAFNWSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000345283791 335313559 /nfs/dbraw/zinc/31/35/59/335313559.db2.gz BLCZVFVILVNPOV-JEBQAFNWSA-N 2 1 306.881 4.254 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000346165736 335384437 /nfs/dbraw/zinc/38/44/37/335384437.db2.gz FBERFKIYGBFSEG-HXUWFJFHSA-N 2 1 324.472 4.120 20 0 DIADMP CC[N@@H+](CCn1ccnc1C)Cc1ccc(Cl)c(Cl)c1 ZINC000346315465 335399227 /nfs/dbraw/zinc/39/92/27/335399227.db2.gz SHHLBAXIQKGLTF-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP CC[N@H+](CCn1cc[nH+]c1C)Cc1ccc(Cl)c(Cl)c1 ZINC000346315465 335399228 /nfs/dbraw/zinc/39/92/28/335399228.db2.gz SHHLBAXIQKGLTF-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP CCCC[C@@H](COC)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348033546 335546820 /nfs/dbraw/zinc/54/68/20/335546820.db2.gz ARGLXVYLXCBJHD-QAPCUYQASA-N 2 1 315.461 4.037 20 0 DIADMP CC1(C)CCC[C@@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000388892264 335613751 /nfs/dbraw/zinc/61/37/51/335613751.db2.gz LHMIFBVZGHCVFQ-GOSISDBHSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000352365409 336214357 /nfs/dbraw/zinc/21/43/57/336214357.db2.gz RFKDTYSZTCARTJ-UHFFFAOYSA-N 2 1 310.441 4.050 20 0 DIADMP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1cnc(C(C)C)s1 ZINC000532328866 336240680 /nfs/dbraw/zinc/24/06/80/336240680.db2.gz BJBREXVSCALJHV-NVXWUHKLSA-N 2 1 323.550 4.257 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000532461140 336248714 /nfs/dbraw/zinc/24/87/14/336248714.db2.gz FEDQRZSPEKEUDC-JOCHJYFZSA-N 2 1 322.496 4.434 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000532461141 336248829 /nfs/dbraw/zinc/24/88/29/336248829.db2.gz FEDQRZSPEKEUDC-QFIPXVFZSA-N 2 1 322.496 4.434 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000532542148 336254729 /nfs/dbraw/zinc/25/47/29/336254729.db2.gz PENZACQCULRHJG-HMFYCAOWSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000192705889 336258907 /nfs/dbraw/zinc/25/89/07/336258907.db2.gz UTIRAUQWGIVIKY-APGKQEFDSA-N 2 1 300.490 4.031 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000192952545 336285705 /nfs/dbraw/zinc/28/57/05/336285705.db2.gz KJFUTZARPUCDIW-CYBMUJFWSA-N 2 1 323.550 4.272 20 0 DIADMP Cc1cc(NCc2ccccc2C[N@H+]2CCCC[C@H]2C)nc(C)[nH+]1 ZINC000301095686 336289737 /nfs/dbraw/zinc/28/97/37/336289737.db2.gz MJPZKSWQIGPUNA-MRXNPFEDSA-N 2 1 324.472 4.080 20 0 DIADMP Cc1cc(NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)nc(C)[nH+]1 ZINC000301095686 336289738 /nfs/dbraw/zinc/28/97/38/336289738.db2.gz MJPZKSWQIGPUNA-MRXNPFEDSA-N 2 1 324.472 4.080 20 0 DIADMP C[NH+](C)[C@@H](CNc1cc[nH+]c2ccsc21)c1cccs1 ZINC000301377430 336303387 /nfs/dbraw/zinc/30/33/87/336303387.db2.gz WRAWXSYGVMGOSK-ZDUSSCGKSA-N 2 1 303.456 4.073 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CCN(c2ccnc3ccc(Cl)cc32)C1 ZINC000301456863 336307938 /nfs/dbraw/zinc/30/79/38/336307938.db2.gz HUHYHEQRGXHUAQ-AWEZNQCLSA-N 2 1 317.864 4.056 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]c3ccc(Cl)cc32)C1 ZINC000301456863 336307939 /nfs/dbraw/zinc/30/79/39/336307939.db2.gz HUHYHEQRGXHUAQ-AWEZNQCLSA-N 2 1 317.864 4.056 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CCN(c2cc[nH+]c3ccc(Cl)cc32)C1 ZINC000301456863 336307940 /nfs/dbraw/zinc/30/79/40/336307940.db2.gz HUHYHEQRGXHUAQ-AWEZNQCLSA-N 2 1 317.864 4.056 20 0 DIADMP Clc1c[nH+]ccc1NCC1CC[NH+](Cc2cccs2)CC1 ZINC000301497740 336310419 /nfs/dbraw/zinc/31/04/19/336310419.db2.gz DDCBANQZCPCVLK-UHFFFAOYSA-N 2 1 321.877 4.121 20 0 DIADMP Cc1ccccc1C[NH+]1CCC(Nc2cc[nH+]cc2Cl)CC1 ZINC000301511774 336311665 /nfs/dbraw/zinc/31/16/65/336311665.db2.gz KQOPSYOWJMEQSW-UHFFFAOYSA-N 2 1 315.848 4.120 20 0 DIADMP Clc1c[nH+]ccc1NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000301602335 336317687 /nfs/dbraw/zinc/31/76/87/336317687.db2.gz WFMGZCALFGFNQX-AWEZNQCLSA-N 2 1 307.850 4.046 20 0 DIADMP CC(C)[N@H+](C)Cc1ccccc1CNc1[nH]c2ccccc2[nH+]1 ZINC000301892750 336336579 /nfs/dbraw/zinc/33/65/79/336336579.db2.gz SEFIPLYLTQBBAC-UHFFFAOYSA-N 2 1 308.429 4.015 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1CNc1[nH]c2ccccc2[nH+]1 ZINC000301892750 336336580 /nfs/dbraw/zinc/33/65/80/336336580.db2.gz SEFIPLYLTQBBAC-UHFFFAOYSA-N 2 1 308.429 4.015 20 0 DIADMP Cc1cc(NCc2ccccc2C[N@@H+](C)Cc2ccco2)cc[nH+]1 ZINC000302534742 336361143 /nfs/dbraw/zinc/36/11/43/336361143.db2.gz DOSOJRMSFPZSKH-UHFFFAOYSA-N 2 1 321.424 4.227 20 0 DIADMP Cc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)ccc1F ZINC000105424362 336387511 /nfs/dbraw/zinc/38/75/11/336387511.db2.gz XYVMLGMOUNEREV-UHFFFAOYSA-N 2 1 314.448 4.264 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472375 336389291 /nfs/dbraw/zinc/38/92/91/336389291.db2.gz BGPNMCSGHUBEIC-CVEARBPZSA-N 2 1 310.441 4.082 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472375 336389292 /nfs/dbraw/zinc/38/92/92/336389292.db2.gz BGPNMCSGHUBEIC-CVEARBPZSA-N 2 1 310.441 4.082 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c2ccsc2S1 ZINC000361973873 336780694 /nfs/dbraw/zinc/78/06/94/336780694.db2.gz YXDFZXFXMDVLAA-CXTNEJHOSA-N 2 1 310.532 4.136 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CC(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584365346 337102207 /nfs/dbraw/zinc/10/22/07/337102207.db2.gz QPPMUJLHEGMSGW-OEXSPLCWSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CC(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584365346 337102208 /nfs/dbraw/zinc/10/22/08/337102208.db2.gz QPPMUJLHEGMSGW-OEXSPLCWSA-N 2 1 320.480 4.358 20 0 DIADMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1 ZINC000173386241 337135011 /nfs/dbraw/zinc/13/50/11/337135011.db2.gz AGIDINBZUUYJHU-DYVFJYSZSA-N 2 1 305.853 4.222 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000178699519 337166118 /nfs/dbraw/zinc/16/61/18/337166118.db2.gz VKQKFKXKGMZQJF-LSDHHAIUSA-N 2 1 317.502 4.290 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000183190877 337190330 /nfs/dbraw/zinc/19/03/30/337190330.db2.gz LIQDORYVKOIOSF-HEHGZKQESA-N 2 1 321.534 4.064 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1CN[C@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135700 337243319 /nfs/dbraw/zinc/24/33/19/337243319.db2.gz CLTNQQAVFVFMTO-UTKZUKDTSA-N 2 1 323.484 4.274 20 0 DIADMP CCC[N@H+]1CCC[C@H]1CN[C@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135700 337243320 /nfs/dbraw/zinc/24/33/20/337243320.db2.gz CLTNQQAVFVFMTO-UTKZUKDTSA-N 2 1 323.484 4.274 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135700 337243321 /nfs/dbraw/zinc/24/33/21/337243321.db2.gz CLTNQQAVFVFMTO-UTKZUKDTSA-N 2 1 323.484 4.274 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135700 337243322 /nfs/dbraw/zinc/24/33/22/337243322.db2.gz CLTNQQAVFVFMTO-UTKZUKDTSA-N 2 1 323.484 4.274 20 0 DIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc(Cl)s1 ZINC000038041954 337263806 /nfs/dbraw/zinc/26/38/06/337263806.db2.gz UVIYTWJTIWRZNC-QWHCGFSZSA-N 2 1 300.899 4.174 20 0 DIADMP CCc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000392672594 337272814 /nfs/dbraw/zinc/27/28/14/337272814.db2.gz ZDRXOWLPVCKRDK-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000398033076 337304871 /nfs/dbraw/zinc/30/48/71/337304871.db2.gz OGSQBBQPBZBHPP-DXIQSLLYSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000398033076 337304872 /nfs/dbraw/zinc/30/48/72/337304872.db2.gz OGSQBBQPBZBHPP-DXIQSLLYSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1nccc2ccccc21 ZINC000584439554 337325696 /nfs/dbraw/zinc/32/56/96/337325696.db2.gz APCGCNXWUYCIOI-IRXDYDNUSA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1nccc2ccccc21 ZINC000584439554 337325697 /nfs/dbraw/zinc/32/56/97/337325697.db2.gz APCGCNXWUYCIOI-IRXDYDNUSA-N 2 1 311.473 4.150 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccccc1 ZINC000128107033 337424015 /nfs/dbraw/zinc/42/40/15/337424015.db2.gz FZQOLXNWPRJPCU-LJQANCHMSA-N 2 1 309.457 4.100 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422735413 337684436 /nfs/dbraw/zinc/68/44/36/337684436.db2.gz UQDQDOILUOCISP-UIFIKXQLSA-N 2 1 308.469 4.091 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)[C@@H]1CCC[NH2+]C1 ZINC000422783220 337686376 /nfs/dbraw/zinc/68/63/76/337686376.db2.gz NTYHZQOQGHOVCY-GRYCIOLGSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422836187 337688693 /nfs/dbraw/zinc/68/86/93/337688693.db2.gz JMIOUYMYZLHCOA-FBFWQHAYSA-N 2 1 310.416 4.184 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(N2CCCC2)c1 ZINC000422876505 337689679 /nfs/dbraw/zinc/68/96/79/337689679.db2.gz QFMBJPYWELYTHX-JHVJFLLYSA-N 2 1 321.468 4.082 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccc(OC3CCCC3)cc2)c2ccccc21 ZINC000422950830 337694560 /nfs/dbraw/zinc/69/45/60/337694560.db2.gz ZDEONOYLPRDVSV-RTWAWAEBSA-N 2 1 322.452 4.242 20 0 DIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423053939 337697319 /nfs/dbraw/zinc/69/73/19/337697319.db2.gz BGZJOKQDRLMADD-SJORKVTESA-N 2 1 320.358 4.248 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)c2ccccc21 ZINC000423167861 337702250 /nfs/dbraw/zinc/70/22/50/337702250.db2.gz FWDGRIVKIXAHST-ZFVVBOAOSA-N 2 1 316.807 4.069 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000423336360 337712651 /nfs/dbraw/zinc/71/26/51/337712651.db2.gz SKDBTOVMKQJAAA-NHYWBVRUSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cc2c(ccc3ccccc23)o1 ZINC000423376789 337717272 /nfs/dbraw/zinc/71/72/72/337717272.db2.gz LFDOZMDDRSCWBE-FMKPAKJESA-N 2 1 308.425 4.377 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]1 ZINC000423393043 337718637 /nfs/dbraw/zinc/71/86/37/337718637.db2.gz YBNJRZGYBVZRHQ-ZMYBRWDISA-N 2 1 314.860 4.160 20 0 DIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423479466 337721898 /nfs/dbraw/zinc/72/18/98/337721898.db2.gz VIDOPGWYFDHJOK-MQIPJXDCSA-N 2 1 308.878 4.011 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2)cc1 ZINC000086279406 337853166 /nfs/dbraw/zinc/85/31/66/337853166.db2.gz OPEMPHSYAUUVCU-MRXNPFEDSA-N 2 1 305.425 4.340 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCCn1cc[nH+]c1C ZINC000119336982 337857747 /nfs/dbraw/zinc/85/77/47/337857747.db2.gz OBVICUPEGLWKHF-SQFISAMPSA-N 2 1 317.864 4.318 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2ccccc2o1 ZINC000119855793 337866610 /nfs/dbraw/zinc/86/66/10/337866610.db2.gz RIBHECWLHAOJMJ-CQSZACIVSA-N 2 1 300.446 4.346 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000119951067 337868019 /nfs/dbraw/zinc/86/80/19/337868019.db2.gz SYPPRGOPPPJTHU-KRWDZBQOSA-N 2 1 324.468 4.010 20 0 DIADMP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000119951504 337868152 /nfs/dbraw/zinc/86/81/52/337868152.db2.gz KEKKQAWJOPOGFQ-QGZVFWFLSA-N 2 1 324.468 4.010 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CC(C)(C)Cc3occc32)CC1 ZINC000089513091 337870483 /nfs/dbraw/zinc/87/04/83/337870483.db2.gz CRVKPUVSKHYEGP-MRXNPFEDSA-N 2 1 304.478 4.146 20 0 DIADMP CCOc1ccccc1[C@@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000120544285 337876520 /nfs/dbraw/zinc/87/65/20/337876520.db2.gz LKUVWVXQCKQLJD-CQSZACIVSA-N 2 1 304.478 4.045 20 0 DIADMP CCCn1cc[nH+]c1CCCN(C)c1cc(C)[nH+]c2ccccc21 ZINC000428651666 338057758 /nfs/dbraw/zinc/05/77/58/338057758.db2.gz MEAXHKLZLIZHGQ-UHFFFAOYSA-N 2 1 322.456 4.219 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000428856735 338062642 /nfs/dbraw/zinc/06/26/42/338062642.db2.gz NPWTWXHYPWVACM-GFCCVEGCSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000428856735 338062643 /nfs/dbraw/zinc/06/26/43/338062643.db2.gz NPWTWXHYPWVACM-GFCCVEGCSA-N 2 1 320.424 4.121 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000429228698 338073924 /nfs/dbraw/zinc/07/39/24/338073924.db2.gz ATCRDBAXVZYXLY-LJQANCHMSA-N 2 1 311.473 4.235 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000429228698 338073925 /nfs/dbraw/zinc/07/39/25/338073925.db2.gz ATCRDBAXVZYXLY-LJQANCHMSA-N 2 1 311.473 4.235 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](CC)c1ccc(F)cc1 ZINC000429248277 338074737 /nfs/dbraw/zinc/07/47/37/338074737.db2.gz VOAHEBXIIBYVDZ-SFHVURJKSA-N 2 1 317.452 4.448 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](CC)c1ccc(F)cc1 ZINC000429248277 338074738 /nfs/dbraw/zinc/07/47/38/338074738.db2.gz VOAHEBXIIBYVDZ-SFHVURJKSA-N 2 1 317.452 4.448 20 0 DIADMP CC(C)CCC[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000429328242 338077823 /nfs/dbraw/zinc/07/78/23/338077823.db2.gz AUSDEXISJSKEMJ-UHFFFAOYSA-N 2 1 303.494 4.056 20 0 DIADMP CCCC[C@@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccccc1 ZINC000432441062 338156578 /nfs/dbraw/zinc/15/65/78/338156578.db2.gz JJMAJOSMEQCGLJ-UYAOXDASSA-N 2 1 318.505 4.008 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000432793722 338168050 /nfs/dbraw/zinc/16/80/50/338168050.db2.gz QGRRYESFSCSFDG-OAHLLOKOSA-N 2 1 316.420 4.002 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000432793722 338168051 /nfs/dbraw/zinc/16/80/51/338168051.db2.gz QGRRYESFSCSFDG-OAHLLOKOSA-N 2 1 316.420 4.002 20 0 DIADMP CCCCCOc1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000432801819 338168517 /nfs/dbraw/zinc/16/85/17/338168517.db2.gz XYECCUOVIBXEMJ-IBGZPJMESA-N 2 1 318.505 4.172 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000432801819 338168518 /nfs/dbraw/zinc/16/85/18/338168518.db2.gz XYECCUOVIBXEMJ-IBGZPJMESA-N 2 1 318.505 4.172 20 0 DIADMP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311847 338191475 /nfs/dbraw/zinc/19/14/75/338191475.db2.gz OCDSLEBEVDIWOW-WMZOPIPTSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311847 338191476 /nfs/dbraw/zinc/19/14/76/338191476.db2.gz OCDSLEBEVDIWOW-WMZOPIPTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311847 338191477 /nfs/dbraw/zinc/19/14/77/338191477.db2.gz OCDSLEBEVDIWOW-WMZOPIPTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311847 338191478 /nfs/dbraw/zinc/19/14/78/338191478.db2.gz OCDSLEBEVDIWOW-WMZOPIPTSA-N 2 1 306.881 4.004 20 0 DIADMP Clc1cccc([C@H]2CC[N@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000433320561 338192167 /nfs/dbraw/zinc/19/21/67/338192167.db2.gz SKIJDYLMWAQCQW-KRWDZBQOSA-N 2 1 306.881 4.005 20 0 DIADMP Clc1cccc([C@H]2CC[N@@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000433320561 338192168 /nfs/dbraw/zinc/19/21/68/338192168.db2.gz SKIJDYLMWAQCQW-KRWDZBQOSA-N 2 1 306.881 4.005 20 0 DIADMP CCc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000434688494 338223583 /nfs/dbraw/zinc/22/35/83/338223583.db2.gz MVKMDUQAGGKTMC-UHFFFAOYSA-N 2 1 323.484 4.161 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@H]3C[C@H](c4ccccc4)C3)CC2)cc1 ZINC000435786742 338249194 /nfs/dbraw/zinc/24/91/94/338249194.db2.gz JHVBFCUACXWWLL-AQYVVDRMSA-N 2 1 320.480 4.187 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436271236 338264728 /nfs/dbraw/zinc/26/47/28/338264728.db2.gz QNRXNAPROKGYMX-OAHLLOKOSA-N 2 1 317.452 4.051 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)CCc3ccccc32)CC[N@@H+]1C ZINC000436295827 338266955 /nfs/dbraw/zinc/26/69/55/338266955.db2.gz SGWWGTVKYKSTDU-AYBZRNKSSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)CCc3ccccc32)CC[N@H+]1C ZINC000436295827 338266956 /nfs/dbraw/zinc/26/69/56/338266956.db2.gz SGWWGTVKYKSTDU-AYBZRNKSSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000438089945 338330822 /nfs/dbraw/zinc/33/08/22/338330822.db2.gz XWIJEJLGJKHANH-IAGOWNOFSA-N 2 1 306.469 4.001 20 0 DIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438215241 338336798 /nfs/dbraw/zinc/33/67/98/338336798.db2.gz YRXXRZVCVGJKPE-QRJUGERDSA-N 2 1 320.443 4.064 20 0 DIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438215241 338336799 /nfs/dbraw/zinc/33/67/99/338336799.db2.gz YRXXRZVCVGJKPE-QRJUGERDSA-N 2 1 320.443 4.064 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000438844994 338353578 /nfs/dbraw/zinc/35/35/78/338353578.db2.gz XJWYMZLSVXVBEU-UFYCRDLUSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000438844994 338353579 /nfs/dbraw/zinc/35/35/79/338353579.db2.gz XJWYMZLSVXVBEU-UFYCRDLUSA-N 2 1 323.484 4.070 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC000439311637 338366675 /nfs/dbraw/zinc/36/66/75/338366675.db2.gz CDBGFMFYWIEMSF-ICSRJNTNSA-N 2 1 300.490 4.131 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000442867284 338436283 /nfs/dbraw/zinc/43/62/83/338436283.db2.gz YHBIKFCKHUPVLJ-OAHLLOKOSA-N 2 1 306.519 4.181 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](C3CC3)CC2)ccc1-c1ccccc1 ZINC000459506841 339032997 /nfs/dbraw/zinc/03/29/97/339032997.db2.gz UXUMTXXHFMVMMO-UHFFFAOYSA-N 2 1 320.480 4.378 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1cccc(Cl)c1 ZINC000459549572 339035241 /nfs/dbraw/zinc/03/52/41/339035241.db2.gz DNMUZGUJUZAHHO-UHFFFAOYSA-N 2 1 319.880 4.054 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1cccc(Cl)c1 ZINC000459549572 339035242 /nfs/dbraw/zinc/03/52/42/339035242.db2.gz DNMUZGUJUZAHHO-UHFFFAOYSA-N 2 1 319.880 4.054 20 0 DIADMP C[C@H](CCc1ccc(Cl)s1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459723577 339044343 /nfs/dbraw/zinc/04/43/43/339044343.db2.gz AECILRUJFIDFOA-ZIAGYGMSSA-N 2 1 314.926 4.044 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](C)C2(CCCCC2)C1 ZINC000462465228 339079391 /nfs/dbraw/zinc/07/93/91/339079391.db2.gz CYADALPVQYTDKO-KRWDZBQOSA-N 2 1 303.494 4.264 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](C)C2(CCCCC2)C1 ZINC000462465228 339079392 /nfs/dbraw/zinc/07/93/92/339079392.db2.gz CYADALPVQYTDKO-KRWDZBQOSA-N 2 1 303.494 4.264 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](C)C2(CCCCC2)C1 ZINC000462465229 339079404 /nfs/dbraw/zinc/07/94/04/339079404.db2.gz CYADALPVQYTDKO-QGZVFWFLSA-N 2 1 303.494 4.264 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](C)C2(CCCCC2)C1 ZINC000462465229 339079405 /nfs/dbraw/zinc/07/94/05/339079405.db2.gz CYADALPVQYTDKO-QGZVFWFLSA-N 2 1 303.494 4.264 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000462672796 339083805 /nfs/dbraw/zinc/08/38/05/339083805.db2.gz GGKFJBZUFYNFFI-UWVAXJGDSA-N 2 1 300.490 4.197 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(-c2cc(C)cc(C)c2)cc1 ZINC000462773790 339087906 /nfs/dbraw/zinc/08/79/06/339087906.db2.gz MLUNGPAKSGIQIK-UHFFFAOYSA-N 2 1 319.452 4.265 20 0 DIADMP C[NH+](C)[C@H](CNc1cc[nH+]c2ccsc21)c1ccc(F)cc1 ZINC000462775312 339087970 /nfs/dbraw/zinc/08/79/70/339087970.db2.gz GDNNSLIIEQGNJN-MRXNPFEDSA-N 2 1 315.417 4.150 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000462780838 339088128 /nfs/dbraw/zinc/08/81/28/339088128.db2.gz ZOCGEDZRURRZMM-GIVPXCGWSA-N 2 1 314.517 4.109 20 0 DIADMP FCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000462821693 339092065 /nfs/dbraw/zinc/09/20/65/339092065.db2.gz MKXPYFUNEXLZTO-XUVXKRRUSA-N 2 1 318.480 4.017 20 0 DIADMP Cc1cc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462888221 339096317 /nfs/dbraw/zinc/09/63/17/339096317.db2.gz DWUNWBAOGAYJQS-DZGCQCFKSA-N 2 1 317.864 4.400 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463117789 339106439 /nfs/dbraw/zinc/10/64/39/339106439.db2.gz VBIAJRSOUXEDHD-KNQAVFIVSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463117789 339106440 /nfs/dbraw/zinc/10/64/40/339106440.db2.gz VBIAJRSOUXEDHD-KNQAVFIVSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C1CCCC1 ZINC000463129166 339106573 /nfs/dbraw/zinc/10/65/73/339106573.db2.gz HLXMACWTTXJCSM-INIZCTEOSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000463141517 339107055 /nfs/dbraw/zinc/10/70/55/339107055.db2.gz CCJVSHSZFWCPOF-UEXGIBASSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000463141517 339107056 /nfs/dbraw/zinc/10/70/56/339107056.db2.gz CCJVSHSZFWCPOF-UEXGIBASSA-N 2 1 308.469 4.390 20 0 DIADMP CC[C@@H](C)C[C@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463193134 339108717 /nfs/dbraw/zinc/10/87/17/339108717.db2.gz URXPLVMRJJGXPD-SJORKVTESA-N 2 1 320.496 4.247 20 0 DIADMP CC[C@H]1CCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463206955 339109351 /nfs/dbraw/zinc/10/93/51/339109351.db2.gz RIJWAKHAXHOXLW-PXNSSMCTSA-N 2 1 318.480 4.001 20 0 DIADMP CC(C)CSCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463281077 339113137 /nfs/dbraw/zinc/11/31/37/339113137.db2.gz JRKFTFMBQVWRSV-PKOBYXMFSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)CSCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463281077 339113138 /nfs/dbraw/zinc/11/31/38/339113138.db2.gz JRKFTFMBQVWRSV-PKOBYXMFSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463281493 339113213 /nfs/dbraw/zinc/11/32/13/339113213.db2.gz KUKPKMJRGASDLY-INIZCTEOSA-N 2 1 318.480 4.001 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)C1 ZINC000464082609 339133667 /nfs/dbraw/zinc/13/36/67/339133667.db2.gz PEAPKWNVMKDVPO-YZGWKJHDSA-N 2 1 314.517 4.279 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1CCCCC1 ZINC000464841306 339156803 /nfs/dbraw/zinc/15/68/03/339156803.db2.gz XQDQMFQGFFMZLO-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCCCC1 ZINC000464841306 339156804 /nfs/dbraw/zinc/15/68/04/339156804.db2.gz XQDQMFQGFFMZLO-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCCCC1 ZINC000464841306 339156805 /nfs/dbraw/zinc/15/68/05/339156805.db2.gz XQDQMFQGFFMZLO-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000467307768 339230909 /nfs/dbraw/zinc/23/09/09/339230909.db2.gz HLVIFTZIJVEANS-GOSISDBHSA-N 2 1 306.881 4.255 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000467350755 339233232 /nfs/dbraw/zinc/23/32/32/339233232.db2.gz UCYRLZYCXUGUKE-LJQANCHMSA-N 2 1 318.892 4.423 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000467435422 339238475 /nfs/dbraw/zinc/23/84/75/339238475.db2.gz YDQUSKDSGOWTNY-FOOPKSTHSA-N 2 1 324.871 4.043 20 0 DIADMP CCCCOc1ccccc1CN(C)[C@H]1CC[N@@H+](CC)[C@H](C)C1 ZINC000468393118 339261518 /nfs/dbraw/zinc/26/15/18/339261518.db2.gz RUPHDEMKOOSRAB-MJGOQNOKSA-N 2 1 318.505 4.170 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)C1 ZINC000469126455 339280824 /nfs/dbraw/zinc/28/08/24/339280824.db2.gz XYGXWFNNZFLEFU-MAUKXSAKSA-N 2 1 306.881 4.113 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469741836 339297447 /nfs/dbraw/zinc/29/74/47/339297447.db2.gz MMBDRXCVFJQYKW-WFASDCNBSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469741836 339297448 /nfs/dbraw/zinc/29/74/48/339297448.db2.gz MMBDRXCVFJQYKW-WFASDCNBSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000469847653 339302424 /nfs/dbraw/zinc/30/24/24/339302424.db2.gz ZKQDMQOCISUIDP-CHWSQXEVSA-N 2 1 320.889 4.238 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c1 ZINC000469991321 339307045 /nfs/dbraw/zinc/30/70/45/339307045.db2.gz ISYDAYYDXQGMPV-WCRBZPEASA-N 2 1 320.480 4.377 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2ccc(-c3cccc(Cl)c3)s2)CC1 ZINC000469998284 339307654 /nfs/dbraw/zinc/30/76/54/339307654.db2.gz FONBEJLBMOYJNE-UHFFFAOYSA-N 2 1 320.889 4.252 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000470016504 339308735 /nfs/dbraw/zinc/30/87/35/339308735.db2.gz UVJZEAGSWWASLC-CYBMUJFWSA-N 2 1 320.889 4.110 20 0 DIADMP FC(F)c1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764490 339327084 /nfs/dbraw/zinc/32/70/84/339327084.db2.gz JKQHUYYYAMZHMM-FUHWJXTLSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764490 339327085 /nfs/dbraw/zinc/32/70/85/339327085.db2.gz JKQHUYYYAMZHMM-FUHWJXTLSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000470764490 339327086 /nfs/dbraw/zinc/32/70/86/339327086.db2.gz JKQHUYYYAMZHMM-FUHWJXTLSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000470764490 339327087 /nfs/dbraw/zinc/32/70/87/339327087.db2.gz JKQHUYYYAMZHMM-FUHWJXTLSA-N 2 1 320.427 4.073 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](CCc2ccc3ccccc3c2)C1 ZINC000470957665 339332962 /nfs/dbraw/zinc/33/29/62/339332962.db2.gz FNLFKKHYVPFFLB-FQEVSTJZSA-N 2 1 322.496 4.046 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](CCc2ccc3ccccc3c2)C1 ZINC000470957665 339332963 /nfs/dbraw/zinc/33/29/63/339332963.db2.gz FNLFKKHYVPFFLB-FQEVSTJZSA-N 2 1 322.496 4.046 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](CCc2ccc3ccccc3c2)C1 ZINC000470957665 339332964 /nfs/dbraw/zinc/33/29/64/339332964.db2.gz FNLFKKHYVPFFLB-FQEVSTJZSA-N 2 1 322.496 4.046 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(Cc2ccccc2)CCCCC1 ZINC000471594002 339348583 /nfs/dbraw/zinc/34/85/83/339348583.db2.gz NVOADCOBCGLGIO-UYAOXDASSA-N 2 1 314.517 4.109 20 0 DIADMP CCSc1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000473146484 339382961 /nfs/dbraw/zinc/38/29/61/339382961.db2.gz MMTZKMRWVWYRIJ-GOSISDBHSA-N 2 1 318.530 4.106 20 0 DIADMP CCSc1cccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000473146484 339382962 /nfs/dbraw/zinc/38/29/62/339382962.db2.gz MMTZKMRWVWYRIJ-GOSISDBHSA-N 2 1 318.530 4.106 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+](C)CC2)C2CCCCC2)cc1 ZINC000479259497 339529986 /nfs/dbraw/zinc/52/99/86/339529986.db2.gz LRVHDQAKUNREOT-FQEVSTJZSA-N 2 1 300.490 4.300 20 0 DIADMP Cc1ccc(C[C@H]([NH2+]C2CC[NH+](C)CC2)c2ccc(C)cc2)cc1 ZINC000480170415 339561844 /nfs/dbraw/zinc/56/18/44/339561844.db2.gz NEZAQIHKQIQFEA-QFIPXVFZSA-N 2 1 322.496 4.271 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H](C1CCCCC1)[NH+](C)C ZINC000480219151 339563956 /nfs/dbraw/zinc/56/39/56/339563956.db2.gz CIFDRHULGTVGDZ-UKRRQHHQSA-N 2 1 308.432 4.208 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000482569353 339636506 /nfs/dbraw/zinc/63/65/06/339636506.db2.gz NWNAAIGBTHETDX-GOSISDBHSA-N 2 1 306.881 4.255 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCC(C)(C)C[C@@H]3C)CC2)[nH+]c1 ZINC000483500157 339667203 /nfs/dbraw/zinc/66/72/03/339667203.db2.gz GIPLXCHLIOMRFS-WMZOPIPTSA-N 2 1 315.505 4.163 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(C)cc1 ZINC000484178114 339682514 /nfs/dbraw/zinc/68/25/14/339682514.db2.gz WWRZMQQHRGBYSY-FQEVSTJZSA-N 2 1 323.484 4.408 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000484486099 339687534 /nfs/dbraw/zinc/68/75/34/339687534.db2.gz FCRABZDRBBVSHN-JYJNAYRXSA-N 2 1 300.446 4.265 20 0 DIADMP Fc1cc(Cl)cc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)c1 ZINC000485683087 339709136 /nfs/dbraw/zinc/70/91/36/339709136.db2.gz HJLWZBJIKBCUFQ-UHFFFAOYSA-N 2 1 324.871 4.223 20 0 DIADMP CC(C)[C@@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccc(F)cn1 ZINC000498931984 340026343 /nfs/dbraw/zinc/02/63/43/340026343.db2.gz WBQLERGYZKWYFW-GOSISDBHSA-N 2 1 309.473 4.016 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]C(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000499049037 340028371 /nfs/dbraw/zinc/02/83/71/340028371.db2.gz WAJORRFIPSYJGU-UHFFFAOYSA-N 2 1 312.244 4.023 20 0 DIADMP C[C@H](C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000501077771 340073940 /nfs/dbraw/zinc/07/39/40/340073940.db2.gz OWZFCCBGCNWMAC-GOSISDBHSA-N 2 1 323.484 4.034 20 0 DIADMP C(C[NH+]1CCC([NH+]2CCCCC2)CC1)SC1CCCCC1 ZINC000501080232 340073948 /nfs/dbraw/zinc/07/39/48/340073948.db2.gz SHZLRKGZMKTMMI-UHFFFAOYSA-N 2 1 310.551 4.003 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3C[C@]32C)CC1 ZINC000502240911 340097477 /nfs/dbraw/zinc/09/74/77/340097477.db2.gz KDWDDWMYVJEUJF-CEWLAPEOSA-N 2 1 312.501 4.128 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1C ZINC000502328357 340099966 /nfs/dbraw/zinc/09/99/66/340099966.db2.gz VRSVTVFGRYKVSD-LJQANCHMSA-N 2 1 323.484 4.216 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502458307 340104466 /nfs/dbraw/zinc/10/44/66/340104466.db2.gz CLXYJJRXZCEOBP-LPHOPBHVSA-N 2 1 312.457 4.069 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502458307 340104467 /nfs/dbraw/zinc/10/44/67/340104467.db2.gz CLXYJJRXZCEOBP-LPHOPBHVSA-N 2 1 312.457 4.069 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000502691104 340110727 /nfs/dbraw/zinc/11/07/27/340110727.db2.gz GHJLAHBZFWINEM-XJKSGUPXSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@H]1CCC[NH+]1C ZINC000502691104 340110728 /nfs/dbraw/zinc/11/07/28/340110728.db2.gz GHJLAHBZFWINEM-XJKSGUPXSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@H]1CCC[N@@H+]1C ZINC000502691104 340110729 /nfs/dbraw/zinc/11/07/29/340110729.db2.gz GHJLAHBZFWINEM-XJKSGUPXSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@H]1CCC[N@H+]1C ZINC000502691104 340110730 /nfs/dbraw/zinc/11/07/30/340110730.db2.gz GHJLAHBZFWINEM-XJKSGUPXSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000502703029 340111417 /nfs/dbraw/zinc/11/14/17/340111417.db2.gz UPTXRQXOIJPLEG-CJNGLKHVSA-N 2 1 314.395 4.183 20 0 DIADMP Fc1cc(-c2ccccc2)ccc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000503561926 340130710 /nfs/dbraw/zinc/13/07/10/340130710.db2.gz HAUDTIAHSATMRN-UXHICEINSA-N 2 1 324.443 4.209 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)C/C=C/c2ccc(Cl)cc2)CC1 ZINC000506327848 340192424 /nfs/dbraw/zinc/19/24/24/340192424.db2.gz VBBSDHXAPKAICR-SNAWJCMRSA-N 2 1 306.881 4.158 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)C/C=C/c2ccc(Cl)cc2)CC1 ZINC000506327848 340192425 /nfs/dbraw/zinc/19/24/25/340192425.db2.gz VBBSDHXAPKAICR-SNAWJCMRSA-N 2 1 306.881 4.158 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C/C=C\c2ccccc2)C1 ZINC000506564014 340196816 /nfs/dbraw/zinc/19/68/16/340196816.db2.gz GXOPLCMQMYJURM-LTKUVUDQSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C/C=C\c2ccccc2)C1 ZINC000506564014 340196817 /nfs/dbraw/zinc/19/68/17/340196817.db2.gz GXOPLCMQMYJURM-LTKUVUDQSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C/C=C\c2ccccc2)C1 ZINC000506564014 340196818 /nfs/dbraw/zinc/19/68/18/340196818.db2.gz GXOPLCMQMYJURM-LTKUVUDQSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1 ZINC000506564014 340196819 /nfs/dbraw/zinc/19/68/19/340196819.db2.gz GXOPLCMQMYJURM-LTKUVUDQSA-N 2 1 312.501 4.286 20 0 DIADMP CC[NH+](CC)CC1CC[NH+](Cc2cccc(Cl)c2F)CC1 ZINC000506893233 340203224 /nfs/dbraw/zinc/20/32/24/340203224.db2.gz RZHMGUWDXWYQOQ-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000507833113 340233668 /nfs/dbraw/zinc/23/36/68/340233668.db2.gz JVMKAWRNQNBKSY-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000507833113 340233669 /nfs/dbraw/zinc/23/36/69/340233669.db2.gz JVMKAWRNQNBKSY-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(-c2cccc(C[NH+]3CCC([NH+](C)C)CC3)c2)cc1 ZINC000508040023 340238097 /nfs/dbraw/zinc/23/80/97/340238097.db2.gz UDONFNDFFDHBPV-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP C[C@@H]([NH2+]C1(c2ccccc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508713114 340251401 /nfs/dbraw/zinc/25/14/01/340251401.db2.gz SCWUOILNHMHETL-QUCCMNQESA-N 2 1 320.480 4.176 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC(C)(C)C1 ZINC000302796086 340282178 /nfs/dbraw/zinc/28/21/78/340282178.db2.gz UUTSSOHFFCVTHG-YLJYHZDGSA-N 2 1 314.517 4.455 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cccc(-c2ccc(C)cc2)c1 ZINC000509976473 340284440 /nfs/dbraw/zinc/28/44/40/340284440.db2.gz GONYMKWAOKLLAY-UHFFFAOYSA-N 2 1 319.452 4.347 20 0 DIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)CCC2 ZINC000510582488 340303325 /nfs/dbraw/zinc/30/33/25/340303325.db2.gz DXRZWSWARLROOY-UYAOXDASSA-N 2 1 316.464 4.153 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303161452 340307544 /nfs/dbraw/zinc/30/75/44/340307544.db2.gz HDBIHFYEIDZCAE-MOPGFXCFSA-N 2 1 300.490 4.336 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CC[C@H]3C3CCC3)C2)c1 ZINC000510723822 340308185 /nfs/dbraw/zinc/30/81/85/340308185.db2.gz UBTUCYQATYTYCX-MNEFBYGVSA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CC[C@H]3C3CCC3)C2)c1 ZINC000510723822 340308186 /nfs/dbraw/zinc/30/81/86/340308186.db2.gz UBTUCYQATYTYCX-MNEFBYGVSA-N 2 1 318.530 4.128 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000510737012 340308840 /nfs/dbraw/zinc/30/88/40/340308840.db2.gz QYIFPUXPBQJAHX-UXHICEINSA-N 2 1 300.490 4.195 20 0 DIADMP CC(C)[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000303219325 340313367 /nfs/dbraw/zinc/31/33/67/340313367.db2.gz ADRBJOWIZUTCFD-TZIWHRDSSA-N 2 1 314.517 4.455 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000510931769 340315289 /nfs/dbraw/zinc/31/52/89/340315289.db2.gz JXVMRYMEXQGBGX-ZWKOTPCHSA-N 2 1 317.864 4.161 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC12CCC2 ZINC000510962025 340316538 /nfs/dbraw/zinc/31/65/38/340316538.db2.gz YJZYVFPBBYJBGQ-MOPGFXCFSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC12CCC2 ZINC000510962025 340316539 /nfs/dbraw/zinc/31/65/39/340316539.db2.gz YJZYVFPBBYJBGQ-MOPGFXCFSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@H]1C1CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511007314 340318000 /nfs/dbraw/zinc/31/80/00/340318000.db2.gz BFPGIWBDBOGUKP-LRGNLBRXSA-N 2 1 312.501 4.065 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511092579 340320469 /nfs/dbraw/zinc/32/04/69/340320469.db2.gz OTNWOTJXSPQRNF-LPHOPBHVSA-N 2 1 322.443 4.033 20 0 DIADMP CC[NH+]1CCC(N(C)Cc2ccc(SC(C)C)cc2)CC1 ZINC000511144035 340322247 /nfs/dbraw/zinc/32/22/47/340322247.db2.gz PSYDIXOWJXRJEH-UHFFFAOYSA-N 2 1 306.519 4.103 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(SC(C)C)cc2)CC1 ZINC000511144035 340322248 /nfs/dbraw/zinc/32/22/48/340322248.db2.gz PSYDIXOWJXRJEH-UHFFFAOYSA-N 2 1 306.519 4.103 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(SC(C)C)cc2)CC1 ZINC000511144035 340322249 /nfs/dbraw/zinc/32/22/49/340322249.db2.gz PSYDIXOWJXRJEH-UHFFFAOYSA-N 2 1 306.519 4.103 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+]CC2CCC(C(C)(C)C)CC2)s1 ZINC000512041879 340346378 /nfs/dbraw/zinc/34/63/78/340346378.db2.gz VBKKVNKKDAXZRO-UHFFFAOYSA-N 2 1 323.550 4.147 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cccc(F)c2F)C1 ZINC000512194456 340351797 /nfs/dbraw/zinc/35/17/97/340351797.db2.gz LAKGLADFDFJXGT-HOTGVXAUSA-N 2 1 322.443 4.051 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512377705 340359410 /nfs/dbraw/zinc/35/94/10/340359410.db2.gz JXORJGPUKFKCJN-HOCLYGCPSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512396211 340360472 /nfs/dbraw/zinc/36/04/72/340360472.db2.gz JUDRVGUNMAKQLP-GOEBONIOSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512396211 340360473 /nfs/dbraw/zinc/36/04/73/340360473.db2.gz JUDRVGUNMAKQLP-GOEBONIOSA-N 2 1 306.881 4.083 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc(Cl)ccc2Cl)CC1 ZINC000512443385 340362008 /nfs/dbraw/zinc/36/20/08/340362008.db2.gz BLPCRMDKDPRYRQ-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2cc(Cl)ccc2Cl)CC1 ZINC000512443385 340362009 /nfs/dbraw/zinc/36/20/09/340362009.db2.gz BLPCRMDKDPRYRQ-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000173388737 340364065 /nfs/dbraw/zinc/36/40/65/340364065.db2.gz IESXJZHEBZRHFF-HOTGVXAUSA-N 2 1 306.519 4.180 20 0 DIADMP Cc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c(C)c1 ZINC000512808252 340378581 /nfs/dbraw/zinc/37/85/81/340378581.db2.gz ABWVFCYHJARTFV-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2cccc(C)c2C)CC1 ZINC000512809437 340378741 /nfs/dbraw/zinc/37/87/41/340378741.db2.gz LCTPOMIJCIFNAH-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP CC(C)Oc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000512829618 340379741 /nfs/dbraw/zinc/37/97/41/340379741.db2.gz UPJKQYBDPHKGFK-GOSISDBHSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2n1)C[NH+]1CCCCC1 ZINC000178408786 340449146 /nfs/dbraw/zinc/44/91/46/340449146.db2.gz ASXZBIPJAGLXFX-IRXDYDNUSA-N 2 1 311.473 4.007 20 0 DIADMP CC[C@@H](C)C[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237018444 340667398 /nfs/dbraw/zinc/66/73/98/340667398.db2.gz XFRPXLOPYGHBFL-QZTJIDSGSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H]1CC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@@H](C)C1 ZINC000237395309 340670658 /nfs/dbraw/zinc/67/06/58/340670658.db2.gz BTTNWADXZZSIQH-IRXDYDNUSA-N 2 1 300.490 4.065 20 0 DIADMP CCCCc1nc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cs1 ZINC000123623556 340792824 /nfs/dbraw/zinc/79/28/24/340792824.db2.gz JZLLXPWTPLUBNI-UHFFFAOYSA-N 2 1 323.550 4.040 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000126210039 340825104 /nfs/dbraw/zinc/82/51/04/340825104.db2.gz BYINHVUVOUPTIZ-SFHVURJKSA-N 2 1 317.452 4.488 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000539069709 340870418 /nfs/dbraw/zinc/87/04/18/340870418.db2.gz SQIDUDDOSGKPGJ-YLJYHZDGSA-N 2 1 313.489 4.219 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccccc1Cl)C(C)C ZINC000540319340 340926815 /nfs/dbraw/zinc/92/68/15/340926815.db2.gz ZERAAWFPZRJVBK-KSSFIOAISA-N 2 1 319.880 4.468 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(CC(C)C)cc1)C1CC1 ZINC000540589910 340936812 /nfs/dbraw/zinc/93/68/12/340936812.db2.gz PEMGDKZMJDHOAD-HXUWFJFHSA-N 2 1 311.473 4.131 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668570 341016496 /nfs/dbraw/zinc/01/64/96/341016496.db2.gz MSXBMWMUWJGUOZ-QFBILLFUSA-N 2 1 304.478 4.139 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668570 341016497 /nfs/dbraw/zinc/01/64/97/341016497.db2.gz MSXBMWMUWJGUOZ-QFBILLFUSA-N 2 1 304.478 4.139 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)CCSc1ccccc1 ZINC000130827730 341048081 /nfs/dbraw/zinc/04/80/81/341048081.db2.gz ZOAYKTDQKUVBMU-INIZCTEOSA-N 2 1 317.502 4.084 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)CCSc1ccccc1 ZINC000130827730 341048082 /nfs/dbraw/zinc/04/80/82/341048082.db2.gz ZOAYKTDQKUVBMU-INIZCTEOSA-N 2 1 317.502 4.084 20 0 DIADMP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc(Cl)s1 ZINC000544895386 341097897 /nfs/dbraw/zinc/09/78/97/341097897.db2.gz AROHGZJQORJKBF-LBPRGKRZSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000131833194 341112463 /nfs/dbraw/zinc/11/24/63/341112463.db2.gz VNXVRJCMXNJUGZ-RXVVDRJESA-N 2 1 322.496 4.281 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000564317221 341206307 /nfs/dbraw/zinc/20/63/07/341206307.db2.gz AKPCERBXWLFUOX-MRXNPFEDSA-N 2 1 317.452 4.100 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000564317221 341206308 /nfs/dbraw/zinc/20/63/08/341206308.db2.gz AKPCERBXWLFUOX-MRXNPFEDSA-N 2 1 317.452 4.100 20 0 DIADMP CC1(C)CC([NH2+]Cc2cnc(C3CCCC3)s2)CC(C)(C)[NH2+]1 ZINC000135824084 341246610 /nfs/dbraw/zinc/24/66/10/341246610.db2.gz QBGUOUKBQJALHZ-UHFFFAOYSA-N 2 1 321.534 4.200 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548483643 341263205 /nfs/dbraw/zinc/26/32/05/341263205.db2.gz CCQJDEWSZOLZER-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000245600670 341304528 /nfs/dbraw/zinc/30/45/28/341304528.db2.gz MIPQCAMGNNQECE-FXAWDEMLSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000245600670 341304529 /nfs/dbraw/zinc/30/45/29/341304529.db2.gz MIPQCAMGNNQECE-FXAWDEMLSA-N 2 1 311.473 4.097 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2CC=CCC2)C3)cc1 ZINC000245665595 341308564 /nfs/dbraw/zinc/30/85/64/341308564.db2.gz GOOSGWGNBQITPW-ZIBCJSCZSA-N 2 1 310.485 4.128 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@]2(C1)CCCN(C)C2 ZINC000550239156 341313119 /nfs/dbraw/zinc/31/31/19/341313119.db2.gz QUOJFVSAVPMKLV-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239156 341313120 /nfs/dbraw/zinc/31/31/20/341313120.db2.gz QUOJFVSAVPMKLV-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239156 341313121 /nfs/dbraw/zinc/31/31/21/341313121.db2.gz QUOJFVSAVPMKLV-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000550239156 341313122 /nfs/dbraw/zinc/31/31/22/341313122.db2.gz QUOJFVSAVPMKLV-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000550239156 341313123 /nfs/dbraw/zinc/31/31/23/341313123.db2.gz QUOJFVSAVPMKLV-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550610749 341319469 /nfs/dbraw/zinc/31/94/69/341319469.db2.gz RLWOKSFYOFRFTD-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550610749 341319470 /nfs/dbraw/zinc/31/94/70/341319470.db2.gz RLWOKSFYOFRFTD-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550619943 341319553 /nfs/dbraw/zinc/31/95/53/341319553.db2.gz RIRHYKSHPUFVPZ-AFYVEPGGSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550619943 341319554 /nfs/dbraw/zinc/31/95/54/341319554.db2.gz RIRHYKSHPUFVPZ-AFYVEPGGSA-N 2 1 300.490 4.238 20 0 DIADMP CC1CCC(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550621552 341319791 /nfs/dbraw/zinc/31/97/91/341319791.db2.gz BAXSRZXXZHLWHF-WXDAQCLHSA-N 2 1 300.490 4.238 20 0 DIADMP CC1CCC(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000550621552 341319792 /nfs/dbraw/zinc/31/97/92/341319792.db2.gz BAXSRZXXZHLWHF-WXDAQCLHSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CCC(C)(C)CC2)C[C@H]1c1ccccc1 ZINC000550665714 341321030 /nfs/dbraw/zinc/32/10/30/341321030.db2.gz NDRMKNJQZXMERW-OALUTQOASA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CCC(C)(C)CC2)C[C@H]1c1ccccc1 ZINC000550665714 341321031 /nfs/dbraw/zinc/32/10/31/341321031.db2.gz NDRMKNJQZXMERW-OALUTQOASA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550700456 341321578 /nfs/dbraw/zinc/32/15/78/341321578.db2.gz JYHGREONGCSFSP-UNMCSNQZSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550700456 341321579 /nfs/dbraw/zinc/32/15/79/341321579.db2.gz JYHGREONGCSFSP-UNMCSNQZSA-N 2 1 322.496 4.271 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000550700136 341321584 /nfs/dbraw/zinc/32/15/84/341321584.db2.gz BZSCFZINPAZSCZ-KJJMTIBFSA-N 2 1 320.480 4.043 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000550700136 341321585 /nfs/dbraw/zinc/32/15/85/341321585.db2.gz BZSCFZINPAZSCZ-KJJMTIBFSA-N 2 1 320.480 4.043 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700453 341321614 /nfs/dbraw/zinc/32/16/14/341321614.db2.gz JYHGREONGCSFSP-IFMALSPDSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700453 341321615 /nfs/dbraw/zinc/32/16/15/341321615.db2.gz JYHGREONGCSFSP-IFMALSPDSA-N 2 1 322.496 4.271 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@H]1c1ccccc1 ZINC000550847884 341324356 /nfs/dbraw/zinc/32/43/56/341324356.db2.gz PCKKVUWVFLNEGH-MSOLQXFVSA-N 2 1 302.506 4.484 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@H]1c1ccccc1 ZINC000550847884 341324357 /nfs/dbraw/zinc/32/43/57/341324357.db2.gz PCKKVUWVFLNEGH-MSOLQXFVSA-N 2 1 302.506 4.484 20 0 DIADMP C[C@H](F)CC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000550881968 341325291 /nfs/dbraw/zinc/32/52/91/341325291.db2.gz FIFRVERLMQAJJA-MTFMMBMASA-N 2 1 318.480 4.015 20 0 DIADMP CC(C)[C@](C)(Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000550919548 341326703 /nfs/dbraw/zinc/32/67/03/341326703.db2.gz SCDKKWUTNKCOFT-MNEFBYGVSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@](C)(Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000550919548 341326704 /nfs/dbraw/zinc/32/67/04/341326704.db2.gz SCDKKWUTNKCOFT-MNEFBYGVSA-N 2 1 322.924 4.370 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000551062941 341330712 /nfs/dbraw/zinc/33/07/12/341330712.db2.gz GFNZPVUFXOAWPC-OALUTQOASA-N 2 1 300.490 4.382 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000551062941 341330713 /nfs/dbraw/zinc/33/07/13/341330713.db2.gz GFNZPVUFXOAWPC-OALUTQOASA-N 2 1 300.490 4.382 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCCc2cccs2)C[C@@H]1c1ccccc1 ZINC000551087625 341331316 /nfs/dbraw/zinc/33/13/16/341331316.db2.gz VEJCYHARWUXNAF-PKOBYXMFSA-N 2 1 314.498 4.106 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2cccs2)C[C@@H]1c1ccccc1 ZINC000551087625 341331317 /nfs/dbraw/zinc/33/13/17/341331317.db2.gz VEJCYHARWUXNAF-PKOBYXMFSA-N 2 1 314.498 4.106 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CCCCc1ccc(Cl)s1 ZINC000551519894 341343673 /nfs/dbraw/zinc/34/36/73/341343673.db2.gz LBMFRXKEXSYDAF-UMVBOHGHSA-N 2 1 314.926 4.043 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC000551833023 341353259 /nfs/dbraw/zinc/35/32/59/341353259.db2.gz FXRVMJWAEKMSBZ-HMXCVIKNSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2F)C2CCCC2)CC[N@@H+]1C ZINC000246834075 341357575 /nfs/dbraw/zinc/35/75/75/341357575.db2.gz BFMDRTGUCCLZMG-ALKREAHSSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2F)C2CCCC2)CC[N@H+]1C ZINC000246834075 341357576 /nfs/dbraw/zinc/35/75/76/341357576.db2.gz BFMDRTGUCCLZMG-ALKREAHSSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2cccc(F)c2)C2CCCC2)CC[N@@H+]1C ZINC000246959472 341359191 /nfs/dbraw/zinc/35/91/91/341359191.db2.gz HSPTWSPAYLJTCC-ZMYBRWDISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2cccc(F)c2)C2CCCC2)CC[N@H+]1C ZINC000246959472 341359192 /nfs/dbraw/zinc/35/91/92/341359192.db2.gz HSPTWSPAYLJTCC-ZMYBRWDISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000247220474 341362341 /nfs/dbraw/zinc/36/23/41/341362341.db2.gz WJVSLZVWGIKLLS-GAOHTFMZSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000247220474 341362342 /nfs/dbraw/zinc/36/23/42/341362342.db2.gz WJVSLZVWGIKLLS-GAOHTFMZSA-N 2 1 316.464 4.054 20 0 DIADMP CC(C)[C@@H]1CC[C@H]1[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000552043365 341364426 /nfs/dbraw/zinc/36/44/26/341364426.db2.gz JXQHRKXDGAWYNZ-LSTHTHJFSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccncc1 ZINC000247438631 341365013 /nfs/dbraw/zinc/36/50/13/341365013.db2.gz NAVJHPYJFLSDBU-ZWKOTPCHSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)Cc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248595362 341380695 /nfs/dbraw/zinc/38/06/95/341380695.db2.gz SOAFFUZRXIYMSS-NSHGMRRFSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H](C1CC1)[NH+](C)Cc1ccc(C[N@H+](C)[C@H](C)C2CC2)cc1 ZINC000552493844 341396357 /nfs/dbraw/zinc/39/63/57/341396357.db2.gz MLNCAJYCCSYEKR-HZPDHXFCSA-N 2 1 300.490 4.147 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1Cl ZINC000552549895 341398397 /nfs/dbraw/zinc/39/83/97/341398397.db2.gz CDGJLCJUPZGLTD-CYBMUJFWSA-N 2 1 324.896 4.262 20 0 DIADMP CC(C)CC[C@@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)C(C)(C)C ZINC000554734302 341462667 /nfs/dbraw/zinc/46/26/67/341462667.db2.gz JCHXCDIKTWULCV-GOSISDBHSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000566884558 341570819 /nfs/dbraw/zinc/57/08/19/341570819.db2.gz PDMXCRFBZSXMFA-INIZCTEOSA-N 2 1 324.255 4.239 20 0 DIADMP COc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000156940579 341629284 /nfs/dbraw/zinc/62/92/84/341629284.db2.gz ZVSTXCFNURBAKC-INIZCTEOSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccco1 ZINC000157023178 341630585 /nfs/dbraw/zinc/63/05/85/341630585.db2.gz WBSXOOUABKYOLE-QGZVFWFLSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cc(F)cc(F)c1 ZINC000157536923 341640001 /nfs/dbraw/zinc/64/00/01/341640001.db2.gz KCGVFKCSTKTHFP-AWEZNQCLSA-N 2 1 322.443 4.413 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cccc(C)c3C)CC2)[nH+]c1 ZINC000163464481 341698624 /nfs/dbraw/zinc/69/86/24/341698624.db2.gz KZTDICNWIDAQOR-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cs1 ZINC000172341615 341797045 /nfs/dbraw/zinc/79/70/45/341797045.db2.gz DLNUWASDOCNLFQ-AWEZNQCLSA-N 2 1 317.502 4.179 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000163280925 521711503 /nfs/dbraw/zinc/71/15/03/521711503.db2.gz NLQNRWYWVXJVHQ-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]CCCn1cc[nH+]c1C ZINC000338014050 521781700 /nfs/dbraw/zinc/78/17/00/521781700.db2.gz DCGGPWWTOLZCJZ-CQSZACIVSA-N 2 1 303.475 4.044 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cccnc1Cl ZINC000157861916 525335021 /nfs/dbraw/zinc/33/50/21/525335021.db2.gz QGVLGGDYSXJOKG-GJZGRUSLSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccccn1 ZINC000159124302 525461426 /nfs/dbraw/zinc/46/14/26/525461426.db2.gz FZIOAEHPWPKWBJ-SFHVURJKSA-N 2 1 323.484 4.308 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1ccccn1 ZINC000159124430 525537634 /nfs/dbraw/zinc/53/76/34/525537634.db2.gz FZIOAEHPWPKWBJ-GOSISDBHSA-N 2 1 323.484 4.308 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1 ZINC000364179703 526209652 /nfs/dbraw/zinc/20/96/52/526209652.db2.gz WMGVBFBRDGPLNV-QGZVFWFLSA-N 2 1 315.505 4.085 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1oc2ccccc2c1C ZINC000178785380 527403494 /nfs/dbraw/zinc/40/34/94/527403494.db2.gz CVDYXPRXBUOJQV-HNNXBMFYSA-N 2 1 311.429 4.377 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000123330233 527405067 /nfs/dbraw/zinc/40/50/67/527405067.db2.gz MENWREFFYZUECK-RBUKOAKNSA-N 2 1 311.473 4.144 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1cc2ccccc2o1)C(C)C ZINC000338012024 527422978 /nfs/dbraw/zinc/42/29/78/527422978.db2.gz KSARVIRSTCXWDB-IBGZPJMESA-N 2 1 311.429 4.315 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](CC1CC1)c1ccc(Cl)cc1 ZINC000338008915 527423011 /nfs/dbraw/zinc/42/30/11/527423011.db2.gz BWJWWPVAFJLBAJ-GOSISDBHSA-N 2 1 317.864 4.366 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]Cc1sc2c(cccc2Cl)c1C ZINC000339219545 527430565 /nfs/dbraw/zinc/43/05/65/527430565.db2.gz VUPTUKKEMMPKOG-UHFFFAOYSA-N 2 1 319.861 4.158 20 0 DIADMP CC(C)C(C)(C)C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579722487 1035530071 /nfs/dbraw/zinc/53/00/71/1035530071.db2.gz LFUPYYLJZYGKLF-IEBWSBKVSA-N 2 1 302.506 4.169 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000035047369 1035532235 /nfs/dbraw/zinc/53/22/35/1035532235.db2.gz LBEHPPUIWXWADE-MRXNPFEDSA-N 2 1 324.921 4.341 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(Cl)cc1Cl ZINC000643545967 1035589912 /nfs/dbraw/zinc/58/99/12/1035589912.db2.gz GKIFLEYXWAVZQW-YPMHNXCESA-N 2 1 313.272 4.319 20 0 DIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546676 1035590965 /nfs/dbraw/zinc/59/09/65/1035590965.db2.gz SPUKOXIQOZJNDM-ZFWWWQNUSA-N 2 1 322.880 4.064 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1F ZINC000643547312 1035600800 /nfs/dbraw/zinc/60/08/00/1035600800.db2.gz CQRMCWOBABUDKS-DOMZBBRYSA-N 2 1 310.844 4.195 20 0 DIADMP Cc1ccc([C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C2CCCC2)o1 ZINC000643548662 1035607578 /nfs/dbraw/zinc/60/75/78/1035607578.db2.gz SUCUWERXWKQLSB-WMZOPIPTSA-N 2 1 302.462 4.084 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(Cl)s1 ZINC000035286244 1035656526 /nfs/dbraw/zinc/65/65/26/1035656526.db2.gz MNNJIOKXPZQTHE-CYBMUJFWSA-N 2 1 300.899 4.174 20 0 DIADMP CC/C=C\CC[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001208734308 1035838217 /nfs/dbraw/zinc/83/82/17/1035838217.db2.gz VXDFBSVWRKMBKL-OTDMDAFTSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001208734308 1035838238 /nfs/dbraw/zinc/83/82/38/1035838238.db2.gz VXDFBSVWRKMBKL-OTDMDAFTSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001208734308 1035838260 /nfs/dbraw/zinc/83/82/60/1035838260.db2.gz VXDFBSVWRKMBKL-OTDMDAFTSA-N 2 1 312.501 4.187 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](C2CC2)C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000705360873 1035882191 /nfs/dbraw/zinc/88/21/91/1035882191.db2.gz CERRPBNVWILJMS-MAODMQOUSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](C2CC2)C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000705360873 1035882211 /nfs/dbraw/zinc/88/22/11/1035882211.db2.gz CERRPBNVWILJMS-MAODMQOUSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](C2CC2)C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000705360874 1035882814 /nfs/dbraw/zinc/88/28/14/1035882814.db2.gz CERRPBNVWILJMS-TYCQWZJGSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](C2CC2)C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000705360874 1035882819 /nfs/dbraw/zinc/88/28/19/1035882819.db2.gz CERRPBNVWILJMS-TYCQWZJGSA-N 2 1 312.501 4.208 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C1CCC(F)(F)CC1 ZINC000535616318 1035944942 /nfs/dbraw/zinc/94/49/42/1035944942.db2.gz JARFGBYDXOGQEL-UHFFFAOYSA-N 2 1 324.459 4.312 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000037649063 1036123821 /nfs/dbraw/zinc/12/38/21/1036123821.db2.gz XKWFXHLZDUYONE-KDOFPFPSSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@@H+]1C ZINC000443887438 1036159115 /nfs/dbraw/zinc/15/91/15/1036159115.db2.gz HCUIKQMKAQJAHY-DGCLKSJQSA-N 2 1 323.362 4.148 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@H+]1C ZINC000443887438 1036159119 /nfs/dbraw/zinc/15/91/19/1036159119.db2.gz HCUIKQMKAQJAHY-DGCLKSJQSA-N 2 1 323.362 4.148 20 0 DIADMP CC1CCC([NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000236826945 1036316937 /nfs/dbraw/zinc/31/69/37/1036316937.db2.gz NGOAKMVLMINWBW-OQGULXLBSA-N 2 1 306.519 4.299 20 0 DIADMP CC1CCC([NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000236826945 1036316953 /nfs/dbraw/zinc/31/69/53/1036316953.db2.gz NGOAKMVLMINWBW-OQGULXLBSA-N 2 1 306.519 4.299 20 0 DIADMP CC1CCC([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CC1 ZINC000236827661 1036317398 /nfs/dbraw/zinc/31/73/98/1036317398.db2.gz NGOAKMVLMINWBW-CSKOPFHVSA-N 2 1 306.519 4.299 20 0 DIADMP CC1CCC([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CC1 ZINC000236827661 1036317417 /nfs/dbraw/zinc/31/74/17/1036317417.db2.gz NGOAKMVLMINWBW-CSKOPFHVSA-N 2 1 306.519 4.299 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000236830463 1036321108 /nfs/dbraw/zinc/32/11/08/1036321108.db2.gz FBDVJWMAZBOWSF-CAOKTKFFSA-N 2 1 300.490 4.208 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000236830463 1036321128 /nfs/dbraw/zinc/32/11/28/1036321128.db2.gz FBDVJWMAZBOWSF-CAOKTKFFSA-N 2 1 300.490 4.208 20 0 DIADMP C[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C(C1CC1)C1CC1 ZINC001167264519 1036346416 /nfs/dbraw/zinc/34/64/16/1036346416.db2.gz MBJUOEDUAQGTJC-UHFFFAOYSA-N 2 1 312.501 4.293 20 0 DIADMP Cc1cc([C@H](C)NCc2ccc(-n3ccnc3)c(F)c2)c(C)o1 ZINC000340414168 1036538153 /nfs/dbraw/zinc/53/81/53/1036538153.db2.gz AIBZTKICDUTBLZ-ZDUSSCGKSA-N 2 1 313.376 4.072 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2csc3ccccc23)C1 ZINC001648814627 1036562699 /nfs/dbraw/zinc/56/26/99/1036562699.db2.gz NGWBPPZRNIAWKY-IYBDPMFKSA-N 2 1 316.514 4.359 20 0 DIADMP Cc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)ccc1Cl ZINC001648817099 1036578687 /nfs/dbraw/zinc/57/86/87/1036578687.db2.gz UVKVGERMJLVXBE-OAHLLOKOSA-N 2 1 308.897 4.250 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(-c2ccccc2)o1 ZINC000121518296 1036580762 /nfs/dbraw/zinc/58/07/62/1036580762.db2.gz WFSWBLWHKTXKKB-JKSUJKDBSA-N 2 1 323.440 4.438 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000315580827 1036581565 /nfs/dbraw/zinc/58/15/65/1036581565.db2.gz QQCAXXOUVOZIRK-WMLDXEAASA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000315580827 1036581578 /nfs/dbraw/zinc/58/15/78/1036581578.db2.gz QQCAXXOUVOZIRK-WMLDXEAASA-N 2 1 322.493 4.217 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000683691247 1036715564 /nfs/dbraw/zinc/71/55/64/1036715564.db2.gz XATGUTFIZCKEHC-XPGWFJOJSA-N 2 1 311.473 4.302 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000539048772 1036786543 /nfs/dbraw/zinc/78/65/43/1036786543.db2.gz CWCJFYRIWNHQLL-HZPDHXFCSA-N 2 1 308.535 4.329 20 0 DIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCC[NH+](C)C ZINC000151905711 1036838022 /nfs/dbraw/zinc/83/80/22/1036838022.db2.gz VMFXKVBMFQEALY-CQSZACIVSA-N 2 1 317.502 4.029 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000580098432 1036947772 /nfs/dbraw/zinc/94/77/72/1036947772.db2.gz CRBDMCXRPGRFEX-YRPNKDGESA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000580098432 1036947790 /nfs/dbraw/zinc/94/77/90/1036947790.db2.gz CRBDMCXRPGRFEX-YRPNKDGESA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCCCF)CC[N@@H+]1Cc1ccccc1 ZINC000556497906 1036956604 /nfs/dbraw/zinc/95/66/04/1036956604.db2.gz QVMATDIHKAZPBJ-MJGOQNOKSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCCCF)CC[N@H+]1Cc1ccccc1 ZINC000556497906 1036956622 /nfs/dbraw/zinc/95/66/22/1036956622.db2.gz QVMATDIHKAZPBJ-MJGOQNOKSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497906 1036956641 /nfs/dbraw/zinc/95/66/41/1036956641.db2.gz QVMATDIHKAZPBJ-MJGOQNOKSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497906 1036956656 /nfs/dbraw/zinc/95/66/56/1036956656.db2.gz QVMATDIHKAZPBJ-MJGOQNOKSA-N 2 1 306.469 4.111 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398019155 1037082832 /nfs/dbraw/zinc/08/28/32/1037082832.db2.gz JCSKRLVSTIEYAJ-KVPLUYHFSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398019155 1037082844 /nfs/dbraw/zinc/08/28/44/1037082844.db2.gz JCSKRLVSTIEYAJ-KVPLUYHFSA-N 2 1 300.490 4.065 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398039734 1037107829 /nfs/dbraw/zinc/10/78/29/1037107829.db2.gz RHVJBVBOFDXTKA-YTQPIUFNSA-N 2 1 300.490 4.065 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398039734 1037107838 /nfs/dbraw/zinc/10/78/38/1037107838.db2.gz RHVJBVBOFDXTKA-YTQPIUFNSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+]([C@@H]2CCc3ccccc32)C1 ZINC001167424472 1037228312 /nfs/dbraw/zinc/22/83/12/1037228312.db2.gz KABUXRTVSLDPNJ-LVCYWYKZSA-N 2 1 312.501 4.260 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001167424472 1037228329 /nfs/dbraw/zinc/22/83/29/1037228329.db2.gz KABUXRTVSLDPNJ-LVCYWYKZSA-N 2 1 312.501 4.260 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(C)c1 ZINC001167429874 1037247325 /nfs/dbraw/zinc/24/73/25/1037247325.db2.gz NRANUTTZTWQVCV-WOJBJXKFSA-N 2 1 314.517 4.481 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001204552672 1037459235 /nfs/dbraw/zinc/45/92/35/1037459235.db2.gz PLDZCKXTPQIPMQ-NDDJGDGRSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001204552672 1037459238 /nfs/dbraw/zinc/45/92/38/1037459238.db2.gz PLDZCKXTPQIPMQ-NDDJGDGRSA-N 2 1 314.517 4.289 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2s1 ZINC000126481832 1038108402 /nfs/dbraw/zinc/10/84/02/1038108402.db2.gz ZYMPPUUGBSTVDG-KBPBESRZSA-N 2 1 300.471 4.036 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](CCc1ccccc1)c1ccccc1 ZINC000341593092 1038161646 /nfs/dbraw/zinc/16/16/46/1038161646.db2.gz YPAAMPGDBYDQOL-NRFANRHFSA-N 2 1 319.452 4.155 20 0 DIADMP CCOc1ccccc1[C@@H](CC)NCC[C@H]1CCCC[N@H+]1C ZINC000341662860 1038210352 /nfs/dbraw/zinc/21/03/52/1038210352.db2.gz VYJLFAPHTYFCLL-SJLPKXTDSA-N 2 1 304.478 4.000 20 0 DIADMP CCOc1ccccc1[C@@H](CC)[NH2+]CC[C@H]1CCCC[N@H+]1C ZINC000341662860 1038210376 /nfs/dbraw/zinc/21/03/76/1038210376.db2.gz VYJLFAPHTYFCLL-SJLPKXTDSA-N 2 1 304.478 4.000 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)C1 ZINC000535778081 1038333121 /nfs/dbraw/zinc/33/31/21/1038333121.db2.gz HMEXUGOXLVQFCW-UONOGXRCSA-N 2 1 312.860 4.250 20 0 DIADMP c1ccc(-c2ccc(CC[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000090468701 1038447256 /nfs/dbraw/zinc/44/72/56/1038447256.db2.gz IWVHGRQXVFPMES-FGZHOGPDSA-N 2 1 320.480 4.113 20 0 DIADMP c1cc2c(o1)CCC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000152236125 1038596857 /nfs/dbraw/zinc/59/68/57/1038596857.db2.gz CONAPTVYVNEFEN-SFHVURJKSA-N 2 1 302.462 4.044 20 0 DIADMP CC(C)CCC[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001167555119 1038613360 /nfs/dbraw/zinc/61/33/60/1038613360.db2.gz ZVYDJTINJJAKMZ-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)CCC[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001167555119 1038613362 /nfs/dbraw/zinc/61/33/62/1038613362.db2.gz ZVYDJTINJJAKMZ-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)CCC[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001167555119 1038613365 /nfs/dbraw/zinc/61/33/65/1038613365.db2.gz ZVYDJTINJJAKMZ-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP c1ccc(-c2ccc(C[N@@H+]3CC[C@H](C[NH+]4CCCC4)C3)cc2)cc1 ZINC000606901470 1038638203 /nfs/dbraw/zinc/63/82/03/1038638203.db2.gz USIGARPPMIQZJT-HXUWFJFHSA-N 2 1 320.480 4.271 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@@H+]1C ZINC001167586162 1038712522 /nfs/dbraw/zinc/71/25/22/1038712522.db2.gz IERYACCZFPZEQU-RDTXWAMCSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@H+]1C ZINC001167586162 1038712531 /nfs/dbraw/zinc/71/25/31/1038712531.db2.gz IERYACCZFPZEQU-RDTXWAMCSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586162 1038712539 /nfs/dbraw/zinc/71/25/39/1038712539.db2.gz IERYACCZFPZEQU-RDTXWAMCSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586162 1038712545 /nfs/dbraw/zinc/71/25/45/1038712545.db2.gz IERYACCZFPZEQU-RDTXWAMCSA-N 2 1 316.876 4.408 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@H]1CCN(C)[C@H](C)C1 ZINC001167586612 1038713875 /nfs/dbraw/zinc/71/38/75/1038713875.db2.gz OXROSFRCHDDGRJ-APWZRJJASA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1 ZINC001167586612 1038713879 /nfs/dbraw/zinc/71/38/79/1038713879.db2.gz OXROSFRCHDDGRJ-APWZRJJASA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1 ZINC001167586612 1038713887 /nfs/dbraw/zinc/71/38/87/1038713887.db2.gz OXROSFRCHDDGRJ-APWZRJJASA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC001167586612 1038713893 /nfs/dbraw/zinc/71/38/93/1038713893.db2.gz OXROSFRCHDDGRJ-APWZRJJASA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC001167586612 1038713897 /nfs/dbraw/zinc/71/38/97/1038713897.db2.gz OXROSFRCHDDGRJ-APWZRJJASA-N 2 1 310.485 4.317 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC[N@H+]1C ZINC000608061588 1038761865 /nfs/dbraw/zinc/76/18/65/1038761865.db2.gz ZIYUBZVSTSXYTE-MJGOQNOKSA-N 2 1 323.484 4.027 20 0 DIADMP C[N@H+](Cc1ccccc1)[C@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000608092657 1038773623 /nfs/dbraw/zinc/77/36/23/1038773623.db2.gz BWLZVVFVQHQHKI-INIZCTEOSA-N 2 1 323.465 4.007 20 0 DIADMP C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000608092657 1038773633 /nfs/dbraw/zinc/77/36/33/1038773633.db2.gz BWLZVVFVQHQHKI-INIZCTEOSA-N 2 1 323.465 4.007 20 0 DIADMP C(=C\C[N@H+]1CCC[C@@H]2CCC[C@H]21)\C[NH+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564645 1038884192 /nfs/dbraw/zinc/88/41/92/1038884192.db2.gz QAJOHXAQOOHVRW-NVFLBURPSA-N 2 1 302.506 4.072 20 0 DIADMP C(=C\C[N@@H+]1CCC[C@@H]2CCC[C@@H]21)\C[NH+]1CCC[C@@H]2CCC[C@H]21 ZINC000608564645 1038884211 /nfs/dbraw/zinc/88/42/11/1038884211.db2.gz QAJOHXAQOOHVRW-NVFLBURPSA-N 2 1 302.506 4.072 20 0 DIADMP C(=C\C[N@H+]1CCC[C@@H]2CCC[C@@H]21)\C[NH+]1CCC[C@@H]2CCC[C@H]21 ZINC000608564645 1038884226 /nfs/dbraw/zinc/88/42/26/1038884226.db2.gz QAJOHXAQOOHVRW-NVFLBURPSA-N 2 1 302.506 4.072 20 0 DIADMP C(=C/C[N@H+]1CCC[C@@H]2CCC[C@H]21)\C[NH+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564646 1038885826 /nfs/dbraw/zinc/88/58/26/1038885826.db2.gz QAJOHXAQOOHVRW-VONYNPSVSA-N 2 1 302.506 4.072 20 0 DIADMP C(=C/C[N@@H+]1CCC[C@@H]2CCC[C@@H]21)\C[NH+]1CCC[C@@H]2CCC[C@H]21 ZINC000608564646 1038885851 /nfs/dbraw/zinc/88/58/51/1038885851.db2.gz QAJOHXAQOOHVRW-VONYNPSVSA-N 2 1 302.506 4.072 20 0 DIADMP C(=C/C[N@H+]1CCC[C@@H]2CCC[C@@H]21)\C[NH+]1CCC[C@@H]2CCC[C@H]21 ZINC000608564646 1038885858 /nfs/dbraw/zinc/88/58/58/1038885858.db2.gz QAJOHXAQOOHVRW-VONYNPSVSA-N 2 1 302.506 4.072 20 0 DIADMP C[C@H](C[NH+]1CCC[C@@H]2CCC[C@H]21)C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564660 1038885908 /nfs/dbraw/zinc/88/59/08/1038885908.db2.gz YMUIVAWWYWCZAR-VYJAJWGXSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H](C[NH+]1CCC[C@@H]2CCC[C@@H]21)C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000608564660 1038885934 /nfs/dbraw/zinc/88/59/34/1038885934.db2.gz YMUIVAWWYWCZAR-VYJAJWGXSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H](C[NH+]1CCC[C@@H]2CCC[C@@H]21)C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000608564660 1038885960 /nfs/dbraw/zinc/88/59/60/1038885960.db2.gz YMUIVAWWYWCZAR-VYJAJWGXSA-N 2 1 304.522 4.152 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342866186 1038934915 /nfs/dbraw/zinc/93/49/15/1038934915.db2.gz YKBUDNUGYQVKHL-GOSISDBHSA-N 2 1 315.461 4.354 20 0 DIADMP CCc1ccc([C@H]2CCCCC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342866186 1038934932 /nfs/dbraw/zinc/93/49/32/1038934932.db2.gz YKBUDNUGYQVKHL-GOSISDBHSA-N 2 1 315.461 4.354 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1C[C@H](c2ccccc2)C1(C)C ZINC000123329704 1039145462 /nfs/dbraw/zinc/14/54/62/1039145462.db2.gz MENWREFFYZUECK-RTBURBONSA-N 2 1 311.473 4.144 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CCC(C)(C)c4cccc2c43)CC[N@@H+]1C ZINC000539558576 1039288693 /nfs/dbraw/zinc/28/86/93/1039288693.db2.gz KOBOZIKTTJWHMK-YKTARERQSA-N 2 1 312.501 4.359 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CCC(C)(C)c4cccc2c43)CC[N@H+]1C ZINC000539558576 1039288699 /nfs/dbraw/zinc/28/86/99/1039288699.db2.gz KOBOZIKTTJWHMK-YKTARERQSA-N 2 1 312.501 4.359 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccs2)CC1 ZINC000539824349 1039339837 /nfs/dbraw/zinc/33/98/37/1039339837.db2.gz AAOLMKSPANNZOC-MRXNPFEDSA-N 2 1 306.519 4.225 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000583532492 1039366580 /nfs/dbraw/zinc/36/65/80/1039366580.db2.gz DFLCPJGFVLAYRG-UHFFFAOYSA-N 2 1 323.843 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000583532492 1039366609 /nfs/dbraw/zinc/36/66/09/1039366609.db2.gz DFLCPJGFVLAYRG-UHFFFAOYSA-N 2 1 323.843 4.150 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1)c1ccsc1 ZINC000669850660 1039383574 /nfs/dbraw/zinc/38/35/74/1039383574.db2.gz DLOGJSDTBVSRME-RVKKMQEKSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1ccncc1[C@@H](C)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000540083030 1039415219 /nfs/dbraw/zinc/41/52/19/1039415219.db2.gz IJYQOLCMYPJEIP-MSOLQXFVSA-N 2 1 323.484 4.266 20 0 DIADMP C[C@H](CC1CC1)[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540142650 1039424436 /nfs/dbraw/zinc/42/44/36/1039424436.db2.gz DDNMZIOGKCOCGX-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540147526 1039427851 /nfs/dbraw/zinc/42/78/51/1039427851.db2.gz ADHDSBPTILNELM-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540150596 1039432101 /nfs/dbraw/zinc/43/21/01/1039432101.db2.gz GOTBCNYDGGPHJQ-IAGOWNOFSA-N 2 1 320.546 4.427 20 0 DIADMP C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984401 1039441753 /nfs/dbraw/zinc/44/17/53/1039441753.db2.gz YNAAQUBTLZGSML-UTKZUKDTSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984401 1039441765 /nfs/dbraw/zinc/44/17/65/1039441765.db2.gz YNAAQUBTLZGSML-UTKZUKDTSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984401 1039441781 /nfs/dbraw/zinc/44/17/81/1039441781.db2.gz YNAAQUBTLZGSML-UTKZUKDTSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@@H]1C[C@H]1[C@H]([NH2+][C@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C)c1ccc(Cl)cc1 ZINC000540189081 1039442812 /nfs/dbraw/zinc/44/28/12/1039442812.db2.gz WUNXEYHDASXHFD-AITFPPKLSA-N 2 1 320.908 4.355 20 0 DIADMP C[C@H](NCC[C@@H]1CCC[N@H+]1C)c1cccc(Cl)c1Cl ZINC000540410990 1039488975 /nfs/dbraw/zinc/48/89/75/1039488975.db2.gz IVAVOKSYKXUVPY-RYUDHWBXSA-N 2 1 301.261 4.128 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2cccc(OCC(C)C)c2)CC1 ZINC000540508181 1039509258 /nfs/dbraw/zinc/50/92/58/1039509258.db2.gz ZRBRAYCPQKSTPX-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(OCC(C)C)c2)CC1 ZINC000540508181 1039509270 /nfs/dbraw/zinc/50/92/70/1039509270.db2.gz ZRBRAYCPQKSTPX-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)C[C@@H](C)CCc2ccccc2)CC1 ZINC000540507603 1039510217 /nfs/dbraw/zinc/51/02/17/1039510217.db2.gz ZGHDDSQELUZDRL-SFHVURJKSA-N 2 1 302.506 4.060 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000540606130 1039525627 /nfs/dbraw/zinc/52/56/27/1039525627.db2.gz CRRFZLXDKBXVIQ-QFIPXVFZSA-N 2 1 320.480 4.212 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](C)CC(F)F)cc1 ZINC000647317933 1039548078 /nfs/dbraw/zinc/54/80/78/1039548078.db2.gz AFBJQVDRGDMDKZ-CHWSQXEVSA-N 2 1 307.388 4.123 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cc2ccncc2s1 ZINC000657824565 1039585350 /nfs/dbraw/zinc/58/53/50/1039585350.db2.gz URSKURNDMYDZGN-HUUCEWRRSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cc2ccncc2s1 ZINC000657824566 1039585555 /nfs/dbraw/zinc/58/55/55/1039585555.db2.gz URSKURNDMYDZGN-LSDHHAIUSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1cc2cnccc2o1 ZINC000657823924 1039586817 /nfs/dbraw/zinc/58/68/17/1039586817.db2.gz LVPUKSFSNGPPTC-MRXNPFEDSA-N 2 1 323.440 4.001 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cc2cnccc2o1 ZINC000657823924 1039586837 /nfs/dbraw/zinc/58/68/37/1039586837.db2.gz LVPUKSFSNGPPTC-MRXNPFEDSA-N 2 1 323.440 4.001 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)C1 ZINC000540989836 1039604493 /nfs/dbraw/zinc/60/44/93/1039604493.db2.gz XJFRINQGYYFQRI-DYVFJYSZSA-N 2 1 312.860 4.108 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000541013152 1039613111 /nfs/dbraw/zinc/61/31/11/1039613111.db2.gz FGKBQGWUDBWCKA-VUOWNZEOSA-N 2 1 318.480 4.170 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000541203186 1039634793 /nfs/dbraw/zinc/63/47/93/1039634793.db2.gz VHTQDTUPKKDHEQ-XZVRFQMRSA-N 2 1 315.486 4.211 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000541203186 1039634810 /nfs/dbraw/zinc/63/48/10/1039634810.db2.gz VHTQDTUPKKDHEQ-XZVRFQMRSA-N 2 1 315.486 4.211 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc2cnccc2o1 ZINC000657838851 1039680506 /nfs/dbraw/zinc/68/05/06/1039680506.db2.gz ZNIFVBZEHJQVPE-CVEARBPZSA-N 2 1 315.461 4.133 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000541660431 1039727138 /nfs/dbraw/zinc/72/71/38/1039727138.db2.gz DMNBSZFIKDQISE-CVEARBPZSA-N 2 1 300.446 4.266 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC[C@@H]1CCCC[N@H+]1C ZINC000541660431 1039727151 /nfs/dbraw/zinc/72/71/51/1039727151.db2.gz DMNBSZFIKDQISE-CVEARBPZSA-N 2 1 300.446 4.266 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1 ZINC000197136813 1039971048 /nfs/dbraw/zinc/97/10/48/1039971048.db2.gz SOJWKPGESCYEFG-HXUWFJFHSA-N 2 1 308.469 4.077 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1 ZINC000197136813 1039971064 /nfs/dbraw/zinc/97/10/64/1039971064.db2.gz SOJWKPGESCYEFG-HXUWFJFHSA-N 2 1 308.469 4.077 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(OC(F)F)c1 ZINC000261883970 1039984914 /nfs/dbraw/zinc/98/49/14/1039984914.db2.gz MWSOBKLSHWOMFQ-MZPVMMEZSA-N 2 1 318.367 4.083 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCSCC2)CC1 ZINC000657890626 1040041807 /nfs/dbraw/zinc/04/18/07/1040041807.db2.gz WFHURZDIOINQOU-FUHWJXTLSA-N 2 1 318.530 4.087 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC(C)(C)c1ccccc1 ZINC000685462839 1040063533 /nfs/dbraw/zinc/06/35/33/1040063533.db2.gz PGVMXCQSNBTYLG-UHFFFAOYSA-N 2 1 313.489 4.135 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000685462839 1040063546 /nfs/dbraw/zinc/06/35/46/1040063546.db2.gz PGVMXCQSNBTYLG-UHFFFAOYSA-N 2 1 313.489 4.135 20 0 DIADMP CN1CCC([N@H+](Cc2ccco2)Cc2ccccc2C2CC2)CC1 ZINC000685467665 1040066237 /nfs/dbraw/zinc/06/62/37/1040066237.db2.gz HGMRBNKEJLASIO-UHFFFAOYSA-N 2 1 324.468 4.253 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@H]2C)cc1 ZINC000685470089 1040067822 /nfs/dbraw/zinc/06/78/22/1040067822.db2.gz SDIBWTFAERCZFE-YLJYHZDGSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000685470089 1040067839 /nfs/dbraw/zinc/06/78/39/1040067839.db2.gz SDIBWTFAERCZFE-YLJYHZDGSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000685470089 1040067857 /nfs/dbraw/zinc/06/78/57/1040067857.db2.gz SDIBWTFAERCZFE-YLJYHZDGSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)cc1 ZINC000685470086 1040068959 /nfs/dbraw/zinc/06/89/59/1040068959.db2.gz SDIBWTFAERCZFE-FXAWDEMLSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000685470086 1040068973 /nfs/dbraw/zinc/06/89/73/1040068973.db2.gz SDIBWTFAERCZFE-FXAWDEMLSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000685470086 1040068978 /nfs/dbraw/zinc/06/89/78/1040068978.db2.gz SDIBWTFAERCZFE-FXAWDEMLSA-N 2 1 318.505 4.028 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+]C(C3CCC3)C3CCC3)C2)cc1 ZINC000309652739 1040088665 /nfs/dbraw/zinc/08/86/65/1040088665.db2.gz AQNGYXPOTQUWDK-GOSISDBHSA-N 2 1 312.501 4.067 20 0 DIADMP CCC1(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000309693140 1040089290 /nfs/dbraw/zinc/08/92/90/1040089290.db2.gz CGBOUEGVDDNKSQ-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C)CCC([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309745416 1040089629 /nfs/dbraw/zinc/08/96/29/1040089629.db2.gz UBZBFBPAKRUZGH-GOSISDBHSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000309868445 1040097632 /nfs/dbraw/zinc/09/76/32/1040097632.db2.gz QEZNLJWKXUKLJW-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)C(C)(C)C(F)F)[N@@H+](C)Cc1ccccc1 ZINC000657900926 1040097690 /nfs/dbraw/zinc/09/76/90/1040097690.db2.gz UPDGAVBJZBTWQX-CABCVRRESA-N 2 1 312.448 4.166 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1ccc(C(F)F)nc1)C(C)C ZINC000657900911 1040099238 /nfs/dbraw/zinc/09/92/38/1040099238.db2.gz UFMRZZPYVZTSMN-CQSZACIVSA-N 2 1 313.436 4.179 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(C(F)F)nc1 ZINC000657901795 1040099602 /nfs/dbraw/zinc/09/96/02/1040099602.db2.gz XBDDLWUHORAAMI-ZDUSSCGKSA-N 2 1 323.431 4.077 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)C1CCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309928417 1040102490 /nfs/dbraw/zinc/10/24/90/1040102490.db2.gz UWIYTLPLJHMQRQ-SQGPQFPESA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000685662431 1040204216 /nfs/dbraw/zinc/20/42/16/1040204216.db2.gz SDRMYIURFSQIHO-ZOBORPQBSA-N 2 1 314.926 4.212 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000685662431 1040204231 /nfs/dbraw/zinc/20/42/31/1040204231.db2.gz SDRMYIURFSQIHO-ZOBORPQBSA-N 2 1 314.926 4.212 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309708968 1040210222 /nfs/dbraw/zinc/21/02/22/1040210222.db2.gz IPPYKABIAARNQS-QFBILLFUSA-N 2 1 314.498 4.311 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)cc1 ZINC000658218145 1040376495 /nfs/dbraw/zinc/37/64/95/1040376495.db2.gz CMPDWEVEVNOPTE-GUYCJALGSA-N 2 1 319.399 4.267 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1 ZINC000658280496 1040400877 /nfs/dbraw/zinc/40/08/77/1040400877.db2.gz IYESEMULTXPDHQ-BLLLJJGKSA-N 2 1 319.399 4.123 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC000658299963 1040409450 /nfs/dbraw/zinc/40/94/50/1040409450.db2.gz IQZXLTSLJKQSAI-WOZUAGRISA-N 2 1 312.501 4.206 20 0 DIADMP CC(C)CC1([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000658321185 1040417872 /nfs/dbraw/zinc/41/78/72/1040417872.db2.gz NJWTZTPRPIZCFV-ACDBMABISA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319473 1040418764 /nfs/dbraw/zinc/41/87/64/1040418764.db2.gz BYUDITMRDQNNNM-XLIONFOSSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccoc1 ZINC000658319473 1040418775 /nfs/dbraw/zinc/41/87/75/1040418775.db2.gz BYUDITMRDQNNNM-XLIONFOSSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319476 1040419241 /nfs/dbraw/zinc/41/92/41/1040419241.db2.gz BZNBMSVMIPPNCZ-IEBWSBKVSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319476 1040419250 /nfs/dbraw/zinc/41/92/50/1040419250.db2.gz BZNBMSVMIPPNCZ-IEBWSBKVSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@H](C[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310216158 1040455705 /nfs/dbraw/zinc/45/57/05/1040455705.db2.gz VXUFANWVSJZGIG-DENIHFKCSA-N 2 1 322.496 4.292 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000309770705 1040726591 /nfs/dbraw/zinc/72/65/91/1040726591.db2.gz HLESTOZNMPBWKV-LNLFQRSKSA-N 2 1 302.506 4.169 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCc4ccccc43)C2)cc1 ZINC000310074590 1040751794 /nfs/dbraw/zinc/75/17/94/1040751794.db2.gz FUWVUMCAKADQBW-DENIHFKCSA-N 2 1 320.480 4.176 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccncc2)cc1 ZINC000414170061 1040948959 /nfs/dbraw/zinc/94/89/59/1040948959.db2.gz BNLBRTLLIFBZSE-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2(C4CCC4)CCC2)C3)cc1 ZINC000414168745 1040949431 /nfs/dbraw/zinc/94/94/31/1040949431.db2.gz ALMNJVBEQCRCDB-MZADTFQBSA-N 2 1 324.512 4.494 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccncc2)cc1 ZINC000414170060 1040950530 /nfs/dbraw/zinc/95/05/30/1040950530.db2.gz BNLBRTLLIFBZSE-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000414194487 1040982208 /nfs/dbraw/zinc/98/22/08/1040982208.db2.gz UUSMVRVLUYJXOJ-UKRRQHHQSA-N 2 1 323.550 4.132 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000414290076 1041086334 /nfs/dbraw/zinc/08/63/34/1041086334.db2.gz SFLMHSIGVUALPR-MRXNPFEDSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000414290076 1041086347 /nfs/dbraw/zinc/08/63/47/1041086347.db2.gz SFLMHSIGVUALPR-MRXNPFEDSA-N 2 1 312.457 4.252 20 0 DIADMP C[C@H]([NH2+][C@H](C[NH3+])C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC000423261121 1041211554 /nfs/dbraw/zinc/21/15/54/1041211554.db2.gz JBYJXNHVNIJLBP-ADNDVJRGSA-N 2 1 320.443 4.241 20 0 DIADMP CCCCCC[C@H](CC)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001170602271 1041359589 /nfs/dbraw/zinc/35/95/89/1041359589.db2.gz YLYHJZHAZXPZAU-SFHVURJKSA-N 2 1 324.553 4.311 20 0 DIADMP CC[C@@H](C)[C@H](C)[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000179841535 1041518984 /nfs/dbraw/zinc/51/89/84/1041518984.db2.gz YEPBTZFWNUYJDF-CVEARBPZSA-N 2 1 303.494 4.064 20 0 DIADMP c1ccc2c(c1)CC[C@H]2CC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000659946058 1041554215 /nfs/dbraw/zinc/55/42/15/1041554215.db2.gz ZKJVALAHMIXLRF-PMACEKPBSA-N 2 1 312.501 4.057 20 0 DIADMP CC[C@H](CC(F)F)C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000659973577 1041564994 /nfs/dbraw/zinc/56/49/94/1041564994.db2.gz RYUWXSJJEAJHNX-AEFFLSMTSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000309712035 1041591452 /nfs/dbraw/zinc/59/14/52/1041591452.db2.gz JQVXIZNJXFFEGY-FXAWDEMLSA-N 2 1 300.490 4.067 20 0 DIADMP CSc1ccc(CNCCC[N@@H+](C)C2CCCCC2)s1 ZINC000584689911 1041643229 /nfs/dbraw/zinc/64/32/29/1041643229.db2.gz LKWJTODJVFPRHG-UHFFFAOYSA-N 2 1 312.548 4.214 20 0 DIADMP CSc1ccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)s1 ZINC000584689911 1041643230 /nfs/dbraw/zinc/64/32/30/1041643230.db2.gz LKWJTODJVFPRHG-UHFFFAOYSA-N 2 1 312.548 4.214 20 0 DIADMP CSc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)s1 ZINC000584689911 1041643235 /nfs/dbraw/zinc/64/32/35/1041643235.db2.gz LKWJTODJVFPRHG-UHFFFAOYSA-N 2 1 312.548 4.214 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2cccs2)C1 ZINC000417313717 1041656176 /nfs/dbraw/zinc/65/61/76/1041656176.db2.gz WTDILZDMHKUBGO-ZJPYXAASSA-N 2 1 320.546 4.198 20 0 DIADMP CSc1cccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660258091 1041692447 /nfs/dbraw/zinc/69/24/47/1041692447.db2.gz ZWOPQBSHPHGBEN-WBVHZDCISA-N 2 1 318.530 4.151 20 0 DIADMP Clc1csc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222166610 1041714560 /nfs/dbraw/zinc/71/45/60/1041714560.db2.gz ABLOXBBNFBXCJN-INIZCTEOSA-N 2 1 312.910 4.147 20 0 DIADMP Clc1csc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222166610 1041714566 /nfs/dbraw/zinc/71/45/66/1041714566.db2.gz ABLOXBBNFBXCJN-INIZCTEOSA-N 2 1 312.910 4.147 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000813789824 1041732812 /nfs/dbraw/zinc/73/28/12/1041732812.db2.gz DYPODBZVPYWNGA-VWWARQNISA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCNc1ccc2c(c1)[nH]c1cc[nH+]cc12 ZINC001167754809 1041751697 /nfs/dbraw/zinc/75/16/97/1041751697.db2.gz WBYPDQWKZBTMKE-OAHLLOKOSA-N 2 1 322.456 4.393 20 0 DIADMP Cc1nc(C)c([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)s1 ZINC000111361579 1041815681 /nfs/dbraw/zinc/81/56/81/1041815681.db2.gz YLSMOJXZQQHNRD-CYBMUJFWSA-N 2 1 309.523 4.065 20 0 DIADMP Cc1nc(C)c([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)s1 ZINC000111361579 1041815682 /nfs/dbraw/zinc/81/56/82/1041815682.db2.gz YLSMOJXZQQHNRD-CYBMUJFWSA-N 2 1 309.523 4.065 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([N@H+]3CC[C@@]4(CC[NH+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761505 1041859162 /nfs/dbraw/zinc/85/91/62/1041859162.db2.gz MVLKDJOOQDQVBF-XWSHUIEDSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH+]3CC[C@@]4(CC[N@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761505 1041859168 /nfs/dbraw/zinc/85/91/68/1041859168.db2.gz MVLKDJOOQDQVBF-XWSHUIEDSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH+]3CC[C@@]4(CC[N@@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761505 1041859172 /nfs/dbraw/zinc/85/91/72/1041859172.db2.gz MVLKDJOOQDQVBF-XWSHUIEDSA-N 2 1 324.512 4.019 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2)cn1)C[NH+]1CCCC1 ZINC000651682226 1041880633 /nfs/dbraw/zinc/88/06/33/1041880633.db2.gz QMGZIHZYDQVIMQ-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccc(-c2ccccc2)cn1 ZINC000651682229 1041880816 /nfs/dbraw/zinc/88/08/16/1041880816.db2.gz QMGZIHZYDQVIMQ-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccccc1F)C(C)C ZINC000661482748 1041943477 /nfs/dbraw/zinc/94/34/77/1041943477.db2.gz CIDVIGJLEBHXAM-SFHVURJKSA-N 2 1 303.425 4.098 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCCCC23CCCC3)cn1 ZINC000815561512 1041962688 /nfs/dbraw/zinc/96/26/88/1041962688.db2.gz IVWFNFRTLVLNFJ-GOSISDBHSA-N 2 1 324.472 4.168 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1ccco1 ZINC000164512514 1041993478 /nfs/dbraw/zinc/99/34/78/1041993478.db2.gz LANTXIBKZFOHIS-MRXNPFEDSA-N 2 1 324.424 4.355 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000164607733 1042022753 /nfs/dbraw/zinc/02/27/53/1042022753.db2.gz IVOMHIWRFYAADW-CYBMUJFWSA-N 2 1 320.506 4.211 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161560664 1042111328 /nfs/dbraw/zinc/11/13/28/1042111328.db2.gz ONIQZCYTWKHSDR-LRDDRELGSA-N 2 1 310.844 4.004 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161560664 1042111332 /nfs/dbraw/zinc/11/13/32/1042111332.db2.gz ONIQZCYTWKHSDR-LRDDRELGSA-N 2 1 310.844 4.004 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1OC ZINC000817898609 1042128214 /nfs/dbraw/zinc/12/82/14/1042128214.db2.gz JWQZYBFQIZXSQX-YSIASYRMSA-N 2 1 324.468 4.229 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170918064 1042165134 /nfs/dbraw/zinc/16/51/34/1042165134.db2.gz SRHLVLFZVLGPEW-RDJZCZTQSA-N 2 1 320.908 4.038 20 0 DIADMP CCCCC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000314782819 1042169141 /nfs/dbraw/zinc/16/91/41/1042169141.db2.gz YIHIGGUXCYNDIF-XLIONFOSSA-N 2 1 300.490 4.382 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000663467866 1042179427 /nfs/dbraw/zinc/17/94/27/1042179427.db2.gz IIWHWGPSNWGEEJ-JBACZVJFSA-N 2 1 312.501 4.034 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001167824173 1042210482 /nfs/dbraw/zinc/21/04/82/1042210482.db2.gz CBUGBGQWNVNUFV-PKOBYXMFSA-N 2 1 320.546 4.287 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001167825832 1042214479 /nfs/dbraw/zinc/21/44/79/1042214479.db2.gz KZDSXNMZYWOIQF-ICSRJNTNSA-N 2 1 318.505 4.040 20 0 DIADMP CCc1nc([C@H](C)[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)cs1 ZINC000820809602 1042229218 /nfs/dbraw/zinc/22/92/18/1042229218.db2.gz DSACGXNEXSBCHR-KGLIPLIRSA-N 2 1 317.502 4.179 20 0 DIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546674 1042229557 /nfs/dbraw/zinc/22/95/57/1042229557.db2.gz SPUKOXIQOZJNDM-HIFRSBDPSA-N 2 1 322.880 4.064 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001167837859 1042250134 /nfs/dbraw/zinc/25/01/34/1042250134.db2.gz NDLGMNGDGLRUHM-AEFFLSMTSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001167837864 1042250261 /nfs/dbraw/zinc/25/02/61/1042250261.db2.gz NDLGMNGDGLRUHM-WMZOPIPTSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCc2cccc(Cl)c2C1 ZINC001167839671 1042250883 /nfs/dbraw/zinc/25/08/83/1042250883.db2.gz BDBKGMDPDFZBKR-OAHLLOKOSA-N 2 1 308.897 4.209 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CC[C@H]2CC2(Cl)Cl)CC1 ZINC000822583119 1042289768 /nfs/dbraw/zinc/28/97/68/1042289768.db2.gz JAKMSECINNKIQW-HNNXBMFYSA-N 2 1 321.336 4.014 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@H]3CCc4[nH+]ccn4C3)oc2cc1C ZINC000278971433 1042254777 /nfs/dbraw/zinc/25/47/77/1042254777.db2.gz NPDYIXULVQNENR-HZPDHXFCSA-N 2 1 323.440 4.159 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCc2c3ccccc3oc2C1 ZINC001167842036 1042257606 /nfs/dbraw/zinc/25/76/06/1042257606.db2.gz WBMXLNIPEZVAIV-INIZCTEOSA-N 2 1 314.473 4.301 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@@H]34)cc2)cc1 ZINC000319790212 1042260248 /nfs/dbraw/zinc/26/02/48/1042260248.db2.gz HWZSPVVOBGDYPN-RTWAWAEBSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@@H]34)cc2)cc1 ZINC000319790212 1042260256 /nfs/dbraw/zinc/26/02/56/1042260256.db2.gz HWZSPVVOBGDYPN-RTWAWAEBSA-N 2 1 306.453 4.070 20 0 DIADMP c1csc([C@H]([NH2+]C[C@H]2CCc3[nH+]ccn3C2)C2CCCC2)c1 ZINC000279035143 1042262861 /nfs/dbraw/zinc/26/28/61/1042262861.db2.gz WPCAKVYNFLMGGT-RDTXWAMCSA-N 2 1 315.486 4.028 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1Cl ZINC000279050883 1042265613 /nfs/dbraw/zinc/26/56/13/1042265613.db2.gz YAEAWSBXOBXEPQ-RYUDHWBXSA-N 2 1 324.255 4.103 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)c2ccccc2)c1 ZINC000324629214 1042270357 /nfs/dbraw/zinc/27/03/57/1042270357.db2.gz UDYBFRRTXDLYPY-DENIHFKCSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)c2ccccc2)c1 ZINC000324629214 1042270360 /nfs/dbraw/zinc/27/03/60/1042270360.db2.gz UDYBFRRTXDLYPY-DENIHFKCSA-N 2 1 322.496 4.324 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(C(F)F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000279715291 1042333855 /nfs/dbraw/zinc/33/38/55/1042333855.db2.gz LQWGRIVASVRMEV-RHSMWYFYSA-N 2 1 322.443 4.367 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2)[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167919169 1042460844 /nfs/dbraw/zinc/46/08/44/1042460844.db2.gz UOXPFLKCZKPQFC-SMTGMISWSA-N 2 1 318.892 4.210 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(Cl)s1 ZINC000571364607 1042482434 /nfs/dbraw/zinc/48/24/34/1042482434.db2.gz CBBVVTPUGZETSS-UHFFFAOYSA-N 2 1 311.882 4.073 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(Cl)s1 ZINC000571364607 1042482436 /nfs/dbraw/zinc/48/24/36/1042482436.db2.gz CBBVVTPUGZETSS-UHFFFAOYSA-N 2 1 311.882 4.073 20 0 DIADMP Cc1ccsc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000513418746 1042539646 /nfs/dbraw/zinc/53/96/46/1042539646.db2.gz CYWYOMPTBVZJMG-KRWDZBQOSA-N 2 1 306.519 4.145 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ccsc2)C[N@H+]1Cc1ccccc1 ZINC000513514266 1042549931 /nfs/dbraw/zinc/54/99/31/1042549931.db2.gz WUTMNPNKZBQONO-AEFFLSMTSA-N 2 1 314.498 4.138 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ccccc2)C[N@H+]1Cc1ccccc1 ZINC000513511154 1042550111 /nfs/dbraw/zinc/55/01/11/1042550111.db2.gz HTZKHNVVQVDPEE-NQIIRXRSSA-N 2 1 308.469 4.077 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C(C2CC2)C2CC2)CC1 ZINC000513713701 1042594767 /nfs/dbraw/zinc/59/47/67/1042594767.db2.gz RYJVPSRFFKUOMI-UHFFFAOYSA-N 2 1 312.501 4.208 20 0 DIADMP CC[N@@H+](CC[C@@H]1CC[NH2+]C1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000420299794 1042598269 /nfs/dbraw/zinc/59/82/69/1042598269.db2.gz JGRUHHJTJFRQHY-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP c1c2ccccc2[nH]c1[C@@H]1CCCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000420307653 1042598835 /nfs/dbraw/zinc/59/88/35/1042598835.db2.gz RPVSTQCPBKQUCE-UZLBHIALSA-N 2 1 311.473 4.085 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327641 1042598871 /nfs/dbraw/zinc/59/88/71/1042598871.db2.gz LPPWLPUPEJWZDO-SJORKVTESA-N 2 1 318.464 4.078 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccncc1Cl ZINC000421819612 1042653307 /nfs/dbraw/zinc/65/33/07/1042653307.db2.gz HZSCAIUMCBUTBE-XHSDSOJGSA-N 2 1 323.912 4.144 20 0 DIADMP Cc1[nH]c2ccc(C[NH2+][C@H]3C[C@@H]([NH3+])c4ccccc43)cc2c1C ZINC000422724032 1042689127 /nfs/dbraw/zinc/68/91/27/1042689127.db2.gz UDWWRDKMEFFDBI-QUCCMNQESA-N 2 1 305.425 4.019 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(N2CCCC2)c1 ZINC000422876504 1042691466 /nfs/dbraw/zinc/69/14/66/1042691466.db2.gz QFMBJPYWELYTHX-IWMITWMQSA-N 2 1 321.468 4.082 20 0 DIADMP Cc1cccc(C([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2cccc(C)c2)c1 ZINC000422846251 1042691545 /nfs/dbraw/zinc/69/15/45/1042691545.db2.gz FEVULIYUOVTKKG-WCRBZPEASA-N 2 1 320.480 4.265 20 0 DIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000422935216 1042693089 /nfs/dbraw/zinc/69/30/89/1042693089.db2.gz DJDQXPCQIZLXFJ-HWWQOWPSSA-N 2 1 308.878 4.206 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccc(OC3CCCC3)cc2)c2ccccc21 ZINC000422950829 1042694654 /nfs/dbraw/zinc/69/46/54/1042694654.db2.gz ZDEONOYLPRDVSV-NHCUHLMSSA-N 2 1 322.452 4.242 20 0 DIADMP Clc1ccc([C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423212696 1042699697 /nfs/dbraw/zinc/69/96/97/1042699697.db2.gz MAUXMFMXPVSZCF-DNVCBOLYSA-N 2 1 314.860 4.019 20 0 DIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CC(C)(C)[NH3+] ZINC000423283204 1042704396 /nfs/dbraw/zinc/70/43/96/1042704396.db2.gz DWSPAKRLSVCMOW-SNVBAGLBSA-N 2 1 323.893 4.160 20 0 DIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@H]([NH3+])C(C)C ZINC000423278618 1042704727 /nfs/dbraw/zinc/70/47/27/1042704727.db2.gz RAOYISKBWYJECZ-CJNGLKHVSA-N 2 1 317.502 4.061 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@@H](C[NH3+])C1CCCCC1 ZINC000423270883 1042705249 /nfs/dbraw/zinc/70/52/49/1042705249.db2.gz XDZICBYBHSPLTL-WFASDCNBSA-N 2 1 309.523 4.133 20 0 DIADMP CC[C@@H]([NH3+])C[NH2+][C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000423457501 1042714151 /nfs/dbraw/zinc/71/41/51/1042714151.db2.gz FZARMTGFXPILAF-IINYFYTJSA-N 2 1 323.893 4.160 20 0 DIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423479465 1042715209 /nfs/dbraw/zinc/71/52/09/1042715209.db2.gz VIDOPGWYFDHJOK-MKBNYLNASA-N 2 1 308.878 4.011 20 0 DIADMP c1ccc2c(c1)cccc2C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167958962 1042801213 /nfs/dbraw/zinc/80/12/13/1042801213.db2.gz LCILSIQZSHLWNE-SEJPIABJSA-N 2 1 320.480 4.335 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000516826786 1042855863 /nfs/dbraw/zinc/85/58/63/1042855863.db2.gz HLMZPQKVOMIABL-UZLBHIALSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000516826786 1042855870 /nfs/dbraw/zinc/85/58/70/1042855870.db2.gz HLMZPQKVOMIABL-UZLBHIALSA-N 2 1 312.501 4.065 20 0 DIADMP CCCCC/C(=C/c1ccccc1)C[N@@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC000425997616 1042896593 /nfs/dbraw/zinc/89/65/93/1042896593.db2.gz YCHUSVYPSRMASQ-VPHKTSFISA-N 2 1 312.501 4.144 20 0 DIADMP CCCCC/C(=C/c1ccccc1)C[NH+]1C[C@H]2C[N@@H+](C)C[C@H]2C1 ZINC000425997616 1042896601 /nfs/dbraw/zinc/89/66/01/1042896601.db2.gz YCHUSVYPSRMASQ-VPHKTSFISA-N 2 1 312.501 4.144 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ccc(F)cc2F)CC1 ZINC000519224088 1042940011 /nfs/dbraw/zinc/94/00/11/1042940011.db2.gz LOYVDEOOWANYQE-HNNXBMFYSA-N 2 1 324.459 4.470 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC(C)(C)C1 ZINC001167967605 1042954213 /nfs/dbraw/zinc/95/42/13/1042954213.db2.gz IKLVASCBNYFUAU-WFDLBOFBSA-N 2 1 304.522 4.196 20 0 DIADMP C[C@@H](CC1CCCCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167970928 1042961693 /nfs/dbraw/zinc/96/16/93/1042961693.db2.gz QHBNMVKWGJZXEP-FAXKSRBJSA-N 2 1 304.522 4.340 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(C)o1 ZINC001167970953 1042962189 /nfs/dbraw/zinc/96/21/89/1042962189.db2.gz QOFTTYFMQJGHKQ-HQSKLWIPSA-N 2 1 302.462 4.034 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(C)o1 ZINC001167970953 1042962193 /nfs/dbraw/zinc/96/21/93/1042962193.db2.gz QOFTTYFMQJGHKQ-HQSKLWIPSA-N 2 1 302.462 4.034 20 0 DIADMP Cc1ccccc1C(C)(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167978184 1042973650 /nfs/dbraw/zinc/97/36/50/1042973650.db2.gz LQKZAYPFVCYXIK-YQQQUEKLSA-N 2 1 312.501 4.225 20 0 DIADMP CC1=CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000519783995 1043003866 /nfs/dbraw/zinc/00/38/66/1043003866.db2.gz XMCAXIKJWNTBTP-WVVQBRDUSA-N 2 1 310.485 4.270 20 0 DIADMP CC[C@@H]1C[N@@H+](CCCn2ccnc2C)CC[C@H]1c1ccccc1 ZINC000441319529 1043035319 /nfs/dbraw/zinc/03/53/19/1043035319.db2.gz VUALBAFZFHBQIT-UYAOXDASSA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@@H]1C[N@H+](CCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000441319529 1043035322 /nfs/dbraw/zinc/03/53/22/1043035322.db2.gz VUALBAFZFHBQIT-UYAOXDASSA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@@H]1C[N@@H+](CCCn2cc[nH+]c2C)CC[C@H]1c1ccccc1 ZINC000441319529 1043035323 /nfs/dbraw/zinc/03/53/23/1043035323.db2.gz VUALBAFZFHBQIT-UYAOXDASSA-N 2 1 311.473 4.097 20 0 DIADMP CN(Cc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167996216 1043087167 /nfs/dbraw/zinc/08/71/67/1043087167.db2.gz ZQDSAJJHKGTJOT-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167996216 1043087178 /nfs/dbraw/zinc/08/71/78/1043087178.db2.gz ZQDSAJJHKGTJOT-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167996216 1043087192 /nfs/dbraw/zinc/08/71/92/1043087192.db2.gz ZQDSAJJHKGTJOT-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP C[NH+](Cc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167996216 1043087205 /nfs/dbraw/zinc/08/72/05/1043087205.db2.gz ZQDSAJJHKGTJOT-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP C[NH+](Cc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167996216 1043087216 /nfs/dbraw/zinc/08/72/16/1043087216.db2.gz ZQDSAJJHKGTJOT-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP c1ccc2cc(CC[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441446832 1043118379 /nfs/dbraw/zinc/11/83/79/1043118379.db2.gz JJZKFXPTQBWIQD-HXUWFJFHSA-N 2 1 322.496 4.190 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(O)c2)cc1 ZINC000178756810 1043137753 /nfs/dbraw/zinc/13/77/53/1043137753.db2.gz ILEICEPHKYFVQY-CABCVRRESA-N 2 1 321.424 4.298 20 0 DIADMP c1cc2cccc3c2c(c1)CC[C@H]3[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000866220081 1043162207 /nfs/dbraw/zinc/16/22/07/1043162207.db2.gz BECWAGRMLBFMEA-HXUWFJFHSA-N 2 1 306.453 4.044 20 0 DIADMP c1cc2cccc3c2c(c1)CC[C@H]3[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000866236813 1043164260 /nfs/dbraw/zinc/16/42/60/1043164260.db2.gz FJBAOKDZGAXUEM-QWFCFKBJSA-N 2 1 306.453 4.044 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cc2c(ccnc2Cl)o1 ZINC000866281546 1043174225 /nfs/dbraw/zinc/17/42/25/1043174225.db2.gz JDSHKYSPIYNSSR-YNEHKIRRSA-N 2 1 321.852 4.005 20 0 DIADMP Cc1ccc(CN[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC001168004827 1043237765 /nfs/dbraw/zinc/23/77/65/1043237765.db2.gz AETBFZMEVJNNTC-HGKCTWBKSA-N 2 1 312.457 4.119 20 0 DIADMP C[N@@H+]([C@@H]1CCc2ccccc21)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001168005209 1043247515 /nfs/dbraw/zinc/24/75/15/1043247515.db2.gz HZDPJEJKORWVGW-KXZRCVDZSA-N 2 1 310.485 4.011 20 0 DIADMP C[NH+]([C@@H]1CCc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001168005209 1043247526 /nfs/dbraw/zinc/24/75/26/1043247526.db2.gz HZDPJEJKORWVGW-KXZRCVDZSA-N 2 1 310.485 4.011 20 0 DIADMP C[NH+]([C@@H]1CCc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001168005209 1043247537 /nfs/dbraw/zinc/24/75/37/1043247537.db2.gz HZDPJEJKORWVGW-KXZRCVDZSA-N 2 1 310.485 4.011 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3occc32)c1 ZINC000192761642 1043275149 /nfs/dbraw/zinc/27/51/49/1043275149.db2.gz GYHOQXGMGPWGAV-IBGZPJMESA-N 2 1 312.457 4.287 20 0 DIADMP C[C@@H]1C[C@@H](NC(=[NH2+])C(C)(C)C)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008844 1043283415 /nfs/dbraw/zinc/28/34/15/1043283415.db2.gz YCSHNFJRXUGIEM-SCAQPMJSSA-N 2 1 301.478 4.041 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[C@H]2F)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168009228 1043285323 /nfs/dbraw/zinc/28/53/23/1043285323.db2.gz ZJMBNVQCKNGXRP-HHUCQEJWSA-N 2 1 318.480 4.156 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1-c1ccccc1 ZINC000427860279 1043312355 /nfs/dbraw/zinc/31/23/55/1043312355.db2.gz YNSSTOULBRPXLT-XLIONFOSSA-N 2 1 308.469 4.234 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1F ZINC000268872454 1043338461 /nfs/dbraw/zinc/33/84/61/1043338461.db2.gz DFHJMTGJTOLUMF-ZDUSSCGKSA-N 2 1 322.493 4.215 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]Cc2ccccc2)C1 ZINC000520947873 1043342728 /nfs/dbraw/zinc/34/27/28/1043342728.db2.gz APPOIUMLCIOAPC-KDURUIRLSA-N 2 1 322.496 4.454 20 0 DIADMP CC[N@H+](CCCc1c[nH+]cn1C)Cc1ccc2ccccc2c1 ZINC000521266262 1043378432 /nfs/dbraw/zinc/37/84/32/1043378432.db2.gz AYHNQJWLSKLOIM-UHFFFAOYSA-N 2 1 307.441 4.028 20 0 DIADMP CC[N@@H+](CCCc1c[nH+]cn1C)Cc1ccc2ccccc2c1 ZINC000521266262 1043378443 /nfs/dbraw/zinc/37/84/43/1043378443.db2.gz AYHNQJWLSKLOIM-UHFFFAOYSA-N 2 1 307.441 4.028 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)nc1 ZINC000270483636 1043388535 /nfs/dbraw/zinc/38/85/35/1043388535.db2.gz KWSCKOMTTJFSFL-LSDHHAIUSA-N 2 1 309.885 4.040 20 0 DIADMP C[N@@H+](CCC[NH2+]C1CCC(C(F)F)CC1)C1CCCCC1 ZINC000442660307 1043397832 /nfs/dbraw/zinc/39/78/32/1043397832.db2.gz YXDOOUFQIPFZEY-UHFFFAOYSA-N 2 1 302.453 4.055 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000271331968 1043412028 /nfs/dbraw/zinc/41/20/28/1043412028.db2.gz CMJFCKXDWBVIGP-WSTZPKSXSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000271331968 1043412039 /nfs/dbraw/zinc/41/20/39/1043412039.db2.gz CMJFCKXDWBVIGP-WSTZPKSXSA-N 2 1 323.484 4.094 20 0 DIADMP C[N@@H+](CCCSc1ccccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000442777617 1043416339 /nfs/dbraw/zinc/41/63/39/1043416339.db2.gz JKKXTQMNHIQRQU-YIONKMFJSA-N 2 1 324.921 4.037 20 0 DIADMP CC[C@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442776703 1043416418 /nfs/dbraw/zinc/41/64/18/1043416418.db2.gz CJZASBBBWOVIHK-FHERZECASA-N 2 1 316.480 4.301 20 0 DIADMP CC[C@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442776703 1043416424 /nfs/dbraw/zinc/41/64/24/1043416424.db2.gz CJZASBBBWOVIHK-FHERZECASA-N 2 1 316.480 4.301 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2S1 ZINC000872020814 1043421807 /nfs/dbraw/zinc/42/18/07/1043421807.db2.gz KPRZNZDKZHAILE-WMLDXEAASA-N 2 1 316.514 4.076 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)Sc3ccccc32)CC[N@@H+]1C ZINC000872040699 1043430811 /nfs/dbraw/zinc/43/08/11/1043430811.db2.gz ZSWYNCLTJVBRQC-IJEWVQPXSA-N 2 1 304.503 4.074 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)Sc3ccccc32)CC[N@H+]1C ZINC000872040699 1043430823 /nfs/dbraw/zinc/43/08/23/1043430823.db2.gz ZSWYNCLTJVBRQC-IJEWVQPXSA-N 2 1 304.503 4.074 20 0 DIADMP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000872052203 1043435378 /nfs/dbraw/zinc/43/53/78/1043435378.db2.gz MGCWXPWOHZFVHA-LSDHHAIUSA-N 2 1 308.432 4.065 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000442854774 1043442901 /nfs/dbraw/zinc/44/29/01/1043442901.db2.gz JBTKAPHJHOILIH-JKSUJKDBSA-N 2 1 306.519 4.324 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(C)(C)C)cc2)C1 ZINC000521827434 1043480389 /nfs/dbraw/zinc/48/03/89/1043480389.db2.gz ITTFSYZLNAYHDX-SFHVURJKSA-N 2 1 302.506 4.194 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc2cc(C)c(C)cc2o1 ZINC000349406319 1043507004 /nfs/dbraw/zinc/50/70/04/1043507004.db2.gz KQPLQCNJLFLCFD-UHFFFAOYSA-N 2 1 311.429 4.077 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc2cc(C)c(C)cc2o1 ZINC000349406319 1043507018 /nfs/dbraw/zinc/50/70/18/1043507018.db2.gz KQPLQCNJLFLCFD-UHFFFAOYSA-N 2 1 311.429 4.077 20 0 DIADMP CC(C)C[C@@H](C[NH2+]C[C@@H]1CC[N@H+](C(C)C)C1)c1ccccc1 ZINC000558419431 1043507258 /nfs/dbraw/zinc/50/72/58/1043507258.db2.gz WNGFWBSGQKOWMW-ICSRJNTNSA-N 2 1 302.506 4.136 20 0 DIADMP CSc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000558486153 1043519274 /nfs/dbraw/zinc/51/92/74/1043519274.db2.gz RVNKSZNZXMSBJC-KBPBESRZSA-N 2 1 324.559 4.213 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000558699628 1043576298 /nfs/dbraw/zinc/57/62/98/1043576298.db2.gz XWZGMHKTFXEUKH-ZLGUVYLKSA-N 2 1 324.468 4.190 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1c[nH+]ccc1N(C)C)CCC2 ZINC000353136573 1043589221 /nfs/dbraw/zinc/58/92/21/1043589221.db2.gz BDIKTWCSLTXUCC-HXUWFJFHSA-N 2 1 323.484 4.438 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CCC(C)C)c1ccoc1 ZINC000353520641 1043613429 /nfs/dbraw/zinc/61/34/29/1043613429.db2.gz OGMXWKPUKRRRHN-GOSISDBHSA-N 2 1 303.450 4.332 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccccc2-c2ccccc2C)C1 ZINC001648960306 1043617989 /nfs/dbraw/zinc/61/79/89/1043617989.db2.gz NQDKOJPLSXUWOH-LJQANCHMSA-N 2 1 322.496 4.484 20 0 DIADMP c1ccc(C[NH+]2CCC(Nc3cc(C4CC4)cc[nH+]3)CC2)cc1 ZINC000353560629 1043618312 /nfs/dbraw/zinc/61/83/12/1043618312.db2.gz NVWFWXLCZBNDBY-UHFFFAOYSA-N 2 1 307.441 4.036 20 0 DIADMP C[C@@H](Nc1cc(C2CC2)cc[nH+]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000353563539 1043619117 /nfs/dbraw/zinc/61/91/17/1043619117.db2.gz TWFWWEBCVANKDL-UZLBHIALSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@@H](Nc1cc(C2CC2)cc[nH+]1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000353563539 1043619129 /nfs/dbraw/zinc/61/91/29/1043619129.db2.gz TWFWWEBCVANKDL-UZLBHIALSA-N 2 1 321.468 4.282 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2(C(F)F)CC2)CC1 ZINC000353609997 1043623702 /nfs/dbraw/zinc/62/37/02/1043623702.db2.gz VJGJLBZQJSYLEE-UHFFFAOYSA-N 2 1 322.443 4.065 20 0 DIADMP CC(C)CC[NH+]1CCC([NH2+][C@H](c2ccccn2)C2CCC2)CC1 ZINC000926751476 1043625154 /nfs/dbraw/zinc/62/51/54/1043625154.db2.gz APOFJSAAZHKFSG-FQEVSTJZSA-N 2 1 315.505 4.023 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754863 1043626656 /nfs/dbraw/zinc/62/66/56/1043626656.db2.gz SQNRTRWUZGQADN-RYUDHWBXSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754863 1043626664 /nfs/dbraw/zinc/62/66/64/1043626664.db2.gz SQNRTRWUZGQADN-RYUDHWBXSA-N 2 1 320.424 4.149 20 0 DIADMP Cc1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC000353649473 1043630641 /nfs/dbraw/zinc/63/06/41/1043630641.db2.gz XTHOWLQVRZEFIK-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000191474388 1043641413 /nfs/dbraw/zinc/64/14/13/1043641413.db2.gz CTYQPPKNQVRBDW-AWEZNQCLSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1ccnc1CCCN(C)[C@@H](C)c1c(F)cccc1F ZINC000191474326 1043642488 /nfs/dbraw/zinc/64/24/88/1043642488.db2.gz HCHJMZIUDODUEN-AWEZNQCLSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000191474402 1043642573 /nfs/dbraw/zinc/64/25/73/1043642573.db2.gz CTYQPPKNQVRBDW-CQSZACIVSA-N 2 1 321.415 4.197 20 0 DIADMP CC(C)C[C@H](C[NH+](C)C[C@H]1CCC[N@@H+](C)C1)c1ccccc1 ZINC000474152417 1043664004 /nfs/dbraw/zinc/66/40/04/1043664004.db2.gz HHLMHRMXYXRODX-AZUAARDMSA-N 2 1 302.506 4.090 20 0 DIADMP CC(C)C[C@@H](C[NH+](C)C[C@@H]1CCC[N@@H+](C)C1)c1ccccc1 ZINC000474152419 1043664323 /nfs/dbraw/zinc/66/43/23/1043664323.db2.gz HHLMHRMXYXRODX-QUCCMNQESA-N 2 1 302.506 4.090 20 0 DIADMP Cc1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)o1 ZINC000354043832 1043676503 /nfs/dbraw/zinc/67/65/03/1043676503.db2.gz CGUGSQGQMDXADP-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](CC(C)C)c2ccccc2)C1 ZINC000474271899 1043718750 /nfs/dbraw/zinc/71/87/50/1043718750.db2.gz PCYKACPVZCFFEU-ICSRJNTNSA-N 2 1 302.506 4.090 20 0 DIADMP CSC(C)(C)C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877064928 1043738849 /nfs/dbraw/zinc/73/88/49/1043738849.db2.gz GFQRWGTUMZPKLB-SJLPKXTDSA-N 2 1 318.530 4.086 20 0 DIADMP CSC(C)(C)C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877064928 1043738864 /nfs/dbraw/zinc/73/88/64/1043738864.db2.gz GFQRWGTUMZPKLB-SJLPKXTDSA-N 2 1 318.530 4.086 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C[NH+](C)C)CCCC2)c2ccsc2S1 ZINC000355055159 1043741310 /nfs/dbraw/zinc/74/13/10/1043741310.db2.gz DDGGZIUZRVMTBI-UKRRQHHQSA-N 2 1 324.559 4.385 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(C[NH+](C)C)CCCC2)c2ccsc2S1 ZINC000355055153 1043743654 /nfs/dbraw/zinc/74/36/54/1043743654.db2.gz DDGGZIUZRVMTBI-DZGCQCFKSA-N 2 1 324.559 4.385 20 0 DIADMP CC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)C1CCCCC1 ZINC000126498017 1043759500 /nfs/dbraw/zinc/75/95/00/1043759500.db2.gz HFHKWTVDWKPBMV-GOSISDBHSA-N 2 1 312.461 4.024 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2coc3ccc(F)cc23)CC1 ZINC001141852816 1043779283 /nfs/dbraw/zinc/77/92/83/1043779283.db2.gz SEEFBEXNSDQDGU-UHFFFAOYSA-N 2 1 318.436 4.124 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2coc3ccc(F)cc23)CC1 ZINC001141858292 1043783343 /nfs/dbraw/zinc/78/33/43/1043783343.db2.gz HGLOLJHNMLZPJZ-UHFFFAOYSA-N 2 1 318.436 4.268 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2coc3ccc(F)cc23)CC1 ZINC001141858292 1043783354 /nfs/dbraw/zinc/78/33/54/1043783354.db2.gz HGLOLJHNMLZPJZ-UHFFFAOYSA-N 2 1 318.436 4.268 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000474468237 1043788658 /nfs/dbraw/zinc/78/86/58/1043788658.db2.gz DXDWRGURAVQETR-QLFBSQMISA-N 2 1 319.880 4.263 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000356395826 1043837622 /nfs/dbraw/zinc/83/76/22/1043837622.db2.gz UITPEBIDKNSZTM-SGWGQVFISA-N 2 1 309.457 4.150 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000356395826 1043837642 /nfs/dbraw/zinc/83/76/42/1043837642.db2.gz UITPEBIDKNSZTM-SGWGQVFISA-N 2 1 309.457 4.150 20 0 DIADMP C[C@H]1CC([NH+]2Cc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039313 1043854412 /nfs/dbraw/zinc/85/44/12/1043854412.db2.gz CWJZABIYYIXEJS-ROUUACIJSA-N 2 1 320.480 4.444 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC[C@](C)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039727 1043857119 /nfs/dbraw/zinc/85/71/19/1043857119.db2.gz HUFSMARPTDJDEY-HLIPFELVSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@](C)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039727 1043857137 /nfs/dbraw/zinc/85/71/37/1043857137.db2.gz HUFSMARPTDJDEY-HLIPFELVSA-N 2 1 318.480 4.252 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2nccc3ccccc32)CC1 ZINC000289671296 1043861430 /nfs/dbraw/zinc/86/14/30/1043861430.db2.gz JEOOKGLWEFIPQB-INIZCTEOSA-N 2 1 311.473 4.150 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C2CCC2)C[C@H]1c1ccccc1 ZINC000453303779 1043882308 /nfs/dbraw/zinc/88/23/08/1043882308.db2.gz DCPVEWIVGMRMBV-MOPGFXCFSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C2CCC2)C[C@H]1c1ccccc1 ZINC000453303779 1043882330 /nfs/dbraw/zinc/88/23/30/1043882330.db2.gz DCPVEWIVGMRMBV-MOPGFXCFSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C2CCC2)C[C@H]1c1ccccc1 ZINC000453303780 1043882678 /nfs/dbraw/zinc/88/26/78/1043882678.db2.gz DCPVEWIVGMRMBV-OALUTQOASA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)C2CCC2)C[C@H]1c1ccccc1 ZINC000453303780 1043882700 /nfs/dbraw/zinc/88/27/00/1043882700.db2.gz DCPVEWIVGMRMBV-OALUTQOASA-N 2 1 300.490 4.238 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)C2CCCC2)CC1 ZINC000474727660 1043901636 /nfs/dbraw/zinc/90/16/36/1043901636.db2.gz KXLHGGYODOVFCS-DLBZAZTESA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000474727665 1043902234 /nfs/dbraw/zinc/90/22/34/1043902234.db2.gz KXLHGGYODOVFCS-SJORKVTESA-N 2 1 300.490 4.380 20 0 DIADMP CC1CC[NH+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168041292 1043903583 /nfs/dbraw/zinc/90/35/83/1043903583.db2.gz RNBNWHMVMNCJHE-QZTJIDSGSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC000474794541 1043919343 /nfs/dbraw/zinc/91/93/43/1043919343.db2.gz JYPIFNPIEVIXHH-QUCCMNQESA-N 2 1 324.553 4.070 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474806636 1043926053 /nfs/dbraw/zinc/92/60/53/1043926053.db2.gz GDDRLUSOVJEQAA-KMWLYBPWSA-N 2 1 320.908 4.437 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474806636 1043926057 /nfs/dbraw/zinc/92/60/57/1043926057.db2.gz GDDRLUSOVJEQAA-KMWLYBPWSA-N 2 1 320.908 4.437 20 0 DIADMP CC(C)C[C@@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000474808621 1043926116 /nfs/dbraw/zinc/92/61/16/1043926116.db2.gz LTSKSCFCNWOQST-UDEWTMQYSA-N 2 1 314.517 4.421 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474818102 1043928232 /nfs/dbraw/zinc/92/82/32/1043928232.db2.gz PTBLGZUBLBFHJO-HUUCEWRRSA-N 2 1 319.880 4.407 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2C[C@@H](C)N(Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042312 1043933822 /nfs/dbraw/zinc/93/38/22/1043933822.db2.gz YUGUGIFCMTYARF-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042312 1043933829 /nfs/dbraw/zinc/93/38/29/1043933829.db2.gz YUGUGIFCMTYARF-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042312 1043933831 /nfs/dbraw/zinc/93/38/31/1043933831.db2.gz YUGUGIFCMTYARF-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042312 1043933838 /nfs/dbraw/zinc/93/38/38/1043933838.db2.gz YUGUGIFCMTYARF-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042312 1043933843 /nfs/dbraw/zinc/93/38/43/1043933843.db2.gz YUGUGIFCMTYARF-FTEYMNFISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@H+](C2C[C@H](C)N(Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042319 1043934784 /nfs/dbraw/zinc/93/47/84/1043934784.db2.gz YUGUGIFCMTYARF-SQNIBIBYSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042319 1043934789 /nfs/dbraw/zinc/93/47/89/1043934789.db2.gz YUGUGIFCMTYARF-SQNIBIBYSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168042319 1043934792 /nfs/dbraw/zinc/93/47/92/1043934792.db2.gz YUGUGIFCMTYARF-SQNIBIBYSA-N 2 1 300.490 4.160 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cccc3cnccc32)CC1 ZINC000639375867 1043942614 /nfs/dbraw/zinc/94/26/14/1043942614.db2.gz IENGBMMWRXLNPZ-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@H]1CC([N@H+]2C[C@@H]3CCC[C@@H]3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168045389 1044028465 /nfs/dbraw/zinc/02/84/65/1044028465.db2.gz JFHZLRYVYSINBX-QGZVKYPTSA-N 2 1 312.501 4.160 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000443854988 1044039850 /nfs/dbraw/zinc/03/98/50/1044039850.db2.gz OZUCROAYMGLHML-CGBFIWBNSA-N 2 1 304.522 4.221 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000562020256 1044049294 /nfs/dbraw/zinc/04/92/94/1044049294.db2.gz VHQDHOYDZOFSQT-WOJBJXKFSA-N 2 1 314.517 4.108 20 0 DIADMP CC(C)(C)OCCCC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000475047413 1044076213 /nfs/dbraw/zinc/07/62/13/1044076213.db2.gz ONWWPBXYOAVNPV-IBGZPJMESA-N 2 1 324.553 4.170 20 0 DIADMP C[C@@H]1CC([NH+]2CCC3(CC3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168048312 1044081344 /nfs/dbraw/zinc/08/13/44/1044081344.db2.gz VHRPZACOQBZOSW-QZTJIDSGSA-N 2 1 312.501 4.304 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1cc(F)ccc1F)C(C)C ZINC000358745078 1044096361 /nfs/dbraw/zinc/09/63/61/1044096361.db2.gz DXKKRXUKVSRSKV-GOSISDBHSA-N 2 1 321.415 4.237 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000281133373 1044098394 /nfs/dbraw/zinc/09/83/94/1044098394.db2.gz YPMVEIVDNBDIKG-HXUWFJFHSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(F)c(C)c1)C1CC1 ZINC000359274553 1044149181 /nfs/dbraw/zinc/14/91/81/1044149181.db2.gz DNPFYUUDCONCEF-LJQANCHMSA-N 2 1 315.436 4.160 20 0 DIADMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1F ZINC000359411656 1044164606 /nfs/dbraw/zinc/16/46/06/1044164606.db2.gz DWKMNTGAIHMFKT-WBMJQRKESA-N 2 1 323.843 4.361 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc2cccnc21 ZINC001137177936 1044166118 /nfs/dbraw/zinc/16/61/18/1044166118.db2.gz HWQMPMYQOMWGER-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc2cccnc21 ZINC001137177936 1044166132 /nfs/dbraw/zinc/16/61/32/1044166132.db2.gz HWQMPMYQOMWGER-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc2cccnc21 ZINC001137177936 1044166136 /nfs/dbraw/zinc/16/61/36/1044166136.db2.gz HWQMPMYQOMWGER-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[C@H](CC[NH2+][C@H]1CCSc2ccc(F)cc21)[NH+]1CCCCC1 ZINC000346876498 1044166428 /nfs/dbraw/zinc/16/64/28/1044166428.db2.gz KJACQOVKQFELHP-PBHICJAKSA-N 2 1 322.493 4.217 20 0 DIADMP CC[C@H]([NH2+]CCC[N@H+](C)C(C)C)c1ccccc1OC(F)F ZINC000359631588 1044183322 /nfs/dbraw/zinc/18/33/22/1044183322.db2.gz IMNQROZXRNFYER-HNNXBMFYSA-N 2 1 314.420 4.059 20 0 DIADMP CC[C@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccccc1OC(F)F ZINC000359631588 1044183329 /nfs/dbraw/zinc/18/33/29/1044183329.db2.gz IMNQROZXRNFYER-HNNXBMFYSA-N 2 1 314.420 4.059 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444208234 1044237528 /nfs/dbraw/zinc/23/75/28/1044237528.db2.gz CMBNIGREEZJWQS-JKSUJKDBSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444208234 1044237543 /nfs/dbraw/zinc/23/75/43/1044237543.db2.gz CMBNIGREEZJWQS-JKSUJKDBSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000883250991 1044244939 /nfs/dbraw/zinc/24/49/39/1044244939.db2.gz XWDXXZZAGQADHI-NVXWUHKLSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000883250991 1044244952 /nfs/dbraw/zinc/24/49/52/1044244952.db2.gz XWDXXZZAGQADHI-NVXWUHKLSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1CC([N@@H+](C)CC(C)(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168052356 1044246140 /nfs/dbraw/zinc/24/61/40/1044246140.db2.gz KOPYUHDEHCWOKW-IRXDYDNUSA-N 2 1 302.506 4.406 20 0 DIADMP FC1(F)CCC[C@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000883266709 1044256353 /nfs/dbraw/zinc/25/63/53/1044256353.db2.gz HPNAIQWVEIWSBR-KRWDZBQOSA-N 2 1 322.443 4.066 20 0 DIADMP CC[C@@H]1CCC[N@H+]1C1C[C@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168054715 1044262353 /nfs/dbraw/zinc/26/23/53/1044262353.db2.gz TUPWDHORMGWSNK-JENIJYKNSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[N@@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054715 1044262366 /nfs/dbraw/zinc/26/23/66/1044262366.db2.gz TUPWDHORMGWSNK-JENIJYKNSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[N@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054715 1044262380 /nfs/dbraw/zinc/26/23/80/1044262380.db2.gz TUPWDHORMGWSNK-JENIJYKNSA-N 2 1 300.490 4.302 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000563570862 1044283179 /nfs/dbraw/zinc/28/31/79/1044283179.db2.gz JUQIIEYZFYKPIY-LZQZEXGQSA-N 2 1 320.908 4.296 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CC(c2cccc(Cl)c2)C1 ZINC000360702105 1044302561 /nfs/dbraw/zinc/30/25/61/1044302561.db2.gz ZHQZNHNTCIQQGH-BELGNNRLSA-N 2 1 317.864 4.017 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCc2ccccc2)CC1 ZINC000563693723 1044303346 /nfs/dbraw/zinc/30/33/46/1044303346.db2.gz QDAYYNJFYSATQK-UHFFFAOYSA-N 2 1 322.496 4.262 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475276524 1044338944 /nfs/dbraw/zinc/33/89/44/1044338944.db2.gz PBXGJPVAXGJSAL-FPOVZHCZSA-N 2 1 322.496 4.038 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC(C)(C)C2)[C@H]1c1cccs1 ZINC000564125673 1044344051 /nfs/dbraw/zinc/34/40/51/1044344051.db2.gz IDHUHFAWUWNFHZ-INMHGKMJSA-N 2 1 306.519 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC(C)(C)C2)[C@H]1c1cccs1 ZINC000564125673 1044344064 /nfs/dbraw/zinc/34/40/64/1044344064.db2.gz IDHUHFAWUWNFHZ-INMHGKMJSA-N 2 1 306.519 4.299 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC(C)(C)C2)[C@@H]1c1cccs1 ZINC000564125672 1044345036 /nfs/dbraw/zinc/34/50/36/1044345036.db2.gz IDHUHFAWUWNFHZ-HLLBOEOZSA-N 2 1 306.519 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC(C)(C)C2)[C@@H]1c1cccs1 ZINC000564125672 1044345051 /nfs/dbraw/zinc/34/50/51/1044345051.db2.gz IDHUHFAWUWNFHZ-HLLBOEOZSA-N 2 1 306.519 4.299 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475297526 1044349040 /nfs/dbraw/zinc/34/90/40/1044349040.db2.gz XNABGCAMNZMLHT-SLTDHEAWSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@@H]1CC([N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168063915 1044393515 /nfs/dbraw/zinc/39/35/15/1044393515.db2.gz OALMGDGIWZODFQ-SMOSDQRPSA-N 2 1 312.501 4.016 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753565 1044438289 /nfs/dbraw/zinc/43/82/89/1044438289.db2.gz KTVHZOQIENTELC-QBIMZIAESA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753565 1044438296 /nfs/dbraw/zinc/43/82/96/1044438296.db2.gz KTVHZOQIENTELC-QBIMZIAESA-N 2 1 306.881 4.180 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CCSc2c(F)cccc21)C[NH+]1CCCCC1 ZINC000336851130 1044439066 /nfs/dbraw/zinc/43/90/66/1044439066.db2.gz HEJVQPTZEDRUFD-RHSMWYFYSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)C1(c2ccccc2)CCCC1 ZINC000248558172 1044445702 /nfs/dbraw/zinc/44/57/02/1044445702.db2.gz LQTBSINKSLNCAQ-SXLOBPIMSA-N 2 1 312.501 4.103 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000565663693 1044447638 /nfs/dbraw/zinc/44/76/38/1044447638.db2.gz BCQYHPMLTBGKBF-FQEVSTJZSA-N 2 1 323.484 4.360 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000565663693 1044447641 /nfs/dbraw/zinc/44/76/41/1044447641.db2.gz BCQYHPMLTBGKBF-FQEVSTJZSA-N 2 1 323.484 4.360 20 0 DIADMP Cc1cscc1C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000565744576 1044454442 /nfs/dbraw/zinc/45/44/42/1044454442.db2.gz WYHLGICAXSCJCJ-FUHWJXTLSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000294966353 1044476164 /nfs/dbraw/zinc/47/61/64/1044476164.db2.gz LJGBFRUKQSNSCX-QAPCUYQASA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000294966353 1044476170 /nfs/dbraw/zinc/47/61/70/1044476170.db2.gz LJGBFRUKQSNSCX-QAPCUYQASA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966353 1044476178 /nfs/dbraw/zinc/47/61/78/1044476178.db2.gz LJGBFRUKQSNSCX-QAPCUYQASA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966353 1044476182 /nfs/dbraw/zinc/47/61/82/1044476182.db2.gz LJGBFRUKQSNSCX-QAPCUYQASA-N 2 1 322.443 4.017 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475564357 1044506858 /nfs/dbraw/zinc/50/68/58/1044506858.db2.gz ALECGPBYNJHZKC-UHFFFAOYSA-N 2 1 306.881 4.063 20 0 DIADMP CC(C)(C)c1ccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)s1 ZINC000475569329 1044508722 /nfs/dbraw/zinc/50/87/22/1044508722.db2.gz WYPVGPUQMGKLGU-UHFFFAOYSA-N 2 1 306.519 4.152 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CC3CCC3)C[C@@H]21 ZINC001202721621 1044511694 /nfs/dbraw/zinc/51/16/94/1044511694.db2.gz GDTXDUZHHMZCID-NZSAHSFTSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CC3CCC3)C[C@@H]21 ZINC001202721621 1044511710 /nfs/dbraw/zinc/51/17/10/1044511710.db2.gz GDTXDUZHHMZCID-NZSAHSFTSA-N 2 1 318.530 4.081 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CC3CCC3)C[C@@H]21 ZINC001202721624 1044513034 /nfs/dbraw/zinc/51/30/34/1044513034.db2.gz GDTXDUZHHMZCID-YTQUADARSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CC3CCC3)C[C@@H]21 ZINC001202721624 1044513049 /nfs/dbraw/zinc/51/30/49/1044513049.db2.gz GDTXDUZHHMZCID-YTQUADARSA-N 2 1 318.530 4.081 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(Cl)nc1 ZINC000179106228 1044540275 /nfs/dbraw/zinc/54/02/75/1044540275.db2.gz FVSAGCLXTJBCIR-XHSDSOJGSA-N 2 1 323.912 4.144 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148029 1044546881 /nfs/dbraw/zinc/54/68/81/1044546881.db2.gz AMPOZOSMWRJRCS-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148029 1044546895 /nfs/dbraw/zinc/54/68/95/1044546895.db2.gz AMPOZOSMWRJRCS-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148029 1044546911 /nfs/dbraw/zinc/54/69/11/1044546911.db2.gz AMPOZOSMWRJRCS-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148029 1044546923 /nfs/dbraw/zinc/54/69/23/1044546923.db2.gz AMPOZOSMWRJRCS-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP CC[N@H+](CCCc1c[nH+]cn1C)[C@@H](C)c1cc2ccccc2o1 ZINC000567747972 1044584143 /nfs/dbraw/zinc/58/41/43/1044584143.db2.gz GICHBUXHZIXNCX-HNNXBMFYSA-N 2 1 311.429 4.182 20 0 DIADMP CC[N@@H+](CCCc1c[nH+]cn1C)[C@@H](C)c1cc2ccccc2o1 ZINC000567747972 1044584159 /nfs/dbraw/zinc/58/41/59/1044584159.db2.gz GICHBUXHZIXNCX-HNNXBMFYSA-N 2 1 311.429 4.182 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000444663816 1044593391 /nfs/dbraw/zinc/59/33/91/1044593391.db2.gz LKSUNEFLDBXBDW-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315279 1044599651 /nfs/dbraw/zinc/59/96/51/1044599651.db2.gz JQJNSEYCOPNHHC-ZWKOTPCHSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315279 1044599662 /nfs/dbraw/zinc/59/96/62/1044599662.db2.gz JQJNSEYCOPNHHC-ZWKOTPCHSA-N 2 1 318.480 4.331 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000568329659 1044616550 /nfs/dbraw/zinc/61/65/50/1044616550.db2.gz AVZFMJWJDWWNQH-JXFKEZNVSA-N 2 1 316.464 4.082 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)cc1 ZINC000348367684 1044622648 /nfs/dbraw/zinc/62/26/48/1044622648.db2.gz FSENHVBDBXBKIU-DZGCQCFKSA-N 2 1 319.399 4.267 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(C)CCCCC2)C[C@@H]1c1ccccc1 ZINC000568776032 1044649049 /nfs/dbraw/zinc/64/90/49/1044649049.db2.gz YXWRIOZZTNVFPC-RTBURBONSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(C)CCCCC2)C[C@@H]1c1ccccc1 ZINC000568776032 1044649056 /nfs/dbraw/zinc/64/90/56/1044649056.db2.gz YXWRIOZZTNVFPC-RTBURBONSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1(C[NH2+]CC(C)(C)C)CCCCC1 ZINC000714233891 1044670067 /nfs/dbraw/zinc/67/00/67/1044670067.db2.gz XDLBTHKYKXPIBV-UHFFFAOYSA-N 2 1 302.506 4.457 20 0 DIADMP C[N@H+](Cc1ccccc1)C1(C[NH2+]CC(C)(C)C)CCCCC1 ZINC000714233891 1044670064 /nfs/dbraw/zinc/67/00/64/1044670064.db2.gz XDLBTHKYKXPIBV-UHFFFAOYSA-N 2 1 302.506 4.457 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@@H](C)c3ccccc3F)CC2)[nH+]c1C ZINC000886668413 1044677176 /nfs/dbraw/zinc/67/71/76/1044677176.db2.gz SHFHRTOJMMGWSG-AWEZNQCLSA-N 2 1 301.409 4.106 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CC(C)=C[C@@H](C)C1 ZINC000570371583 1044752597 /nfs/dbraw/zinc/75/25/97/1044752597.db2.gz SGEOIQCBFMGKSL-SJLPKXTDSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CC(C)=C[C@@H](C)C1 ZINC000570371583 1044752615 /nfs/dbraw/zinc/75/26/15/1044752615.db2.gz SGEOIQCBFMGKSL-SJLPKXTDSA-N 2 1 303.494 4.150 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(F)c2)c1 ZINC000123980170 1044790904 /nfs/dbraw/zinc/79/09/04/1044790904.db2.gz TYRPSUKBSQJZST-HNNXBMFYSA-N 2 1 300.421 4.128 20 0 DIADMP CC(C)(C)[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(F)c1 ZINC000459390036 1044820200 /nfs/dbraw/zinc/82/02/00/1044820200.db2.gz IDBMFYTZLIJDEZ-SFHVURJKSA-N 2 1 304.453 4.129 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)CC1 ZINC000572023210 1044839648 /nfs/dbraw/zinc/83/96/48/1044839648.db2.gz OUJOJQSABUAHJD-CQSZACIVSA-N 2 1 324.896 4.262 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)CC1 ZINC000572023209 1044840501 /nfs/dbraw/zinc/84/05/01/1044840501.db2.gz OUJOJQSABUAHJD-AWEZNQCLSA-N 2 1 324.896 4.262 20 0 DIADMP C[C@H](C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890166 1044881608 /nfs/dbraw/zinc/88/16/08/1044881608.db2.gz QKADYBYNVRGXAA-NVXWUHKLSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890166 1044881621 /nfs/dbraw/zinc/88/16/21/1044881621.db2.gz QKADYBYNVRGXAA-NVXWUHKLSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890166 1044881633 /nfs/dbraw/zinc/88/16/33/1044881633.db2.gz QKADYBYNVRGXAA-NVXWUHKLSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890166 1044881646 /nfs/dbraw/zinc/88/16/46/1044881646.db2.gz QKADYBYNVRGXAA-NVXWUHKLSA-N 2 1 320.908 4.107 20 0 DIADMP Cc1cccc(C[N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)n1 ZINC000411396836 1045002431 /nfs/dbraw/zinc/00/24/31/1045002431.db2.gz XXMLGMGAHREPBR-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1Cl ZINC000575974959 1045023717 /nfs/dbraw/zinc/02/37/17/1045023717.db2.gz IKQLMGAGHPODOI-OFQRWUPVSA-N 2 1 324.896 4.261 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000446755213 1045031994 /nfs/dbraw/zinc/03/19/94/1045031994.db2.gz YZQBRTQUSXEYNY-LAUBAEHRSA-N 2 1 312.501 4.300 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1 ZINC000576353285 1045052417 /nfs/dbraw/zinc/05/24/17/1045052417.db2.gz CGYMIXLXWNCRFZ-CRAIPNDOSA-N 2 1 320.908 4.107 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC2CCCCC2)C3)cc1 ZINC000447512176 1045139393 /nfs/dbraw/zinc/13/93/93/1045139393.db2.gz OWCILOAQTVORGU-MZADTFQBSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000525991307 1045150789 /nfs/dbraw/zinc/15/07/89/1045150789.db2.gz KSKDCWDPHNQFPV-AOIWGVFYSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(F)ccc2Cl)CC1 ZINC000526083513 1045165704 /nfs/dbraw/zinc/16/57/04/1045165704.db2.gz MQCZGRJYYXABRS-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[C@H](CC[NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccc1 ZINC000447823508 1045178385 /nfs/dbraw/zinc/17/83/85/1045178385.db2.gz WTGKTDGPINEEPV-RBUKOAKNSA-N 2 1 302.506 4.282 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694632 1045191250 /nfs/dbraw/zinc/19/12/50/1045191250.db2.gz FSTHQVYTCSKUOH-WCFLWFBJSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694632 1045191253 /nfs/dbraw/zinc/19/12/53/1045191253.db2.gz FSTHQVYTCSKUOH-WCFLWFBJSA-N 2 1 318.408 4.044 20 0 DIADMP Cc1ccccc1C[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccco1 ZINC000924700914 1045191663 /nfs/dbraw/zinc/19/16/63/1045191663.db2.gz ZLTAGTQYKYEJOV-AABGKKOBSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccco1 ZINC000924700914 1045191667 /nfs/dbraw/zinc/19/16/67/1045191667.db2.gz ZLTAGTQYKYEJOV-AABGKKOBSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccco1 ZINC000924700914 1045191672 /nfs/dbraw/zinc/19/16/72/1045191672.db2.gz ZLTAGTQYKYEJOV-AABGKKOBSA-N 2 1 324.468 4.088 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ncccc1Cl ZINC000924949526 1045214802 /nfs/dbraw/zinc/21/48/02/1045214802.db2.gz GUUJUNVBQKVFBX-CJNGLKHVSA-N 2 1 320.868 4.007 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668282 1045246356 /nfs/dbraw/zinc/24/63/56/1045246356.db2.gz VHYSXUUHCQMTDR-QCGYCXEESA-N 2 1 318.530 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668282 1045246367 /nfs/dbraw/zinc/24/63/67/1045246367.db2.gz VHYSXUUHCQMTDR-QCGYCXEESA-N 2 1 318.530 4.155 20 0 DIADMP CC(C)C(C)(C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000578482875 1045247290 /nfs/dbraw/zinc/24/72/90/1045247290.db2.gz OYIGDEUKIVEJFP-ACDBMABISA-N 2 1 314.517 4.454 20 0 DIADMP c1cn2c([nH+]1)CC[C@H](C[NH2+][C@H]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC000527695193 1045250422 /nfs/dbraw/zinc/25/04/22/1045250422.db2.gz LUPJUPQPPIGSDA-RLLQIKCJSA-N 2 1 323.484 4.152 20 0 DIADMP Fc1cc2c(cc1Cl)[C@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CC2 ZINC000527853502 1045268501 /nfs/dbraw/zinc/26/85/01/1045268501.db2.gz PMUIVIJWSADTQN-GOSISDBHSA-N 2 1 322.855 4.073 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768594 1045270550 /nfs/dbraw/zinc/27/05/50/1045270550.db2.gz JLHWUPOZKVHGRL-JENIJYKNSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768594 1045270559 /nfs/dbraw/zinc/27/05/59/1045270559.db2.gz JLHWUPOZKVHGRL-JENIJYKNSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000449036532 1045336654 /nfs/dbraw/zinc/33/66/54/1045336654.db2.gz UNEAQDPFPLXJSK-GOSISDBHSA-N 2 1 308.469 4.046 20 0 DIADMP CCc1nccn1[C@H]1CCC[N@@H+](Cc2cccc3ccoc32)C1 ZINC000449025090 1045337783 /nfs/dbraw/zinc/33/77/83/1045337783.db2.gz GEBFDVSRRDEJKV-KRWDZBQOSA-N 2 1 309.413 4.029 20 0 DIADMP Cc1cc(C[N@H+](C)C2CCN(Cc3ccccc3)CC2)cs1 ZINC000449023224 1045337809 /nfs/dbraw/zinc/33/78/09/1045337809.db2.gz ORNDXACMDFBGJJ-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP Cc1cc(CN(C)C2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000449023224 1045337813 /nfs/dbraw/zinc/33/78/13/1045337813.db2.gz ORNDXACMDFBGJJ-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000449085909 1045343491 /nfs/dbraw/zinc/34/34/91/1045343491.db2.gz AQSCCZRTAPFZEW-PMACEKPBSA-N 2 1 320.480 4.378 20 0 DIADMP Clc1ccc([C@H]2CC[C@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000449071738 1045344317 /nfs/dbraw/zinc/34/43/17/1045344317.db2.gz OLHXCYAEOURVNP-YJBOKZPZSA-N 2 1 318.892 4.193 20 0 DIADMP CSCC1CCC([NH2+]CCCC[N@H+]2CCCC[C@H]2C)CC1 ZINC000449081613 1045345581 /nfs/dbraw/zinc/34/55/81/1045345581.db2.gz GRJQCINLLVXEMF-WWDZGPRUSA-N 2 1 312.567 4.152 20 0 DIADMP C[C@H]([NH2+]Cc1cccc2ccoc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000449234785 1045363180 /nfs/dbraw/zinc/36/31/80/1045363180.db2.gz RDAGPYDPLLXMSO-YJBOKZPZSA-N 2 1 312.457 4.175 20 0 DIADMP Cc1cccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1F ZINC000449221902 1045364694 /nfs/dbraw/zinc/36/46/94/1045364694.db2.gz UWXHAPMQBCVKEE-UHFFFAOYSA-N 2 1 312.432 4.020 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000119148758 1045402236 /nfs/dbraw/zinc/40/22/36/1045402236.db2.gz JAWBRVRXMWWKIK-KRWDZBQOSA-N 2 1 311.473 4.272 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000119148758 1045402242 /nfs/dbraw/zinc/40/22/42/1045402242.db2.gz JAWBRVRXMWWKIK-KRWDZBQOSA-N 2 1 311.473 4.272 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCCC2(F)F)cc1 ZINC000449505923 1045404746 /nfs/dbraw/zinc/40/47/46/1045404746.db2.gz ZQUFQTXSXIQFMO-CZUORRHYSA-N 2 1 319.399 4.267 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000119256532 1045412682 /nfs/dbraw/zinc/41/26/82/1045412682.db2.gz NYPDMBHVGWPKTK-CQSZACIVSA-N 2 1 305.853 4.318 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000119256532 1045412685 /nfs/dbraw/zinc/41/26/85/1045412685.db2.gz NYPDMBHVGWPKTK-CQSZACIVSA-N 2 1 305.853 4.318 20 0 DIADMP CC(C)C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000449560814 1045414109 /nfs/dbraw/zinc/41/41/09/1045414109.db2.gz PVZSVXPFEPCAEJ-XUBOLADHSA-N 2 1 300.490 4.031 20 0 DIADMP c1ccc([C@@H]2CCCC[C@@H]2C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000449691826 1045427452 /nfs/dbraw/zinc/42/74/52/1045427452.db2.gz YOBYITDHNOWSDY-NCYKPQTJSA-N 2 1 312.501 4.177 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CC1 ZINC001204690064 1045429708 /nfs/dbraw/zinc/42/97/08/1045429708.db2.gz LQDAANXQSRQQPD-SOAGJPPSSA-N 2 1 306.538 4.399 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC000449780710 1045437152 /nfs/dbraw/zinc/43/71/52/1045437152.db2.gz ZAGJFVPOXMULGF-QAPCUYQASA-N 2 1 306.881 4.050 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC000449780708 1045437725 /nfs/dbraw/zinc/43/77/25/1045437725.db2.gz ZAGJFVPOXMULGF-CRAIPNDOSA-N 2 1 306.881 4.050 20 0 DIADMP CCCc1ccc2[nH+]ccc(N3CCC(c4[nH]cc[nH+]4)CC3)c2c1 ZINC000450295599 1045485414 /nfs/dbraw/zinc/48/54/14/1045485414.db2.gz ZOSZTGZWLNSICT-UHFFFAOYSA-N 2 1 320.440 4.294 20 0 DIADMP C(=C\c1ccccc1)\CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000450602781 1045524620 /nfs/dbraw/zinc/52/46/20/1045524620.db2.gz RTRXKWZQUAGLSC-RVNVJMBNSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C\c1ccccc1)\CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000450602781 1045524637 /nfs/dbraw/zinc/52/46/37/1045524637.db2.gz RTRXKWZQUAGLSC-RVNVJMBNSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C\c1ccccc1)\CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000450602781 1045524648 /nfs/dbraw/zinc/52/46/48/1045524648.db2.gz RTRXKWZQUAGLSC-RVNVJMBNSA-N 2 1 310.485 4.039 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000720184274 1045578190 /nfs/dbraw/zinc/57/81/90/1045578190.db2.gz MQOZFDKKTXYBIP-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC000720184274 1045578197 /nfs/dbraw/zinc/57/81/97/1045578197.db2.gz MQOZFDKKTXYBIP-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)SCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390870308 1045584459 /nfs/dbraw/zinc/58/44/59/1045584459.db2.gz FTUCEJLXWMSSPE-GOSISDBHSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)SCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390870308 1045584468 /nfs/dbraw/zinc/58/44/68/1045584468.db2.gz FTUCEJLXWMSSPE-GOSISDBHSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC000450892618 1045590710 /nfs/dbraw/zinc/59/07/10/1045590710.db2.gz FAEXWIBMZOLILY-OAQYLSRUSA-N 2 1 319.452 4.107 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC000450892618 1045590720 /nfs/dbraw/zinc/59/07/20/1045590720.db2.gz FAEXWIBMZOLILY-OAQYLSRUSA-N 2 1 319.452 4.107 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC000392287813 1045649158 /nfs/dbraw/zinc/64/91/58/1045649158.db2.gz YSQVZFBSQNATOX-SFHVURJKSA-N 2 1 320.480 4.059 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1cc2c(ccc3ccccc23)o1 ZINC000530407478 1045660272 /nfs/dbraw/zinc/66/02/72/1045660272.db2.gz MCUFQRCDOJAAHK-AWEZNQCLSA-N 2 1 319.408 4.213 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(-c2cccs2)cc1 ZINC000530460378 1045671142 /nfs/dbraw/zinc/67/11/42/1045671142.db2.gz OJLOMWOJLQJOKI-AWEZNQCLSA-N 2 1 311.454 4.042 20 0 DIADMP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629556381 1045679024 /nfs/dbraw/zinc/67/90/24/1045679024.db2.gz OPBCKYGYQKRKOI-IPMKNSEASA-N 2 1 312.844 4.452 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194267 1045832654 /nfs/dbraw/zinc/83/26/54/1045832654.db2.gz WWSWFRVTSKUGEH-RBUKOAKNSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194267 1045832670 /nfs/dbraw/zinc/83/26/70/1045832670.db2.gz WWSWFRVTSKUGEH-RBUKOAKNSA-N 2 1 310.485 4.106 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3c4ccccc4sc32)C1 ZINC000531715407 1045903791 /nfs/dbraw/zinc/90/37/91/1045903791.db2.gz XSOGNCRPLWOVPO-YOEHRIQHSA-N 2 1 314.498 4.210 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000531711520 1045903862 /nfs/dbraw/zinc/90/38/62/1045903862.db2.gz NCAPMKOXEAAYPM-HLIPFELVSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)c1ccc(CCC[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1 ZINC000531713583 1045904658 /nfs/dbraw/zinc/90/46/58/1045904658.db2.gz CPMWBWRSZLXQDX-MBOZVWFJSA-N 2 1 302.506 4.061 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000531717190 1045910953 /nfs/dbraw/zinc/91/09/53/1045910953.db2.gz GKIDFYJSVBSLHE-QAPCUYQASA-N 2 1 308.897 4.359 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H](C2CC2)C2CCC2)CC1 ZINC000453131511 1045953874 /nfs/dbraw/zinc/95/38/74/1045953874.db2.gz VIANRYWGMZNMDO-KKSFZXQISA-N 2 1 312.501 4.380 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccsc1 ZINC000453200007 1045980099 /nfs/dbraw/zinc/98/00/99/1045980099.db2.gz UCLJZPLEGWOQQZ-RKVPGOIHSA-N 2 1 306.519 4.442 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC000902456683 1046000950 /nfs/dbraw/zinc/00/09/50/1046000950.db2.gz QMLXURDXCVQHFZ-QZTJIDSGSA-N 2 1 322.443 4.285 20 0 DIADMP CC[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(F)F ZINC000453252698 1046004506 /nfs/dbraw/zinc/00/45/06/1046004506.db2.gz VJQKFIAJDJFPDR-OFLPRAFFSA-N 2 1 310.432 4.063 20 0 DIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C(C)(F)F ZINC000453301321 1046021848 /nfs/dbraw/zinc/02/18/48/1046021848.db2.gz XVGKGYUYASHIIV-OOHWJJMZSA-N 2 1 310.432 4.063 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@@H+]1C ZINC000453308373 1046028249 /nfs/dbraw/zinc/02/82/49/1046028249.db2.gz DLRURMMQQLYQHB-ZLENFMNRSA-N 2 1 310.844 4.003 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@H+]1C ZINC000453308373 1046028262 /nfs/dbraw/zinc/02/82/62/1046028262.db2.gz DLRURMMQQLYQHB-ZLENFMNRSA-N 2 1 310.844 4.003 20 0 DIADMP CC[NH+](CC)C1CC[NH+](Cc2ccc(C)c3ccccc23)CC1 ZINC001138016963 1046060349 /nfs/dbraw/zinc/06/03/49/1046060349.db2.gz SSQDJVSJXBBVRE-UHFFFAOYSA-N 2 1 310.485 4.454 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453389340 1046065532 /nfs/dbraw/zinc/06/55/32/1046065532.db2.gz CEOBDYZSWOTTKH-CYBMUJFWSA-N 2 1 323.550 4.274 20 0 DIADMP C[N@@H+](CCCC[NH2+]C1CCC(c2ccccc2)CC1)C1CC1 ZINC000453398727 1046076020 /nfs/dbraw/zinc/07/60/20/1046076020.db2.gz KUMCTJZYZIOADO-UHFFFAOYSA-N 2 1 300.490 4.177 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453410807 1046080210 /nfs/dbraw/zinc/08/02/10/1046080210.db2.gz VHQPVUFCOQDZFD-OAHLLOKOSA-N 2 1 300.446 4.266 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H](c1cccs1)C1CCCC1)C1CC1 ZINC000453394777 1046081772 /nfs/dbraw/zinc/08/17/72/1046081772.db2.gz HAWWMFOTWOPGID-GOSISDBHSA-N 2 1 306.519 4.443 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000453419056 1046087603 /nfs/dbraw/zinc/08/76/03/1046087603.db2.gz KWZXSXKVYJEQTL-MAUKXSAKSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000453419056 1046087618 /nfs/dbraw/zinc/08/76/18/1046087618.db2.gz KWZXSXKVYJEQTL-MAUKXSAKSA-N 2 1 322.443 4.065 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(Oc2ccccc2)o1)C1CC1 ZINC000453594952 1046090702 /nfs/dbraw/zinc/09/07/02/1046090702.db2.gz IUAIPBBVSCJQLG-UHFFFAOYSA-N 2 1 314.429 4.036 20 0 DIADMP C[N@@H+](CCCC[NH2+]CC(c1ccccc1)c1ccccc1)C1CC1 ZINC000453592850 1046095882 /nfs/dbraw/zinc/09/58/82/1046095882.db2.gz FLKOXBBOBSXDDJ-UHFFFAOYSA-N 2 1 322.496 4.283 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000532214878 1046116245 /nfs/dbraw/zinc/11/62/45/1046116245.db2.gz YWEQIAUONJLJHY-KSSFIOAISA-N 2 1 306.881 4.037 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000532220089 1046116613 /nfs/dbraw/zinc/11/66/13/1046116613.db2.gz QFPMKQGCKYZCOR-INIZCTEOSA-N 2 1 321.424 4.335 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC[N@H+]1C ZINC000532216934 1046117265 /nfs/dbraw/zinc/11/72/65/1046117265.db2.gz MGXLSTKJXPRZKG-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000532270224 1046126168 /nfs/dbraw/zinc/12/61/68/1046126168.db2.gz VAYUUUKYCBQNJC-KRWDZBQOSA-N 2 1 324.459 4.312 20 0 DIADMP c1ccc([C@H](CC2CC2)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903137656 1046171960 /nfs/dbraw/zinc/17/19/60/1046171960.db2.gz OPBPQUGSSLVGFJ-KRIYCRJKSA-N 2 1 310.485 4.275 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903168226 1046183046 /nfs/dbraw/zinc/18/30/46/1046183046.db2.gz UZGIAUWMBSXDGE-PNFOFYCQSA-N 2 1 316.514 4.217 20 0 DIADMP CC(F)(F)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903174225 1046183179 /nfs/dbraw/zinc/18/31/79/1046183179.db2.gz GNSAXQCHXMRUIS-ZNXRZULTSA-N 2 1 320.427 4.046 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(OC)c(Cl)c2)CC1 ZINC001138476546 1046194764 /nfs/dbraw/zinc/19/47/64/1046194764.db2.gz MNSZCSWTAVCSMF-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC)c(Cl)c2)CC1 ZINC001138476546 1046194769 /nfs/dbraw/zinc/19/47/69/1046194769.db2.gz MNSZCSWTAVCSMF-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000475754719 1046201474 /nfs/dbraw/zinc/20/14/74/1046201474.db2.gz LDVRVGNCXCYKBD-HNNXBMFYSA-N 2 1 321.509 4.087 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1CCC1CCCCC1 ZINC001168173874 1046258638 /nfs/dbraw/zinc/25/86/38/1046258638.db2.gz FGDXGSNMVNJJJG-LJQANCHMSA-N 2 1 303.494 4.407 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1CCC1CCCCC1 ZINC001168173874 1046258648 /nfs/dbraw/zinc/25/86/48/1046258648.db2.gz FGDXGSNMVNJJJG-LJQANCHMSA-N 2 1 303.494 4.407 20 0 DIADMP Fc1ccc(-c2ccc(C[NH+]3CCC([NH+]4CCC4)CC3)cc2)cc1 ZINC001138684759 1046267844 /nfs/dbraw/zinc/26/78/44/1046267844.db2.gz PKIBAUUMTJEEOF-UHFFFAOYSA-N 2 1 324.443 4.163 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1 ZINC000638406356 1046318312 /nfs/dbraw/zinc/31/83/12/1046318312.db2.gz GWMMACOWJJDARO-QUCCMNQESA-N 2 1 310.441 4.046 20 0 DIADMP Cc1occc1C[NH2+][C@H]1CCN(C2CC2)[C@H](c2ccccc2)C1 ZINC000638406355 1046320126 /nfs/dbraw/zinc/32/01/26/1046320126.db2.gz GWMMACOWJJDARO-ICSRJNTNSA-N 2 1 310.441 4.046 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]([NH3+])CC(F)F)c1cccc(C(F)(F)F)c1 ZINC000903924921 1046339061 /nfs/dbraw/zinc/33/90/61/1046339061.db2.gz KKNUGASOFGVBIA-CHWSQXEVSA-N 2 1 324.337 4.119 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccs2)s1)CC1CC[NH+](C)CC1 ZINC001139019292 1046358276 /nfs/dbraw/zinc/35/82/76/1046358276.db2.gz SWXBSTKMGFKEJF-UHFFFAOYSA-N 2 1 320.527 4.250 20 0 DIADMP Cc1ccc(C[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)cc1C ZINC001139360917 1046436798 /nfs/dbraw/zinc/43/67/98/1046436798.db2.gz IXAVHXXTSFBXSI-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C[C@H]1CC=CCC1 ZINC000676903308 1046446633 /nfs/dbraw/zinc/44/66/33/1046446633.db2.gz JLWSAXSTROKYFV-SFHVURJKSA-N 2 1 324.468 4.358 20 0 DIADMP CCC[N@@H+](CCCCn1ccnc1C)CCc1cccc(F)c1 ZINC000123994341 1046451352 /nfs/dbraw/zinc/45/13/52/1046451352.db2.gz NNMNEHOKZWDTTR-UHFFFAOYSA-N 2 1 317.452 4.066 20 0 DIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)CCc1cccc(F)c1 ZINC000123994341 1046451355 /nfs/dbraw/zinc/45/13/55/1046451355.db2.gz NNMNEHOKZWDTTR-UHFFFAOYSA-N 2 1 317.452 4.066 20 0 DIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)CCc1cccc(F)c1 ZINC000123994341 1046451360 /nfs/dbraw/zinc/45/13/60/1046451360.db2.gz NNMNEHOKZWDTTR-UHFFFAOYSA-N 2 1 317.452 4.066 20 0 DIADMP CC(C)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202938704 1046452308 /nfs/dbraw/zinc/45/23/08/1046452308.db2.gz JUQDTCVCMIGKRG-NCYKPQTJSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000124879380 1046460724 /nfs/dbraw/zinc/46/07/24/1046460724.db2.gz CGMBWTGSQMLPKY-DNVCBOLYSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000124879380 1046460727 /nfs/dbraw/zinc/46/07/27/1046460727.db2.gz CGMBWTGSQMLPKY-DNVCBOLYSA-N 2 1 315.436 4.194 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125808928 1046471862 /nfs/dbraw/zinc/47/18/62/1046471862.db2.gz SNQJKWMZHUJLGE-DZKIICNBSA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125808928 1046471863 /nfs/dbraw/zinc/47/18/63/1046471863.db2.gz SNQJKWMZHUJLGE-DZKIICNBSA-N 2 1 324.559 4.384 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125797694 1046472418 /nfs/dbraw/zinc/47/24/18/1046472418.db2.gz REBOEIXPGXJJFU-KSSFIOAISA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125797694 1046472422 /nfs/dbraw/zinc/47/24/22/1046472422.db2.gz REBOEIXPGXJJFU-KSSFIOAISA-N 2 1 310.432 4.126 20 0 DIADMP c1csc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCCCC2)c1 ZINC000677241144 1046477700 /nfs/dbraw/zinc/47/77/00/1046477700.db2.gz MJCZHERVEHHBCW-IRXDYDNUSA-N 2 1 318.530 4.166 20 0 DIADMP Cc1csc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1Cl ZINC001137291078 1046489389 /nfs/dbraw/zinc/48/93/89/1046489389.db2.gz DBLVLVFZNPNXPU-UHFFFAOYSA-N 2 1 314.926 4.262 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206606331 1046498044 /nfs/dbraw/zinc/49/80/44/1046498044.db2.gz LDHSKFWVTBTCAM-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206606331 1046498048 /nfs/dbraw/zinc/49/80/48/1046498048.db2.gz LDHSKFWVTBTCAM-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccccc2C(F)F)CC1 ZINC001139799979 1046519748 /nfs/dbraw/zinc/51/97/48/1046519748.db2.gz ARZOCWMKIXHGME-UHFFFAOYSA-N 2 1 310.432 4.176 20 0 DIADMP CC[NH+](CC)CCCC1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000782537478 1046534245 /nfs/dbraw/zinc/53/42/45/1046534245.db2.gz YMCDTVGXPMXZCV-NTCAYCPXSA-N 2 1 307.309 4.139 20 0 DIADMP Cc1ccsc1C[NH2+]C1CC[NH+](Cc2ccccc2C)CC1 ZINC000097465588 1046544339 /nfs/dbraw/zinc/54/43/39/1046544339.db2.gz RAYDSXUHBUPQJP-UHFFFAOYSA-N 2 1 314.498 4.119 20 0 DIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1F ZINC000678074463 1046550164 /nfs/dbraw/zinc/55/01/64/1046550164.db2.gz BQROGUVNYGOJFT-UHFFFAOYSA-N 2 1 303.425 4.023 20 0 DIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1F ZINC000678074463 1046550179 /nfs/dbraw/zinc/55/01/79/1046550179.db2.gz BQROGUVNYGOJFT-UHFFFAOYSA-N 2 1 303.425 4.023 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2ccccc2[C@@H]1C(C)C ZINC000678077758 1046553718 /nfs/dbraw/zinc/55/37/18/1046553718.db2.gz FTPUHGNOPPEKFY-FQEVSTJZSA-N 2 1 311.473 4.227 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2ccccc2[C@@H]1C(C)C ZINC000678077758 1046553735 /nfs/dbraw/zinc/55/37/35/1046553735.db2.gz FTPUHGNOPPEKFY-FQEVSTJZSA-N 2 1 311.473 4.227 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2ccccc2[C@H]1C(C)C ZINC000678077759 1046554180 /nfs/dbraw/zinc/55/41/80/1046554180.db2.gz FTPUHGNOPPEKFY-HXUWFJFHSA-N 2 1 311.473 4.227 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2ccccc2[C@H]1C(C)C ZINC000678077759 1046554191 /nfs/dbraw/zinc/55/41/91/1046554191.db2.gz FTPUHGNOPPEKFY-HXUWFJFHSA-N 2 1 311.473 4.227 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cc2ccccc2cn1 ZINC001140001755 1046566946 /nfs/dbraw/zinc/56/69/46/1046566946.db2.gz ZGJZWHLKYNYROX-LEWJYISDSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2cn1 ZINC001140001755 1046566960 /nfs/dbraw/zinc/56/69/60/1046566960.db2.gz ZGJZWHLKYNYROX-LEWJYISDSA-N 2 1 323.484 4.074 20 0 DIADMP Clc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)o1 ZINC000678139316 1046567551 /nfs/dbraw/zinc/56/75/51/1046567551.db2.gz QWLRYKUQEOAIRX-UHFFFAOYSA-N 2 1 310.869 4.021 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000195136744 1046590339 /nfs/dbraw/zinc/59/03/39/1046590339.db2.gz LJBRVRZFHBHZFH-FPOVZHCZSA-N 2 1 323.484 4.035 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)n1 ZINC000678412928 1046630454 /nfs/dbraw/zinc/63/04/54/1046630454.db2.gz BWEKFAZPMMTUME-JZXOWHBKSA-N 2 1 317.521 4.107 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000678499868 1046649662 /nfs/dbraw/zinc/64/96/62/1046649662.db2.gz QJCKHDZAKICPBY-IBGZPJMESA-N 2 1 322.496 4.140 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000643346345 1046661309 /nfs/dbraw/zinc/66/13/09/1046661309.db2.gz XFSVPRKKKBEITC-RJCAOGMDSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000643346345 1046661313 /nfs/dbraw/zinc/66/13/13/1046661313.db2.gz XFSVPRKKKBEITC-RJCAOGMDSA-N 2 1 324.871 4.015 20 0 DIADMP CC[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000834789262 1046671921 /nfs/dbraw/zinc/67/19/21/1046671921.db2.gz BUPBNQIOXIUQKU-SFTDATJTSA-N 2 1 323.484 4.035 20 0 DIADMP CC[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000834789260 1046672204 /nfs/dbraw/zinc/67/22/04/1046672204.db2.gz BUPBNQIOXIUQKU-NHCUHLMSSA-N 2 1 323.484 4.035 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1OC(F)F ZINC000643547007 1046673053 /nfs/dbraw/zinc/67/30/53/1046673053.db2.gz YFJJBTMQHMGILW-ZFWWWQNUSA-N 2 1 324.415 4.003 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000643548691 1046673287 /nfs/dbraw/zinc/67/32/87/1046673287.db2.gz TWNGXMNXFWVKTB-DOMZBBRYSA-N 2 1 318.848 4.412 20 0 DIADMP CC1(C)CC[C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc21 ZINC000678611807 1046678620 /nfs/dbraw/zinc/67/86/20/1046678620.db2.gz NKJNKMFLBYDKNT-KURKYZTESA-N 2 1 312.501 4.058 20 0 DIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]CCC[N@@H+](C)CC(C)C ZINC001203031519 1046684272 /nfs/dbraw/zinc/68/42/72/1046684272.db2.gz IKHNOIYLFZFGLD-UHFFFAOYSA-N 2 1 316.411 4.081 20 0 DIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+]CCC[N@H+](C)CC(C)C ZINC001203031519 1046684275 /nfs/dbraw/zinc/68/42/75/1046684275.db2.gz IKHNOIYLFZFGLD-UHFFFAOYSA-N 2 1 316.411 4.081 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000533307353 1046694156 /nfs/dbraw/zinc/69/41/56/1046694156.db2.gz CMNMXSOKGOSHCZ-YWFITGJYSA-N 2 1 300.490 4.048 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678769169 1046696254 /nfs/dbraw/zinc/69/62/54/1046696254.db2.gz MUCVHXDARDISHY-HLIPFELVSA-N 2 1 300.490 4.020 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533426204 1046719164 /nfs/dbraw/zinc/71/91/64/1046719164.db2.gz PNKIBNSQUUPOKY-MOPGFXCFSA-N 2 1 304.453 4.227 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533426204 1046719180 /nfs/dbraw/zinc/71/91/80/1046719180.db2.gz PNKIBNSQUUPOKY-MOPGFXCFSA-N 2 1 304.453 4.227 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000678892331 1046727774 /nfs/dbraw/zinc/72/77/74/1046727774.db2.gz FNYIYGORPASLSE-SCLBCKFNSA-N 2 1 321.415 4.093 20 0 DIADMP C[C@H](C[N@@H+](C)C1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000533519933 1046744820 /nfs/dbraw/zinc/74/48/20/1046744820.db2.gz IXQGGBQVDYQBBB-LJQANCHMSA-N 2 1 322.496 4.387 20 0 DIADMP C[C@H](C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000533519933 1046744834 /nfs/dbraw/zinc/74/48/34/1046744834.db2.gz IXQGGBQVDYQBBB-LJQANCHMSA-N 2 1 322.496 4.387 20 0 DIADMP C[C@H](C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000533519933 1046744849 /nfs/dbraw/zinc/74/48/49/1046744849.db2.gz IXQGGBQVDYQBBB-LJQANCHMSA-N 2 1 322.496 4.387 20 0 DIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1(C)CC1 ZINC000796870140 1046750517 /nfs/dbraw/zinc/75/05/17/1046750517.db2.gz BTEMRUHXVWITCJ-IPJUCJBFSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCC(F)(F)C2)cc1 ZINC000679073866 1046767988 /nfs/dbraw/zinc/76/79/88/1046767988.db2.gz NRTIURMCMUBTBW-WFASDCNBSA-N 2 1 305.372 4.019 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)cc1 ZINC000679073861 1046769255 /nfs/dbraw/zinc/76/92/55/1046769255.db2.gz NRTIURMCMUBTBW-DOMZBBRYSA-N 2 1 305.372 4.019 20 0 DIADMP C[C@@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1ccc(F)c2ccccc21 ZINC000645406979 1046788726 /nfs/dbraw/zinc/78/87/26/1046788726.db2.gz UWYIDVXMLNZEJU-GDBMZVCRSA-N 2 1 312.432 4.114 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001140592324 1046799954 /nfs/dbraw/zinc/79/99/54/1046799954.db2.gz GTPYVKCWNJMSLO-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP Cc1ccc(F)cc1C[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001140592324 1046799964 /nfs/dbraw/zinc/79/99/64/1046799964.db2.gz GTPYVKCWNJMSLO-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP CCC[N@H+]1CC[C@@H](CN[C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000247156522 1046826286 /nfs/dbraw/zinc/82/62/86/1046826286.db2.gz TXWDIWQGJJNAES-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000247156522 1046826297 /nfs/dbraw/zinc/82/62/97/1046826297.db2.gz TXWDIWQGJJNAES-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000247156522 1046826313 /nfs/dbraw/zinc/82/63/13/1046826313.db2.gz TXWDIWQGJJNAES-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP C[C@H](NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccoc1 ZINC000248177947 1046837079 /nfs/dbraw/zinc/83/70/79/1046837079.db2.gz VWQNLKMBKLMREJ-GRDNDAEWSA-N 2 1 304.459 4.075 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000248405914 1046843146 /nfs/dbraw/zinc/84/31/46/1046843146.db2.gz RWEBBSUFGBSQKJ-KPFFTGBYSA-N 2 1 300.490 4.380 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(C(C)(C)C)[nH]2)CC1 ZINC001137380479 1046885001 /nfs/dbraw/zinc/88/50/01/1046885001.db2.gz NCLAMYLPADTCBW-UHFFFAOYSA-N 2 1 305.510 4.009 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(C(C)(C)C)[nH]2)CC1 ZINC001137380479 1046885019 /nfs/dbraw/zinc/88/50/19/1046885019.db2.gz NCLAMYLPADTCBW-UHFFFAOYSA-N 2 1 305.510 4.009 20 0 DIADMP c1oc2ccccc2c1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001140786089 1046898303 /nfs/dbraw/zinc/89/83/03/1046898303.db2.gz YCHJKWLBXUVGKC-SFHVURJKSA-N 2 1 312.457 4.273 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C[C@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176189 1046948799 /nfs/dbraw/zinc/94/87/99/1046948799.db2.gz XTTFUOCSTOXDPA-ICSRJNTNSA-N 2 1 310.485 4.130 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C[C@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176189 1046948809 /nfs/dbraw/zinc/94/88/09/1046948809.db2.gz XTTFUOCSTOXDPA-ICSRJNTNSA-N 2 1 310.485 4.130 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]C2CCC(F)(F)CC2)CC1 ZINC000647183998 1046951391 /nfs/dbraw/zinc/95/13/91/1046951391.db2.gz XDOVNZWXJYPDMY-OAHLLOKOSA-N 2 1 322.443 4.380 20 0 DIADMP C[C@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@@]1(C)CC[NH2+]C1 ZINC000261897106 1046954798 /nfs/dbraw/zinc/95/47/98/1046954798.db2.gz VCZXQJAXHSGITA-APWZRJJASA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H](c1cccs1)[N@@H+](Cc1ccccc1)C[C@@]1(C)CC[NH2+]C1 ZINC000261897106 1046954805 /nfs/dbraw/zinc/95/48/05/1046954805.db2.gz VCZXQJAXHSGITA-APWZRJJASA-N 2 1 314.498 4.311 20 0 DIADMP C(CCC[N@H+]1CCC[C@@H]1C1CC1)CC[NH+]1CCC[C@@H]1C1CC1 ZINC000729814714 1046959602 /nfs/dbraw/zinc/95/96/02/1046959602.db2.gz UOZMXDDOXPJAKB-WOJBJXKFSA-N 2 1 304.522 4.296 20 0 DIADMP C[C@H](c1cccs1)[N@H+](Cc1ccccc1)CC1CC[NH2+]CC1 ZINC000262257800 1046961707 /nfs/dbraw/zinc/96/17/07/1046961707.db2.gz QVUZTADGWARDPN-MRXNPFEDSA-N 2 1 314.498 4.311 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)s1 ZINC000647344704 1046986441 /nfs/dbraw/zinc/98/64/41/1046986441.db2.gz XMFNLYWCKBUPBZ-NXHRZFHOSA-N 2 1 314.498 4.053 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCC(F)CC1 ZINC000647349371 1046989138 /nfs/dbraw/zinc/98/91/38/1046989138.db2.gz MHNJLIYNACLQAW-OYGLOCFBSA-N 2 1 318.480 4.015 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC000647354476 1046991449 /nfs/dbraw/zinc/99/14/49/1046991449.db2.gz KSGZHCRPSPVIPS-CCBSWLOLSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799177569 1047009334 /nfs/dbraw/zinc/00/93/34/1047009334.db2.gz VCCRXRUQTQZDTJ-OAHLLOKOSA-N 2 1 306.881 4.209 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+]C2(c3cccc(Cl)c3)CCC2)c2ccccc21 ZINC000647804770 1047015496 /nfs/dbraw/zinc/01/54/96/1047015496.db2.gz YMSMFGFKYSYBAH-MSOLQXFVSA-N 2 1 312.844 4.454 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000536697263 1047075768 /nfs/dbraw/zinc/07/57/68/1047075768.db2.gz NLALXDFSZOPSDE-SFHVURJKSA-N 2 1 324.468 4.254 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000536697263 1047075779 /nfs/dbraw/zinc/07/57/79/1047075779.db2.gz NLALXDFSZOPSDE-SFHVURJKSA-N 2 1 324.468 4.254 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)s1 ZINC000379619965 1047080707 /nfs/dbraw/zinc/08/07/07/1047080707.db2.gz CFZZMKFYPMGHTG-CRAIPNDOSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)s1 ZINC000379619965 1047080720 /nfs/dbraw/zinc/08/07/20/1047080720.db2.gz CFZZMKFYPMGHTG-CRAIPNDOSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)s1 ZINC000379619967 1047080920 /nfs/dbraw/zinc/08/09/20/1047080920.db2.gz CFZZMKFYPMGHTG-MAUKXSAKSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)s1 ZINC000379619967 1047080938 /nfs/dbraw/zinc/08/09/38/1047080938.db2.gz CFZZMKFYPMGHTG-MAUKXSAKSA-N 2 1 314.498 4.199 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccccc1Cl ZINC000191506636 1047088119 /nfs/dbraw/zinc/08/81/19/1047088119.db2.gz BPPFWDFOFUNJTF-UHFFFAOYSA-N 2 1 305.853 4.011 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccccc1Cl ZINC000191506636 1047088134 /nfs/dbraw/zinc/08/81/34/1047088134.db2.gz BPPFWDFOFUNJTF-UHFFFAOYSA-N 2 1 305.853 4.011 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379646897 1047088907 /nfs/dbraw/zinc/08/89/07/1047088907.db2.gz JQRIKUFUDAJGET-RXVVDRJESA-N 2 1 308.469 4.138 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379646897 1047088922 /nfs/dbraw/zinc/08/89/22/1047088922.db2.gz JQRIKUFUDAJGET-RXVVDRJESA-N 2 1 308.469 4.138 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379644652 1047090675 /nfs/dbraw/zinc/09/06/75/1047090675.db2.gz CMHKPILGQYXBEX-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379644652 1047090687 /nfs/dbraw/zinc/09/06/87/1047090687.db2.gz CMHKPILGQYXBEX-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379644654 1047091446 /nfs/dbraw/zinc/09/14/46/1047091446.db2.gz CMHKPILGQYXBEX-UMGGQSCQSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379644654 1047091458 /nfs/dbraw/zinc/09/14/58/1047091458.db2.gz CMHKPILGQYXBEX-UMGGQSCQSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379640714 1047092464 /nfs/dbraw/zinc/09/24/64/1047092464.db2.gz CCJVSHSZFWCPOF-BBTUJRGHSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000379640714 1047092477 /nfs/dbraw/zinc/09/24/77/1047092477.db2.gz CCJVSHSZFWCPOF-BBTUJRGHSA-N 2 1 308.469 4.390 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000379653744 1047093372 /nfs/dbraw/zinc/09/33/72/1047093372.db2.gz GNJBRZVVESRXMH-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC000379653744 1047093384 /nfs/dbraw/zinc/09/33/84/1047093384.db2.gz GNJBRZVVESRXMH-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379653610 1047094897 /nfs/dbraw/zinc/09/48/97/1047094897.db2.gz GKGQZBVJRNAUNV-UMGGQSCQSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379653610 1047094910 /nfs/dbraw/zinc/09/49/10/1047094910.db2.gz GKGQZBVJRNAUNV-UMGGQSCQSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CCCC1 ZINC000379654477 1047095097 /nfs/dbraw/zinc/09/50/97/1047095097.db2.gz IPWACZFBMFWBCO-UWVAXJGDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CCCC1 ZINC000379654477 1047095106 /nfs/dbraw/zinc/09/51/06/1047095106.db2.gz IPWACZFBMFWBCO-UWVAXJGDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657080 1047097047 /nfs/dbraw/zinc/09/70/47/1047097047.db2.gz RPSSLXHAGOVGMP-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657080 1047097059 /nfs/dbraw/zinc/09/70/59/1047097059.db2.gz RPSSLXHAGOVGMP-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000536828947 1047103437 /nfs/dbraw/zinc/10/34/37/1047103437.db2.gz UWBPMQWTGGSFDS-AOIWGVFYSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]C(C2CC2)C2CC2)C[N@H+]1Cc1ccccc1 ZINC000536831427 1047113542 /nfs/dbraw/zinc/11/35/42/1047113542.db2.gz IUODFVSOGYCWRU-AEFFLSMTSA-N 2 1 312.501 4.065 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc2c(s1)CCCC2 ZINC000536864475 1047115072 /nfs/dbraw/zinc/11/50/72/1047115072.db2.gz NWZVAONBOVQIFK-KBPBESRZSA-N 2 1 317.502 4.119 20 0 DIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)CCCC1CC[NH2+]CC1 ZINC000649411103 1047126504 /nfs/dbraw/zinc/12/65/04/1047126504.db2.gz RBYHHINWXZXKGM-AWEZNQCLSA-N 2 1 317.502 4.069 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001116554736 1047155935 /nfs/dbraw/zinc/15/59/35/1047155935.db2.gz CPJJJWLKYVCTKW-KXIUCKCTSA-N 2 1 306.881 4.048 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072719 1047168041 /nfs/dbraw/zinc/16/80/41/1047168041.db2.gz LWAXPYXVQVFPPU-ROUUACIJSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072719 1047168050 /nfs/dbraw/zinc/16/80/50/1047168050.db2.gz LWAXPYXVQVFPPU-ROUUACIJSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072719 1047168054 /nfs/dbraw/zinc/16/80/54/1047168054.db2.gz LWAXPYXVQVFPPU-ROUUACIJSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072720 1047168660 /nfs/dbraw/zinc/16/86/60/1047168660.db2.gz LWAXPYXVQVFPPU-ZWKOTPCHSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072720 1047168663 /nfs/dbraw/zinc/16/86/63/1047168663.db2.gz LWAXPYXVQVFPPU-ZWKOTPCHSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072720 1047168671 /nfs/dbraw/zinc/16/86/71/1047168671.db2.gz LWAXPYXVQVFPPU-ZWKOTPCHSA-N 2 1 318.505 4.037 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc2ccccc21 ZINC000682130201 1047174149 /nfs/dbraw/zinc/17/41/49/1047174149.db2.gz BXUPXIGWDOTACR-IERDGZPVSA-N 2 1 308.469 4.365 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCC34CCCC4)C2)cc1 ZINC000682731694 1047215783 /nfs/dbraw/zinc/21/57/83/1047215783.db2.gz GBLKAQGVXJCHLL-UXHICEINSA-N 2 1 312.501 4.211 20 0 DIADMP c1c2ccccc2sc1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897982038 1047311635 /nfs/dbraw/zinc/31/16/35/1047311635.db2.gz VQLYUIAJFXBFAD-UHFFFAOYSA-N 2 1 300.471 4.008 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000840809331 1047336735 /nfs/dbraw/zinc/33/67/35/1047336735.db2.gz JHNYWGFXAKNSQX-HUUCEWRRSA-N 2 1 324.896 4.040 20 0 DIADMP CC[N@H+](CCC[NH2+][C@H](C)c1cnc(C)s1)C1CCCCC1 ZINC000652237760 1047348870 /nfs/dbraw/zinc/34/88/70/1047348870.db2.gz CPWFNDOAAJZKHK-CQSZACIVSA-N 2 1 309.523 4.147 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H](C)c1cnc(C)s1)C1CCCCC1 ZINC000652237760 1047348884 /nfs/dbraw/zinc/34/88/84/1047348884.db2.gz CPWFNDOAAJZKHK-CQSZACIVSA-N 2 1 309.523 4.147 20 0 DIADMP c1ccc(-c2ccccc2C[NH+]2CCC([NH+]3CCCC3)CC2)cc1 ZINC001142331402 1047434260 /nfs/dbraw/zinc/43/42/60/1047434260.db2.gz XKORGDKAOLCDGO-UHFFFAOYSA-N 2 1 320.480 4.414 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2ccccc2-c2ccccc2)CC1 ZINC001142349375 1047434410 /nfs/dbraw/zinc/43/44/10/1047434410.db2.gz YJPSUKRFAOSSDR-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2ccccc2-c2ccccc2)CC1 ZINC001142349375 1047434412 /nfs/dbraw/zinc/43/44/12/1047434412.db2.gz YJPSUKRFAOSSDR-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001168322747 1047444827 /nfs/dbraw/zinc/44/48/27/1047444827.db2.gz GWCNIVAAWAMEQJ-DAWZGUTISA-N 2 1 306.881 4.350 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC001168323761 1047447362 /nfs/dbraw/zinc/44/73/62/1047447362.db2.gz CEENJJJYIPOSQD-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP C[C@H]1C[N@H+](C2CCC([NH+](C)C)CC2)CCc2ccc(Cl)cc21 ZINC001168326938 1047453222 /nfs/dbraw/zinc/45/32/22/1047453222.db2.gz FTDBASDECIAHJY-NNGSBXSVSA-N 2 1 320.908 4.174 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620491 1047462213 /nfs/dbraw/zinc/46/22/13/1047462213.db2.gz TXGSHMJKZRVLPE-KRWDZBQOSA-N 2 1 314.473 4.213 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620491 1047462216 /nfs/dbraw/zinc/46/22/16/1047462216.db2.gz TXGSHMJKZRVLPE-KRWDZBQOSA-N 2 1 314.473 4.213 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620491 1047462225 /nfs/dbraw/zinc/46/22/25/1047462225.db2.gz TXGSHMJKZRVLPE-KRWDZBQOSA-N 2 1 314.473 4.213 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620491 1047462230 /nfs/dbraw/zinc/46/22/30/1047462230.db2.gz TXGSHMJKZRVLPE-KRWDZBQOSA-N 2 1 314.473 4.213 20 0 DIADMP CCSc1ccccc1[C@@H](C)NC1CC[NH+](C2CC2)CC1 ZINC000119671817 1047467965 /nfs/dbraw/zinc/46/79/65/1047467965.db2.gz BIMVLDRUXIABDL-CQSZACIVSA-N 2 1 304.503 4.076 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119671817 1047467970 /nfs/dbraw/zinc/46/79/70/1047467970.db2.gz BIMVLDRUXIABDL-CQSZACIVSA-N 2 1 304.503 4.076 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC001203136743 1047549578 /nfs/dbraw/zinc/54/95/78/1047549578.db2.gz SRGRAJXVGDLDLF-JMPLCFMRSA-N 2 1 306.881 4.065 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cccc(-c3ccccc3)c2)C1 ZINC000537649368 1047562169 /nfs/dbraw/zinc/56/21/69/1047562169.db2.gz JIYGKLNZVAXPEG-IBGZPJMESA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC000537649368 1047562172 /nfs/dbraw/zinc/56/21/72/1047562172.db2.gz JIYGKLNZVAXPEG-IBGZPJMESA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC000537649368 1047562175 /nfs/dbraw/zinc/56/21/75/1047562175.db2.gz JIYGKLNZVAXPEG-IBGZPJMESA-N 2 1 308.469 4.127 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCCC[C@H](C[NH3+])C3)c(C)c12 ZINC001206631842 1047568221 /nfs/dbraw/zinc/56/82/21/1047568221.db2.gz AWUGBGXFIGMMMY-CYBMUJFWSA-N 2 1 308.516 4.140 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccc1N(C)C ZINC000537655605 1047569856 /nfs/dbraw/zinc/56/98/56/1047569856.db2.gz ZLCXMSVDKVJPAS-ZWKOTPCHSA-N 2 1 317.521 4.058 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)CC(C)(C)c2ccccc2)C1 ZINC000314961586 1047591628 /nfs/dbraw/zinc/59/16/28/1047591628.db2.gz UWAFAHHRZDUCQX-ZWKOTPCHSA-N 2 1 302.506 4.063 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccccc2CCc2ccccc2)C1 ZINC001206641573 1047601525 /nfs/dbraw/zinc/60/15/25/1047601525.db2.gz YZBKKAAUEMSEBS-HXUWFJFHSA-N 2 1 322.496 4.033 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@H](C[NH3+])C2)ccc1Oc1ccccc1 ZINC001206649334 1047631649 /nfs/dbraw/zinc/63/16/49/1047631649.db2.gz URJKJXBDKQIBNF-LJQANCHMSA-N 2 1 324.468 4.348 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@H](C[NH3+])C2)ccc1Oc1ccccc1 ZINC001206649333 1047632029 /nfs/dbraw/zinc/63/20/29/1047632029.db2.gz URJKJXBDKQIBNF-IBGZPJMESA-N 2 1 324.468 4.348 20 0 DIADMP CCOc1ccccc1[C@@H](C)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946791 1047647719 /nfs/dbraw/zinc/64/77/19/1047647719.db2.gz TZMWYXBJTVKDRF-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000537946791 1047647721 /nfs/dbraw/zinc/64/77/21/1047647721.db2.gz TZMWYXBJTVKDRF-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946791 1047647725 /nfs/dbraw/zinc/64/77/25/1047647725.db2.gz TZMWYXBJTVKDRF-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000538101080 1047657026 /nfs/dbraw/zinc/65/70/26/1047657026.db2.gz OPANEAWIXUSSJK-KSSFIOAISA-N 2 1 306.881 4.113 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000538099168 1047657193 /nfs/dbraw/zinc/65/71/93/1047657193.db2.gz RUJVHEQRXXGMBJ-XLIONFOSSA-N 2 1 300.490 4.156 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000538101081 1047657603 /nfs/dbraw/zinc/65/76/03/1047657603.db2.gz OPANEAWIXUSSJK-RDTXWAMCSA-N 2 1 306.881 4.113 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cccc(-c2ccccc2)c1 ZINC000538406874 1047673096 /nfs/dbraw/zinc/67/30/96/1047673096.db2.gz XKBUPVZDWXDQDI-KRWDZBQOSA-N 2 1 306.453 4.266 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000538393719 1047674237 /nfs/dbraw/zinc/67/42/37/1047674237.db2.gz QMILHIBIKNRCGD-HZPDHXFCSA-N 2 1 314.473 4.296 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000538393719 1047674240 /nfs/dbraw/zinc/67/42/40/1047674240.db2.gz QMILHIBIKNRCGD-HZPDHXFCSA-N 2 1 314.473 4.296 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000538408107 1047676127 /nfs/dbraw/zinc/67/61/27/1047676127.db2.gz RUQANXCFSSGFKL-KRWDZBQOSA-N 2 1 324.390 4.008 20 0 DIADMP Cc1c[nH+]c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc1C ZINC001156318616 1047707920 /nfs/dbraw/zinc/70/79/20/1047707920.db2.gz WSRQKOVEYHHUOU-XUVXKRRUSA-N 2 1 321.468 4.021 20 0 DIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752131 1047709225 /nfs/dbraw/zinc/70/92/25/1047709225.db2.gz KIBLXWUKTUYLGX-SFHVURJKSA-N 2 1 324.468 4.110 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752131 1047709231 /nfs/dbraw/zinc/70/92/31/1047709231.db2.gz KIBLXWUKTUYLGX-SFHVURJKSA-N 2 1 324.468 4.110 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752131 1047709237 /nfs/dbraw/zinc/70/92/37/1047709237.db2.gz KIBLXWUKTUYLGX-SFHVURJKSA-N 2 1 324.468 4.110 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000538752131 1047709241 /nfs/dbraw/zinc/70/92/41/1047709241.db2.gz KIBLXWUKTUYLGX-SFHVURJKSA-N 2 1 324.468 4.110 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCCn1cc[nH+]c1C ZINC000538781412 1047710060 /nfs/dbraw/zinc/71/00/60/1047710060.db2.gz ACAYHWITSQFGRV-WOJBJXKFSA-N 2 1 311.473 4.240 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1CCCn1cc[nH+]c1C ZINC000538781412 1047710063 /nfs/dbraw/zinc/71/00/63/1047710063.db2.gz ACAYHWITSQFGRV-WOJBJXKFSA-N 2 1 311.473 4.240 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000539041663 1047726202 /nfs/dbraw/zinc/72/62/02/1047726202.db2.gz NXXMBUANDCRWDJ-HBFSDRIKSA-N 2 1 323.484 4.033 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)CCC2 ZINC000539046044 1047731668 /nfs/dbraw/zinc/73/16/68/1047731668.db2.gz GAKJEVVANMSAKE-CVAIRZPRSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)CCC2 ZINC000539046044 1047731671 /nfs/dbraw/zinc/73/16/71/1047731671.db2.gz GAKJEVVANMSAKE-CVAIRZPRSA-N 2 1 300.490 4.260 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000539159763 1047739133 /nfs/dbraw/zinc/73/91/33/1047739133.db2.gz XTKFBRMOEYXPOM-XLIONFOSSA-N 2 1 300.490 4.239 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000539216521 1047741785 /nfs/dbraw/zinc/74/17/85/1047741785.db2.gz FBTNRUXFZQGLLT-RDTXWAMCSA-N 2 1 319.880 4.468 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000539216515 1047741879 /nfs/dbraw/zinc/74/18/79/1047741879.db2.gz FBTNRUXFZQGLLT-KBXCAEBGSA-N 2 1 319.880 4.468 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(-c2ccncc2)cc1 ZINC000539339021 1047748583 /nfs/dbraw/zinc/74/85/83/1047748583.db2.gz APDOVYKCUOQGOL-UWJYYQICSA-N 2 1 323.484 4.274 20 0 DIADMP CC(C)(C)C[N@@H+](C1CC[NH2+]CC1)C(C)(C)c1ccnc(Cl)c1 ZINC001157892165 1047762726 /nfs/dbraw/zinc/76/27/26/1047762726.db2.gz LBIILPQAPHWLTE-UHFFFAOYSA-N 2 1 323.912 4.070 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000552923262 1047806557 /nfs/dbraw/zinc/80/65/57/1047806557.db2.gz KYFQSMNRVFURJV-NXHRZFHOSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000552923262 1047806567 /nfs/dbraw/zinc/80/65/67/1047806567.db2.gz KYFQSMNRVFURJV-NXHRZFHOSA-N 2 1 322.443 4.065 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048383 1047832982 /nfs/dbraw/zinc/83/29/82/1047832982.db2.gz ASNHONLBPYFSIF-DNVCBOLYSA-N 2 1 324.459 4.372 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048383 1047832989 /nfs/dbraw/zinc/83/29/89/1047832989.db2.gz ASNHONLBPYFSIF-DNVCBOLYSA-N 2 1 324.459 4.372 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]C(C)(C)c2ccnc(Cl)c2)CC1(C)C ZINC001159395506 1047841114 /nfs/dbraw/zinc/84/11/14/1047841114.db2.gz JQSSKEQXRMPBJM-UHFFFAOYSA-N 2 1 323.912 4.211 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+](C)CC2)C2CCCCC2)cc1 ZINC000479259499 1047854560 /nfs/dbraw/zinc/85/45/60/1047854560.db2.gz LRVHDQAKUNREOT-HXUWFJFHSA-N 2 1 300.490 4.300 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961466 1047868708 /nfs/dbraw/zinc/86/87/08/1047868708.db2.gz YYHIHPOSONXJPZ-KSSFIOAISA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961466 1047868729 /nfs/dbraw/zinc/86/87/29/1047868729.db2.gz YYHIHPOSONXJPZ-KSSFIOAISA-N 2 1 322.443 4.065 20 0 DIADMP CCCc1ccc(C[N@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)s1 ZINC001183065222 1047886446 /nfs/dbraw/zinc/88/64/46/1047886446.db2.gz IHVSMNCIAYHGMM-QAPCUYQASA-N 2 1 308.535 4.253 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3c(C)cc(C)cc3C)CC2)[nH+]c1C ZINC001197844950 1047886524 /nfs/dbraw/zinc/88/65/24/1047886524.db2.gz QRVFWEVCXVPLCR-UHFFFAOYSA-N 2 1 311.473 4.331 20 0 DIADMP CCCc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)s1 ZINC001183065221 1047888375 /nfs/dbraw/zinc/88/83/75/1047888375.db2.gz IHVSMNCIAYHGMM-MAUKXSAKSA-N 2 1 308.535 4.253 20 0 DIADMP CC[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Cl)c1 ZINC000479522044 1047914550 /nfs/dbraw/zinc/91/45/50/1047914550.db2.gz LUDQOIJGOMVMDV-ABHNRTSZSA-N 2 1 306.881 4.398 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2ccc([C@H]3CC[NH2+]C3)cc2)cc1 ZINC001159779551 1047923077 /nfs/dbraw/zinc/92/30/77/1047923077.db2.gz YSJBQUCWPDMSAS-KRWDZBQOSA-N 2 1 309.457 4.353 20 0 DIADMP C[N@@H+](Cc1ccccc1Nc1cncc(C[NH3+])c1)C1CCCCC1 ZINC001159791110 1047924861 /nfs/dbraw/zinc/92/48/61/1047924861.db2.gz KLNYXJDBNDHGJZ-UHFFFAOYSA-N 2 1 324.472 4.048 20 0 DIADMP c1ccc(OC2CC[NH2+]CC2)c(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001159806204 1047928759 /nfs/dbraw/zinc/92/87/59/1047928759.db2.gz YYTIJSURKFTROI-UHFFFAOYSA-N 2 1 319.408 4.109 20 0 DIADMP CC(C)C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)CC1CC[NH+](C)CC1 ZINC001183464713 1047931319 /nfs/dbraw/zinc/93/13/19/1047931319.db2.gz WVFAVZFBBJKKLR-SFTDATJTSA-N 2 1 314.517 4.090 20 0 DIADMP Cc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)cc1Cl ZINC001183509924 1047938818 /nfs/dbraw/zinc/93/88/18/1047938818.db2.gz ATTBMBSZRJTLRG-UHFFFAOYSA-N 2 1 308.897 4.346 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC1 ZINC001205288096 1047991544 /nfs/dbraw/zinc/99/15/44/1047991544.db2.gz FYIPMLAMFHTEPV-INIZCTEOSA-N 2 1 306.500 4.180 20 0 DIADMP CC(C)C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000479911705 1048005595 /nfs/dbraw/zinc/00/55/95/1048005595.db2.gz LDYCLOYWXWGBNZ-MJGOQNOKSA-N 2 1 303.494 4.023 20 0 DIADMP CC(C)C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000479911705 1048005612 /nfs/dbraw/zinc/00/56/12/1048005612.db2.gz LDYCLOYWXWGBNZ-MJGOQNOKSA-N 2 1 303.494 4.023 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1cccc(Cl)c1)CC(C)C ZINC001174863504 1048006471 /nfs/dbraw/zinc/00/64/71/1048006471.db2.gz PIHAMGYFBHZQEC-UHFFFAOYSA-N 2 1 305.853 4.003 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1cccc(Cl)c1)CC(C)C ZINC001174863504 1048006486 /nfs/dbraw/zinc/00/64/86/1048006486.db2.gz PIHAMGYFBHZQEC-UHFFFAOYSA-N 2 1 305.853 4.003 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000554089725 1048008057 /nfs/dbraw/zinc/00/80/57/1048008057.db2.gz YQMMQUJMXXZGLM-AQNXPRMDSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000554089725 1048008072 /nfs/dbraw/zinc/00/80/72/1048008072.db2.gz YQMMQUJMXXZGLM-AQNXPRMDSA-N 2 1 312.501 4.065 20 0 DIADMP C[N@@H+](CCC[NH2+]C[C@H]1CCCC(C)(C)C1)Cc1ccccc1 ZINC001199038719 1048029021 /nfs/dbraw/zinc/02/90/21/1048029021.db2.gz YPPBZFYDNIKEDO-IBGZPJMESA-N 2 1 302.506 4.315 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001199344333 1048055094 /nfs/dbraw/zinc/05/50/94/1048055094.db2.gz GIVWPFISGOMLFH-QGZVFWFLSA-N 2 1 300.490 4.166 20 0 DIADMP CCc1cccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001199320146 1048056713 /nfs/dbraw/zinc/05/67/13/1048056713.db2.gz JRHMWEPDKWAAFS-HDICACEKSA-N 2 1 302.506 4.097 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(C2CC2)cc1 ZINC001199336184 1048059453 /nfs/dbraw/zinc/05/94/53/1048059453.db2.gz IPPQSJKJWSXEIT-KRWDZBQOSA-N 2 1 300.490 4.308 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2SCC)CC1 ZINC000480138343 1048063531 /nfs/dbraw/zinc/06/35/31/1048063531.db2.gz GSRVJRMKRCYGQD-OAHLLOKOSA-N 2 1 306.519 4.324 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000480169173 1048075915 /nfs/dbraw/zinc/07/59/15/1048075915.db2.gz OOLNNSTVCIXYGL-OAHLLOKOSA-N 2 1 323.550 4.348 20 0 DIADMP CCCCOCC[N@@H+](CCCC)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174982941 1048080085 /nfs/dbraw/zinc/08/00/85/1048080085.db2.gz BFGJTLWVWKKBIO-UHFFFAOYSA-N 2 1 312.542 4.214 20 0 DIADMP CC(C)C[N@@H+]1CCCC[C@@H]1C[NH2+][C@H](C)CCCC(F)(F)F ZINC000480186991 1048085668 /nfs/dbraw/zinc/08/56/68/1048085668.db2.gz YLTDECKLGFHJQJ-HUUCEWRRSA-N 2 1 308.432 4.208 20 0 DIADMP CC(C)C[N@H+]1CCCC[C@@H]1C[NH2+][C@H](C)CCCC(F)(F)F ZINC000480186991 1048085684 /nfs/dbraw/zinc/08/56/84/1048085684.db2.gz YLTDECKLGFHJQJ-HUUCEWRRSA-N 2 1 308.432 4.208 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)c2ccccc12 ZINC000480191100 1048088892 /nfs/dbraw/zinc/08/88/92/1048088892.db2.gz HVHWJXMJLZIAJG-MRXNPFEDSA-N 2 1 314.473 4.229 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCCC(F)(F)F)c1 ZINC000480210028 1048092374 /nfs/dbraw/zinc/09/23/74/1048092374.db2.gz PIYOCYMNTSDDCW-AWEZNQCLSA-N 2 1 316.411 4.349 20 0 DIADMP CCCCC1CCC(C[NH2+]Cc2c[nH+]ccc2N(C)C)CC1 ZINC001199732885 1048092978 /nfs/dbraw/zinc/09/29/78/1048092978.db2.gz VFYNUBVIXNBTPR-UHFFFAOYSA-N 2 1 303.494 4.234 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000480223791 1048094417 /nfs/dbraw/zinc/09/44/17/1048094417.db2.gz JEHQIYGYEANOOE-HUUCEWRRSA-N 2 1 308.432 4.209 20 0 DIADMP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000480266032 1048106271 /nfs/dbraw/zinc/10/62/71/1048106271.db2.gz NPOZFFYSHCYUEI-HXUWFJFHSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@H]2CC[N@H+](Cc3cccc(Cl)c3)C2)c1 ZINC001161183074 1048112081 /nfs/dbraw/zinc/11/20/81/1048112081.db2.gz OUYAJNZKQRVHER-KRWDZBQOSA-N 2 1 315.848 4.038 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@H]2CC[N@@H+](Cc3cccc(Cl)c3)C2)c1 ZINC001161183074 1048112098 /nfs/dbraw/zinc/11/20/98/1048112098.db2.gz OUYAJNZKQRVHER-KRWDZBQOSA-N 2 1 315.848 4.038 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCc2ccc(-c3ccccc3)cc2)CC1(C)C ZINC001201017579 1048174006 /nfs/dbraw/zinc/17/40/06/1048174006.db2.gz KJBKLZGCYYRELX-NRFANRHFSA-N 2 1 322.496 4.359 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000480616871 1048191872 /nfs/dbraw/zinc/19/18/72/1048191872.db2.gz WNTGBXLPRZBDFW-IPELMVKDSA-N 2 1 318.530 4.465 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000480616871 1048191878 /nfs/dbraw/zinc/19/18/78/1048191878.db2.gz WNTGBXLPRZBDFW-IPELMVKDSA-N 2 1 318.530 4.465 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc(F)ccc1F ZINC000480607994 1048192286 /nfs/dbraw/zinc/19/22/86/1048192286.db2.gz KKOGQSXTHKIIFC-CABCVRRESA-N 2 1 310.432 4.128 20 0 DIADMP COc1ccccc1[C@H](C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000480630628 1048194854 /nfs/dbraw/zinc/19/48/54/1048194854.db2.gz MIOLMOZGWRGYLI-SJORKVTESA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)cc(F)c1 ZINC000480634757 1048201956 /nfs/dbraw/zinc/20/19/56/1048201956.db2.gz VHAPAFOHUVEJGK-GJZGRUSLSA-N 2 1 310.432 4.270 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000480718797 1048227903 /nfs/dbraw/zinc/22/79/03/1048227903.db2.gz FSRCKDINVKYJDH-PKOBYXMFSA-N 2 1 320.546 4.020 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000480718797 1048227916 /nfs/dbraw/zinc/22/79/16/1048227916.db2.gz FSRCKDINVKYJDH-PKOBYXMFSA-N 2 1 320.546 4.020 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCCC2 ZINC000480743107 1048233260 /nfs/dbraw/zinc/23/32/60/1048233260.db2.gz FWKDPTHRDUBYIQ-ZHALLVOQSA-N 2 1 318.892 4.324 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480746340 1048235833 /nfs/dbraw/zinc/23/58/33/1048235833.db2.gz QOVMTKFUZMSZHY-PXNSSMCTSA-N 2 1 300.490 4.156 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000480746341 1048236553 /nfs/dbraw/zinc/23/65/53/1048236553.db2.gz QOVMTKFUZMSZHY-XLIONFOSSA-N 2 1 300.490 4.156 20 0 DIADMP C(CC[N@H+]1CCC[C@@H]1C1CCC1)C[NH+]1CCC[C@@H]1C1CCC1 ZINC000555033326 1048256201 /nfs/dbraw/zinc/25/62/01/1048256201.db2.gz PKBLKPCQLJVOBS-WOJBJXKFSA-N 2 1 304.522 4.296 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@@H]3C2)cc1 ZINC001201426328 1048263848 /nfs/dbraw/zinc/26/38/48/1048263848.db2.gz JAFLHSGTYWTDNR-BDTNDASRSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]3C2)cc1 ZINC001201426328 1048263861 /nfs/dbraw/zinc/26/38/61/1048263861.db2.gz JAFLHSGTYWTDNR-BDTNDASRSA-N 2 1 324.512 4.187 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@@H]3C2)cc1 ZINC001201426328 1048263867 /nfs/dbraw/zinc/26/38/67/1048263867.db2.gz JAFLHSGTYWTDNR-BDTNDASRSA-N 2 1 324.512 4.187 20 0 DIADMP CC(C)[PH+](CCNc1cc[nH+]c(N2CCCCC2)n1)C(C)C ZINC001162362236 1048269835 /nfs/dbraw/zinc/26/98/35/1048269835.db2.gz WSVPCKPPHUVXOB-UHFFFAOYSA-N 2 1 322.437 4.178 20 0 DIADMP [NH3+][C@@H]1CCC[C@H](Nc2[nH+]ccc3cc(-c4ccc(F)cc4)[nH]c32)C1 ZINC001162394242 1048273204 /nfs/dbraw/zinc/27/32/04/1048273204.db2.gz OLPCKMNQEUFJCK-CVEARBPZSA-N 2 1 324.403 4.051 20 0 DIADMP c1[nH+]c2ccccn2c1Nc1ccc(C[NH+]2CCCCC2)cc1 ZINC001175361454 1048276707 /nfs/dbraw/zinc/27/67/07/1048276707.db2.gz MTCNBNHRGRQFJC-UHFFFAOYSA-N 2 1 306.413 4.064 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC000481045782 1048296754 /nfs/dbraw/zinc/29/67/54/1048296754.db2.gz GTDNOOUHBDPBCV-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001201554104 1048306450 /nfs/dbraw/zinc/30/64/50/1048306450.db2.gz UVKZVTASILAWBM-INIZCTEOSA-N 2 1 306.469 4.158 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001201554104 1048306462 /nfs/dbraw/zinc/30/64/62/1048306462.db2.gz UVKZVTASILAWBM-INIZCTEOSA-N 2 1 306.469 4.158 20 0 DIADMP CC[C@@H](C)C[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201518022 1048309643 /nfs/dbraw/zinc/30/96/43/1048309643.db2.gz YOQNQTCNQLAVNJ-OAHLLOKOSA-N 2 1 308.897 4.282 20 0 DIADMP CC[C@@H](C)C[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001201518022 1048309656 /nfs/dbraw/zinc/30/96/56/1048309656.db2.gz YOQNQTCNQLAVNJ-OAHLLOKOSA-N 2 1 308.897 4.282 20 0 DIADMP CCC(CC)C[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201526189 1048311213 /nfs/dbraw/zinc/31/12/13/1048311213.db2.gz SDURCJARFSAUFG-UHFFFAOYSA-N 2 1 320.546 4.472 20 0 DIADMP CCC(CC)C[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201525964 1048311660 /nfs/dbraw/zinc/31/16/60/1048311660.db2.gz MPHBQXLXHFEWAZ-IBGZPJMESA-N 2 1 318.505 4.392 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001205922831 1048312090 /nfs/dbraw/zinc/31/20/90/1048312090.db2.gz BLILRRIWGBGLGW-NWDGAFQWSA-N 2 1 308.878 4.114 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001201559615 1048316247 /nfs/dbraw/zinc/31/62/47/1048316247.db2.gz MDLYCZFNBZIYNI-KRWDZBQOSA-N 2 1 303.494 4.145 20 0 DIADMP CCC[C@H](C)C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001201562941 1048317585 /nfs/dbraw/zinc/31/75/85/1048317585.db2.gz JMJXAQHRAVAWEZ-INIZCTEOSA-N 2 1 306.469 4.158 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001201562941 1048317602 /nfs/dbraw/zinc/31/76/02/1048317602.db2.gz JMJXAQHRAVAWEZ-INIZCTEOSA-N 2 1 306.469 4.158 20 0 DIADMP CC(C)CC[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201614020 1048332090 /nfs/dbraw/zinc/33/20/90/1048332090.db2.gz CFMXCBCFMOSXSU-SFHVURJKSA-N 2 1 304.478 4.002 20 0 DIADMP CC(C)CC[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001201626316 1048337939 /nfs/dbraw/zinc/33/79/39/1048337939.db2.gz GBKLGFIGTNLOJT-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CC[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001201626316 1048337953 /nfs/dbraw/zinc/33/79/53/1048337953.db2.gz GBKLGFIGTNLOJT-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CC[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001201626316 1048337969 /nfs/dbraw/zinc/33/79/69/1048337969.db2.gz GBKLGFIGTNLOJT-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCCC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201706459 1048350892 /nfs/dbraw/zinc/35/08/92/1048350892.db2.gz NIQZFEPSKGYMCH-RYQLBKOJSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201706459 1048350905 /nfs/dbraw/zinc/35/09/05/1048350905.db2.gz NIQZFEPSKGYMCH-RYQLBKOJSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201706459 1048350920 /nfs/dbraw/zinc/35/09/20/1048350920.db2.gz NIQZFEPSKGYMCH-RYQLBKOJSA-N 2 1 306.519 4.081 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)C1 ZINC000481296747 1048354346 /nfs/dbraw/zinc/35/43/46/1048354346.db2.gz URAVNERIUWYVDY-ROUUACIJSA-N 2 1 308.469 4.346 20 0 DIADMP CCCC[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001201717309 1048355350 /nfs/dbraw/zinc/35/53/50/1048355350.db2.gz MNHFOCHHTNEHBO-UHFFFAOYSA-N 2 1 300.490 4.165 20 0 DIADMP CCCCC[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001201744369 1048362388 /nfs/dbraw/zinc/36/23/88/1048362388.db2.gz JRHXAEFPIVZVKC-WOJBJXKFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001201744369 1048362404 /nfs/dbraw/zinc/36/24/04/1048362404.db2.gz JRHXAEFPIVZVKC-WOJBJXKFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001201744369 1048362421 /nfs/dbraw/zinc/36/24/21/1048362421.db2.gz JRHXAEFPIVZVKC-WOJBJXKFSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000481421328 1048399247 /nfs/dbraw/zinc/39/92/47/1048399247.db2.gz FWMHUZAJSVPFGC-HNNXBMFYSA-N 2 1 312.457 4.409 20 0 DIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC001206680608 1048402485 /nfs/dbraw/zinc/40/24/85/1048402485.db2.gz NZYWOWLYDASBLU-ROUUACIJSA-N 2 1 302.506 4.064 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC000555598175 1048402684 /nfs/dbraw/zinc/40/26/84/1048402684.db2.gz PUGQLHXFDPQKSQ-IBGZPJMESA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC000555598175 1048402691 /nfs/dbraw/zinc/40/26/91/1048402691.db2.gz PUGQLHXFDPQKSQ-IBGZPJMESA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1 ZINC000555598175 1048402695 /nfs/dbraw/zinc/40/26/95/1048402695.db2.gz PUGQLHXFDPQKSQ-IBGZPJMESA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC000555598175 1048402702 /nfs/dbraw/zinc/40/27/02/1048402702.db2.gz PUGQLHXFDPQKSQ-IBGZPJMESA-N 2 1 318.530 4.105 20 0 DIADMP CCc1ccc(N[C@@H]2CC3(CC[NH2+]CC3)c3ccc(C)cc32)[nH+]c1 ZINC001163034963 1048406388 /nfs/dbraw/zinc/40/63/88/1048406388.db2.gz YVPZCUYWPBRUOU-LJQANCHMSA-N 2 1 321.468 4.131 20 0 DIADMP CC(C)(C)CC[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001202086496 1048445864 /nfs/dbraw/zinc/44/58/64/1048445864.db2.gz BETUARRLGYDGIU-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001202086496 1048445872 /nfs/dbraw/zinc/44/58/72/1048445872.db2.gz BETUARRLGYDGIU-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202086496 1048445875 /nfs/dbraw/zinc/44/58/75/1048445875.db2.gz BETUARRLGYDGIU-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](CC1CCCC1)CC2 ZINC001202140047 1048460134 /nfs/dbraw/zinc/46/01/34/1048460134.db2.gz ULKBNUFUEHEPPR-LJQANCHMSA-N 2 1 316.489 4.146 20 0 DIADMP c1csc(C[N@@H+]2CCC3(C2)CC[NH+](CC2CCCC2)CC3)c1 ZINC001202161427 1048468717 /nfs/dbraw/zinc/46/87/17/1048468717.db2.gz UPGCTQBXXPYCMW-UHFFFAOYSA-N 2 1 318.530 4.226 20 0 DIADMP CC[C@@H](C[N@@H+](CC)CCCCn1ccnc1C)c1ccccc1 ZINC000481764472 1048480452 /nfs/dbraw/zinc/48/04/52/1048480452.db2.gz HBTCMLGOWMXKQV-IBGZPJMESA-N 2 1 313.489 4.487 20 0 DIADMP CC[C@@H](C[N@H+](CC)CCCCn1cc[nH+]c1C)c1ccccc1 ZINC000481764472 1048480459 /nfs/dbraw/zinc/48/04/59/1048480459.db2.gz HBTCMLGOWMXKQV-IBGZPJMESA-N 2 1 313.489 4.487 20 0 DIADMP CC[C@@H](C[N@@H+](CC)CCCCn1cc[nH+]c1C)c1ccccc1 ZINC000481764472 1048480461 /nfs/dbraw/zinc/48/04/61/1048480461.db2.gz HBTCMLGOWMXKQV-IBGZPJMESA-N 2 1 313.489 4.487 20 0 DIADMP CC1(C)CCC[C@H](C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202227572 1048489108 /nfs/dbraw/zinc/48/91/08/1048489108.db2.gz MVZBRIKNYMUCMY-VQTJNVASSA-N 2 1 314.517 4.315 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H](c1cccnc1)C1CCC1)C1CCCCC1 ZINC000481913316 1048525800 /nfs/dbraw/zinc/52/58/00/1048525800.db2.gz MGHBFOURZAJLLA-FQEVSTJZSA-N 2 1 315.505 4.167 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@H]3CC[N@H+](C)C[C@H]3C)c2)c1 ZINC000481935507 1048533164 /nfs/dbraw/zinc/53/31/64/1048533164.db2.gz YTRZFXARXLLPFB-UTKZUKDTSA-N 2 1 308.469 4.092 20 0 DIADMP c1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000567851526 1048541437 /nfs/dbraw/zinc/54/14/37/1048541437.db2.gz NMGCCCVZFCQXKS-OAQYLSRUSA-N 2 1 320.480 4.016 20 0 DIADMP c1ccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000567851526 1048541451 /nfs/dbraw/zinc/54/14/51/1048541451.db2.gz NMGCCCVZFCQXKS-OAQYLSRUSA-N 2 1 320.480 4.016 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C)c1c(Cl)cccc1Cl ZINC000482096338 1048556051 /nfs/dbraw/zinc/55/60/51/1048556051.db2.gz QIYMWGROPSQQMB-LALPHHSUSA-N 2 1 315.288 4.027 20 0 DIADMP CC[C@H]1CCC[C@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001202456740 1048556553 /nfs/dbraw/zinc/55/65/53/1048556553.db2.gz LZHNXHRLAGEEHY-OALUTQOASA-N 2 1 300.490 4.067 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+][C@@H](C)c1ccc2ccccc2n1 ZINC000482232639 1048572078 /nfs/dbraw/zinc/57/20/78/1048572078.db2.gz BGADDXBENQKXMC-KRWDZBQOSA-N 2 1 313.489 4.398 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC)cc1 ZINC000482340553 1048590014 /nfs/dbraw/zinc/59/00/14/1048590014.db2.gz ATOXMFDLGKKADR-XLIONFOSSA-N 2 1 318.505 4.246 20 0 DIADMP Cc1cccc(C[C@@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)c1 ZINC000482341725 1048590082 /nfs/dbraw/zinc/59/00/82/1048590082.db2.gz CFSDVNCPSZFLKN-TZIWHRDSSA-N 2 1 314.517 4.026 20 0 DIADMP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000482352182 1048590440 /nfs/dbraw/zinc/59/04/40/1048590440.db2.gz AIVMOGZNBUIYGH-UYAOXDASSA-N 2 1 320.496 4.103 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(OC)cc1 ZINC000482340551 1048590586 /nfs/dbraw/zinc/59/05/86/1048590586.db2.gz ATOXMFDLGKKADR-FXAWDEMLSA-N 2 1 318.505 4.246 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359816 1048592184 /nfs/dbraw/zinc/59/21/84/1048592184.db2.gz QUFSBJSLCORPSD-ZIAGYGMSSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359816 1048592198 /nfs/dbraw/zinc/59/21/98/1048592198.db2.gz QUFSBJSLCORPSD-ZIAGYGMSSA-N 2 1 312.860 4.250 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000850381622 1048644261 /nfs/dbraw/zinc/64/42/61/1048644261.db2.gz HUXKJJCVSZVIBI-KFWWJZLASA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000850381622 1048644270 /nfs/dbraw/zinc/64/42/70/1048644270.db2.gz HUXKJJCVSZVIBI-KFWWJZLASA-N 2 1 318.427 4.104 20 0 DIADMP Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000482693125 1048660037 /nfs/dbraw/zinc/66/00/37/1048660037.db2.gz NUGADUFRGBUNHQ-OALUTQOASA-N 2 1 300.490 4.049 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC000850539048 1048686874 /nfs/dbraw/zinc/68/68/74/1048686874.db2.gz PYUGUMMFVRVMBM-NRXISQOPSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC000850539048 1048686880 /nfs/dbraw/zinc/68/68/80/1048686880.db2.gz PYUGUMMFVRVMBM-NRXISQOPSA-N 2 1 318.427 4.104 20 0 DIADMP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc2ccccc2n1 ZINC000483149795 1048748346 /nfs/dbraw/zinc/74/83/46/1048748346.db2.gz BNCOXWMRXMCHJA-HNAYVOBHSA-N 2 1 313.489 4.252 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001206715502 1048752515 /nfs/dbraw/zinc/75/25/15/1048752515.db2.gz STTBLYFVALWRNF-JLAWEPINSA-N 2 1 312.501 4.238 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001206715502 1048752528 /nfs/dbraw/zinc/75/25/28/1048752528.db2.gz STTBLYFVALWRNF-JLAWEPINSA-N 2 1 312.501 4.238 20 0 DIADMP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1cc(F)c(F)c(F)c1 ZINC000483205036 1048753936 /nfs/dbraw/zinc/75/39/36/1048753936.db2.gz UDYRKXMIDFUSEF-XHDPSFHLSA-N 2 1 316.411 4.121 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000194608069 1048763045 /nfs/dbraw/zinc/76/30/45/1048763045.db2.gz BQOSSJTWHHPZRY-QWFCFKBJSA-N 2 1 314.517 4.423 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCC(C)(C)C3CC3)C2)CC1 ZINC001190650658 1048772569 /nfs/dbraw/zinc/77/25/69/1048772569.db2.gz DAEWYZUVWXVJPD-GOSISDBHSA-N 2 1 306.538 4.257 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001190650760 1048772624 /nfs/dbraw/zinc/77/26/24/1048772624.db2.gz GDILJWNMMKHYHF-IAGOWNOFSA-N 2 1 316.480 4.112 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483495364 1048806577 /nfs/dbraw/zinc/80/65/77/1048806577.db2.gz YTOSEDBBLDIPMZ-CZAAIQMYSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483495364 1048806589 /nfs/dbraw/zinc/80/65/89/1048806589.db2.gz YTOSEDBBLDIPMZ-CZAAIQMYSA-N 2 1 308.469 4.317 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCc3cccc4ccccc43)CC[C@@H]21 ZINC000483494398 1048809627 /nfs/dbraw/zinc/80/96/27/1048809627.db2.gz USAFJNDUOPKTFG-IRLDBZIGSA-N 2 1 322.496 4.189 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCc3cccc4ccccc43)CC[C@@H]21 ZINC000483494398 1048809637 /nfs/dbraw/zinc/80/96/37/1048809637.db2.gz USAFJNDUOPKTFG-IRLDBZIGSA-N 2 1 322.496 4.189 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)C1CCCCC1 ZINC000483500271 1048809873 /nfs/dbraw/zinc/80/98/73/1048809873.db2.gz HCQFQIQSFBECMM-IBGZPJMESA-N 2 1 315.505 4.307 20 0 DIADMP CCCC[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C1CC1 ZINC001167023828 1048834164 /nfs/dbraw/zinc/83/41/64/1048834164.db2.gz LWARXZJXTYMPSS-UHFFFAOYSA-N 2 1 300.490 4.437 20 0 DIADMP Cc1cccc(CN[C@@H]2C[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001177170610 1048835628 /nfs/dbraw/zinc/83/56/28/1048835628.db2.gz AFFMCZDVTBOGMZ-FQEVSTJZSA-N 2 1 308.469 4.138 20 0 DIADMP Cc1cccc(CN[C@@H]2C[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001177170610 1048835653 /nfs/dbraw/zinc/83/56/53/1048835653.db2.gz AFFMCZDVTBOGMZ-FQEVSTJZSA-N 2 1 308.469 4.138 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001191068677 1048835813 /nfs/dbraw/zinc/83/58/13/1048835813.db2.gz CONBXWQSNJUHDK-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP Cc1cccc(CN[C@H]2C[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001177170611 1048836330 /nfs/dbraw/zinc/83/63/30/1048836330.db2.gz AFFMCZDVTBOGMZ-HXUWFJFHSA-N 2 1 308.469 4.138 20 0 DIADMP Cc1cccc(CN[C@H]2C[N@@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001177170611 1048836348 /nfs/dbraw/zinc/83/63/48/1048836348.db2.gz AFFMCZDVTBOGMZ-HXUWFJFHSA-N 2 1 308.469 4.138 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C(C)(C)C ZINC000483735291 1048849690 /nfs/dbraw/zinc/84/96/90/1048849690.db2.gz YWJYEEGNGGZJFY-INIZCTEOSA-N 2 1 314.473 4.436 20 0 DIADMP CC(C)[C@@H]1CCC[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC001177245020 1048853910 /nfs/dbraw/zinc/85/39/10/1048853910.db2.gz KLHVFPOYPTWSLT-TZIWHRDSSA-N 2 1 314.517 4.239 20 0 DIADMP CC(C)[C@@H]1CCC[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC001177245020 1048853931 /nfs/dbraw/zinc/85/39/31/1048853931.db2.gz KLHVFPOYPTWSLT-TZIWHRDSSA-N 2 1 314.517 4.239 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001177289382 1048856236 /nfs/dbraw/zinc/85/62/36/1048856236.db2.gz FLKNQKJUNZIOTK-HDICACEKSA-N 2 1 314.517 4.412 20 0 DIADMP C[NH+](C)[C@@H](C[NH2+]C1CCC(C2CCC2)CC1)C1CCCCC1 ZINC001177294073 1048857582 /nfs/dbraw/zinc/85/75/82/1048857582.db2.gz DKIFNPUCHTVBGN-UUKMXZOPSA-N 2 1 306.538 4.445 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)c1 ZINC001177290115 1048858672 /nfs/dbraw/zinc/85/86/72/1048858672.db2.gz NGJNZZYSAZRQTR-HDICACEKSA-N 2 1 316.533 4.460 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)c1 ZINC001177261989 1048860062 /nfs/dbraw/zinc/86/00/62/1048860062.db2.gz MULJWQVZTYUQMA-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1 ZINC001177261989 1048860085 /nfs/dbraw/zinc/86/00/85/1048860085.db2.gz MULJWQVZTYUQMA-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC001177299536 1048861727 /nfs/dbraw/zinc/86/17/27/1048861727.db2.gz UKVKKVIKGQFQDE-VQTJNVASSA-N 2 1 316.533 4.500 20 0 DIADMP CC(C)C[C@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccccn1 ZINC000483846305 1048867821 /nfs/dbraw/zinc/86/78/21/1048867821.db2.gz DZWPRXAWHRVBHF-IBGZPJMESA-N 2 1 305.510 4.267 20 0 DIADMP CC(C)C1CCC(C[NH2+][C@H](C)C[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC001177458581 1048888808 /nfs/dbraw/zinc/88/88/08/1048888808.db2.gz DZYCDOJJYWLRSP-ITFVSGOZSA-N 2 1 308.554 4.405 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2CC[C@H]2CCC[NH+]2C)cc1 ZINC001191180964 1048890120 /nfs/dbraw/zinc/89/01/20/1048890120.db2.gz BRTUERIMGSBRBY-SXLOBPIMSA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[NH+]2CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001191180964 1048890140 /nfs/dbraw/zinc/89/01/40/1048890140.db2.gz BRTUERIMGSBRBY-SXLOBPIMSA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[NH+]2CC[C@H]2CCC[N@H+]2C)cc1 ZINC001191180964 1048890160 /nfs/dbraw/zinc/89/01/60/1048890160.db2.gz BRTUERIMGSBRBY-SXLOBPIMSA-N 2 1 300.490 4.252 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@@H](C)C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177458787 1048890616 /nfs/dbraw/zinc/89/06/16/1048890616.db2.gz IGPLOINXOJVVNB-ZRNYENFQSA-N 2 1 316.533 4.211 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177458787 1048890630 /nfs/dbraw/zinc/89/06/30/1048890630.db2.gz IGPLOINXOJVVNB-ZRNYENFQSA-N 2 1 316.533 4.211 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001191258628 1048894825 /nfs/dbraw/zinc/89/48/25/1048894825.db2.gz OUEVIAMZKBUOPI-NRSPTQNISA-N 2 1 314.517 4.377 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001191258628 1048894853 /nfs/dbraw/zinc/89/48/53/1048894853.db2.gz OUEVIAMZKBUOPI-NRSPTQNISA-N 2 1 314.517 4.377 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001191258628 1048894872 /nfs/dbraw/zinc/89/48/72/1048894872.db2.gz OUEVIAMZKBUOPI-NRSPTQNISA-N 2 1 314.517 4.377 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001191255183 1048897221 /nfs/dbraw/zinc/89/72/21/1048897221.db2.gz CECIOLBAVLARTH-MOPGFXCFSA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001191255183 1048897226 /nfs/dbraw/zinc/89/72/26/1048897226.db2.gz CECIOLBAVLARTH-MOPGFXCFSA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c(C)c1 ZINC001191255183 1048897240 /nfs/dbraw/zinc/89/72/40/1048897240.db2.gz CECIOLBAVLARTH-MOPGFXCFSA-N 2 1 302.506 4.479 20 0 DIADMP CC[C@@H](C[NH2+]CC(C)(C)[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001177483617 1048898008 /nfs/dbraw/zinc/89/80/08/1048898008.db2.gz ZNBGFYGVAGNEPT-MSOLQXFVSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@@H](C[NH2+]CC(C)(C)[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001177483617 1048898020 /nfs/dbraw/zinc/89/80/20/1048898020.db2.gz ZNBGFYGVAGNEPT-MSOLQXFVSA-N 2 1 302.506 4.280 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CC[C@@H]2CCC[NH+]2C)o1 ZINC001191260079 1048898653 /nfs/dbraw/zinc/89/86/53/1048898653.db2.gz ZFSWUDGQLRVLJI-RYRKJORJSA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[NH+]2CC[C@@H]2CCC[N@@H+]2C)o1 ZINC001191260079 1048898669 /nfs/dbraw/zinc/89/86/69/1048898669.db2.gz ZFSWUDGQLRVLJI-RYRKJORJSA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[NH+]2CC[C@@H]2CCC[N@H+]2C)o1 ZINC001191260079 1048898679 /nfs/dbraw/zinc/89/86/79/1048898679.db2.gz ZFSWUDGQLRVLJI-RYRKJORJSA-N 2 1 304.478 4.099 20 0 DIADMP CC(C)Cc1ccc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)cc1 ZINC001191260117 1048899977 /nfs/dbraw/zinc/89/99/77/1048899977.db2.gz ZTGKNDQLNBNAMV-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccc(C[N@@H+](C)CC[C@H]2CCCC[NH+]2C)cc1 ZINC001191260117 1048899986 /nfs/dbraw/zinc/89/99/86/1048899986.db2.gz ZTGKNDQLNBNAMV-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccc(C[NH+](C)CC[C@H]2CCCC[N@@H+]2C)cc1 ZINC001191260117 1048900000 /nfs/dbraw/zinc/90/00/00/1048900000.db2.gz ZTGKNDQLNBNAMV-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccc(C[NH+](C)CC[C@H]2CCCC[N@H+]2C)cc1 ZINC001191260117 1048900012 /nfs/dbraw/zinc/90/00/12/1048900012.db2.gz ZTGKNDQLNBNAMV-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000484173926 1048908894 /nfs/dbraw/zinc/90/88/94/1048908894.db2.gz QWWZVCOGIDZNSP-KRWDZBQOSA-N 2 1 323.484 4.272 20 0 DIADMP CC/C=C\CC[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359296 1048932797 /nfs/dbraw/zinc/93/27/97/1048932797.db2.gz TYSKQWZUWTWBHH-YOXWTLATSA-N 2 1 312.501 4.331 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]CC2CCCCC2)CC1 ZINC001177875620 1048949311 /nfs/dbraw/zinc/94/93/11/1048949311.db2.gz NNAOMBPZYHDDNT-KRWDZBQOSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]CC2CCCCC2)CC1 ZINC001177875622 1048949589 /nfs/dbraw/zinc/94/95/89/1048949589.db2.gz NNAOMBPZYHDDNT-QGZVFWFLSA-N 2 1 300.490 4.382 20 0 DIADMP CC(C)CC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191522069 1048959010 /nfs/dbraw/zinc/95/90/10/1048959010.db2.gz ZUOMUALVNQSYEQ-PMACEKPBSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191522069 1048959023 /nfs/dbraw/zinc/95/90/23/1048959023.db2.gz ZUOMUALVNQSYEQ-PMACEKPBSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191522069 1048959033 /nfs/dbraw/zinc/95/90/33/1048959033.db2.gz ZUOMUALVNQSYEQ-PMACEKPBSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C/C=C\c1c(C)cc(C)cc1C ZINC001177911238 1048960778 /nfs/dbraw/zinc/96/07/78/1048960778.db2.gz HNBWIHBOSMWFGM-FPLPWBNLSA-N 2 1 311.473 4.200 20 0 DIADMP CCC(CC)([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Cl)cc1 ZINC001191569959 1048967257 /nfs/dbraw/zinc/96/72/57/1048967257.db2.gz VAKQUAGHTFATHM-KRWDZBQOSA-N 2 1 308.897 4.429 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+]CC3CCC=CCC3)CC2)cc1 ZINC001203783527 1048996017 /nfs/dbraw/zinc/99/60/17/1048996017.db2.gz VPUWXEJZXPNNCG-UHFFFAOYSA-N 2 1 312.501 4.030 20 0 DIADMP Cc1[nH+]c2c(Nc3ccc(C[NH+]4CCCC4)cc3)cccn2c1C ZINC001203795358 1049000237 /nfs/dbraw/zinc/00/02/37/1049000237.db2.gz GBXOGMMVXKFHLI-UHFFFAOYSA-N 2 1 320.440 4.291 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001203856544 1049015532 /nfs/dbraw/zinc/01/55/32/1049015532.db2.gz LDQDOMIEOZNOPG-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001203856544 1049015545 /nfs/dbraw/zinc/01/55/45/1049015545.db2.gz LDQDOMIEOZNOPG-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001203856547 1049016242 /nfs/dbraw/zinc/01/62/42/1049016242.db2.gz LDQDOMIEOZNOPG-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001203856547 1049016259 /nfs/dbraw/zinc/01/62/59/1049016259.db2.gz LDQDOMIEOZNOPG-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@@H+](c1ccc(N[C@H]2CC[NH+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802223 1049024208 /nfs/dbraw/zinc/02/42/08/1049024208.db2.gz JIVMRHUJLROVBD-LPHOPBHVSA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@H+](c1ccc(N[C@H]2CC[NH+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802223 1049024219 /nfs/dbraw/zinc/02/42/19/1049024219.db2.gz JIVMRHUJLROVBD-LPHOPBHVSA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@H]2CC[N@H+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802223 1049024227 /nfs/dbraw/zinc/02/42/27/1049024227.db2.gz JIVMRHUJLROVBD-LPHOPBHVSA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802223 1049024239 /nfs/dbraw/zinc/02/42/39/1049024239.db2.gz JIVMRHUJLROVBD-LPHOPBHVSA-N 2 1 303.494 4.064 20 0 DIADMP Cc1cccc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)c1 ZINC001203893359 1049025457 /nfs/dbraw/zinc/02/54/57/1049025457.db2.gz BQAZWDZQMAPXQG-UHFFFAOYSA-N 2 1 300.490 4.224 20 0 DIADMP Cc1cc2cc(C[NH2+]CC3(C[NH+](C)C)CCCC3)oc2cc1C ZINC001178448809 1049034099 /nfs/dbraw/zinc/03/40/99/1049034099.db2.gz CZZYHMOIJXTPKB-UHFFFAOYSA-N 2 1 314.473 4.261 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(OC)c2ccccc12 ZINC001203995249 1049056961 /nfs/dbraw/zinc/05/69/61/1049056961.db2.gz GJAIQQUOSWXMQN-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2c[nH+]ccc2N(C)C)CC(C)(C)C1 ZINC001178601295 1049066026 /nfs/dbraw/zinc/06/60/26/1049066026.db2.gz NTACQAHQRCSESQ-CVEARBPZSA-N 2 1 303.494 4.090 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195139149 1049069372 /nfs/dbraw/zinc/06/93/72/1049069372.db2.gz QBFLFKPQAYKRIU-FUHWJXTLSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195132148 1049070919 /nfs/dbraw/zinc/07/09/19/1049070919.db2.gz YMYSLWZTYDQSKP-WMZOPIPTSA-N 2 1 314.498 4.229 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192324793 1049079719 /nfs/dbraw/zinc/07/97/19/1049079719.db2.gz LURIUJXBCNIBIK-PZJWPPBQSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192324793 1049079733 /nfs/dbraw/zinc/07/97/33/1049079733.db2.gz LURIUJXBCNIBIK-PZJWPPBQSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192324793 1049079748 /nfs/dbraw/zinc/07/97/48/1049079748.db2.gz LURIUJXBCNIBIK-PZJWPPBQSA-N 2 1 312.501 4.259 20 0 DIADMP Cn1c[nH+]c2cccc(Nc3cccc(C[NH+]4CCCCC4)c3)c21 ZINC001204119068 1049088579 /nfs/dbraw/zinc/08/85/79/1049088579.db2.gz UUHDJQTZQPMNMV-UHFFFAOYSA-N 2 1 320.440 4.303 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2)cc1)CC1CC[NH+](C)CC1 ZINC001204133957 1049090354 /nfs/dbraw/zinc/09/03/54/1049090354.db2.gz ABCQQIYQRWCEQZ-UHFFFAOYSA-N 2 1 308.469 4.127 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001178811788 1049093056 /nfs/dbraw/zinc/09/30/56/1049093056.db2.gz XXXKLKVXJHZUCR-VHBXLISGSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC001178811788 1049093062 /nfs/dbraw/zinc/09/30/62/1049093062.db2.gz XXXKLKVXJHZUCR-VHBXLISGSA-N 2 1 314.517 4.454 20 0 DIADMP C[NH+]1CCC2(CC[N@@H+](Cc3ccc(-c4ccccc4)cc3)C2)CC1 ZINC001204138924 1049094385 /nfs/dbraw/zinc/09/43/85/1049094385.db2.gz YBQFZSOUXJZKCX-UHFFFAOYSA-N 2 1 320.480 4.271 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2ccc(C(C)C)cc2)CC1 ZINC001204165788 1049103208 /nfs/dbraw/zinc/10/32/08/1049103208.db2.gz HMZLDBMTSVXSSS-UHFFFAOYSA-N 2 1 323.484 4.252 20 0 DIADMP Cc1ccc(C[NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)cc1 ZINC001204173228 1049105029 /nfs/dbraw/zinc/10/50/29/1049105029.db2.gz WZKMGJJSRWVKKU-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2(C3CCC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001178921598 1049109618 /nfs/dbraw/zinc/10/96/18/1049109618.db2.gz ADSCJNCCWJTMIL-YLJYHZDGSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2(C3CCC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001178921598 1049109626 /nfs/dbraw/zinc/10/96/26/1049109626.db2.gz ADSCJNCCWJTMIL-YLJYHZDGSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc(Cl)ccc1F ZINC001192575896 1049118521 /nfs/dbraw/zinc/11/85/21/1049118521.db2.gz XPLKTDNORZOHOG-GFCCVEGCSA-N 2 1 309.816 4.115 20 0 DIADMP CCCC[N@@H+](CCC)Cc1ccc(OCCC[NH+](C)C)cc1 ZINC001204268398 1049126137 /nfs/dbraw/zinc/12/61/37/1049126137.db2.gz KLRDYZSTEOUOIE-UHFFFAOYSA-N 2 1 306.494 4.029 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1CCC(F)CC1 ZINC001179071932 1049128668 /nfs/dbraw/zinc/12/86/68/1049128668.db2.gz MDZJQKKFDPMCOA-UHFFFAOYSA-N 2 1 320.496 4.263 20 0 DIADMP CC(C)C[N@H+](C)CCC[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC001179081960 1049128694 /nfs/dbraw/zinc/12/86/94/1049128694.db2.gz QYQNEVZQHOEQCH-UHFFFAOYSA-N 2 1 310.485 4.421 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC001179081960 1049128699 /nfs/dbraw/zinc/12/86/99/1049128699.db2.gz QYQNEVZQHOEQCH-UHFFFAOYSA-N 2 1 310.485 4.421 20 0 DIADMP CCCCCOc1ccc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1 ZINC001179160096 1049138832 /nfs/dbraw/zinc/13/88/32/1049138832.db2.gz TYBRGRNAFBXXGD-LJQANCHMSA-N 2 1 318.505 4.077 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CC1 ZINC000716710925 1049145707 /nfs/dbraw/zinc/14/57/07/1049145707.db2.gz YXUDZBZPOLGKJQ-VMXMFDLUSA-N 2 1 312.501 4.064 20 0 DIADMP Cc1ccc(C[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)cc1C ZINC001204353766 1049146613 /nfs/dbraw/zinc/14/66/13/1049146613.db2.gz PSIOQTHAMNRYOH-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)cc1C ZINC001204353766 1049146621 /nfs/dbraw/zinc/14/66/21/1049146621.db2.gz PSIOQTHAMNRYOH-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)[C@@H]2CCc3ccc(F)cc32)cc1 ZINC001192911151 1049148202 /nfs/dbraw/zinc/14/82/02/1049148202.db2.gz ZORDKTAWCVDRDI-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP C([NH2+]C1CCC2(CCC2)CC1)[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001179387160 1049162361 /nfs/dbraw/zinc/16/23/61/1049162361.db2.gz YLHKOBGCAOHTHW-LJQANCHMSA-N 2 1 304.522 4.486 20 0 DIADMP C([NH2+]C1CCC2(CCC2)CC1)[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001179387160 1049162366 /nfs/dbraw/zinc/16/23/66/1049162366.db2.gz YLHKOBGCAOHTHW-LJQANCHMSA-N 2 1 304.522 4.486 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001179468888 1049169411 /nfs/dbraw/zinc/16/94/11/1049169411.db2.gz SDSMMGQJGJFSBL-NLWGTHIKSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001179468888 1049169416 /nfs/dbraw/zinc/16/94/16/1049169416.db2.gz SDSMMGQJGJFSBL-NLWGTHIKSA-N 2 1 302.506 4.455 20 0 DIADMP Cc1c(F)cccc1C[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001204513929 1049178903 /nfs/dbraw/zinc/17/89/03/1049178903.db2.gz OJRLEZXCORMTKY-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP Cc1c(F)cccc1C[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001204513929 1049178911 /nfs/dbraw/zinc/17/89/11/1049178911.db2.gz OJRLEZXCORMTKY-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP C[C@H]([NH2+][C@H]1CCN(C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107264 1049217733 /nfs/dbraw/zinc/21/77/33/1049217733.db2.gz MNIHORATMYDZMJ-STQMWFEESA-N 2 1 314.395 4.229 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107264 1049217746 /nfs/dbraw/zinc/21/77/46/1049217746.db2.gz MNIHORATMYDZMJ-STQMWFEESA-N 2 1 314.395 4.229 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107264 1049217760 /nfs/dbraw/zinc/21/77/60/1049217760.db2.gz MNIHORATMYDZMJ-STQMWFEESA-N 2 1 314.395 4.229 20 0 DIADMP c1ccc(CCCCCC[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000858223522 1049228376 /nfs/dbraw/zinc/22/83/76/1049228376.db2.gz USDUSPZZGZTHHA-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC001179904453 1049237853 /nfs/dbraw/zinc/23/78/53/1049237853.db2.gz BZUSWHZRJQYOSU-HOJAQTOUSA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC001179904453 1049237863 /nfs/dbraw/zinc/23/78/63/1049237863.db2.gz BZUSWHZRJQYOSU-HOJAQTOUSA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC001179904453 1049237873 /nfs/dbraw/zinc/23/78/73/1049237873.db2.gz BZUSWHZRJQYOSU-HOJAQTOUSA-N 2 1 302.506 4.088 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204735372 1049244160 /nfs/dbraw/zinc/24/41/60/1049244160.db2.gz RMXHTDPVMVBGPH-UHFFFAOYSA-N 2 1 314.498 4.175 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(C)(C)C)cc1 ZINC000195651616 1049244234 /nfs/dbraw/zinc/24/42/34/1049244234.db2.gz BBENRTRHLUTFRK-JKSUJKDBSA-N 2 1 300.490 4.119 20 0 DIADMP CC(C)(C)C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000195651632 1049244746 /nfs/dbraw/zinc/24/47/46/1049244746.db2.gz AYGFKBGUGFIVOD-VQIMIIECSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@@H+](CC(c1ccccc1)c1ccccc1)C[C@H]1CCC[NH+](C)C1 ZINC001179993531 1049247232 /nfs/dbraw/zinc/24/72/32/1049247232.db2.gz LYJIIGYOHIBZIK-IBGZPJMESA-N 2 1 322.496 4.092 20 0 DIADMP C[NH+](CC(c1ccccc1)c1ccccc1)C[C@H]1CCC[N@H+](C)C1 ZINC001179993531 1049247237 /nfs/dbraw/zinc/24/72/37/1049247237.db2.gz LYJIIGYOHIBZIK-IBGZPJMESA-N 2 1 322.496 4.092 20 0 DIADMP C[NH+](CC(c1ccccc1)c1ccccc1)C[C@H]1CCC[N@@H+](C)C1 ZINC001179993531 1049247246 /nfs/dbraw/zinc/24/72/46/1049247246.db2.gz LYJIIGYOHIBZIK-IBGZPJMESA-N 2 1 322.496 4.092 20 0 DIADMP C[N@@H+](CC(c1ccccc1)c1ccccc1)C[C@@H]1CCC[NH+](C)C1 ZINC001179993532 1049247533 /nfs/dbraw/zinc/24/75/33/1049247533.db2.gz LYJIIGYOHIBZIK-LJQANCHMSA-N 2 1 322.496 4.092 20 0 DIADMP C[NH+](CC(c1ccccc1)c1ccccc1)C[C@@H]1CCC[N@H+](C)C1 ZINC001179993532 1049247543 /nfs/dbraw/zinc/24/75/43/1049247543.db2.gz LYJIIGYOHIBZIK-LJQANCHMSA-N 2 1 322.496 4.092 20 0 DIADMP C[NH+](CC(c1ccccc1)c1ccccc1)C[C@@H]1CCC[N@@H+](C)C1 ZINC001179993532 1049247553 /nfs/dbraw/zinc/24/75/53/1049247553.db2.gz LYJIIGYOHIBZIK-LJQANCHMSA-N 2 1 322.496 4.092 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000485439567 1049247560 /nfs/dbraw/zinc/24/75/60/1049247560.db2.gz OLKJVYPTJGJHFK-CVEARBPZSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000485439567 1049247566 /nfs/dbraw/zinc/24/75/66/1049247566.db2.gz OLKJVYPTJGJHFK-CVEARBPZSA-N 2 1 306.881 4.209 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1Cl ZINC000858491100 1049264232 /nfs/dbraw/zinc/26/42/32/1049264232.db2.gz YCOPIGDDKHYMMA-HUUCEWRRSA-N 2 1 324.896 4.040 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001193990347 1049295529 /nfs/dbraw/zinc/29/55/29/1049295529.db2.gz OHBAFDKLWRKBCT-BDTNDASRSA-N 2 1 320.480 4.202 20 0 DIADMP CC[C@@H](c1ccccc1)[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001193990347 1049295536 /nfs/dbraw/zinc/29/55/36/1049295536.db2.gz OHBAFDKLWRKBCT-BDTNDASRSA-N 2 1 320.480 4.202 20 0 DIADMP CC[C@@H](c1ccccc1)[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001193990347 1049295543 /nfs/dbraw/zinc/29/55/43/1049295543.db2.gz OHBAFDKLWRKBCT-BDTNDASRSA-N 2 1 320.480 4.202 20 0 DIADMP Cc1occc1C[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC001180225154 1049309450 /nfs/dbraw/zinc/30/94/50/1049309450.db2.gz ONFJJSGIFBGWMB-INIZCTEOSA-N 2 1 304.478 4.065 20 0 DIADMP CC(C)(C[N@@H+]1CCCC[C@H]1C[NH3+])Sc1ccc(Cl)cc1 ZINC001204919255 1049309500 /nfs/dbraw/zinc/30/95/00/1049309500.db2.gz WQWIIJRGPQYEKJ-AWEZNQCLSA-N 2 1 312.910 4.024 20 0 DIADMP CC(C)(C[N@H+]1CCCC[C@H]1C[NH3+])Sc1ccc(Cl)cc1 ZINC001204919255 1049309512 /nfs/dbraw/zinc/30/95/12/1049309512.db2.gz WQWIIJRGPQYEKJ-AWEZNQCLSA-N 2 1 312.910 4.024 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000485691396 1049314062 /nfs/dbraw/zinc/31/40/62/1049314062.db2.gz DPECFIIVMIBCAA-AWEZNQCLSA-N 2 1 312.860 4.223 20 0 DIADMP C[C@H](c1nc2ccccc2o1)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859213519 1049319708 /nfs/dbraw/zinc/31/97/08/1049319708.db2.gz WIOPFXWBHXAKIK-OAHLLOKOSA-N 2 1 323.440 4.082 20 0 DIADMP C[C@H](c1nc2ccccc2o1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859213519 1049319717 /nfs/dbraw/zinc/31/97/17/1049319717.db2.gz WIOPFXWBHXAKIK-OAHLLOKOSA-N 2 1 323.440 4.082 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000485698077 1049320871 /nfs/dbraw/zinc/32/08/71/1049320871.db2.gz XUBYLWHFHJICDG-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000485698077 1049320889 /nfs/dbraw/zinc/32/08/89/1049320889.db2.gz XUBYLWHFHJICDG-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP CCCCCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001194153543 1049329113 /nfs/dbraw/zinc/32/91/13/1049329113.db2.gz PFUAXYNAFGWXAT-KRWDZBQOSA-N 2 1 308.535 4.391 20 0 DIADMP CCCCCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC001194153543 1049329126 /nfs/dbraw/zinc/32/91/26/1049329126.db2.gz PFUAXYNAFGWXAT-KRWDZBQOSA-N 2 1 308.535 4.391 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](C[C@H]2CC=C(CCC=C(C)C)CC2)C1 ZINC001205001194 1049337561 /nfs/dbraw/zinc/33/75/61/1049337561.db2.gz PBSSNCHGUXDPHL-VQTJNVASSA-N 2 1 304.522 4.391 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001205009329 1049340542 /nfs/dbraw/zinc/34/05/42/1049340542.db2.gz NVCRGYJEYPKXPU-DGSRBQDKSA-N 2 1 320.480 4.288 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000777130158 1049359007 /nfs/dbraw/zinc/35/90/07/1049359007.db2.gz PTTPZECTUCXSOG-YQXATGRUSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000777130158 1049359009 /nfs/dbraw/zinc/35/90/09/1049359009.db2.gz PTTPZECTUCXSOG-YQXATGRUSA-N 2 1 300.490 4.064 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000485908711 1049361224 /nfs/dbraw/zinc/36/12/24/1049361224.db2.gz VYZKOZYGSMFBOR-PLACYPQZSA-N 2 1 312.501 4.129 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000485908711 1049361235 /nfs/dbraw/zinc/36/12/35/1049361235.db2.gz VYZKOZYGSMFBOR-PLACYPQZSA-N 2 1 312.501 4.129 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000485908710 1049361303 /nfs/dbraw/zinc/36/13/03/1049361303.db2.gz VYZKOZYGSMFBOR-NCYKPQTJSA-N 2 1 312.501 4.129 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000485908710 1049361316 /nfs/dbraw/zinc/36/13/16/1049361316.db2.gz VYZKOZYGSMFBOR-NCYKPQTJSA-N 2 1 312.501 4.129 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)CC1 ZINC001205116483 1049384981 /nfs/dbraw/zinc/38/49/81/1049384981.db2.gz AENOKSSEVLVISO-GOSISDBHSA-N 2 1 314.860 4.320 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC[C@@H]([NH3+])CC1 ZINC001205123925 1049385779 /nfs/dbraw/zinc/38/57/79/1049385779.db2.gz HKGDQDSOGGVIRT-GOSISDBHSA-N 2 1 310.441 4.101 20 0 DIADMP CC(C)[C@H]1CCc2ccccc2[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001180622767 1049386577 /nfs/dbraw/zinc/38/65/77/1049386577.db2.gz JXQOWNKUVHCEOF-PYEZFCHVSA-N 2 1 312.501 4.161 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C[C@H]1C[NH3+] ZINC001205146506 1049393670 /nfs/dbraw/zinc/39/36/70/1049393670.db2.gz YBBMKAHKYZZZGQ-KBXCAEBGSA-N 2 1 314.860 4.034 20 0 DIADMP CC(C)[C@](C)(Cc1ccc(Cl)cc1)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001194625028 1049397678 /nfs/dbraw/zinc/39/76/78/1049397678.db2.gz JNAFQTMPPZTOPV-OALUTQOASA-N 2 1 322.924 4.371 20 0 DIADMP c1ccc([C@H]2CCCC[N@@H+]2Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC001205171629 1049401938 /nfs/dbraw/zinc/40/19/38/1049401938.db2.gz USLXFDWMSOCMKD-OAQYLSRUSA-N 2 1 306.453 4.060 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC001194640933 1049402533 /nfs/dbraw/zinc/40/25/33/1049402533.db2.gz JZKCWQFHFRATTG-UWJYYQICSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC001194640933 1049402538 /nfs/dbraw/zinc/40/25/38/1049402538.db2.gz JZKCWQFHFRATTG-UWJYYQICSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC001194640933 1049402543 /nfs/dbraw/zinc/40/25/43/1049402543.db2.gz JZKCWQFHFRATTG-UWJYYQICSA-N 2 1 314.517 4.463 20 0 DIADMP c1cc2c(cccc2C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)[nH]1 ZINC001205264080 1049419715 /nfs/dbraw/zinc/41/97/15/1049419715.db2.gz YQZNEBUVSNKPDV-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC001205263896 1049420222 /nfs/dbraw/zinc/42/02/22/1049420222.db2.gz FKODMXGKDQSJPP-AWEZNQCLSA-N 2 1 318.408 4.002 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cc1 ZINC001205303336 1049432988 /nfs/dbraw/zinc/43/29/88/1049432988.db2.gz CRHZPNCPVHKFQL-HKUYNNGSSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C[C@H]1C[NH3+] ZINC001205304781 1049433221 /nfs/dbraw/zinc/43/32/21/1049433221.db2.gz PQUYSVDVFUFLLP-UKRRQHHQSA-N 2 1 318.848 4.017 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]C3CCC4(CC4)CC3)C2)c1 ZINC000486683971 1049454761 /nfs/dbraw/zinc/45/47/61/1049454761.db2.gz AIHXTFIBHGGXFQ-INIZCTEOSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]C3CCC4(CC4)CC3)C2)c1 ZINC000486683971 1049454764 /nfs/dbraw/zinc/45/47/64/1049454764.db2.gz AIHXTFIBHGGXFQ-INIZCTEOSA-N 2 1 318.530 4.273 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385393 1049455672 /nfs/dbraw/zinc/45/56/72/1049455672.db2.gz DTZUMTHPBXQNNX-NCXUSEDFSA-N 2 1 306.538 4.445 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C2CCC3(CC3)CC2)CC1 ZINC000486715534 1049458917 /nfs/dbraw/zinc/45/89/17/1049458917.db2.gz WZJUBHHQJIQFEV-UHFFFAOYSA-N 2 1 312.501 4.272 20 0 DIADMP C[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C1CC(C)(C)C1 ZINC001195002647 1049460733 /nfs/dbraw/zinc/46/07/33/1049460733.db2.gz MBTBUQFPHYMSFM-UHFFFAOYSA-N 2 1 300.490 4.293 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]1[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181314798 1049465232 /nfs/dbraw/zinc/46/52/32/1049465232.db2.gz ICIPSVWQCCLRNB-HBMCJLEFSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001181383831 1049469684 /nfs/dbraw/zinc/46/96/84/1049469684.db2.gz ZOMQRASFGTZYGK-QZTJIDSGSA-N 2 1 316.489 4.450 20 0 DIADMP CC[C@]1(C)CCC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001181349050 1049470695 /nfs/dbraw/zinc/47/06/95/1049470695.db2.gz KGINFQQCHXBCCH-HSALFYBXSA-N 2 1 300.490 4.067 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001181592178 1049493682 /nfs/dbraw/zinc/49/36/82/1049493682.db2.gz YHGSVVYHDYSCLM-KBWCOIMZSA-N 2 1 314.517 4.351 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001181592178 1049493688 /nfs/dbraw/zinc/49/36/88/1049493688.db2.gz YHGSVVYHDYSCLM-KBWCOIMZSA-N 2 1 314.517 4.351 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@](F)(C[NH3+])CC2)cc1 ZINC001205545565 1049495011 /nfs/dbraw/zinc/49/50/11/1049495011.db2.gz JJBBMOUZHBFXSD-FXAWDEMLSA-N 2 1 320.496 4.142 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001205546668 1049495449 /nfs/dbraw/zinc/49/54/49/1049495449.db2.gz YICHSLONKFURLP-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@](F)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001205545532 1049495470 /nfs/dbraw/zinc/49/54/70/1049495470.db2.gz IZBCFDUYMYZFOM-OXJNMPFZSA-N 2 1 314.448 4.096 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(Cl)cs2)C1 ZINC000486951726 1049496713 /nfs/dbraw/zinc/49/67/13/1049496713.db2.gz UKFLGGCYJTVQKW-ZDUSSCGKSA-N 2 1 300.899 4.003 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC[C@H]1C[NH3+] ZINC001205602692 1049509145 /nfs/dbraw/zinc/50/91/45/1049509145.db2.gz LOHRWYFZQORSEJ-UTKZUKDTSA-N 2 1 308.469 4.160 20 0 DIADMP CCCCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)cc1 ZINC001205603085 1049509653 /nfs/dbraw/zinc/50/96/53/1049509653.db2.gz NQIMLPKVZPOHQM-HKUYNNGSSA-N 2 1 318.505 4.062 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205616763 1049510810 /nfs/dbraw/zinc/51/08/10/1049510810.db2.gz GWLAUBPOMRNZSM-HIFRSBDPSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC[C@H]1C[NH3+] ZINC001205617191 1049511304 /nfs/dbraw/zinc/51/13/04/1049511304.db2.gz ICDLXRAPYDWRIZ-RDJZCZTQSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205616767 1049512368 /nfs/dbraw/zinc/51/23/68/1049512368.db2.gz GWLAUBPOMRNZSM-ZFWWWQNUSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC[C@@H]1C[NH3+] ZINC001205617189 1049512613 /nfs/dbraw/zinc/51/26/13/1049512613.db2.gz ICDLXRAPYDWRIZ-NVXWUHKLSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)CC[C@@H]1C[NH3+] ZINC001205618254 1049513968 /nfs/dbraw/zinc/51/39/68/1049513968.db2.gz TWOBJJZBVMCVQL-DOTOQJQBSA-N 2 1 322.452 4.393 20 0 DIADMP CC[C@@H]1CCC[C@@H](C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)C1 ZINC001205622411 1049514917 /nfs/dbraw/zinc/51/49/17/1049514917.db2.gz SAVONTWBRLWPEG-QZTJIDSGSA-N 2 1 316.489 4.450 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)CC[C@H]1C[NH3+] ZINC001205625950 1049514972 /nfs/dbraw/zinc/51/49/72/1049514972.db2.gz CXFWZQYKRBAKPT-HOTGVXAUSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC[C@@H]1C[NH3+] ZINC001205629145 1049515734 /nfs/dbraw/zinc/51/57/34/1049515734.db2.gz XUVXNAVLAWOPFN-CRAIPNDOSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CC[C@@H]1C[NH3+] ZINC001205638590 1049517380 /nfs/dbraw/zinc/51/73/80/1049517380.db2.gz POQSBFFLDIMOHN-PGRDOPGGSA-N 2 1 322.496 4.084 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](CCCc1c[nH+]cn1C)CC(C)C ZINC001195414028 1049522392 /nfs/dbraw/zinc/52/23/92/1049522392.db2.gz VBQMRLDCQXOJMF-UHFFFAOYSA-N 2 1 313.489 4.128 20 0 DIADMP Cc1cccc(C)c1C[N@H+](CCCc1c[nH+]cn1C)CC(C)C ZINC001195414028 1049522405 /nfs/dbraw/zinc/52/24/05/1049522405.db2.gz VBQMRLDCQXOJMF-UHFFFAOYSA-N 2 1 313.489 4.128 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c1Cl ZINC001205651785 1049523564 /nfs/dbraw/zinc/52/35/64/1049523564.db2.gz JWQYRVQKYFUQDO-AAEUAGOBSA-N 2 1 315.288 4.109 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1cccc(OC(C)(C)C)c1 ZINC001205685009 1049532311 /nfs/dbraw/zinc/53/23/11/1049532311.db2.gz PDZHNLJQLKJWHK-UHFFFAOYSA-N 2 1 320.521 4.418 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1cccc(OC(C)(C)C)c1 ZINC001205685009 1049532325 /nfs/dbraw/zinc/53/23/25/1049532325.db2.gz PDZHNLJQLKJWHK-UHFFFAOYSA-N 2 1 320.521 4.418 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)C[C@@H](C)c1cccc(Cl)c1 ZINC001205685466 1049532620 /nfs/dbraw/zinc/53/26/20/1049532620.db2.gz VRDYOERRJJAMJC-MRXNPFEDSA-N 2 1 310.913 4.497 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1ccc2c(c1)CCCC2 ZINC001205684659 1049532791 /nfs/dbraw/zinc/53/27/91/1049532791.db2.gz JVQVEABEEAHGAR-UHFFFAOYSA-N 2 1 302.506 4.119 20 0 DIADMP [NH3+]C[C@@H]1C[N@H+](Cc2ccc(C3CCCCC3)cc2)CCC1(F)F ZINC001205795197 1049566137 /nfs/dbraw/zinc/56/61/37/1049566137.db2.gz DNLWWAGKEHJXPS-GOSISDBHSA-N 2 1 322.443 4.150 20 0 DIADMP [NH3+]C[C@@H]1C[N@@H+](Cc2ccc(C3CCCCC3)cc2)CCC1(F)F ZINC001205795197 1049566146 /nfs/dbraw/zinc/56/61/46/1049566146.db2.gz DNLWWAGKEHJXPS-GOSISDBHSA-N 2 1 322.443 4.150 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC001182152085 1049578720 /nfs/dbraw/zinc/57/87/20/1049578720.db2.gz IJPNVUSVUQGFNM-MSOLQXFVSA-N 2 1 304.522 4.453 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC001182152085 1049578729 /nfs/dbraw/zinc/57/87/29/1049578729.db2.gz IJPNVUSVUQGFNM-MSOLQXFVSA-N 2 1 304.522 4.453 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001205903870 1049596100 /nfs/dbraw/zinc/59/61/00/1049596100.db2.gz RLVVEMLEKFHZBZ-GJZGRUSLSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001205903871 1049597814 /nfs/dbraw/zinc/59/78/14/1049597814.db2.gz RLVVEMLEKFHZBZ-HUUCEWRRSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001205903446 1049598698 /nfs/dbraw/zinc/59/86/98/1049598698.db2.gz OZIYBBNFZWHQLG-ZFWWWQNUSA-N 2 1 318.848 4.159 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@H](C[NH3+])[C@H]2C)cccc1-c1ccccc1 ZINC001205912382 1049600260 /nfs/dbraw/zinc/60/02/60/1049600260.db2.gz ABMIMSDXQUPPOW-IEBWSBKVSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCCC[C@H]([NH3+])C2)c1 ZINC001205937634 1049606581 /nfs/dbraw/zinc/60/65/81/1049606581.db2.gz BLMGKWNCOIALBA-FQEVSTJZSA-N 2 1 308.469 4.284 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCCC[C@H]([NH3+])C2)c1 ZINC001205937634 1049606587 /nfs/dbraw/zinc/60/65/87/1049606587.db2.gz BLMGKWNCOIALBA-FQEVSTJZSA-N 2 1 308.469 4.284 20 0 DIADMP C[C@@H]1C[N@@H+](CC(c2ccccc2)c2ccccc2)CCC[C@H]1C[NH3+] ZINC001205981909 1049618772 /nfs/dbraw/zinc/61/87/72/1049618772.db2.gz IYXQNPPANKNSCH-NQIIRXRSSA-N 2 1 322.496 4.125 20 0 DIADMP C[C@H]1C[N@@H+](CC(c2ccccc2)c2ccccc2)CCC[C@H]1C[NH3+] ZINC001205981910 1049619261 /nfs/dbraw/zinc/61/92/61/1049619261.db2.gz IYXQNPPANKNSCH-RXVVDRJESA-N 2 1 322.496 4.125 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1)c1cccc2ccccc21 ZINC001205984674 1049619784 /nfs/dbraw/zinc/61/97/84/1049619784.db2.gz UCBQYDZLFJEACJ-SCTDSRPQSA-N 2 1 310.485 4.250 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2-c2cccs2)CCC[C@@H]1C[NH3+] ZINC001206004789 1049626418 /nfs/dbraw/zinc/62/64/18/1049626418.db2.gz VKVOTWFHOYPYTQ-HZPDHXFCSA-N 2 1 314.498 4.222 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cc(Cl)ccc2F)CC1 ZINC001206020064 1049630387 /nfs/dbraw/zinc/63/03/87/1049630387.db2.gz GVPVCAVJFDNRFR-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CCC[C@H]1C[NH3+] ZINC001206022088 1049632329 /nfs/dbraw/zinc/63/23/29/1049632329.db2.gz BEZKSNKKPNCPTD-AVRDEDQJSA-N 2 1 322.496 4.084 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CCC[C@@H]1C[NH3+] ZINC001206022094 1049632971 /nfs/dbraw/zinc/63/29/71/1049632971.db2.gz BEZKSNKKPNCPTD-XMSQKQJNSA-N 2 1 322.496 4.084 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)CS1 ZINC000488415156 1049648552 /nfs/dbraw/zinc/64/85/52/1049648552.db2.gz PDCZAEFUMGSPHX-RBUKOAKNSA-N 2 1 320.546 4.147 20 0 DIADMP CC(C)C1CC([NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)C1 ZINC000488432131 1049652784 /nfs/dbraw/zinc/65/27/84/1049652784.db2.gz LOWFNWWIXUCPBI-VQSBYGRUSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1 ZINC000488435854 1049655193 /nfs/dbraw/zinc/65/51/93/1049655193.db2.gz SNUJIGCYEZUUEA-IKGGRYGDSA-N 2 1 312.567 4.151 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1C[C@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001196632316 1049680153 /nfs/dbraw/zinc/68/01/53/1049680153.db2.gz NMPRNAINHMBBRR-VXKWHMMOSA-N 2 1 322.496 4.176 20 0 DIADMP C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000488584466 1049680892 /nfs/dbraw/zinc/68/08/92/1049680892.db2.gz RNGLALDLDGCGFS-DFGXFYAUSA-N 2 1 324.578 4.149 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2ccc3ccccc3c2)CC1 ZINC001196685742 1049682314 /nfs/dbraw/zinc/68/23/14/1049682314.db2.gz ZSCVHYPIDCCVTP-UHFFFAOYSA-N 2 1 308.469 4.290 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001206276784 1049697169 /nfs/dbraw/zinc/69/71/69/1049697169.db2.gz JPZUABRCXUXMQN-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[NH2+]C[C@@H](C)C2)c1 ZINC001206277976 1049698467 /nfs/dbraw/zinc/69/84/67/1049698467.db2.gz XAJFHJRNTORZCC-MRXNPFEDSA-N 2 1 308.469 4.012 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CC[NH2+]C[C@@H](C)C2)c1 ZINC001206277976 1049698481 /nfs/dbraw/zinc/69/84/81/1049698481.db2.gz XAJFHJRNTORZCC-MRXNPFEDSA-N 2 1 308.469 4.012 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@](C)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001206296791 1049703699 /nfs/dbraw/zinc/70/36/99/1049703699.db2.gz UTTJSWOIJUOMRO-DYESRHJHSA-N 2 1 310.485 4.394 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001206296327 1049703827 /nfs/dbraw/zinc/70/38/27/1049703827.db2.gz QZFCKNWOYBRLOT-OAQYLSRUSA-N 2 1 324.468 4.430 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2Oc2ccccc2)CC1 ZINC001206303781 1049705730 /nfs/dbraw/zinc/70/57/30/1049705730.db2.gz GMQYECKXRYTZOF-OAQYLSRUSA-N 2 1 324.468 4.430 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)s2)CC1 ZINC001206304620 1049706513 /nfs/dbraw/zinc/70/65/13/1049706513.db2.gz NLDBEZGUOGMVMT-QGZVFWFLSA-N 2 1 320.527 4.428 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2Cc2ccccc2Cl)CC1 ZINC001196937164 1049706338 /nfs/dbraw/zinc/70/63/38/1049706338.db2.gz XOBSTOWGSPGRMC-SFHVURJKSA-N 2 1 320.908 4.426 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2Cc2ccccc2Cl)CC1 ZINC001196937164 1049706345 /nfs/dbraw/zinc/70/63/45/1049706345.db2.gz XOBSTOWGSPGRMC-SFHVURJKSA-N 2 1 320.908 4.426 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)cnc1-c1ccccc1 ZINC001206326457 1049714202 /nfs/dbraw/zinc/71/42/02/1049714202.db2.gz NULDJRAUBZJBEM-OAQYLSRUSA-N 2 1 323.484 4.008 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC001206335308 1049714843 /nfs/dbraw/zinc/71/48/43/1049714843.db2.gz GDNXKOOKHXSJIU-IWKCEXAMSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC001206335308 1049714850 /nfs/dbraw/zinc/71/48/50/1049714850.db2.gz GDNXKOOKHXSJIU-IWKCEXAMSA-N 2 1 320.908 4.439 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2ccccc2-c2cccs2)C1 ZINC001206351861 1049717770 /nfs/dbraw/zinc/71/77/70/1049717770.db2.gz JXXKMXLWQKSQRL-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2ccccc2-c2cccs2)C1 ZINC001206351861 1049717776 /nfs/dbraw/zinc/71/77/76/1049717776.db2.gz JXXKMXLWQKSQRL-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)CCCc1ccccc1Cl ZINC001197285462 1049737632 /nfs/dbraw/zinc/73/76/32/1049737632.db2.gz QLJGZDBOOZYRNV-UHFFFAOYSA-N 2 1 322.924 4.471 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCCC[C@](C)(C[NH3+])C2)cc1 ZINC001206540555 1049753604 /nfs/dbraw/zinc/75/36/04/1049753604.db2.gz CEXFLMJXBHLUIX-HXUWFJFHSA-N 2 1 318.505 4.207 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1cc(C)nc(Cl)c1)C1CCCCC1 ZINC001206560521 1049755777 /nfs/dbraw/zinc/75/57/77/1049755777.db2.gz RHRPLSZBLFXFIG-UHFFFAOYSA-N 2 1 323.912 4.178 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cc(C)nc(Cl)c1)C1CCCCC1 ZINC001206560521 1049755785 /nfs/dbraw/zinc/75/57/85/1049755785.db2.gz RHRPLSZBLFXFIG-UHFFFAOYSA-N 2 1 323.912 4.178 20 0 DIADMP CSc1cccc(Cl)c1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206566234 1049756558 /nfs/dbraw/zinc/75/65/58/1049756558.db2.gz YUPXNODHQSGFOT-INIZCTEOSA-N 2 1 312.910 4.013 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206566234 1049756564 /nfs/dbraw/zinc/75/65/64/1049756564.db2.gz YUPXNODHQSGFOT-INIZCTEOSA-N 2 1 312.910 4.013 20 0 DIADMP CC(C)[N@@H+](Cc1cc2cc(Cl)ccc2[nH]1)[C@@H]1CCC[NH2+]CC1 ZINC001206579947 1049760654 /nfs/dbraw/zinc/76/06/54/1049760654.db2.gz BMCLHLBLYBCTMW-QGZVFWFLSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@H+](Cc1cccc(Cl)c1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206583825 1049761678 /nfs/dbraw/zinc/76/16/78/1049761678.db2.gz WXAOMIVVDDHSFP-CQSZACIVSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(Cl)c1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206583825 1049761686 /nfs/dbraw/zinc/76/16/86/1049761686.db2.gz WXAOMIVVDDHSFP-CQSZACIVSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1cc2ccccc2s1)[C@@H]1CCC[NH2+]CC1 ZINC001206582258 1049762097 /nfs/dbraw/zinc/76/20/97/1049762097.db2.gz NDLNUZSGPWDXKE-MRXNPFEDSA-N 2 1 302.487 4.254 20 0 DIADMP CCCCOc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001206582064 1049762638 /nfs/dbraw/zinc/76/26/38/1049762638.db2.gz LLLXRHPXXOQCMY-LJQANCHMSA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2c1cccc2Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206591583 1049764464 /nfs/dbraw/zinc/76/44/64/1049764464.db2.gz TUROUPNJDIEXCX-OAHLLOKOSA-N 2 1 319.880 4.174 20 0 DIADMP CCCCOc1cccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1 ZINC001206588575 1049764493 /nfs/dbraw/zinc/76/44/93/1049764493.db2.gz BXEGCHFZWDCFOV-IBGZPJMESA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1-c1ccncc1)[C@@H]1CCC[NH2+]CC1 ZINC001206598064 1049765997 /nfs/dbraw/zinc/76/59/97/1049765997.db2.gz HRXRWQYYNLOGGO-HXUWFJFHSA-N 2 1 323.484 4.101 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001206616419 1049770867 /nfs/dbraw/zinc/77/08/67/1049770867.db2.gz NYACMRSMCDNKPS-CQSZACIVSA-N 2 1 318.848 4.161 20 0 DIADMP C1CCC2(C1)CCCC[C@H]2[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001206715755 1049784099 /nfs/dbraw/zinc/78/40/99/1049784099.db2.gz WWIKCATXIPGCDV-IEBWSBKVSA-N 2 1 304.522 4.486 20 0 DIADMP C1CCC2(C1)CCCC[C@H]2[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001206715755 1049784106 /nfs/dbraw/zinc/78/41/06/1049784106.db2.gz WWIKCATXIPGCDV-IEBWSBKVSA-N 2 1 304.522 4.486 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001206770480 1049796777 /nfs/dbraw/zinc/79/67/77/1049796777.db2.gz SIYXXCGNMPJDKO-GJZGRUSLSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001206771396 1049797015 /nfs/dbraw/zinc/79/70/15/1049797015.db2.gz WOFSRTUYHITINI-HUUCEWRRSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001206771459 1049797138 /nfs/dbraw/zinc/79/71/38/1049797138.db2.gz WYZTYXXUVBTQNT-KBPBESRZSA-N 2 1 318.848 4.159 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cccc(C(F)F)c2)CC1 ZINC001207130908 1049839660 /nfs/dbraw/zinc/83/96/60/1049839660.db2.gz KFKPPTLGVJPEKM-UHFFFAOYSA-N 2 1 310.432 4.176 20 0 DIADMP C[N@@H+]1CC[C@@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174679 1049850318 /nfs/dbraw/zinc/85/03/18/1049850318.db2.gz NITZUYFURQVNGR-RTBURBONSA-N 2 1 304.522 4.153 20 0 DIADMP C[N@H+]1CC[C@@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174679 1049850331 /nfs/dbraw/zinc/85/03/31/1049850331.db2.gz NITZUYFURQVNGR-RTBURBONSA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@H+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174679 1049850348 /nfs/dbraw/zinc/85/03/48/1049850348.db2.gz NITZUYFURQVNGR-RTBURBONSA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@@H+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174679 1049850360 /nfs/dbraw/zinc/85/03/60/1049850360.db2.gz NITZUYFURQVNGR-RTBURBONSA-N 2 1 304.522 4.153 20 0 DIADMP C[N@H+](C1CC1)C1CC[NH+](C[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1 ZINC001207198400 1049861602 /nfs/dbraw/zinc/86/16/02/1049861602.db2.gz SQGQXAGGPPAYMP-KXBFYZLASA-N 2 1 318.892 4.002 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+](C[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1 ZINC001207198400 1049861624 /nfs/dbraw/zinc/86/16/24/1049861624.db2.gz SQGQXAGGPPAYMP-KXBFYZLASA-N 2 1 318.892 4.002 20 0 DIADMP C[N@H+](C1CC1)C1CC[NH+](C[C@H]2C[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001207198388 1049862084 /nfs/dbraw/zinc/86/20/84/1049862084.db2.gz SQGQXAGGPPAYMP-DNVCBOLYSA-N 2 1 318.892 4.002 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+](C[C@H]2C[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001207198388 1049862093 /nfs/dbraw/zinc/86/20/93/1049862093.db2.gz SQGQXAGGPPAYMP-DNVCBOLYSA-N 2 1 318.892 4.002 20 0 DIADMP CCC[N@@H+](CC1CC1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207284530 1049873701 /nfs/dbraw/zinc/87/37/01/1049873701.db2.gz OXXGCFBSAFNCHQ-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CCC[C@H]4CCC[C@@H]43)CC2)cc1 ZINC001207290719 1049875415 /nfs/dbraw/zinc/87/54/15/1049875415.db2.gz BFMKAWWAFDVAAR-RTWAWAEBSA-N 2 1 312.501 4.163 20 0 DIADMP CCC(CC)[N@@H+](CC)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207292538 1049875616 /nfs/dbraw/zinc/87/56/16/1049875616.db2.gz SYWRBNOZTRSFRH-UHFFFAOYSA-N 2 1 302.506 4.409 20 0 DIADMP CCOc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)c(C)c1 ZINC001207301588 1049879292 /nfs/dbraw/zinc/87/92/92/1049879292.db2.gz IMUDPBAZAVCACE-UHFFFAOYSA-N 2 1 318.505 4.092 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1CCC1CC[NH+](C)CC1 ZINC001207487115 1049897067 /nfs/dbraw/zinc/89/70/67/1049897067.db2.gz HNGSHWADEAIGRY-SFHVURJKSA-N 2 1 318.530 4.277 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1CCC1CC[NH+](C)CC1 ZINC001207487113 1049897398 /nfs/dbraw/zinc/89/73/98/1049897398.db2.gz HNGSHWADEAIGRY-GOSISDBHSA-N 2 1 318.530 4.277 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@H]2C1 ZINC001207783035 1049939180 /nfs/dbraw/zinc/93/91/80/1049939180.db2.gz AGDMHTBORVDEPF-GTAWCEEGSA-N 2 1 306.538 4.255 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](C[C@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001207936453 1049959200 /nfs/dbraw/zinc/95/92/00/1049959200.db2.gz GXCWUQSXXWKCRU-GOSISDBHSA-N 2 1 316.533 4.405 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)CC1 ZINC001207937128 1049959820 /nfs/dbraw/zinc/95/98/20/1049959820.db2.gz HAGZEQUXYYIVGY-NHCUHLMSSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937128 1049959832 /nfs/dbraw/zinc/95/98/32/1049959832.db2.gz HAGZEQUXYYIVGY-NHCUHLMSSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937128 1049959844 /nfs/dbraw/zinc/95/98/44/1049959844.db2.gz HAGZEQUXYYIVGY-NHCUHLMSSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)CC1 ZINC001207937127 1049959947 /nfs/dbraw/zinc/95/99/47/1049959947.db2.gz HAGZEQUXYYIVGY-LEWJYISDSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937127 1049959956 /nfs/dbraw/zinc/95/99/56/1049959956.db2.gz HAGZEQUXYYIVGY-LEWJYISDSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937127 1049959961 /nfs/dbraw/zinc/95/99/61/1049959961.db2.gz HAGZEQUXYYIVGY-LEWJYISDSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)CC1 ZINC001207942170 1049963984 /nfs/dbraw/zinc/96/39/84/1049963984.db2.gz VXQIBOWZPBXMAF-HBMCJLEFSA-N 2 1 316.533 4.343 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)CC1 ZINC001207942170 1049963992 /nfs/dbraw/zinc/96/39/92/1049963992.db2.gz VXQIBOWZPBXMAF-HBMCJLEFSA-N 2 1 316.533 4.343 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)CC1 ZINC001207942170 1049964008 /nfs/dbraw/zinc/96/40/08/1049964008.db2.gz VXQIBOWZPBXMAF-HBMCJLEFSA-N 2 1 316.533 4.343 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001208106077 1049973600 /nfs/dbraw/zinc/97/36/00/1049973600.db2.gz FJDZWXFVXGOWBL-SFHVURJKSA-N 2 1 304.453 4.085 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1CC1(C)CC[NH+](C)CC1 ZINC001208110173 1049973912 /nfs/dbraw/zinc/97/39/12/1049973912.db2.gz XFRPWWBTODIMJF-KRWDZBQOSA-N 2 1 318.530 4.277 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)CC1 ZINC001208113438 1049974167 /nfs/dbraw/zinc/97/41/67/1049974167.db2.gz INYLJRJUOAUOHW-ZDUSSCGKSA-N 2 1 312.910 4.270 20 0 DIADMP CC/C=C\CCCCC[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001208190838 1049983317 /nfs/dbraw/zinc/98/33/17/1049983317.db2.gz PMKSXVVSBKBSMP-PLNGDYQASA-N 2 1 315.505 4.455 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001208601907 1049997387 /nfs/dbraw/zinc/99/73/87/1049997387.db2.gz SMECOVCNXYGPHD-GOSISDBHSA-N 2 1 318.530 4.277 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)C(c2ccccc2)c2ccccc2)CC1 ZINC001208592776 1049997672 /nfs/dbraw/zinc/99/76/72/1049997672.db2.gz BROHFKWDJMPTHH-UHFFFAOYSA-N 2 1 322.496 4.440 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001208599408 1049997912 /nfs/dbraw/zinc/99/79/12/1049997912.db2.gz GWBZKUYJEFDCHB-LJQANCHMSA-N 2 1 304.453 4.085 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH+]2CCC(c3ccc4ccccc4c3)CC2)C1 ZINC001208610152 1049997936 /nfs/dbraw/zinc/99/79/36/1049997936.db2.gz YXGUZRNXUBVIKK-SFHVURJKSA-N 2 1 322.496 4.361 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC1 ZINC001208601925 1049998069 /nfs/dbraw/zinc/99/80/69/1049998069.db2.gz SZNDGYVMWDFCKK-HNNXBMFYSA-N 2 1 320.908 4.034 20 0 DIADMP c1cc(C[N@@H+]2CCC3(C2)CC[NH+](CCC2CCCC2)CC3)co1 ZINC001208694508 1050002275 /nfs/dbraw/zinc/00/22/75/1050002275.db2.gz YTBPOOCLWVFNQR-UHFFFAOYSA-N 2 1 316.489 4.148 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](CCC2CCCC2)CC1 ZINC001208695998 1050003245 /nfs/dbraw/zinc/00/32/45/1050003245.db2.gz IZDPZZPVIWMSOS-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](CCC2CCCC2)CC1 ZINC001208695998 1050003251 /nfs/dbraw/zinc/00/32/51/1050003251.db2.gz IZDPZZPVIWMSOS-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@H](C[N@@H+](C)CC1CC[NH+](C)CC1)c1cccc2ccccc21 ZINC001208720504 1050006211 /nfs/dbraw/zinc/00/62/11/1050006211.db2.gz YDRXULPQOMEWEI-QGZVFWFLSA-N 2 1 310.485 4.217 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)CC[N@@H+]1C ZINC000498353582 1050014954 /nfs/dbraw/zinc/01/49/54/1050014954.db2.gz MXWPZAVTOQPQHD-BTHPGYMESA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)CC[N@H+]1C ZINC000498353582 1050014958 /nfs/dbraw/zinc/01/49/58/1050014958.db2.gz MXWPZAVTOQPQHD-BTHPGYMESA-N 2 1 300.490 4.175 20 0 DIADMP Clc1cccc([C@H]2CC[N@@H+](C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC001168387729 1050023614 /nfs/dbraw/zinc/02/36/14/1050023614.db2.gz RPYGTSIYOFZCHC-KRWDZBQOSA-N 2 1 318.892 4.004 20 0 DIADMP Clc1cccc([C@H]2CC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC001168387729 1050023619 /nfs/dbraw/zinc/02/36/19/1050023619.db2.gz RPYGTSIYOFZCHC-KRWDZBQOSA-N 2 1 318.892 4.004 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168387722 1050024004 /nfs/dbraw/zinc/02/40/04/1050024004.db2.gz RBAPPLXEBQBTDA-UHFFFAOYSA-N 2 1 306.881 4.036 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)C1CC[NH+](CC2CC2)CC1 ZINC001168388251 1050024970 /nfs/dbraw/zinc/02/49/70/1050024970.db2.gz CWEFIEFNXRBDFK-UHFFFAOYSA-N 2 1 308.469 4.146 20 0 DIADMP C[C@@H]1CCC[N@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@H]1C ZINC001208935148 1050025134 /nfs/dbraw/zinc/02/51/34/1050025134.db2.gz INGFUMKCZXDROI-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@H]1C ZINC001208935148 1050025140 /nfs/dbraw/zinc/02/51/40/1050025140.db2.gz INGFUMKCZXDROI-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)[C@H]1C ZINC001208935148 1050025146 /nfs/dbraw/zinc/02/51/46/1050025146.db2.gz INGFUMKCZXDROI-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@H]1C ZINC001208935148 1050025153 /nfs/dbraw/zinc/02/51/53/1050025153.db2.gz INGFUMKCZXDROI-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929971 1050025973 /nfs/dbraw/zinc/02/59/73/1050025973.db2.gz XPQJXBBJAWEVEH-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929971 1050025978 /nfs/dbraw/zinc/02/59/78/1050025978.db2.gz XPQJXBBJAWEVEH-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929971 1050025983 /nfs/dbraw/zinc/02/59/83/1050025983.db2.gz XPQJXBBJAWEVEH-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929971 1050025989 /nfs/dbraw/zinc/02/59/89/1050025989.db2.gz XPQJXBBJAWEVEH-NSHGMRRFSA-N 2 1 300.490 4.162 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168388074 1050026071 /nfs/dbraw/zinc/02/60/71/1050026071.db2.gz AONQJYMNAWSDFW-IBGZPJMESA-N 2 1 318.892 4.351 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC[C@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208938164 1050026454 /nfs/dbraw/zinc/02/64/54/1050026454.db2.gz VIBFIHNOEMNUJX-PWRODBHTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CC[C@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208938164 1050026460 /nfs/dbraw/zinc/02/64/60/1050026460.db2.gz VIBFIHNOEMNUJX-PWRODBHTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CC[C@H]4CCC[C@@H]4C3)C2)cc1 ZINC001208938164 1050026466 /nfs/dbraw/zinc/02/64/66/1050026466.db2.gz VIBFIHNOEMNUJX-PWRODBHTSA-N 2 1 312.501 4.021 20 0 DIADMP CC(C)[C@H]1CCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947046 1050026511 /nfs/dbraw/zinc/02/65/11/1050026511.db2.gz YBWBMEBSVJGWFI-VQTJNVASSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947046 1050026518 /nfs/dbraw/zinc/02/65/18/1050026518.db2.gz YBWBMEBSVJGWFI-VQTJNVASSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208947046 1050026524 /nfs/dbraw/zinc/02/65/24/1050026524.db2.gz YBWBMEBSVJGWFI-VQTJNVASSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208947046 1050026529 /nfs/dbraw/zinc/02/65/29/1050026529.db2.gz YBWBMEBSVJGWFI-VQTJNVASSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CC[C@@H]4CCC[C@H]4C3)C2)cc1 ZINC001208938159 1050028218 /nfs/dbraw/zinc/02/82/18/1050028218.db2.gz VIBFIHNOEMNUJX-ACRUOGEOSA-N 2 1 312.501 4.021 20 0 DIADMP CC(C)[N@H+](CC1CC1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208937614 1050028172 /nfs/dbraw/zinc/02/81/72/1050028172.db2.gz USYWTPJBCVGCJI-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[N@@H+](CC1CC1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208937614 1050028179 /nfs/dbraw/zinc/02/81/79/1050028179.db2.gz USYWTPJBCVGCJI-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[NH+](CC1CC1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208937614 1050028184 /nfs/dbraw/zinc/02/81/84/1050028184.db2.gz USYWTPJBCVGCJI-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[NH+](CC1CC1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208937614 1050028189 /nfs/dbraw/zinc/02/81/89/1050028189.db2.gz USYWTPJBCVGCJI-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC[C@@H]4CCC[C@H]4C3)C2)cc1 ZINC001208938159 1050028213 /nfs/dbraw/zinc/02/82/13/1050028213.db2.gz VIBFIHNOEMNUJX-ACRUOGEOSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CC[C@@H]4CCC[C@H]4C3)C2)cc1 ZINC001208938159 1050028223 /nfs/dbraw/zinc/02/82/23/1050028223.db2.gz VIBFIHNOEMNUJX-ACRUOGEOSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@H]1C[N@@H+](C[C@@H]2CC[NH+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208945242 1050028315 /nfs/dbraw/zinc/02/83/15/1050028315.db2.gz BOEMXHYJNKKXSU-UYAOXDASSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1C[NH+](C[C@@H]2CC[N@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208945242 1050028319 /nfs/dbraw/zinc/02/83/19/1050028319.db2.gz BOEMXHYJNKKXSU-UYAOXDASSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1C[NH+](C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208945242 1050028323 /nfs/dbraw/zinc/02/83/23/1050028323.db2.gz BOEMXHYJNKKXSU-UYAOXDASSA-N 2 1 320.480 4.128 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208938324 1050028650 /nfs/dbraw/zinc/02/86/50/1050028650.db2.gz ASZZZTXZUVEMMF-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H]1CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208938324 1050028657 /nfs/dbraw/zinc/02/86/57/1050028657.db2.gz ASZZZTXZUVEMMF-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H]1CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208938324 1050028663 /nfs/dbraw/zinc/02/86/63/1050028663.db2.gz ASZZZTXZUVEMMF-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC001208957151 1050029080 /nfs/dbraw/zinc/02/90/80/1050029080.db2.gz CXPYIFJQYJSNQN-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208957151 1050029087 /nfs/dbraw/zinc/02/90/87/1050029087.db2.gz CXPYIFJQYJSNQN-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208957151 1050029093 /nfs/dbraw/zinc/02/90/93/1050029093.db2.gz CXPYIFJQYJSNQN-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168393114 1050055034 /nfs/dbraw/zinc/05/50/34/1050055034.db2.gz WASMILDZIGHJFI-IBGZPJMESA-N 2 1 318.892 4.351 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168393114 1050055039 /nfs/dbraw/zinc/05/50/39/1050055039.db2.gz WASMILDZIGHJFI-IBGZPJMESA-N 2 1 318.892 4.351 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+](CCC[NH+]2CCCCC2)C1 ZINC001209449146 1050060402 /nfs/dbraw/zinc/06/04/02/1050060402.db2.gz UVEQFUKPLDXVPK-MRXNPFEDSA-N 2 1 306.881 4.005 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001209449146 1050060406 /nfs/dbraw/zinc/06/04/06/1050060406.db2.gz UVEQFUKPLDXVPK-MRXNPFEDSA-N 2 1 306.881 4.005 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2CCC[NH+]2CCCCC2)cc1 ZINC001209451042 1050061227 /nfs/dbraw/zinc/06/12/27/1050061227.db2.gz RNSDOTIPMVDILR-HXUWFJFHSA-N 2 1 316.489 4.098 20 0 DIADMP c1cc2ccc(C[NH+]3CCC4(CCC[N@H+]4CC4CC4)CC3)cc2[nH]1 ZINC001209509477 1050064408 /nfs/dbraw/zinc/06/44/08/1050064408.db2.gz BUAFHQBTRCKTCC-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP c1cc2ccc(C[NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)cc2[nH]1 ZINC001209509477 1050064414 /nfs/dbraw/zinc/06/44/14/1050064414.db2.gz BUAFHQBTRCKTCC-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP CC(C)[N@@H+](Cc1cc2cc(Cl)ccc2[nH]1)C1CCN(C)CC1 ZINC001209727229 1050078907 /nfs/dbraw/zinc/07/89/07/1050078907.db2.gz XZAUAOIWVMUPDB-UHFFFAOYSA-N 2 1 319.880 4.126 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H](C)CCc2ccccc2)CC1 ZINC000590786887 1050106815 /nfs/dbraw/zinc/10/68/15/1050106815.db2.gz IVHAQPSQSYALAL-GOSISDBHSA-N 2 1 302.506 4.060 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@@H]2CCc3c(Cl)cccc3C2)C1 ZINC001171032583 1050156078 /nfs/dbraw/zinc/15/60/78/1050156078.db2.gz GSHGYKWFUZERPF-DOTOQJQBSA-N 2 1 320.908 4.038 20 0 DIADMP CSC1(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)CC1 ZINC000347946620 1050162847 /nfs/dbraw/zinc/16/28/47/1050162847.db2.gz SBWOVKVCJPKFTL-INIZCTEOSA-N 2 1 318.530 4.046 20 0 DIADMP CCCC[C@H](COC)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348033544 1050171987 /nfs/dbraw/zinc/17/19/87/1050171987.db2.gz ARGLXVYLXCBJHD-MAUKXSAKSA-N 2 1 315.461 4.037 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)CC[NH2+]1 ZINC001210496369 1050267223 /nfs/dbraw/zinc/26/72/23/1050267223.db2.gz GWPFAXZDOGXSSF-AWEZNQCLSA-N 2 1 310.466 4.238 20 0 DIADMP CC[NH+](CC)c1ccc(NC2=CC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC001210707474 1050342264 /nfs/dbraw/zinc/34/22/64/1050342264.db2.gz BHKQUVKGUFSSLJ-HXUWFJFHSA-N 2 1 313.489 4.477 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(NC2=CC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC001210713968 1050345379 /nfs/dbraw/zinc/34/53/79/1050345379.db2.gz HTPHUGKDBKKAGX-LJQANCHMSA-N 2 1 322.456 4.125 20 0 DIADMP [NH3+]CCCCCCC[N@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000844220662 1050372016 /nfs/dbraw/zinc/37/20/16/1050372016.db2.gz JCKAETIKKIXXRN-INIZCTEOSA-N 2 1 317.502 4.342 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000738312746 1050529873 /nfs/dbraw/zinc/52/98/73/1050529873.db2.gz VQTQHEJQZLNLIT-GFCCVEGCSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000738312353 1050530431 /nfs/dbraw/zinc/53/04/31/1050530431.db2.gz QVTQYYBGJHPWJB-GFCCVEGCSA-N 2 1 315.288 4.328 20 0 DIADMP COc1ccccc1C1([NH3+])CC[NH+]([C@@H](C)CCCC(C)C)CC1 ZINC001170070334 1050569183 /nfs/dbraw/zinc/56/91/83/1050569183.db2.gz DELIILJQHJNWOA-KRWDZBQOSA-N 2 1 318.505 4.160 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(-c2ccccc2)cn1 ZINC000845941154 1050636576 /nfs/dbraw/zinc/63/65/76/1050636576.db2.gz CSKXNQJTMCATGP-FFZOFVMBSA-N 2 1 323.484 4.272 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@@H+]1C ZINC000575171825 1050651573 /nfs/dbraw/zinc/65/15/73/1050651573.db2.gz JFXVCUOPEDQEQM-FXAWDEMLSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@H+]1C ZINC000575171825 1050651583 /nfs/dbraw/zinc/65/15/83/1050651583.db2.gz JFXVCUOPEDQEQM-FXAWDEMLSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171825 1050651590 /nfs/dbraw/zinc/65/15/90/1050651590.db2.gz JFXVCUOPEDQEQM-FXAWDEMLSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171825 1050651601 /nfs/dbraw/zinc/65/16/01/1050651601.db2.gz JFXVCUOPEDQEQM-FXAWDEMLSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001170109369 1050839226 /nfs/dbraw/zinc/83/92/26/1050839226.db2.gz OJXJARCTJQSDJW-LIMACUPBSA-N 2 1 312.501 4.303 20 0 DIADMP C[C@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170121081 1050887220 /nfs/dbraw/zinc/88/72/20/1050887220.db2.gz KZVKYUOQXOVFSP-UDTPNQRGSA-N 2 1 304.453 4.086 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000348218001 1051003741 /nfs/dbraw/zinc/00/37/41/1051003741.db2.gz FLRKTLWCZYPEPH-IBGZPJMESA-N 2 1 315.436 4.338 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000348218001 1051003754 /nfs/dbraw/zinc/00/37/54/1051003754.db2.gz FLRKTLWCZYPEPH-IBGZPJMESA-N 2 1 315.436 4.338 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000348199412 1051005814 /nfs/dbraw/zinc/00/58/14/1051005814.db2.gz CGMBWTGSQMLPKY-BEFAXECRSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000348199412 1051005829 /nfs/dbraw/zinc/00/58/29/1051005829.db2.gz CGMBWTGSQMLPKY-BEFAXECRSA-N 2 1 315.436 4.194 20 0 DIADMP C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001170158334 1051072145 /nfs/dbraw/zinc/07/21/45/1051072145.db2.gz NTXAKTYCLNRZIN-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158334 1051072152 /nfs/dbraw/zinc/07/21/52/1051072152.db2.gz NTXAKTYCLNRZIN-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158334 1051072161 /nfs/dbraw/zinc/07/21/61/1051072161.db2.gz NTXAKTYCLNRZIN-NRSPTQNISA-N 2 1 312.501 4.163 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(CC(C)C)cc2)C1 ZINC000743862904 1051083537 /nfs/dbraw/zinc/08/35/37/1051083537.db2.gz MUAFXQSCZPMKRG-FQEVSTJZSA-N 2 1 302.506 4.049 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(CC(C)C)cc2)C1 ZINC000743862904 1051083543 /nfs/dbraw/zinc/08/35/43/1051083543.db2.gz MUAFXQSCZPMKRG-FQEVSTJZSA-N 2 1 302.506 4.049 20 0 DIADMP CC(C)C[C@@H](C)C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170204965 1051150194 /nfs/dbraw/zinc/15/01/94/1051150194.db2.gz HDJVBILWTHEMFL-TZIWHRDSSA-N 2 1 314.517 4.267 20 0 DIADMP Cc1cccc(C2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)c1 ZINC001171630294 1051174503 /nfs/dbraw/zinc/17/45/03/1051174503.db2.gz LPRMPRGZDBYFNO-UHFFFAOYSA-N 2 1 300.490 4.225 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2cc(F)cc(Cl)c2)CC1(C)C ZINC001171613957 1051177312 /nfs/dbraw/zinc/17/73/12/1051177312.db2.gz RZMAQHLIBHNMGH-UHFFFAOYSA-N 2 1 312.860 4.220 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2csc(Cl)c2)CC1(C)C ZINC001171623556 1051180232 /nfs/dbraw/zinc/18/02/32/1051180232.db2.gz CAIAMODSDDXIPM-UHFFFAOYSA-N 2 1 300.899 4.143 20 0 DIADMP Cc1cccnc1[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)C1CC1 ZINC001171623437 1051180355 /nfs/dbraw/zinc/18/03/55/1051180355.db2.gz YRPRWIPADGJZAQ-GOSISDBHSA-N 2 1 315.505 4.082 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]C(C)(C)c2ccccc2F)CC1(C)C ZINC001171625742 1051181660 /nfs/dbraw/zinc/18/16/60/1051181660.db2.gz NEUUCVKRQIQLJB-UHFFFAOYSA-N 2 1 306.469 4.302 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+]2CCc3cc(Cl)ccc3C2)CC1(C)C ZINC001171639569 1051195155 /nfs/dbraw/zinc/19/51/55/1051195155.db2.gz PHSYBOGGMZWTOP-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCc3cc(Cl)ccc3C2)CC1(C)C ZINC001171639569 1051195162 /nfs/dbraw/zinc/19/51/62/1051195162.db2.gz PHSYBOGGMZWTOP-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP CC[N@H+](Cc1ccccc1F)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171641122 1051196373 /nfs/dbraw/zinc/19/63/73/1051196373.db2.gz CZNLXSKQOPDMHD-UHFFFAOYSA-N 2 1 306.469 4.299 20 0 DIADMP CC[N@@H+](Cc1ccccc1F)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171641122 1051196379 /nfs/dbraw/zinc/19/63/79/1051196379.db2.gz CZNLXSKQOPDMHD-UHFFFAOYSA-N 2 1 306.469 4.299 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)cn1 ZINC001171643067 1051198040 /nfs/dbraw/zinc/19/80/40/1051198040.db2.gz RIDZJYDTZVZKGZ-SFHVURJKSA-N 2 1 315.505 4.178 20 0 DIADMP CCC(CC)[N@@H+]([C@@H]1Cc2cccc(F)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001171786164 1051219800 /nfs/dbraw/zinc/21/98/00/1051219800.db2.gz XNOFFGFQPGNBNG-KBAYOESNSA-N 2 1 318.480 4.053 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@]1(C)Cc1ccccc1Cl ZINC001171900113 1051236988 /nfs/dbraw/zinc/23/69/88/1051236988.db2.gz HIIQSNAMORKZSY-MJGOQNOKSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@@]1(C)Cc1ccccc1Cl ZINC001171900113 1051237001 /nfs/dbraw/zinc/23/70/01/1051237001.db2.gz HIIQSNAMORKZSY-MJGOQNOKSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@@]1(C)Cc1ccccc1Cl ZINC001171900113 1051237012 /nfs/dbraw/zinc/23/70/12/1051237012.db2.gz HIIQSNAMORKZSY-MJGOQNOKSA-N 2 1 320.908 4.221 20 0 DIADMP CC1(C)C[C@H]([NH2+]C[C@@H]2CCC[C@H]2F)CC[N@H+]1Cc1ccccc1 ZINC001171961743 1051245389 /nfs/dbraw/zinc/24/53/89/1051245389.db2.gz BBCUVCXCPTWZOJ-IPMKNSEASA-N 2 1 318.480 4.157 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171963051 1051246821 /nfs/dbraw/zinc/24/68/21/1051246821.db2.gz GOKQBUKJHSDXPM-IRXDYDNUSA-N 2 1 322.443 4.207 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171966190 1051248899 /nfs/dbraw/zinc/24/88/99/1051248899.db2.gz TULBMFOYHZKWCQ-IBGZPJMESA-N 2 1 300.490 4.352 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171989120 1051256116 /nfs/dbraw/zinc/25/61/16/1051256116.db2.gz YFIUPZSJRZUDOQ-LJQANCHMSA-N 2 1 312.501 4.306 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001171989120 1051256129 /nfs/dbraw/zinc/25/61/29/1051256129.db2.gz YFIUPZSJRZUDOQ-LJQANCHMSA-N 2 1 312.501 4.306 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001171989120 1051256138 /nfs/dbraw/zinc/25/61/38/1051256138.db2.gz YFIUPZSJRZUDOQ-LJQANCHMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976343 1051263921 /nfs/dbraw/zinc/26/39/21/1051263921.db2.gz KEPOPQUBXSUUFD-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976343 1051263930 /nfs/dbraw/zinc/26/39/30/1051263930.db2.gz KEPOPQUBXSUUFD-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976343 1051263938 /nfs/dbraw/zinc/26/39/38/1051263938.db2.gz KEPOPQUBXSUUFD-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976343 1051263948 /nfs/dbraw/zinc/26/39/48/1051263948.db2.gz KEPOPQUBXSUUFD-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980117 1051266680 /nfs/dbraw/zinc/26/66/80/1051266680.db2.gz SMTRHKPVDBRZPY-BWPNAZKDSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C1CCC1 ZINC001171981213 1051266927 /nfs/dbraw/zinc/26/69/27/1051266927.db2.gz ZSGCLMVDMLDZOV-APWZRJJASA-N 2 1 300.490 4.208 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171978370 1051267170 /nfs/dbraw/zinc/26/71/70/1051267170.db2.gz YIVUIMKPUBSBOD-QGZVFWFLSA-N 2 1 322.443 4.161 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978370 1051267183 /nfs/dbraw/zinc/26/71/83/1051267183.db2.gz YIVUIMKPUBSBOD-QGZVFWFLSA-N 2 1 322.443 4.161 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984696 1051267863 /nfs/dbraw/zinc/26/78/63/1051267863.db2.gz XQRCSZRQXAGCIV-QGZVFWFLSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@]1(CF)CC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977997 1051268975 /nfs/dbraw/zinc/26/89/75/1051268975.db2.gz VQUVWKHEDGEYQG-AZUAARDMSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@]1(CF)CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977997 1051268984 /nfs/dbraw/zinc/26/89/84/1051268984.db2.gz VQUVWKHEDGEYQG-AZUAARDMSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@]1(CF)CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977997 1051268995 /nfs/dbraw/zinc/26/89/95/1051268995.db2.gz VQUVWKHEDGEYQG-AZUAARDMSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@@]1(CF)CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978005 1051269583 /nfs/dbraw/zinc/26/95/83/1051269583.db2.gz VQUVWKHEDGEYQG-QUCCMNQESA-N 2 1 318.480 4.111 20 0 DIADMP C[C@@]1(CF)CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978005 1051269586 /nfs/dbraw/zinc/26/95/86/1051269586.db2.gz VQUVWKHEDGEYQG-QUCCMNQESA-N 2 1 318.480 4.111 20 0 DIADMP C[C@@]1(CF)CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978005 1051269591 /nfs/dbraw/zinc/26/95/91/1051269591.db2.gz VQUVWKHEDGEYQG-QUCCMNQESA-N 2 1 318.480 4.111 20 0 DIADMP C[N@H+](C1CCCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074911 1051275144 /nfs/dbraw/zinc/27/51/44/1051275144.db2.gz MSWJHUQVIDXBLO-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@@H+](C1CCCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074911 1051275150 /nfs/dbraw/zinc/27/51/50/1051275150.db2.gz MSWJHUQVIDXBLO-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172074911 1051275159 /nfs/dbraw/zinc/27/51/59/1051275159.db2.gz MSWJHUQVIDXBLO-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172074911 1051275165 /nfs/dbraw/zinc/27/51/65/1051275165.db2.gz MSWJHUQVIDXBLO-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCCC24CC4)C3)cc1 ZINC001172079206 1051278501 /nfs/dbraw/zinc/27/85/01/1051278501.db2.gz MUSFWLXLQQBXPW-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCCC24CC4)C3)cc1 ZINC001172079206 1051278508 /nfs/dbraw/zinc/27/85/08/1051278508.db2.gz MUSFWLXLQQBXPW-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2CCCC24CC4)C3)cc1 ZINC001172079206 1051278519 /nfs/dbraw/zinc/27/85/19/1051278519.db2.gz MUSFWLXLQQBXPW-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2CCCC24CC4)C3)cc1 ZINC001172079206 1051278526 /nfs/dbraw/zinc/27/85/26/1051278526.db2.gz MUSFWLXLQQBXPW-PMOLBWCYSA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC[C@@H]4C[C@@H]42)C3)cc1 ZINC001172081348 1051278900 /nfs/dbraw/zinc/27/89/00/1051278900.db2.gz CBMRRWPKGULULD-MJCUULBUSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC[C@@H]4C[C@@H]42)C3)cc1 ZINC001172081348 1051278915 /nfs/dbraw/zinc/27/89/15/1051278915.db2.gz CBMRRWPKGULULD-MJCUULBUSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2CCC[C@@H]4C[C@@H]42)C3)cc1 ZINC001172081348 1051278925 /nfs/dbraw/zinc/27/89/25/1051278925.db2.gz CBMRRWPKGULULD-MJCUULBUSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2CCC[C@@H]4C[C@@H]42)C3)cc1 ZINC001172081348 1051278935 /nfs/dbraw/zinc/27/89/35/1051278935.db2.gz CBMRRWPKGULULD-MJCUULBUSA-N 2 1 310.485 4.056 20 0 DIADMP CC[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172089854 1051281455 /nfs/dbraw/zinc/28/14/55/1051281455.db2.gz SNMPDDYXUUGJAI-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172089854 1051281465 /nfs/dbraw/zinc/28/14/65/1051281465.db2.gz SNMPDDYXUUGJAI-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172089854 1051281476 /nfs/dbraw/zinc/28/14/76/1051281476.db2.gz SNMPDDYXUUGJAI-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172089854 1051281485 /nfs/dbraw/zinc/28/14/85/1051281485.db2.gz SNMPDDYXUUGJAI-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172089858 1051282468 /nfs/dbraw/zinc/28/24/68/1051282468.db2.gz SNMPDDYXUUGJAI-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172089858 1051282480 /nfs/dbraw/zinc/28/24/80/1051282480.db2.gz SNMPDDYXUUGJAI-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172089858 1051282495 /nfs/dbraw/zinc/28/24/95/1051282495.db2.gz SNMPDDYXUUGJAI-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172089858 1051282512 /nfs/dbraw/zinc/28/25/12/1051282512.db2.gz SNMPDDYXUUGJAI-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP FC1(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC001172064624 1051283956 /nfs/dbraw/zinc/28/39/56/1051283956.db2.gz DOUFCHFWOVCWJX-LDLYASANSA-N 2 1 316.464 4.054 20 0 DIADMP CC[C@@H](C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067746 1051284803 /nfs/dbraw/zinc/28/48/03/1051284803.db2.gz NQNGWZULUXCUFY-AFYVEPGGSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CC1 ZINC001172063746 1051284918 /nfs/dbraw/zinc/28/49/18/1051284918.db2.gz CGHYWRQHVMHPIU-ACDBMABISA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC001172063746 1051284924 /nfs/dbraw/zinc/28/49/24/1051284924.db2.gz CGHYWRQHVMHPIU-ACDBMABISA-N 2 1 312.501 4.350 20 0 DIADMP CC1CC(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172064086 1051285175 /nfs/dbraw/zinc/28/51/75/1051285175.db2.gz FLCOESMCVYEUCA-LCXRTDQJSA-N 2 1 312.501 4.208 20 0 DIADMP F[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172064075 1051285945 /nfs/dbraw/zinc/28/59/45/1051285945.db2.gz FJAJGYMDJPZGPF-IVDHNXQLSA-N 2 1 316.464 4.052 20 0 DIADMP CCCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172068368 1051287340 /nfs/dbraw/zinc/28/73/40/1051287340.db2.gz QKIUXWHZYVYMPY-ACDBMABISA-N 2 1 300.490 4.352 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCC4(CC4)C2)C3)cc1 ZINC001172069052 1051288884 /nfs/dbraw/zinc/28/88/84/1051288884.db2.gz NNARFGFQAPJSGY-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCC4(CC4)C2)C3)cc1 ZINC001172069052 1051288894 /nfs/dbraw/zinc/28/88/94/1051288894.db2.gz NNARFGFQAPJSGY-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@@H+]2CCC4(CC4)C2)C3)cc1 ZINC001172069052 1051288897 /nfs/dbraw/zinc/28/88/97/1051288897.db2.gz NNARFGFQAPJSGY-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@H+]2CCC4(CC4)C2)C3)cc1 ZINC001172069052 1051288903 /nfs/dbraw/zinc/28/89/03/1051288903.db2.gz NNARFGFQAPJSGY-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP CC[N@H+](Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127920 1051290269 /nfs/dbraw/zinc/29/02/69/1051290269.db2.gz LQRMDNUAKBKHAE-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127920 1051290283 /nfs/dbraw/zinc/29/02/83/1051290283.db2.gz LQRMDNUAKBKHAE-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172127920 1051290296 /nfs/dbraw/zinc/29/02/96/1051290296.db2.gz LQRMDNUAKBKHAE-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1ccc(Cl)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172127920 1051290309 /nfs/dbraw/zinc/29/03/09/1051290309.db2.gz LQRMDNUAKBKHAE-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC4(CC4)C2)C3)cc1 ZINC001172069053 1051290400 /nfs/dbraw/zinc/29/04/00/1051290400.db2.gz NNARFGFQAPJSGY-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC4(CC4)C2)C3)cc1 ZINC001172069053 1051290417 /nfs/dbraw/zinc/29/04/17/1051290417.db2.gz NNARFGFQAPJSGY-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2CCC4(CC4)C2)C3)cc1 ZINC001172069053 1051290434 /nfs/dbraw/zinc/29/04/34/1051290434.db2.gz NNARFGFQAPJSGY-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2CCC4(CC4)C2)C3)cc1 ZINC001172069053 1051290447 /nfs/dbraw/zinc/29/04/47/1051290447.db2.gz NNARFGFQAPJSGY-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172131090 1051291345 /nfs/dbraw/zinc/29/13/45/1051291345.db2.gz UPOBFHDZRZAJQJ-BQJUDKOJSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[NH+]2[C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172131090 1051291353 /nfs/dbraw/zinc/29/13/53/1051291353.db2.gz UPOBFHDZRZAJQJ-BQJUDKOJSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172131090 1051291360 /nfs/dbraw/zinc/29/13/60/1051291360.db2.gz UPOBFHDZRZAJQJ-BQJUDKOJSA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172131090 1051291372 /nfs/dbraw/zinc/29/13/72/1051291372.db2.gz UPOBFHDZRZAJQJ-BQJUDKOJSA-N 2 1 312.501 4.456 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131096 1051291709 /nfs/dbraw/zinc/29/17/09/1051291709.db2.gz UWTBAPNXPYXKQV-CAOSSQGBSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131096 1051291720 /nfs/dbraw/zinc/29/17/20/1051291720.db2.gz UWTBAPNXPYXKQV-CAOSSQGBSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131096 1051291727 /nfs/dbraw/zinc/29/17/27/1051291727.db2.gz UWTBAPNXPYXKQV-CAOSSQGBSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131096 1051291738 /nfs/dbraw/zinc/29/17/38/1051291738.db2.gz UWTBAPNXPYXKQV-CAOSSQGBSA-N 2 1 306.881 4.348 20 0 DIADMP CC[N@H+](Cc1ccc(C)c(C)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131968 1051292308 /nfs/dbraw/zinc/29/23/08/1051292308.db2.gz ZVDBSIJRBQFVFF-PMOLBWCYSA-N 2 1 300.490 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131968 1051292324 /nfs/dbraw/zinc/29/23/24/1051292324.db2.gz ZVDBSIJRBQFVFF-PMOLBWCYSA-N 2 1 300.490 4.141 20 0 DIADMP CC[NH+](Cc1ccc(C)c(C)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131968 1051292338 /nfs/dbraw/zinc/29/23/38/1051292338.db2.gz ZVDBSIJRBQFVFF-PMOLBWCYSA-N 2 1 300.490 4.141 20 0 DIADMP CC[NH+](Cc1ccc(C)c(C)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131968 1051292352 /nfs/dbraw/zinc/29/23/52/1051292352.db2.gz ZVDBSIJRBQFVFF-PMOLBWCYSA-N 2 1 300.490 4.141 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3)CCCCC1)C2 ZINC001172106883 1051295167 /nfs/dbraw/zinc/29/51/67/1051295167.db2.gz QSZXWKVHUHLKAO-ACDBMABISA-N 2 1 312.501 4.451 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3)CCCCC1)C2 ZINC001172106883 1051295172 /nfs/dbraw/zinc/29/51/72/1051295172.db2.gz QSZXWKVHUHLKAO-ACDBMABISA-N 2 1 312.501 4.451 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(Cl)c1F ZINC001172101532 1051295197 /nfs/dbraw/zinc/29/51/97/1051295197.db2.gz ZJGSXKRZQWYIOI-YIYPIFLZSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1F ZINC001172101532 1051295205 /nfs/dbraw/zinc/29/52/05/1051295205.db2.gz ZJGSXKRZQWYIOI-YIYPIFLZSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(Cl)c1F ZINC001172101530 1051296456 /nfs/dbraw/zinc/29/64/56/1051296456.db2.gz ZJGSXKRZQWYIOI-SYQHCUMBSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1F ZINC001172101530 1051296467 /nfs/dbraw/zinc/29/64/67/1051296467.db2.gz ZJGSXKRZQWYIOI-SYQHCUMBSA-N 2 1 310.844 4.145 20 0 DIADMP CCC(CC)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001172108695 1051298425 /nfs/dbraw/zinc/29/84/25/1051298425.db2.gz YGVUTJWEFLZDFK-LDLYASANSA-N 2 1 300.490 4.307 20 0 DIADMP CCC(CC)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001172108695 1051298438 /nfs/dbraw/zinc/29/84/38/1051298438.db2.gz YGVUTJWEFLZDFK-LDLYASANSA-N 2 1 300.490 4.307 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112456 1051299722 /nfs/dbraw/zinc/29/97/22/1051299722.db2.gz XCUDCSBLPPZMEG-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112456 1051299737 /nfs/dbraw/zinc/29/97/37/1051299737.db2.gz XCUDCSBLPPZMEG-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(C)ccc1C ZINC001172111580 1051299883 /nfs/dbraw/zinc/29/98/83/1051299883.db2.gz VQKABOZXUPHRNZ-FTEYMNFISA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(C)ccc1C ZINC001172111580 1051299892 /nfs/dbraw/zinc/29/98/92/1051299892.db2.gz VQKABOZXUPHRNZ-FTEYMNFISA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)ccc1F ZINC001172112105 1051300568 /nfs/dbraw/zinc/30/05/68/1051300568.db2.gz TUFBIKZMWYSOLD-AFIMGQEJSA-N 2 1 308.416 4.021 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110081 1051300942 /nfs/dbraw/zinc/30/09/42/1051300942.db2.gz JSSHOBOMICYOJV-BKEDOTJMSA-N 2 1 318.892 4.322 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110081 1051300956 /nfs/dbraw/zinc/30/09/56/1051300956.db2.gz JSSHOBOMICYOJV-BKEDOTJMSA-N 2 1 318.892 4.322 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(Cl)c1 ZINC001172109707 1051301089 /nfs/dbraw/zinc/30/10/89/1051301089.db2.gz KDHRIRHWBBDOLK-XMTFNYHQSA-N 2 1 306.881 4.396 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1 ZINC001172109707 1051301098 /nfs/dbraw/zinc/30/10/98/1051301098.db2.gz KDHRIRHWBBDOLK-XMTFNYHQSA-N 2 1 306.881 4.396 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C)c1C ZINC001172110428 1051301233 /nfs/dbraw/zinc/30/12/33/1051301233.db2.gz MTWQFCQNIOTTTG-AJYBTWMASA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1C ZINC001172110428 1051301238 /nfs/dbraw/zinc/30/12/38/1051301238.db2.gz MTWQFCQNIOTTTG-AJYBTWMASA-N 2 1 300.490 4.359 20 0 DIADMP CCc1ccc([C@@H](CC)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172111880 1051302313 /nfs/dbraw/zinc/30/23/13/1051302313.db2.gz XTMQMFBXYASQEA-YSTOQKLRSA-N 2 1 300.490 4.305 20 0 DIADMP CCc1ccc([C@@H](CC)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172111880 1051302321 /nfs/dbraw/zinc/30/23/21/1051302321.db2.gz XTMQMFBXYASQEA-YSTOQKLRSA-N 2 1 300.490 4.305 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001172108815 1051302451 /nfs/dbraw/zinc/30/24/51/1051302451.db2.gz ZRAXRQNGIVUPCO-YSTOQKLRSA-N 2 1 300.490 4.379 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001172108815 1051302456 /nfs/dbraw/zinc/30/24/56/1051302456.db2.gz ZRAXRQNGIVUPCO-YSTOQKLRSA-N 2 1 300.490 4.379 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc(Cl)c3)CCC1)C2 ZINC001172115094 1051304195 /nfs/dbraw/zinc/30/41/95/1051304195.db2.gz QRHATJUTVAUESX-BCDXTJNWSA-N 2 1 318.892 4.324 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3cccc(Cl)c3)CCC1)C2 ZINC001172115094 1051304211 /nfs/dbraw/zinc/30/42/11/1051304211.db2.gz QRHATJUTVAUESX-BCDXTJNWSA-N 2 1 318.892 4.324 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001172121769 1051305252 /nfs/dbraw/zinc/30/52/52/1051305252.db2.gz MGGAPLGWWWAIRE-YDZRNGNQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001172121769 1051305262 /nfs/dbraw/zinc/30/52/62/1051305262.db2.gz MGGAPLGWWWAIRE-YDZRNGNQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001172121769 1051305270 /nfs/dbraw/zinc/30/52/70/1051305270.db2.gz MGGAPLGWWWAIRE-YDZRNGNQSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115694 1051305590 /nfs/dbraw/zinc/30/55/90/1051305590.db2.gz YXVVMKOTBFORRJ-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115694 1051305600 /nfs/dbraw/zinc/30/56/00/1051305600.db2.gz YXVVMKOTBFORRJ-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115694 1051305612 /nfs/dbraw/zinc/30/56/12/1051305612.db2.gz YXVVMKOTBFORRJ-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+](Cc1ccccc1)C(C)(C)C)C2 ZINC001172115694 1051305623 /nfs/dbraw/zinc/30/56/23/1051305623.db2.gz YXVVMKOTBFORRJ-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1[C@@H]3CC[C@@H](C3)[C@H]1c1ccccc1)C2 ZINC001172119011 1051305668 /nfs/dbraw/zinc/30/56/68/1051305668.db2.gz UXJNYZVXIFZMQN-JKJPFATMSA-N 2 1 324.512 4.174 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1[C@@H]3CC[C@@H](C3)[C@H]1c1ccccc1)C2 ZINC001172119011 1051305679 /nfs/dbraw/zinc/30/56/79/1051305679.db2.gz UXJNYZVXIFZMQN-JKJPFATMSA-N 2 1 324.512 4.174 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1Cl ZINC001172116996 1051306227 /nfs/dbraw/zinc/30/62/27/1051306227.db2.gz JRVNFUPAAMOYJX-AFIMGQEJSA-N 2 1 306.881 4.396 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001172121767 1051306441 /nfs/dbraw/zinc/30/64/41/1051306441.db2.gz MGGAPLGWWWAIRE-MANSERQUSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001172121767 1051306451 /nfs/dbraw/zinc/30/64/51/1051306451.db2.gz MGGAPLGWWWAIRE-MANSERQUSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001172121767 1051306460 /nfs/dbraw/zinc/30/64/60/1051306460.db2.gz MGGAPLGWWWAIRE-MANSERQUSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120181 1051306759 /nfs/dbraw/zinc/30/67/59/1051306759.db2.gz ACOFIOWAGBQKSZ-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120181 1051306763 /nfs/dbraw/zinc/30/67/63/1051306763.db2.gz ACOFIOWAGBQKSZ-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120181 1051306766 /nfs/dbraw/zinc/30/67/66/1051306766.db2.gz ACOFIOWAGBQKSZ-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@@H](c3cccc(Cl)c3)C1)C2 ZINC001172120181 1051306773 /nfs/dbraw/zinc/30/67/73/1051306773.db2.gz ACOFIOWAGBQKSZ-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c([C@@H]3CCC[NH2+]3)cc3ccccc31)C2 ZINC001172124303 1051306838 /nfs/dbraw/zinc/30/68/38/1051306838.db2.gz KNJSVMBLLARBFS-RDGPPVDQSA-N 2 1 323.484 4.254 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120269 1051306932 /nfs/dbraw/zinc/30/69/32/1051306932.db2.gz CEHVPUIIPBXLEG-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120269 1051306946 /nfs/dbraw/zinc/30/69/46/1051306946.db2.gz CEHVPUIIPBXLEG-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120269 1051306949 /nfs/dbraw/zinc/30/69/49/1051306949.db2.gz CEHVPUIIPBXLEG-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120269 1051306953 /nfs/dbraw/zinc/30/69/53/1051306953.db2.gz CEHVPUIIPBXLEG-OQIJWPOYSA-N 2 1 318.892 4.145 20 0 DIADMP COCCC[NH+]1CCC([N@H+](C)C2CCC(C(C)(C)C)CC2)CC1 ZINC001172253395 1051329771 /nfs/dbraw/zinc/32/97/71/1051329771.db2.gz ODRNWCHVQNYKGW-UHFFFAOYSA-N 2 1 324.553 4.024 20 0 DIADMP COCCC[NH+]1CCC([N@@H+](C)C2CCC(C(C)(C)C)CC2)CC1 ZINC001172253395 1051329782 /nfs/dbraw/zinc/32/97/82/1051329782.db2.gz ODRNWCHVQNYKGW-UHFFFAOYSA-N 2 1 324.553 4.024 20 0 DIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334467 1051358660 /nfs/dbraw/zinc/35/86/60/1051358660.db2.gz MLOMUUMUZUBSHP-HNJRGHQBSA-N 2 1 324.553 4.342 20 0 DIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172337929 1051360324 /nfs/dbraw/zinc/36/03/24/1051360324.db2.gz XHSOSRNUNZGLLD-DMUMMCEESA-N 2 1 324.553 4.485 20 0 DIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338539 1051360628 /nfs/dbraw/zinc/36/06/28/1051360628.db2.gz ZADRAMOMJLNGBD-DWRORGKVSA-N 2 1 310.526 4.095 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000380956182 1051366067 /nfs/dbraw/zinc/36/60/67/1051366067.db2.gz UOYIRPGFNPCJIP-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)C([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000381827231 1051373834 /nfs/dbraw/zinc/37/38/34/1051373834.db2.gz HROFUUAYODSIEQ-PKOBYXMFSA-N 2 1 302.506 4.167 20 0 DIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001172362239 1051373830 /nfs/dbraw/zinc/37/38/30/1051373830.db2.gz SBIJLVISTICIPK-QZTJIDSGSA-N 2 1 324.553 4.309 20 0 DIADMP CC[C@@H](CC(C)C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001172401492 1051400450 /nfs/dbraw/zinc/40/04/50/1051400450.db2.gz ZNJYIEYLYPTCBN-IBGZPJMESA-N 2 1 318.505 4.392 20 0 DIADMP CC(C)COCC[C@@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172466056 1051414983 /nfs/dbraw/zinc/41/49/83/1051414983.db2.gz ACSNGFHMTJWOAJ-QWFCFKBJSA-N 2 1 324.553 4.342 20 0 DIADMP CC(C)COCC[C@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172466054 1051415002 /nfs/dbraw/zinc/41/50/02/1051415002.db2.gz ACSNGFHMTJWOAJ-BJLQDIEVSA-N 2 1 324.553 4.342 20 0 DIADMP c1[nH+]cn([C@@H]2CCC[C@@H](c3ccccc3)C2)c1C1CC[NH2+]CC1 ZINC001172549350 1051432374 /nfs/dbraw/zinc/43/23/74/1051432374.db2.gz OMMMRUPQWUMHST-RTBURBONSA-N 2 1 309.457 4.249 20 0 DIADMP CC[N@@H+](C)C1CC[NH+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172550258 1051432762 /nfs/dbraw/zinc/43/27/62/1051432762.db2.gz VSPSDQJMUJQOTA-QUCCMNQESA-N 2 1 300.490 4.129 20 0 DIADMP CC[NH+]1CCC([N@H+](C)[C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172552043 1051435267 /nfs/dbraw/zinc/43/52/67/1051435267.db2.gz KCHMZHLQMSTYBP-QUCCMNQESA-N 2 1 300.490 4.129 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)[C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172552043 1051435275 /nfs/dbraw/zinc/43/52/75/1051435275.db2.gz KCHMZHLQMSTYBP-QUCCMNQESA-N 2 1 300.490 4.129 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172554325 1051437476 /nfs/dbraw/zinc/43/74/76/1051437476.db2.gz XTIADIQNJJDYRT-UXHICEINSA-N 2 1 300.490 4.131 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172555852 1051438853 /nfs/dbraw/zinc/43/88/53/1051438853.db2.gz JYNZQQZPJDJYBA-MISYRCLQSA-N 2 1 300.490 4.164 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccc(Oc3ccccc3)cc1)C2 ZINC001169092762 1051508537 /nfs/dbraw/zinc/50/85/37/1051508537.db2.gz CNAXJSLMDFDKTL-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cccc(-c3cccs3)c1)C2 ZINC001169100492 1051508742 /nfs/dbraw/zinc/50/87/42/1051508742.db2.gz JXSOQZVLLSZSEH-NNZMDNLPSA-N 2 1 312.482 4.130 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cccc(-c3ccccc3)c1)C2 ZINC001169092685 1051508869 /nfs/dbraw/zinc/50/88/69/1051508869.db2.gz CJSCUVCMLUAGSO-WKCHPHFGSA-N 2 1 306.453 4.068 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001169085267 1051516524 /nfs/dbraw/zinc/51/65/24/1051516524.db2.gz MVDCKEGLIWUSOE-OAQYLSRUSA-N 2 1 314.517 4.202 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116974 1051519087 /nfs/dbraw/zinc/51/90/87/1051519087.db2.gz VBPXXTLNPVUCRJ-PDOICOKGSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116974 1051519099 /nfs/dbraw/zinc/51/90/99/1051519099.db2.gz VBPXXTLNPVUCRJ-PDOICOKGSA-N 2 1 316.464 4.272 20 0 DIADMP CC(C)Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001169117874 1051522541 /nfs/dbraw/zinc/52/25/41/1051522541.db2.gz BBQCWDYAGOPYHC-XLNTUCKNSA-N 2 1 300.490 4.161 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3cccc4ccccc43)CC1)C2 ZINC001169108571 1051528540 /nfs/dbraw/zinc/52/85/40/1051528540.db2.gz BMVYTNLJZLOZEB-NNZMDNLPSA-N 2 1 306.453 4.044 20 0 DIADMP Cc1cc([NH2+][C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)ccc1N(C)C ZINC001169150088 1051535234 /nfs/dbraw/zinc/53/52/34/1051535234.db2.gz ASBVLQRZFUMLCW-QFBILLFUSA-N 2 1 303.494 4.017 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001172848851 1051536691 /nfs/dbraw/zinc/53/66/91/1051536691.db2.gz YHCCOECQPYVSMI-CYBMUJFWSA-N 2 1 324.871 4.004 20 0 DIADMP Cc1cc[nH+]c2cc(N[C@@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)ccc12 ZINC001169152425 1051538109 /nfs/dbraw/zinc/53/81/09/1051538109.db2.gz PRMBGPKCLBRDQG-OXQOHEQNSA-N 2 1 311.473 4.499 20 0 DIADMP Cc1[nH+]c2ccccn2c1Nc1ccc(C2CC[NH+](C)CC2)cc1 ZINC001212687970 1051552800 /nfs/dbraw/zinc/55/28/00/1051552800.db2.gz XNOZGNUCJDJWDL-UHFFFAOYSA-N 2 1 320.440 4.196 20 0 DIADMP CC[NH+]1CCC([NH2+]C(C)(C)Cc2ccc3ccccc3c2)CC1 ZINC001169224216 1051556066 /nfs/dbraw/zinc/55/60/66/1051556066.db2.gz DKDLQQVHUWHQSD-UHFFFAOYSA-N 2 1 310.485 4.235 20 0 DIADMP CC[NH+]1CCC([NH+]2CCC(CCCc3ccccc3)CC2)CC1 ZINC001169246653 1051562494 /nfs/dbraw/zinc/56/24/94/1051562494.db2.gz TVJYMYGEXHVHQW-UHFFFAOYSA-N 2 1 314.517 4.206 20 0 DIADMP CC[NH+]1CCC([NH2+]C2(CC3CCC3)CCC(F)(F)CC2)CC1 ZINC001169240849 1051563078 /nfs/dbraw/zinc/56/30/78/1051563078.db2.gz LSBUUOSGLQPROJ-UHFFFAOYSA-N 2 1 314.464 4.199 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc2ccccc2n1 ZINC000178396085 1051571051 /nfs/dbraw/zinc/57/10/51/1051571051.db2.gz AICARQVYSFEVJS-QGZVFWFLSA-N 2 1 311.473 4.007 20 0 DIADMP COCCC[C@@H](C)[NH2+]CC1([NH2+][C@H](C)c2ccccc2)CCCC1 ZINC000178532804 1051576975 /nfs/dbraw/zinc/57/69/75/1051576975.db2.gz LWQLIVAMBDTWPF-QZTJIDSGSA-N 2 1 318.505 4.055 20 0 DIADMP CCCOC1CCC([N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)CC1 ZINC001173100647 1051606910 /nfs/dbraw/zinc/60/69/10/1051606910.db2.gz QUJGBEJXQQGNIG-NUVZVAJJSA-N 2 1 322.537 4.063 20 0 DIADMP CCCOC1CCC([NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)CC1 ZINC001173100647 1051606918 /nfs/dbraw/zinc/60/69/18/1051606918.db2.gz QUJGBEJXQQGNIG-NUVZVAJJSA-N 2 1 322.537 4.063 20 0 DIADMP CCCOC1CCC([NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)CC1 ZINC001173100647 1051606923 /nfs/dbraw/zinc/60/69/23/1051606923.db2.gz QUJGBEJXQQGNIG-NUVZVAJJSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001173112125 1051609844 /nfs/dbraw/zinc/60/98/44/1051609844.db2.gz QTTFBGPTEGCMCH-UHFFFAOYSA-N 2 1 308.897 4.425 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCCc3ccccc3C2)CC1 ZINC001173114577 1051611496 /nfs/dbraw/zinc/61/14/96/1051611496.db2.gz PUGBCKAJXOEPMK-UHFFFAOYSA-N 2 1 300.490 4.088 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)CCc2cccc(Cl)c2)CC1 ZINC001173115082 1051611858 /nfs/dbraw/zinc/61/18/58/1051611858.db2.gz WMKFPZVRKNAUAZ-UHFFFAOYSA-N 2 1 322.924 4.467 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@H]2c2ccc(C)nc2)CC1 ZINC001173113375 1051611898 /nfs/dbraw/zinc/61/18/98/1051611898.db2.gz OMZMMWAONJKEFF-MHJFOBGBSA-N 2 1 315.505 4.180 20 0 DIADMP C[N@@H+]1CCCC12CC[NH+](C[C@@H]1CC[C@@H](c3ccccc3)C1)CC2 ZINC001168459039 1051613267 /nfs/dbraw/zinc/61/32/67/1051613267.db2.gz QJWBLJIWCBFRCB-UYAOXDASSA-N 2 1 312.501 4.131 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](C[C@@H]1CC[C@@H](c3ccccc3)C1)CC2 ZINC001168459039 1051613273 /nfs/dbraw/zinc/61/32/73/1051613273.db2.gz QJWBLJIWCBFRCB-UYAOXDASSA-N 2 1 312.501 4.131 20 0 DIADMP C[NH2+]Cc1cccc(Nc2cc[nH+]c(-c3ccccc3)c2)c1F ZINC001216219981 1051632054 /nfs/dbraw/zinc/63/20/54/1051632054.db2.gz FUWYFLLTUVZUTN-UHFFFAOYSA-N 2 1 307.372 4.351 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)n1c[nH+]cc1CC[NH3+] ZINC001173209451 1051647887 /nfs/dbraw/zinc/64/78/87/1051647887.db2.gz ZATZMCDKNVGRSQ-KRWDZBQOSA-N 2 1 319.452 4.168 20 0 DIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000493884564 1051663972 /nfs/dbraw/zinc/66/39/72/1051663972.db2.gz YSBKKHQLDGKDAF-BJLQDIEVSA-N 2 1 318.505 4.007 20 0 DIADMP CO[C@H](c1ccccc1)[C@H](C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000493884566 1051664083 /nfs/dbraw/zinc/66/40/83/1051664083.db2.gz YSBKKHQLDGKDAF-HBFSDRIKSA-N 2 1 318.505 4.007 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173270610 1051668820 /nfs/dbraw/zinc/66/88/20/1051668820.db2.gz NZDBHXRSCKHULA-KNTRFNDTSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272244 1051669166 /nfs/dbraw/zinc/66/91/66/1051669166.db2.gz UIIAPSOZDPCPIU-AFYVEPGGSA-N 2 1 300.490 4.337 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293922 1051674951 /nfs/dbraw/zinc/67/49/51/1051674951.db2.gz LLRTULYBRNAWKZ-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293922 1051674957 /nfs/dbraw/zinc/67/49/57/1051674957.db2.gz LLRTULYBRNAWKZ-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293925 1051675739 /nfs/dbraw/zinc/67/57/39/1051675739.db2.gz LLRTULYBRNAWKZ-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293925 1051675744 /nfs/dbraw/zinc/67/57/44/1051675744.db2.gz LLRTULYBRNAWKZ-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP CCSC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001173296722 1051678212 /nfs/dbraw/zinc/67/82/12/1051678212.db2.gz VVJCLCWHLZGSKV-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP CCSC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001173296722 1051678216 /nfs/dbraw/zinc/67/82/16/1051678216.db2.gz VVJCLCWHLZGSKV-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP CCSC[C@H](C)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173296631 1051678635 /nfs/dbraw/zinc/67/86/35/1051678635.db2.gz VIGGLPDGWQUSRU-SZMVWBNQSA-N 2 1 312.567 4.280 20 0 DIADMP CCSC[C@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173298726 1051679936 /nfs/dbraw/zinc/67/99/36/1051679936.db2.gz QKMHWATUHYSQSS-WBAXXEDZSA-N 2 1 324.509 4.039 20 0 DIADMP CCSC[C@H](C)[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173299210 1051680258 /nfs/dbraw/zinc/68/02/58/1051680258.db2.gz SMZCNZUNDNGHCL-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP CCSC[C@H](C)[NH+]1CCC([N@H+](CC)Cc2ccccc2)CC1 ZINC001173303874 1051681701 /nfs/dbraw/zinc/68/17/01/1051681701.db2.gz BJVROJFPISFAAF-KRWDZBQOSA-N 2 1 320.546 4.115 20 0 DIADMP CCSC[C@H](C)[NH+]1CCC([N@@H+](CC)Cc2ccccc2)CC1 ZINC001173303874 1051681707 /nfs/dbraw/zinc/68/17/07/1051681707.db2.gz BJVROJFPISFAAF-KRWDZBQOSA-N 2 1 320.546 4.115 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001173288849 1051691085 /nfs/dbraw/zinc/69/10/85/1051691085.db2.gz PKVOPSSMPBCLLZ-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288849 1051691090 /nfs/dbraw/zinc/69/10/90/1051691090.db2.gz PKVOPSSMPBCLLZ-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001173288849 1051691094 /nfs/dbraw/zinc/69/10/94/1051691094.db2.gz PKVOPSSMPBCLLZ-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC001173289052 1051691243 /nfs/dbraw/zinc/69/12/43/1051691243.db2.gz QMLZBVBLCAEJNM-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291778 1051692147 /nfs/dbraw/zinc/69/21/47/1051692147.db2.gz CLGMSLMYJXKJKH-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291778 1051692157 /nfs/dbraw/zinc/69/21/57/1051692157.db2.gz CLGMSLMYJXKJKH-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001206025682 1051732452 /nfs/dbraw/zinc/73/24/52/1051732452.db2.gz OZBSLYSRKBAJHF-OLZOCXBDSA-N 2 1 315.288 4.109 20 0 DIADMP CC[C@@H]1CC[C@@H]1Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000806158013 1051761132 /nfs/dbraw/zinc/76/11/32/1051761132.db2.gz VJXQVJQSBWJAEQ-XLIONFOSSA-N 2 1 315.505 4.065 20 0 DIADMP c1ccc2c(c1)CCC21CCC([NH2+]C2CC[NH+](C3CC3)CC2)CC1 ZINC001173689703 1051781023 /nfs/dbraw/zinc/78/10/23/1051781023.db2.gz SGHPZBJBOZLLLU-UHFFFAOYSA-N 2 1 324.512 4.030 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)s1 ZINC001206214183 1051789792 /nfs/dbraw/zinc/78/97/92/1051789792.db2.gz XNRMJWQUZRTZLK-SJORKVTESA-N 2 1 312.498 4.132 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768215380 1051904544 /nfs/dbraw/zinc/90/45/44/1051904544.db2.gz FBMZEHNWVWUDEI-HNNXBMFYSA-N 2 1 300.421 4.080 20 0 DIADMP Cc1cscc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000494495252 1051905720 /nfs/dbraw/zinc/90/57/20/1051905720.db2.gz MVBVNIHJBOCKMS-DNVCBOLYSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768265326 1051911446 /nfs/dbraw/zinc/91/14/46/1051911446.db2.gz WXFLQNMXWAEQJZ-OAHLLOKOSA-N 2 1 300.421 4.080 20 0 DIADMP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cnn1C(C)C ZINC000191178188 1051962833 /nfs/dbraw/zinc/96/28/33/1051962833.db2.gz IDALMEHOLUUFND-DLBZAZTESA-N 2 1 320.525 4.078 20 0 DIADMP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cnn1C(C)C ZINC000191178204 1051963834 /nfs/dbraw/zinc/96/38/34/1051963834.db2.gz IDALMEHOLUUFND-IRXDYDNUSA-N 2 1 320.525 4.078 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)cc1 ZINC001204141501 1052157675 /nfs/dbraw/zinc/15/76/75/1052157675.db2.gz UTNKZOPVAWYSNH-ZWKOTPCHSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001204141501 1052157679 /nfs/dbraw/zinc/15/76/79/1052157679.db2.gz UTNKZOPVAWYSNH-ZWKOTPCHSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001204141501 1052157686 /nfs/dbraw/zinc/15/76/86/1052157686.db2.gz UTNKZOPVAWYSNH-ZWKOTPCHSA-N 2 1 318.530 4.247 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)[C@@H]1C ZINC000495077911 1052211307 /nfs/dbraw/zinc/21/13/07/1052211307.db2.gz HISVIZFLVKYFFV-JXXFODFXSA-N 2 1 312.457 4.046 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCS2 ZINC000250022260 1052217783 /nfs/dbraw/zinc/21/77/83/1052217783.db2.gz MYTLDITXSXLPCK-IJEWVQPXSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCS2 ZINC000250022260 1052217793 /nfs/dbraw/zinc/21/77/93/1052217793.db2.gz MYTLDITXSXLPCK-IJEWVQPXSA-N 2 1 322.905 4.093 20 0 DIADMP CCC[C@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)C(C)(C)C ZINC001218293621 1052218779 /nfs/dbraw/zinc/21/87/79/1052218779.db2.gz KQVQYYVCHDQTJO-IBGZPJMESA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)=CCC[C@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218318436 1052224729 /nfs/dbraw/zinc/22/47/29/1052224729.db2.gz WQAAYTQKZDCTAX-KRWDZBQOSA-N 2 1 316.489 4.123 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000250257268 1052225613 /nfs/dbraw/zinc/22/56/13/1052225613.db2.gz REWYCUAQYPZIOX-FGTMMUONSA-N 2 1 304.865 4.008 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2OC2CCCCCCC2)CC1 ZINC001218352400 1052229749 /nfs/dbraw/zinc/22/97/49/1052229749.db2.gz FOCUSKUCIWUISN-UHFFFAOYSA-N 2 1 316.489 4.101 20 0 DIADMP CC[C@H](C)CC[C@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218356127 1052230434 /nfs/dbraw/zinc/23/04/34/1052230434.db2.gz AELKRYLHYZSRJM-IRXDYDNUSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@H](C)CC[C@@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218356123 1052231135 /nfs/dbraw/zinc/23/11/35/1052231135.db2.gz AELKRYLHYZSRJM-DLBZAZTESA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccc(C)c(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000309704651 1052235894 /nfs/dbraw/zinc/23/58/94/1052235894.db2.gz HHUJPSWADRBHOF-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP Cc1cc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)cc(C)[nH+]1 ZINC000310273572 1052262674 /nfs/dbraw/zinc/26/26/74/1052262674.db2.gz UGMSKGIKUMIMOT-HMXCVIKNSA-N 2 1 321.468 4.021 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000495415047 1052340831 /nfs/dbraw/zinc/34/08/31/1052340831.db2.gz MENVEIZRWVZREY-PBGAUENZSA-N 2 1 316.464 4.080 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCSC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000089516534 1052380280 /nfs/dbraw/zinc/38/02/80/1052380280.db2.gz FZOYZDGJDJLURK-WMZOPIPTSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCSC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000089516534 1052380286 /nfs/dbraw/zinc/38/02/86/1052380286.db2.gz FZOYZDGJDJLURK-WMZOPIPTSA-N 2 1 320.546 4.161 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000236605612 1052427009 /nfs/dbraw/zinc/42/70/09/1052427009.db2.gz GMEKVRPQGAFTFC-QGZVFWFLSA-N 2 1 304.478 4.064 20 0 DIADMP CC[NH+](CC)CCC[NH2+]Cc1cccc(Oc2ccccc2)c1 ZINC000319799921 1052431900 /nfs/dbraw/zinc/43/19/00/1052431900.db2.gz IYVNIYUVSIQEIP-UHFFFAOYSA-N 2 1 312.457 4.300 20 0 DIADMP CC1(C)CCCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000236906543 1052432666 /nfs/dbraw/zinc/43/26/66/1052432666.db2.gz RRXBRZYPMHQANN-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236931083 1052432900 /nfs/dbraw/zinc/43/29/00/1052432900.db2.gz HPZYYBSRGSSLDS-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236931083 1052432906 /nfs/dbraw/zinc/43/29/06/1052432906.db2.gz HPZYYBSRGSSLDS-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccc(C)cc2)o1 ZINC000237408556 1052440021 /nfs/dbraw/zinc/44/00/21/1052440021.db2.gz YVWXYPGGAXNUGE-INIZCTEOSA-N 2 1 323.440 4.186 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC001222149028 1052450523 /nfs/dbraw/zinc/45/05/23/1052450523.db2.gz VENHXSCXRYXQGJ-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167350 1052456046 /nfs/dbraw/zinc/45/60/46/1052456046.db2.gz KOQDBGFPACQZRL-LJQANCHMSA-N 2 1 322.443 4.019 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167350 1052456050 /nfs/dbraw/zinc/45/60/50/1052456050.db2.gz KOQDBGFPACQZRL-LJQANCHMSA-N 2 1 322.443 4.019 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)sc1C ZINC001222173025 1052457000 /nfs/dbraw/zinc/45/70/00/1052457000.db2.gz PVLODYSLJNXUPB-SFHVURJKSA-N 2 1 306.519 4.111 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CC[C@]23CCC[NH2+]C3)CC1 ZINC001222192566 1052458842 /nfs/dbraw/zinc/45/88/42/1052458842.db2.gz WWJSLERHEPEJAT-UXHICEINSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@]23CCC[NH2+]C3)CC1 ZINC001222192566 1052458845 /nfs/dbraw/zinc/45/88/45/1052458845.db2.gz WWJSLERHEPEJAT-UXHICEINSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CC[C@@]23CCC[NH2+]C3)CC1 ZINC001222192572 1052459099 /nfs/dbraw/zinc/45/90/99/1052459099.db2.gz WWJSLERHEPEJAT-WOJBJXKFSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@]23CCC[NH2+]C3)CC1 ZINC001222192572 1052459106 /nfs/dbraw/zinc/45/91/06/1052459106.db2.gz WWJSLERHEPEJAT-WOJBJXKFSA-N 2 1 302.506 4.287 20 0 DIADMP c1csc(-c2ccccc2C[N@@H+]2CCC[C@]23CCC[NH2+]C3)c1 ZINC001222247644 1052468713 /nfs/dbraw/zinc/46/87/13/1052468713.db2.gz HFMBOQPNIBQCIK-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP c1csc(-c2ccccc2C[N@H+]2CCC[C@]23CCC[NH2+]C3)c1 ZINC001222247644 1052468718 /nfs/dbraw/zinc/46/87/18/1052468718.db2.gz HFMBOQPNIBQCIK-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222271275 1052471719 /nfs/dbraw/zinc/47/17/19/1052471719.db2.gz FCQYRRMVQDZQJF-IBGZPJMESA-N 2 1 314.498 4.175 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)cc1 ZINC001222272635 1052471732 /nfs/dbraw/zinc/47/17/32/1052471732.db2.gz XVNCEQVFDNDGGF-JOCHJYFZSA-N 2 1 320.480 4.319 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000316783442 1052472984 /nfs/dbraw/zinc/47/29/84/1052472984.db2.gz MXWHIDMSFVFRCC-SOUVJXGZSA-N 2 1 300.446 4.129 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000316783442 1052472987 /nfs/dbraw/zinc/47/29/87/1052472987.db2.gz MXWHIDMSFVFRCC-SOUVJXGZSA-N 2 1 300.446 4.129 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[NH+]1CCC2(CCCC[NH2+]2)CC1 ZINC001222287423 1052473859 /nfs/dbraw/zinc/47/38/59/1052473859.db2.gz JKEUUZIRQLCDOF-SFHVURJKSA-N 2 1 324.553 4.216 20 0 DIADMP c1ccc(-c2cccc(C[NH+]3CCC4(CCCC[NH2+]4)CC3)c2)cc1 ZINC001222298398 1052476076 /nfs/dbraw/zinc/47/60/76/1052476076.db2.gz UFKGAIKQDBAPJX-UHFFFAOYSA-N 2 1 320.480 4.462 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001222309751 1052478499 /nfs/dbraw/zinc/47/84/99/1052478499.db2.gz RCGHLDHNBLBYMC-FQEVSTJZSA-N 2 1 300.490 4.092 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222308632 1052478603 /nfs/dbraw/zinc/47/86/03/1052478603.db2.gz KUSSFKFOIXCKIM-AZUAARDMSA-N 2 1 324.553 4.216 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)cc2)cc1 ZINC001222310916 1052478688 /nfs/dbraw/zinc/47/86/88/1052478688.db2.gz YNXATGKCYTUTDL-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(C2(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)CCCC2)cc1 ZINC001222308115 1052479135 /nfs/dbraw/zinc/47/91/35/1052479135.db2.gz HAQVWMFMLRXCOZ-NRFANRHFSA-N 2 1 312.501 4.107 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001222309795 1052479154 /nfs/dbraw/zinc/47/91/54/1052479154.db2.gz SJGMJKUOFPKMBI-YTQUADARSA-N 2 1 318.892 4.052 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)cc2)o1 ZINC001222316229 1052480664 /nfs/dbraw/zinc/48/06/64/1052480664.db2.gz URGWVTYKJNXSET-OAQYLSRUSA-N 2 1 324.468 4.363 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001222315930 1052481022 /nfs/dbraw/zinc/48/10/22/1052481022.db2.gz RJZQSXMYDWFTKZ-FQEVSTJZSA-N 2 1 300.490 4.137 20 0 DIADMP Fc1ccc([C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000393391064 1052481175 /nfs/dbraw/zinc/48/11/75/1052481175.db2.gz CFAVITVRYUMNNI-PCCBWWKXSA-N 2 1 324.443 4.132 20 0 DIADMP CCc1cc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)ccc1Cl ZINC001222320336 1052482055 /nfs/dbraw/zinc/48/20/55/1052482055.db2.gz GVUFLOGRRIRHSA-GOSISDBHSA-N 2 1 306.881 4.011 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222355701 1052489681 /nfs/dbraw/zinc/48/96/81/1052489681.db2.gz TZZGFEISAPRKRT-NRFANRHFSA-N 2 1 320.436 4.304 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222355701 1052489684 /nfs/dbraw/zinc/48/96/84/1052489684.db2.gz TZZGFEISAPRKRT-NRFANRHFSA-N 2 1 320.436 4.304 20 0 DIADMP CC1=CC[C@@H](CC[N@H+]2C[C@H](c3ccccc3)C3(C[NH2+]C3)C2)C1(C)C ZINC001222596053 1052515966 /nfs/dbraw/zinc/51/59/66/1052515966.db2.gz PCLLSASAVMSCOZ-VQTJNVASSA-N 2 1 324.512 4.058 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@H](c2cccc(Cl)c2Cl)C1 ZINC001235884949 1052538020 /nfs/dbraw/zinc/53/80/20/1052538020.db2.gz NIYHIVGIQYQIPA-ZDUSSCGKSA-N 2 1 315.288 4.302 20 0 DIADMP C[C@@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)C(C)(C)C ZINC000670270442 1052548662 /nfs/dbraw/zinc/54/86/62/1052548662.db2.gz GDYNBGCEPBHGKT-HNNXBMFYSA-N 2 1 303.494 4.081 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000036975356 1052575123 /nfs/dbraw/zinc/57/51/23/1052575123.db2.gz HBPFLQNZXMARQX-HQSKLWIPSA-N 2 1 306.881 4.252 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Cl)s2)CC1 ZINC000037150207 1052605877 /nfs/dbraw/zinc/60/58/77/1052605877.db2.gz QFVDVRPTHJLPGY-LBPRGKRZSA-N 2 1 300.899 4.317 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(F)c(Cl)c2)CC1 ZINC000037149840 1052605893 /nfs/dbraw/zinc/60/58/93/1052605893.db2.gz DZBBNQJQMYWGFG-CYBMUJFWSA-N 2 1 312.860 4.394 20 0 DIADMP CC(C)(CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1)C1CC1 ZINC000328556635 1052625829 /nfs/dbraw/zinc/62/58/29/1052625829.db2.gz AOUGXBYIBDJMFM-UHFFFAOYSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644329 1052627629 /nfs/dbraw/zinc/62/76/29/1052627629.db2.gz FVZFHIIJJQJGMC-LRDDRELGSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644329 1052627635 /nfs/dbraw/zinc/62/76/35/1052627635.db2.gz FVZFHIIJJQJGMC-LRDDRELGSA-N 2 1 315.288 4.376 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)s2)CC1 ZINC000124059304 1052635892 /nfs/dbraw/zinc/63/58/92/1052635892.db2.gz PMWJTXQSWPCAFL-GFCCVEGCSA-N 2 1 300.899 4.173 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CCN([C@H](C)c3ccccc3)CC2)o1 ZINC000125189443 1052645445 /nfs/dbraw/zinc/64/54/45/1052645445.db2.gz WNQQIDAUMYKLMZ-DLBZAZTESA-N 2 1 312.457 4.464 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000125456338 1052649285 /nfs/dbraw/zinc/64/92/85/1052649285.db2.gz TVPRCGMNORGWFD-UHFFFAOYSA-N 2 1 323.440 4.267 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000125456338 1052649292 /nfs/dbraw/zinc/64/92/92/1052649292.db2.gz TVPRCGMNORGWFD-UHFFFAOYSA-N 2 1 323.440 4.267 20 0 DIADMP COc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000125958743 1052659398 /nfs/dbraw/zinc/65/93/98/1052659398.db2.gz CQIICGVDYTXNBM-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000125958743 1052659401 /nfs/dbraw/zinc/65/94/01/1052659401.db2.gz CQIICGVDYTXNBM-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP c1ccc(-c2ccccc2C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000917395407 1052723504 /nfs/dbraw/zinc/72/35/04/1052723504.db2.gz MVNLZAANGPUTGH-WOJBJXKFSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2ccccc2C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000917393922 1052723594 /nfs/dbraw/zinc/72/35/94/1052723594.db2.gz NTCGSARQHFSQPW-UHFFFAOYSA-N 2 1 306.453 4.070 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000556060401 1052794867 /nfs/dbraw/zinc/79/48/67/1052794867.db2.gz GQTLYDQLNXAWGU-VQIMIIECSA-N 2 1 314.498 4.236 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)s1 ZINC000556060401 1052794872 /nfs/dbraw/zinc/79/48/72/1052794872.db2.gz GQTLYDQLNXAWGU-VQIMIIECSA-N 2 1 314.498 4.236 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556119225 1052804214 /nfs/dbraw/zinc/80/42/14/1052804214.db2.gz SBTACVXIAFGLOT-ZKMOHVOUSA-N 2 1 320.480 4.345 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556119225 1052804216 /nfs/dbraw/zinc/80/42/16/1052804216.db2.gz SBTACVXIAFGLOT-ZKMOHVOUSA-N 2 1 320.480 4.345 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000556149605 1052810194 /nfs/dbraw/zinc/81/01/94/1052810194.db2.gz JJONRUJOHMZIMJ-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000556177553 1052816174 /nfs/dbraw/zinc/81/61/74/1052816174.db2.gz BHYHFKCMRUMCRO-LEWJYISDSA-N 2 1 320.480 4.187 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000556177553 1052816178 /nfs/dbraw/zinc/81/61/78/1052816178.db2.gz BHYHFKCMRUMCRO-LEWJYISDSA-N 2 1 320.480 4.187 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556178287 1052817328 /nfs/dbraw/zinc/81/73/28/1052817328.db2.gz YZZCEXQWCRXFOE-BZUAXINKSA-N 2 1 314.395 4.143 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556178287 1052817329 /nfs/dbraw/zinc/81/73/29/1052817329.db2.gz YZZCEXQWCRXFOE-BZUAXINKSA-N 2 1 314.395 4.143 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000556225342 1052822884 /nfs/dbraw/zinc/82/28/84/1052822884.db2.gz SKZSHIIDXIKOOX-JWHDQAAXSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@@H]1c1ccccc1 ZINC000556225342 1052822888 /nfs/dbraw/zinc/82/28/88/1052822888.db2.gz SKZSHIIDXIKOOX-JWHDQAAXSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000556225496 1052822956 /nfs/dbraw/zinc/82/29/56/1052822956.db2.gz VLDFXBCZOFYNPW-CIAFKFPVSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000556225496 1052822962 /nfs/dbraw/zinc/82/29/62/1052822962.db2.gz VLDFXBCZOFYNPW-CIAFKFPVSA-N 2 1 320.480 4.358 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000556584043 1052867301 /nfs/dbraw/zinc/86/73/01/1052867301.db2.gz OKBMTHBTBFPGPK-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000556763271 1052880807 /nfs/dbraw/zinc/88/08/07/1052880807.db2.gz VMBPHSZDASBBMZ-UHFFFAOYSA-N 2 1 313.489 4.401 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000556763271 1052880812 /nfs/dbraw/zinc/88/08/12/1052880812.db2.gz VMBPHSZDASBBMZ-UHFFFAOYSA-N 2 1 313.489 4.401 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000556867626 1052890176 /nfs/dbraw/zinc/89/01/76/1052890176.db2.gz HFLXBMLZLNQPQO-LEAZDLGRSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000556867626 1052890179 /nfs/dbraw/zinc/89/01/79/1052890179.db2.gz HFLXBMLZLNQPQO-LEAZDLGRSA-N 2 1 300.490 4.064 20 0 DIADMP c1ccc(-c2ccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)cc2)cc1 ZINC001226784652 1052931113 /nfs/dbraw/zinc/93/11/13/1052931113.db2.gz KNXHNCYHHWFBLK-UHFFFAOYSA-N 2 1 306.453 4.072 20 0 DIADMP C[C@@H]([NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1)C1CCCC1 ZINC000179841144 1053031118 /nfs/dbraw/zinc/03/11/18/1053031118.db2.gz YHMHWOVXODGTCM-MRXNPFEDSA-N 2 1 315.505 4.208 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236453289 1053039748 /nfs/dbraw/zinc/03/97/48/1053039748.db2.gz PWYUPWRQIMVIDQ-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP c1csc(-c2ccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)cc2)c1 ZINC001228556921 1053133969 /nfs/dbraw/zinc/13/39/69/1053133969.db2.gz UAYDCPMERMHHHS-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP C[NH+](C)CC(C)(C)C[NH2+]Cc1ccc(-c2cccs2)cc1 ZINC001560248458 1053142296 /nfs/dbraw/zinc/14/22/96/1053142296.db2.gz RPAWTZRGTHEOMD-UHFFFAOYSA-N 2 1 302.487 4.093 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2([NH+](C)C)CCCC2)C[C@@H](c2ccccc2)C1 ZINC000323645546 1053164803 /nfs/dbraw/zinc/16/48/03/1053164803.db2.gz UUKZWERFUUYURQ-YSIASYRMSA-N 2 1 314.517 4.423 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC001318418920 1053167297 /nfs/dbraw/zinc/16/72/97/1053167297.db2.gz BFPGJZFJZIDVCU-LJQANCHMSA-N 2 1 308.469 4.175 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000089512988 1053205659 /nfs/dbraw/zinc/20/56/59/1053205659.db2.gz MKILDLNYHBKXCP-CYBMUJFWSA-N 2 1 323.550 4.488 20 0 DIADMP Fc1ccccc1[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284500 1053258471 /nfs/dbraw/zinc/25/84/71/1053258471.db2.gz BRYRWVVKLAVWFK-QRWLVFNGSA-N 2 1 316.464 4.131 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC001319992472 1053292392 /nfs/dbraw/zinc/29/23/92/1053292392.db2.gz SYPNEONAOIBVEO-SFHVURJKSA-N 2 1 323.484 4.054 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(CC(C)C)cc1)C(C)C ZINC000618481605 1053311685 /nfs/dbraw/zinc/31/16/85/1053311685.db2.gz PCNYZNZOXUXZDS-HXUWFJFHSA-N 2 1 313.489 4.377 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC001320599087 1053347487 /nfs/dbraw/zinc/34/74/87/1053347487.db2.gz VJHMTEKMODWKRF-KBXCAEBGSA-N 2 1 306.881 4.113 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634018 1053530123 /nfs/dbraw/zinc/53/01/23/1053530123.db2.gz PHQGCFUXIOLIND-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634018 1053530138 /nfs/dbraw/zinc/53/01/38/1053530138.db2.gz PHQGCFUXIOLIND-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000261918042 1053543709 /nfs/dbraw/zinc/54/37/09/1053543709.db2.gz RDPAFPMRYNBPCW-VHKYSDTDSA-N 2 1 310.441 4.269 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472755 1053582669 /nfs/dbraw/zinc/58/26/69/1053582669.db2.gz PIUKASJHJYUCAU-KBPBESRZSA-N 2 1 320.864 4.469 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472755 1053582680 /nfs/dbraw/zinc/58/26/80/1053582680.db2.gz PIUKASJHJYUCAU-KBPBESRZSA-N 2 1 320.864 4.469 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940221 1053613877 /nfs/dbraw/zinc/61/38/77/1053613877.db2.gz DRRRXPZZGJNKFE-CZUORRHYSA-N 2 1 312.860 4.252 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940221 1053613878 /nfs/dbraw/zinc/61/38/78/1053613878.db2.gz DRRRXPZZGJNKFE-CZUORRHYSA-N 2 1 312.860 4.252 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2)CC1 ZINC000763612884 1053615313 /nfs/dbraw/zinc/61/53/13/1053615313.db2.gz HHQBSKQVYALPIW-FQEVSTJZSA-N 2 1 308.469 4.270 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CCC(C(F)F)CC2)C[C@H]1c1ccccc1 ZINC000414171872 1053672814 /nfs/dbraw/zinc/67/28/14/1053672814.db2.gz DFSVMERBMQZZOZ-HIEASXQVSA-N 2 1 322.443 4.235 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CCC(C(F)F)CC2)C[C@H]1c1ccccc1 ZINC000414171872 1053672820 /nfs/dbraw/zinc/67/28/20/1053672820.db2.gz DFSVMERBMQZZOZ-HIEASXQVSA-N 2 1 322.443 4.235 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)c3ccccc32)C1 ZINC001324964003 1053690663 /nfs/dbraw/zinc/69/06/63/1053690663.db2.gz DOTDMLJJHWRRTN-HZPDHXFCSA-N 2 1 314.448 4.361 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccccc2)c1)CC1CC[NH+](C)CC1 ZINC001231509810 1053773693 /nfs/dbraw/zinc/77/36/93/1053773693.db2.gz FXOFUHXJVISVSX-UHFFFAOYSA-N 2 1 308.469 4.127 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1c(Cl)cccc1Cl ZINC000155939852 1053792980 /nfs/dbraw/zinc/79/29/80/1053792980.db2.gz PZEXKYFBWYRAJJ-UPJWGTAASA-N 2 1 315.288 4.169 20 0 DIADMP Cc1sc2ccccc2c1C[NH+]1CCC([N@H+](C)C2CC2)CC1 ZINC001231648136 1053817098 /nfs/dbraw/zinc/81/70/98/1053817098.db2.gz ALWUAMDGSUUFRC-UHFFFAOYSA-N 2 1 314.498 4.268 20 0 DIADMP Cc1sc2ccccc2c1C[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001231648136 1053817109 /nfs/dbraw/zinc/81/71/09/1053817109.db2.gz ALWUAMDGSUUFRC-UHFFFAOYSA-N 2 1 314.498 4.268 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001327616478 1053868253 /nfs/dbraw/zinc/86/82/53/1053868253.db2.gz MLASSWCULNZZBS-NVXWUHKLSA-N 2 1 318.530 4.181 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)C1 ZINC000163274820 1053893881 /nfs/dbraw/zinc/89/38/81/1053893881.db2.gz WHQIUPXPXOGERQ-HOTGVXAUSA-N 2 1 306.519 4.180 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)CC1 ZINC000159318256 1054037263 /nfs/dbraw/zinc/03/72/63/1054037263.db2.gz IUTVSHUYCMXDOJ-LLVKDONJSA-N 2 1 301.261 4.128 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3ccc(C)c(C)c3)CC2)[nH+]c1 ZINC000163481208 1054043624 /nfs/dbraw/zinc/04/36/24/1054043624.db2.gz QHUOYFMOKIAAIV-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc(C)c(F)c(C)c1 ZINC000164710553 1054061457 /nfs/dbraw/zinc/06/14/57/1054061457.db2.gz DYDDFCSGAQDPKN-OAHLLOKOSA-N 2 1 303.425 4.078 20 0 DIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000164702258 1054062313 /nfs/dbraw/zinc/06/23/13/1054062313.db2.gz XQCPTDHHEAQSPY-KRWDZBQOSA-N 2 1 305.853 4.366 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CC[N@@H+]1C ZINC000166406198 1054090608 /nfs/dbraw/zinc/09/06/08/1054090608.db2.gz SMRYGSODEMGHCR-UEKVPHQBSA-N 2 1 313.272 4.053 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)CC(F)(F)F)cc1 ZINC000166699385 1054094602 /nfs/dbraw/zinc/09/46/02/1054094602.db2.gz ONOISEXZZVSVOF-NEPJUHHUSA-N 2 1 311.351 4.172 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCCC(F)F)CC1 ZINC001332448191 1054119770 /nfs/dbraw/zinc/11/97/70/1054119770.db2.gz ORUNKJXPVLGPOX-UHFFFAOYSA-N 2 1 310.432 4.065 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc2nc(Cl)ccc2c1 ZINC001233445326 1054277723 /nfs/dbraw/zinc/27/77/23/1054277723.db2.gz AMYZLFUUDBFTFX-UHFFFAOYSA-N 2 1 319.880 4.052 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)C1 ZINC001338445626 1054306029 /nfs/dbraw/zinc/30/60/29/1054306029.db2.gz GKKANOIEBNQQDS-SJLPKXTDSA-N 2 1 318.530 4.162 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3cc(C)c(C)cc32)C1 ZINC001338445620 1054306123 /nfs/dbraw/zinc/30/61/23/1054306123.db2.gz GKKANOIEBNQQDS-AEFFLSMTSA-N 2 1 318.530 4.162 20 0 DIADMP CC[NH+](CC)C1CC[NH+](CCc2ccc3ccccc3c2)CC1 ZINC001339095269 1054324147 /nfs/dbraw/zinc/32/41/47/1054324147.db2.gz TZTKOILHPXJERP-UHFFFAOYSA-N 2 1 310.485 4.189 20 0 DIADMP CCCc1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC001339360309 1054336669 /nfs/dbraw/zinc/33/66/69/1054336669.db2.gz PDNPQJLHVSYWNZ-FQEVSTJZSA-N 2 1 300.490 4.089 20 0 DIADMP CC[C@H](C)c1ccc(NC(=[NH2+])NCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000849062171 1054369651 /nfs/dbraw/zinc/36/96/51/1054369651.db2.gz JFNAJUGUXKLTBN-JKSUJKDBSA-N 2 1 316.493 4.011 20 0 DIADMP CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1C[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC001340977209 1054371908 /nfs/dbraw/zinc/37/19/08/1054371908.db2.gz QFWLJMLFPMYGTN-INMHGKMJSA-N 2 1 323.550 4.003 20 0 DIADMP C[NH2+][C@H](C)CC[NH2+][C@H](C)c1ccc2ccccc2c1OC(F)F ZINC001345481484 1054496262 /nfs/dbraw/zinc/49/62/62/1054496262.db2.gz CSIXJUZWOQGHAE-CHWSQXEVSA-N 2 1 322.399 4.090 20 0 DIADMP c1cc(-c2ccccc2)sc1C[N@@H+](C1CC1)C1CC[NH2+]CC1 ZINC001345942606 1054521187 /nfs/dbraw/zinc/52/11/87/1054521187.db2.gz DXEVHIHFVLJBBA-UHFFFAOYSA-N 2 1 312.482 4.132 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCCCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC000671309300 1054553451 /nfs/dbraw/zinc/55/34/51/1054553451.db2.gz SBMRLSJVTBEGPG-RBUKOAKNSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)CC1(C)C ZINC000623335351 1054563621 /nfs/dbraw/zinc/56/36/21/1054563621.db2.gz JOMWUERDPKWNQS-IBGZPJMESA-N 2 1 308.469 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)CC1(C)C ZINC000623335351 1054563636 /nfs/dbraw/zinc/56/36/36/1054563636.db2.gz JOMWUERDPKWNQS-IBGZPJMESA-N 2 1 308.469 4.238 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485282 1054604056 /nfs/dbraw/zinc/60/40/56/1054604056.db2.gz USAMAMFLXRTOOX-CZUORRHYSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485282 1054604074 /nfs/dbraw/zinc/60/40/74/1054604074.db2.gz USAMAMFLXRTOOX-CZUORRHYSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485280 1054604612 /nfs/dbraw/zinc/60/46/12/1054604612.db2.gz USAMAMFLXRTOOX-BBRMVZONSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485280 1054604618 /nfs/dbraw/zinc/60/46/18/1054604618.db2.gz USAMAMFLXRTOOX-BBRMVZONSA-N 2 1 322.880 4.016 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001234992142 1054637178 /nfs/dbraw/zinc/63/71/78/1054637178.db2.gz JBHGDWFPDCLKKZ-UWJYYQICSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001234992138 1054638340 /nfs/dbraw/zinc/63/83/40/1054638340.db2.gz JBHGDWFPDCLKKZ-LAUBAEHRSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC000178079212 1054641480 /nfs/dbraw/zinc/64/14/80/1054641480.db2.gz NCWAYSYTEHBHBI-MIJOPJBOSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccoc1 ZINC000178079212 1054641487 /nfs/dbraw/zinc/64/14/87/1054641487.db2.gz NCWAYSYTEHBHBI-MIJOPJBOSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC000178079212 1054641493 /nfs/dbraw/zinc/64/14/93/1054641493.db2.gz NCWAYSYTEHBHBI-MIJOPJBOSA-N 2 1 310.441 4.126 20 0 DIADMP C[N@H+]1CC[C@@H](NCc2c(Cl)oc3ccccc32)CC1(C)C ZINC000623645111 1054642290 /nfs/dbraw/zinc/64/22/90/1054642290.db2.gz OQCOFSOKCSUBMX-GFCCVEGCSA-N 2 1 306.837 4.049 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001235031370 1054642914 /nfs/dbraw/zinc/64/29/14/1054642914.db2.gz FWYFXGUZNNJIHN-JOCHJYFZSA-N 2 1 320.480 4.156 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)c1 ZINC001235031371 1054643674 /nfs/dbraw/zinc/64/36/74/1054643674.db2.gz FWYFXGUZNNJIHN-QFIPXVFZSA-N 2 1 320.480 4.156 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c1 ZINC001235038677 1054644125 /nfs/dbraw/zinc/64/41/25/1054644125.db2.gz KWHWILMIDXWEEO-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c1 ZINC001235038677 1054644132 /nfs/dbraw/zinc/64/41/32/1054644132.db2.gz KWHWILMIDXWEEO-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP CCc1cc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)ccc1Cl ZINC001235037080 1054644453 /nfs/dbraw/zinc/64/44/53/1054644453.db2.gz DDNSFPZKHQXWIB-GOSISDBHSA-N 2 1 306.881 4.011 20 0 DIADMP CCc1cc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)ccc1Cl ZINC001235037080 1054644456 /nfs/dbraw/zinc/64/44/56/1054644456.db2.gz DDNSFPZKHQXWIB-GOSISDBHSA-N 2 1 306.881 4.011 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001235040340 1054645729 /nfs/dbraw/zinc/64/57/29/1054645729.db2.gz KZSAIDDECNCIIY-NEWSRXKRSA-N 2 1 318.892 4.052 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)c2)cs1 ZINC001235092317 1054653802 /nfs/dbraw/zinc/65/38/02/1054653802.db2.gz LZAVFSJVWMOKCK-UHFFFAOYSA-N 2 1 318.511 4.052 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2CCC23CC[NH2+]CC3)s1 ZINC001235102968 1054656854 /nfs/dbraw/zinc/65/68/54/1054656854.db2.gz MLPXKVPNABEFTA-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CCC23CC[NH2+]CC3)s1 ZINC001235102968 1054656856 /nfs/dbraw/zinc/65/68/56/1054656856.db2.gz MLPXKVPNABEFTA-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP Cc1cc(C[N@@H+]2CCC23CC[NH2+]CC3)ccc1Oc1ccccc1 ZINC001235104630 1054657413 /nfs/dbraw/zinc/65/74/13/1054657413.db2.gz UWSRVTIZGIXYGM-UHFFFAOYSA-N 2 1 322.452 4.115 20 0 DIADMP Cc1cc(C[N@H+]2CCC23CC[NH2+]CC3)ccc1Oc1ccccc1 ZINC001235104630 1054657417 /nfs/dbraw/zinc/65/74/17/1054657417.db2.gz UWSRVTIZGIXYGM-UHFFFAOYSA-N 2 1 322.452 4.115 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1 ZINC001235155357 1054666576 /nfs/dbraw/zinc/66/65/76/1054666576.db2.gz CZJAPQDUMRRUCM-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235154055 1054666633 /nfs/dbraw/zinc/66/66/33/1054666633.db2.gz HLVDCJNVHUAQJM-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP Clc1cccc(CCC[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1 ZINC001235152384 1054666862 /nfs/dbraw/zinc/66/68/62/1054666862.db2.gz MNLCDYWOEVTDLR-LJQANCHMSA-N 2 1 320.908 4.127 20 0 DIADMP CCCc1ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)s1 ZINC001235156853 1054667379 /nfs/dbraw/zinc/66/73/79/1054667379.db2.gz RTTKIJLEWIIVIW-GOSISDBHSA-N 2 1 306.519 4.055 20 0 DIADMP c1csc(-c2ccccc2C[N@H+]2CCCC23CC[NH2+]CC3)c1 ZINC001235145284 1054667602 /nfs/dbraw/zinc/66/76/02/1054667602.db2.gz SOKOSHLHJHAGSZ-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP Cc1cc(F)cc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1Cl ZINC001235160172 1054668976 /nfs/dbraw/zinc/66/89/76/1054668976.db2.gz ZJNRDPFFRAOPSJ-KRWDZBQOSA-N 2 1 324.871 4.142 20 0 DIADMP Cc1ccc(Cl)cc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235161690 1054669934 /nfs/dbraw/zinc/66/99/34/1054669934.db2.gz UJCXZAJLJXLNRC-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235177459 1054675459 /nfs/dbraw/zinc/67/54/59/1054675459.db2.gz JLVHOVKKQUTKDO-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235177459 1054675466 /nfs/dbraw/zinc/67/54/66/1054675466.db2.gz JLVHOVKKQUTKDO-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235189016 1054677899 /nfs/dbraw/zinc/67/78/99/1054677899.db2.gz FBDXFJACFXAMOJ-UHFFFAOYSA-N 2 1 310.441 4.055 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCCCC23CC[NH2+]CC3)c1C ZINC001235191081 1054679948 /nfs/dbraw/zinc/67/99/48/1054679948.db2.gz KLEDDJUOSSSFPX-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP Fc1ccc(C[N@H+]2CCCCC23CC[NH2+]CC3)c2ccccc12 ZINC001235189903 1054680775 /nfs/dbraw/zinc/68/07/75/1054680775.db2.gz PTQQDKVLPCVKPI-UHFFFAOYSA-N 2 1 312.432 4.087 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235190078 1054681496 /nfs/dbraw/zinc/68/14/96/1054681496.db2.gz TVGLTJXXZACSKW-UHFFFAOYSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@@H]4C[NH2+]C[C@@H]4C3)cc12 ZINC001235198588 1054684922 /nfs/dbraw/zinc/68/49/22/1054684922.db2.gz QTWSXMAHDJOZKZ-HZPDHXFCSA-N 2 1 322.477 4.096 20 0 DIADMP Cc1cc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]3[NH3+])cc(C)c1-c1ccc(F)cc1 ZINC001235253030 1054693124 /nfs/dbraw/zinc/69/31/24/1054693124.db2.gz BOVFRLFIJDORRK-IHPCNDPISA-N 2 1 324.443 4.031 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CCC[N@H+]3CCC2CCCCC2)cc1 ZINC001235247254 1054693144 /nfs/dbraw/zinc/69/31/44/1054693144.db2.gz CHEKCKDHZOTSIX-NHCUHLMSSA-N 2 1 312.501 4.178 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CCC[N@@H+]3CCC2CCCCC2)cc1 ZINC001235247254 1054693150 /nfs/dbraw/zinc/69/31/50/1054693150.db2.gz CHEKCKDHZOTSIX-NHCUHLMSSA-N 2 1 312.501 4.178 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235260692 1054694590 /nfs/dbraw/zinc/69/45/90/1054694590.db2.gz HFBDPBWEHHNRFZ-FUHWJXTLSA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235260692 1054694596 /nfs/dbraw/zinc/69/45/96/1054694596.db2.gz HFBDPBWEHHNRFZ-FUHWJXTLSA-N 2 1 306.519 4.055 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235272497 1054697515 /nfs/dbraw/zinc/69/75/15/1054697515.db2.gz QCTXGNPIRSNUQJ-LEWJYISDSA-N 2 1 320.480 4.154 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@H](C4C[NH2+]C4)C3)cc12 ZINC001235339174 1054703567 /nfs/dbraw/zinc/70/35/67/1054703567.db2.gz DRTVVOYFJWPFMP-HNNXBMFYSA-N 2 1 322.477 4.096 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235348098 1054707716 /nfs/dbraw/zinc/70/77/16/1054707716.db2.gz AAUQAUXURIWSEM-FVTFTPSCSA-N 2 1 324.512 4.058 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc(F)cc3)o2)CCN1C ZINC000179906121 1054713452 /nfs/dbraw/zinc/71/34/52/1054713452.db2.gz MLQWHLCZGIRVPY-PBHICJAKSA-N 2 1 316.420 4.000 20 0 DIADMP CC1(C[N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CCCCC1 ZINC001235380428 1054713557 /nfs/dbraw/zinc/71/35/57/1054713557.db2.gz VCKWYXXZLMXPEB-CTNGQTDRSA-N 2 1 312.501 4.036 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235424630 1054716347 /nfs/dbraw/zinc/71/63/47/1054716347.db2.gz HUHILFXELIGRBA-ROUUACIJSA-N 2 1 300.490 4.022 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235428579 1054717135 /nfs/dbraw/zinc/71/71/35/1054717135.db2.gz OPNIDBIPNZJDLG-PMACEKPBSA-N 2 1 322.496 4.360 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc1 ZINC001235429606 1054717175 /nfs/dbraw/zinc/71/71/75/1054717175.db2.gz ZHRLJJILMAKJHC-PMACEKPBSA-N 2 1 300.490 4.022 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC001235428553 1054719149 /nfs/dbraw/zinc/71/91/49/1054719149.db2.gz QQCLKHXDSMSNMK-VQTJNVASSA-N 2 1 300.490 4.022 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+](C)CC1CC[NH2+]CC1 ZINC001235433186 1054719884 /nfs/dbraw/zinc/71/98/84/1054719884.db2.gz RHPFGCZLINHYCV-UHFFFAOYSA-N 2 1 324.468 4.219 20 0 DIADMP C[N@@H+](CCC[NH3+])Cc1cccc(-c2ccccc2C(F)(F)F)c1 ZINC001235435565 1054721425 /nfs/dbraw/zinc/72/14/25/1054721425.db2.gz PPMFQKRJBHEUIN-UHFFFAOYSA-N 2 1 322.374 4.153 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cc2c(s1)CC[NH2+]C2 ZINC001235445841 1054723088 /nfs/dbraw/zinc/72/30/88/1054723088.db2.gz VAOZXUWCPABHBI-GOSISDBHSA-N 2 1 312.482 4.039 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc2c(s1)C[NH2+]CC2 ZINC001235445960 1054723268 /nfs/dbraw/zinc/72/32/68/1054723268.db2.gz WHMXRNWSTZYNML-SFHVURJKSA-N 2 1 312.482 4.039 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000180093594 1054734674 /nfs/dbraw/zinc/73/46/74/1054734674.db2.gz LDWSOLQAJFBVLM-FZKQIMNGSA-N 2 1 317.864 4.222 20 0 DIADMP CC[C@@H](C)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180113879 1054735726 /nfs/dbraw/zinc/73/57/26/1054735726.db2.gz DSQACTBMAPFPTC-SALMWKFDSA-N 2 1 300.490 4.206 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001235664829 1054763652 /nfs/dbraw/zinc/76/36/52/1054763652.db2.gz XKYSSBDYFSUDID-UHFFFAOYSA-N 2 1 308.469 4.135 20 0 DIADMP C[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1cccc2ccccc21 ZINC001235662172 1054765603 /nfs/dbraw/zinc/76/56/03/1054765603.db2.gz GZZWUIKFINMVAC-UHFFFAOYSA-N 2 1 322.477 4.179 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@@H](C[NH3+])C2)c1 ZINC001235673523 1054766175 /nfs/dbraw/zinc/76/61/75/1054766175.db2.gz BQAPVYDURQVSCT-IBGZPJMESA-N 2 1 308.469 4.141 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001235675646 1054769697 /nfs/dbraw/zinc/76/96/97/1054769697.db2.gz KODVKHOWQBBSMK-OAHLLOKOSA-N 2 1 310.466 4.225 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC001235675260 1054770097 /nfs/dbraw/zinc/77/00/97/1054770097.db2.gz TVTYQBXIHZFEGJ-SFHVURJKSA-N 2 1 300.833 4.136 20 0 DIADMP C[N@@H+](CCC[NH2+]C1CCCCC1)C12CC3CC(CC(C3)C1)C2 ZINC001235689377 1054779605 /nfs/dbraw/zinc/77/96/05/1054779605.db2.gz FYBXZNNDMYFBFX-UHFFFAOYSA-N 2 1 304.522 4.199 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001235693590 1054783395 /nfs/dbraw/zinc/78/33/95/1054783395.db2.gz DJOMCXKDDQKXLM-LJQANCHMSA-N 2 1 312.844 4.280 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@@H+]3CCCC4(C[NH2+]C4)C3)cc12 ZINC001235713625 1054785146 /nfs/dbraw/zinc/78/51/46/1054785146.db2.gz MSBSFAZGFZXWCN-UHFFFAOYSA-N 2 1 322.477 4.240 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CCCC4(C[NH2+]C4)C3)cc12 ZINC001235713625 1054785158 /nfs/dbraw/zinc/78/51/58/1054785158.db2.gz MSBSFAZGFZXWCN-UHFFFAOYSA-N 2 1 322.477 4.240 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1sc(Cl)c2ccccc21 ZINC001235717067 1054788245 /nfs/dbraw/zinc/78/82/45/1054788245.db2.gz CHZKLXDRZIMTLZ-UHFFFAOYSA-N 2 1 322.905 4.376 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC1(C)C ZINC001474152922 1054788347 /nfs/dbraw/zinc/78/83/47/1054788347.db2.gz YLMMOBRAYYWWHI-WMLDXEAASA-N 2 1 324.871 4.393 20 0 DIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2nc(C)cs2)c1 ZINC000623866835 1054792338 /nfs/dbraw/zinc/79/23/38/1054792338.db2.gz HVZZEVBEKORRDA-HNNXBMFYSA-N 2 1 317.502 4.144 20 0 DIADMP CC[N@@H+](Cc1cccc(Oc2ccccc2)c1)C1CC[NH2+]CC1 ZINC001235762388 1054800812 /nfs/dbraw/zinc/80/08/12/1054800812.db2.gz SYOMAXNHFZILQJ-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP CC[N@@H+](Cc1cccc(-c2ccccc2)c1C)C1CC[NH2+]CC1 ZINC001235764443 1054801062 /nfs/dbraw/zinc/80/10/62/1054801062.db2.gz DDKRTJZYHLVNRV-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP CC[N@H+](Cc1ccccc1Oc1ccccc1)C1CC[NH2+]CC1 ZINC001235761544 1054802028 /nfs/dbraw/zinc/80/20/28/1054802028.db2.gz MKPUJURFNDNCFA-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP CC[N@@H+](Cc1ccccc1Oc1ccccc1)C1CC[NH2+]CC1 ZINC001235761544 1054802040 /nfs/dbraw/zinc/80/20/40/1054802040.db2.gz MKPUJURFNDNCFA-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+](CC)C1CC[NH2+]CC1 ZINC001235760598 1054802231 /nfs/dbraw/zinc/80/22/31/1054802231.db2.gz GDRHSGYCIHMKPJ-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](CC)C1CC[NH2+]CC1 ZINC001235760598 1054802242 /nfs/dbraw/zinc/80/22/42/1054802242.db2.gz GDRHSGYCIHMKPJ-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP [NH3+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001235777469 1054803679 /nfs/dbraw/zinc/80/36/79/1054803679.db2.gz MEFLLWCLQOJKNS-MQVJKMGUSA-N 2 1 316.832 4.054 20 0 DIADMP CC1(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC[NH2+]CC1 ZINC001235791764 1054806669 /nfs/dbraw/zinc/80/66/69/1054806669.db2.gz CRBCKIPSNQJPNB-NRFANRHFSA-N 2 1 320.480 4.024 20 0 DIADMP [NH3+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001235809918 1054813473 /nfs/dbraw/zinc/81/34/73/1054813473.db2.gz MEFLLWCLQOJKNS-MUJYYYPQSA-N 2 1 316.832 4.054 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235925593 1054848719 /nfs/dbraw/zinc/84/87/19/1054848719.db2.gz WMMDPWGJCSHVLR-HNNXBMFYSA-N 2 1 310.466 4.368 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1ccccc1-c1ccccc1Cl ZINC001235925571 1054849299 /nfs/dbraw/zinc/84/92/99/1054849299.db2.gz VYQTYVIVEPBXMN-INIZCTEOSA-N 2 1 314.860 4.320 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)CC1 ZINC001235929572 1054852681 /nfs/dbraw/zinc/85/26/81/1054852681.db2.gz RODHHFMPAAPKQL-UFYCRDLUSA-N 2 1 302.506 4.001 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3C[C@@H]4CC[NH2+]C[C@H]4C3)cc12 ZINC001235940332 1054858912 /nfs/dbraw/zinc/85/89/12/1054858912.db2.gz SJOQTZHQCWGDEL-HOTGVXAUSA-N 2 1 322.477 4.096 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC001235940890 1054860764 /nfs/dbraw/zinc/86/07/64/1054860764.db2.gz TYPQANPNRWRQGW-GOEBONIOSA-N 2 1 322.477 4.096 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+](CCC[NH2+]C3CCCCC3)C2)c1 ZINC001235949570 1054866097 /nfs/dbraw/zinc/86/60/97/1054866097.db2.gz BWHGRMWDCACIOJ-QGZVFWFLSA-N 2 1 320.908 4.442 20 0 DIADMP Clc1cccc([C@@H]2CC[N@@H+](CCC[NH2+]C3CCCCC3)C2)c1 ZINC001235949570 1054866108 /nfs/dbraw/zinc/86/61/08/1054866108.db2.gz BWHGRMWDCACIOJ-QGZVFWFLSA-N 2 1 320.908 4.442 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC001235951329 1054866142 /nfs/dbraw/zinc/86/61/42/1054866142.db2.gz QEJVUKAVZLXCBR-IBGZPJMESA-N 2 1 318.505 4.077 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001235950875 1054866494 /nfs/dbraw/zinc/86/64/94/1054866494.db2.gz OAUGSZRJLOUHHM-GOSISDBHSA-N 2 1 318.505 4.077 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001235950875 1054866501 /nfs/dbraw/zinc/86/65/01/1054866501.db2.gz OAUGSZRJLOUHHM-GOSISDBHSA-N 2 1 318.505 4.077 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001235950841 1054867108 /nfs/dbraw/zinc/86/71/08/1054867108.db2.gz NWUVJWKQSLDZQY-HKUYNNGSSA-N 2 1 316.533 4.094 20 0 DIADMP CCC[C@@H](C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)OCC ZINC000624049275 1054867194 /nfs/dbraw/zinc/86/71/94/1054867194.db2.gz CTJCEEYICRHFMD-BEFAXECRSA-N 2 1 315.461 4.037 20 0 DIADMP COc1cccc([C@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)c1 ZINC001235950087 1054867304 /nfs/dbraw/zinc/86/73/04/1054867304.db2.gz OEUBIZVIEBXNDC-HXUWFJFHSA-N 2 1 316.489 4.145 20 0 DIADMP C[N@@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccc(Oc2ccccc2)cc1 ZINC001235950157 1054867326 /nfs/dbraw/zinc/86/73/26/1054867326.db2.gz SJHYCDMUIHSXMU-GOSISDBHSA-N 2 1 324.468 4.300 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)C[C@H]3CCC[NH2+]C3)c(C)c12 ZINC001235956279 1054868901 /nfs/dbraw/zinc/86/89/01/1054868901.db2.gz BSFWSFRFRQYIJY-ZDUSSCGKSA-N 2 1 308.516 4.011 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+](C)C[C@@H]3CCC[NH2+]C3)cc2)c1 ZINC001235956188 1054869019 /nfs/dbraw/zinc/86/90/19/1054869019.db2.gz ANWGIPPFOFMLNH-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)C[C@H]3CCC[NH2+]C3)cc2)cc1 ZINC001235957784 1054869833 /nfs/dbraw/zinc/86/98/33/1054869833.db2.gz UGMMTWKFPARHOG-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP CCCCCCc1csc(C[N@@H+](C)C[C@H]2CCC[NH2+]C2)c1 ZINC001235959356 1054870506 /nfs/dbraw/zinc/87/05/06/1054870506.db2.gz OOUVZWYORKKIHH-KRWDZBQOSA-N 2 1 308.535 4.302 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001235961525 1054873121 /nfs/dbraw/zinc/87/31/21/1054873121.db2.gz DUZDWMBTSKLDEC-UHFFFAOYSA-N 2 1 314.860 4.008 20 0 DIADMP C[N@@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccccc1Oc1ccccc1 ZINC001235970112 1054877295 /nfs/dbraw/zinc/87/72/95/1054877295.db2.gz ZDCOVZIJGHHYRB-SFHVURJKSA-N 2 1 324.468 4.300 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)CC1 ZINC001235975810 1054878985 /nfs/dbraw/zinc/87/89/85/1054878985.db2.gz WZEYMVMYGPNDCP-RBUKOAKNSA-N 2 1 324.512 4.116 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000624119456 1054885751 /nfs/dbraw/zinc/88/57/51/1054885751.db2.gz BJZNUAUBXQAPEH-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624119456 1054885768 /nfs/dbraw/zinc/88/57/68/1054885768.db2.gz BJZNUAUBXQAPEH-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP C[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)C1CCC(C(C)(C)C)CC1 ZINC001236009608 1054893643 /nfs/dbraw/zinc/89/36/43/1054893643.db2.gz WCDCVAZIANAICF-UHFFFAOYSA-N 2 1 320.546 4.431 20 0 DIADMP CC[N@H+](Cc1ccccc1-c1ccc(F)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236007496 1054893693 /nfs/dbraw/zinc/89/36/93/1054893693.db2.gz NNDQEYLADBXCCI-LJQANCHMSA-N 2 1 312.432 4.067 20 0 DIADMP CC[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236007496 1054893696 /nfs/dbraw/zinc/89/36/96/1054893696.db2.gz NNDQEYLADBXCCI-LJQANCHMSA-N 2 1 312.432 4.067 20 0 DIADMP CCC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(F)cc1F ZINC000181660182 1054926984 /nfs/dbraw/zinc/92/69/84/1054926984.db2.gz WPSBZMDZZJTMNN-SFHVURJKSA-N 2 1 321.415 4.381 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728499 1054931741 /nfs/dbraw/zinc/93/17/41/1054931741.db2.gz SJDUTUTWQWLVIR-OLZOCXBDSA-N 2 1 306.837 4.079 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728499 1054931753 /nfs/dbraw/zinc/93/17/53/1054931753.db2.gz SJDUTUTWQWLVIR-OLZOCXBDSA-N 2 1 306.837 4.079 20 0 DIADMP C[N@@H+](CCCCC[NH3+])CCC(c1ccccc1)c1ccccc1 ZINC001236093277 1054940642 /nfs/dbraw/zinc/94/06/42/1054940642.db2.gz UJFBWPAIHYVIKC-UHFFFAOYSA-N 2 1 310.485 4.269 20 0 DIADMP CC[N@H+](Cc1c(F)cccc1Cl)CC1CC2(C1)CC[NH2+]CC2 ZINC001236105094 1054948137 /nfs/dbraw/zinc/94/81/37/1054948137.db2.gz SIDSGPGOGRCUPB-UHFFFAOYSA-N 2 1 324.871 4.081 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2CC2CC3(C2)CC[NH2+]CC3)c1 ZINC001236152492 1054970308 /nfs/dbraw/zinc/97/03/08/1054970308.db2.gz QKTDEIIQEVJPAV-SFHVURJKSA-N 2 1 318.892 4.257 20 0 DIADMP C[C@H](c1cccc2ccccc21)N(C)C[C@H]([NH3+])Cc1ccccc1 ZINC001236188809 1054984159 /nfs/dbraw/zinc/98/41/59/1054984159.db2.gz DPTNPKMSCAOWQQ-YLJYHZDGSA-N 2 1 318.464 4.403 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+](C)C[C@H]([NH3+])Cc1ccccc1 ZINC001236188809 1054984172 /nfs/dbraw/zinc/98/41/72/1054984172.db2.gz DPTNPKMSCAOWQQ-YLJYHZDGSA-N 2 1 318.464 4.403 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)C[C@H]([NH3+])Cc1ccccc1 ZINC001236188809 1054984183 /nfs/dbraw/zinc/98/41/83/1054984183.db2.gz DPTNPKMSCAOWQQ-YLJYHZDGSA-N 2 1 318.464 4.403 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3oc21)[C@]1(C)CCC[NH2+]C1 ZINC001236207195 1054999920 /nfs/dbraw/zinc/99/99/20/1054999920.db2.gz NBKIZOLHMFSTSB-HXUWFJFHSA-N 2 1 308.425 4.160 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)[C@]1(C)CCC[NH2+]C1 ZINC001236207195 1054999928 /nfs/dbraw/zinc/99/99/28/1054999928.db2.gz NBKIZOLHMFSTSB-HXUWFJFHSA-N 2 1 308.425 4.160 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)C[C@@H](C)c2cccc3ccccc32)CC1 ZINC001236213407 1055001930 /nfs/dbraw/zinc/00/19/30/1055001930.db2.gz SJZQOXIUIZUGFC-IPJUCJBFSA-N 2 1 310.485 4.406 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236214672 1055001961 /nfs/dbraw/zinc/00/19/61/1055001961.db2.gz DNCSBCPFSRQDJS-MSOLQXFVSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1ccc2oc3ccccc3c2c1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236214672 1055001974 /nfs/dbraw/zinc/00/19/74/1055001974.db2.gz DNCSBCPFSRQDJS-MSOLQXFVSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236214674 1055003195 /nfs/dbraw/zinc/00/31/95/1055003195.db2.gz DNCSBCPFSRQDJS-QZTJIDSGSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1ccc2oc3ccccc3c2c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236214674 1055003208 /nfs/dbraw/zinc/00/32/08/1055003208.db2.gz DNCSBCPFSRQDJS-QZTJIDSGSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236217596 1055003942 /nfs/dbraw/zinc/00/39/42/1055003942.db2.gz PJXVNXXPOWTYOV-PMACEKPBSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccsc2)c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236217587 1055005886 /nfs/dbraw/zinc/00/58/86/1055005886.db2.gz PFYXVDUEKROUID-ZWKOTPCHSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccsc2)c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236217587 1055005900 /nfs/dbraw/zinc/00/59/00/1055005900.db2.gz PFYXVDUEKROUID-ZWKOTPCHSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236218444 1055006657 /nfs/dbraw/zinc/00/66/57/1055006657.db2.gz RXSQBYQXPDJFPC-PMACEKPBSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236218444 1055006671 /nfs/dbraw/zinc/00/66/71/1055006671.db2.gz RXSQBYQXPDJFPC-PMACEKPBSA-N 2 1 312.432 4.194 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)[C@H]3CCCC[C@H]3[NH3+])c(C)c12 ZINC001236219466 1055008359 /nfs/dbraw/zinc/00/83/59/1055008359.db2.gz WOMJRZQNLVCXLJ-OLZOCXBDSA-N 2 1 308.516 4.281 20 0 DIADMP Cc1csc2sc(C[N@H+](C)[C@H]3CCCC[C@H]3[NH3+])c(C)c12 ZINC001236219466 1055008371 /nfs/dbraw/zinc/00/83/71/1055008371.db2.gz WOMJRZQNLVCXLJ-OLZOCXBDSA-N 2 1 308.516 4.281 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2)s1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236219811 1055010721 /nfs/dbraw/zinc/01/07/21/1055010721.db2.gz XUMYKPPITTVMGK-IAGOWNOFSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236219811 1055010735 /nfs/dbraw/zinc/01/07/35/1055010735.db2.gz XUMYKPPITTVMGK-IAGOWNOFSA-N 2 1 300.471 4.117 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+](C)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236221580 1055012055 /nfs/dbraw/zinc/01/20/55/1055012055.db2.gz CVTPMMOTEQWKAS-HAQNSBGRSA-N 2 1 301.261 4.004 20 0 DIADMP COc1ccc(-c2cccc(C[N@@H+](C)[C@H]3CC[C@H]([NH3+])CC3)c2)cc1 ZINC001236221984 1055012340 /nfs/dbraw/zinc/01/23/40/1055012340.db2.gz IWWUTIAGWHRNOH-MXVIHJGJSA-N 2 1 324.468 4.064 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236221465 1055013011 /nfs/dbraw/zinc/01/30/11/1055013011.db2.gz GLIFUNDXRIFTSU-WGSAOQKQSA-N 2 1 318.505 4.347 20 0 DIADMP C[N@@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224828 1055014003 /nfs/dbraw/zinc/01/40/03/1055014003.db2.gz XJDKLGJYETXTQZ-SHTZXODSSA-N 2 1 313.489 4.167 20 0 DIADMP C[N@@H+](Cc1cccc(C(F)(F)F)c1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223832 1055014741 /nfs/dbraw/zinc/01/47/41/1055014741.db2.gz QIWQVXOEBBTIII-HAQNSBGRSA-N 2 1 320.786 4.061 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)C1(C)CC[NH2+]CC1 ZINC001236226529 1055017667 /nfs/dbraw/zinc/01/76/67/1055017667.db2.gz OAEVGGNBUXMEQR-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP C[N@H+](Cc1sccc1Oc1ccccc1)C1(C)CC[NH2+]CC1 ZINC001236226146 1055018173 /nfs/dbraw/zinc/01/81/73/1055018173.db2.gz KJFXUUSFHKWCEW-UHFFFAOYSA-N 2 1 316.470 4.114 20 0 DIADMP C[N@@H+](Cc1sccc1Oc1ccccc1)C1(C)CC[NH2+]CC1 ZINC001236226146 1055018186 /nfs/dbraw/zinc/01/81/86/1055018186.db2.gz KJFXUUSFHKWCEW-UHFFFAOYSA-N 2 1 316.470 4.114 20 0 DIADMP Cc1cc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)cs1 ZINC001236229456 1055018619 /nfs/dbraw/zinc/01/86/19/1055018619.db2.gz ADJKNQLWBOWNSE-UHFFFAOYSA-N 2 1 314.498 4.329 20 0 DIADMP Cc1c(C[N@H+](C)C2(C)CC[NH2+]CC2)cccc1-c1ccccc1 ZINC001236227812 1055019109 /nfs/dbraw/zinc/01/91/09/1055019109.db2.gz MMRPQXQGBDGXDT-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2cccs2)Cc2ccccc2)CC1 ZINC001236228581 1055019459 /nfs/dbraw/zinc/01/94/59/1055019459.db2.gz WPEZBYSNRSVAQR-UHFFFAOYSA-N 2 1 300.471 4.020 20 0 DIADMP c1ccc(CCCC[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1 ZINC001236285179 1055047927 /nfs/dbraw/zinc/04/79/27/1055047927.db2.gz BXQOHVHBSVPPIY-UHFFFAOYSA-N 2 1 322.496 4.264 20 0 DIADMP c1ccc(C[N@H+](CCC2CCCCC2)C2CC[NH2+]CC2)cc1 ZINC001236288117 1055050059 /nfs/dbraw/zinc/05/00/59/1055050059.db2.gz WCKNXJGPJPMGLW-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP Cc1cc(C)c(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c(C)c1 ZINC001236287144 1055050879 /nfs/dbraw/zinc/05/08/79/1055050879.db2.gz PMIVOJVNDGXPSL-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236304007 1055051871 /nfs/dbraw/zinc/05/18/71/1055051871.db2.gz GAHJLYNRMAMDCU-UHFFFAOYSA-N 2 1 322.496 4.312 20 0 DIADMP c1ccc(CCCC[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236369747 1055076273 /nfs/dbraw/zinc/07/62/73/1055076273.db2.gz CTDKNPRGABGIDN-HXUWFJFHSA-N 2 1 314.517 4.254 20 0 DIADMP Cc1ccc([C@H](C)CC[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)o1 ZINC001236371231 1055076311 /nfs/dbraw/zinc/07/63/11/1055076311.db2.gz IICZYVFYJONOGK-AEFFLSMTSA-N 2 1 318.505 4.326 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc2ccccc2n1 ZINC000184500553 1055078159 /nfs/dbraw/zinc/07/81/59/1055078159.db2.gz CBMBFGZPQKYHMG-DLBZAZTESA-N 2 1 311.473 4.150 20 0 DIADMP Clc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236372840 1055080195 /nfs/dbraw/zinc/08/01/95/1055080195.db2.gz DTJNSLRHHHTYMK-ZDUSSCGKSA-N 2 1 312.910 4.146 20 0 DIADMP Cc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(C)s1 ZINC001236373694 1055080394 /nfs/dbraw/zinc/08/03/94/1055080394.db2.gz JLKXPHJNVHVMTJ-INIZCTEOSA-N 2 1 306.519 4.109 20 0 DIADMP c1ccc(C2CC2)c(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374692 1055081563 /nfs/dbraw/zinc/08/15/63/1055081563.db2.gz SKMCAKQHDCVGCH-QGZVFWFLSA-N 2 1 312.501 4.308 20 0 DIADMP Fc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)ccc1Cl ZINC001236375053 1055081667 /nfs/dbraw/zinc/08/16/67/1055081667.db2.gz UVNYSCCKIPXPRO-OAHLLOKOSA-N 2 1 324.871 4.223 20 0 DIADMP c1c2ccccc2oc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375472 1055083244 /nfs/dbraw/zinc/08/32/44/1055083244.db2.gz YLLFIGVGBJMCCH-INIZCTEOSA-N 2 1 312.457 4.177 20 0 DIADMP CC[N@H+](Cc1ccccc1-c1ccccc1C)C[C@@H]1CC[NH2+]C1 ZINC001236408407 1055100421 /nfs/dbraw/zinc/10/04/21/1055100421.db2.gz LNSSHFALMTYUDX-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000193206563 1055101160 /nfs/dbraw/zinc/10/11/60/1055101160.db2.gz SNOSBJQQHLHXSP-CHWSQXEVSA-N 2 1 312.910 4.144 20 0 DIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206563 1055101163 /nfs/dbraw/zinc/10/11/63/1055101163.db2.gz SNOSBJQQHLHXSP-CHWSQXEVSA-N 2 1 312.910 4.144 20 0 DIADMP CC[N@H+](Cc1ccc2sc3ccccc3c2c1)C[C@H]1CC[NH2+]C1 ZINC001236412518 1055101856 /nfs/dbraw/zinc/10/18/56/1055101856.db2.gz WDWZXHJSANSPRO-INIZCTEOSA-N 2 1 324.493 4.486 20 0 DIADMP CCCCCCc1ccc(C[N@@H+](CC)C[C@@H]2CC[NH2+]C2)s1 ZINC001236412364 1055102797 /nfs/dbraw/zinc/10/27/97/1055102797.db2.gz SVYWGGSYVUACLF-MRXNPFEDSA-N 2 1 308.535 4.302 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415467 1055103231 /nfs/dbraw/zinc/10/32/31/1055103231.db2.gz OKIDJDCEAGTZOA-DOMZBBRYSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415467 1055103244 /nfs/dbraw/zinc/10/32/44/1055103244.db2.gz OKIDJDCEAGTZOA-DOMZBBRYSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccc(C[NH+](C)C)c2)nc1 ZINC001236418612 1055105022 /nfs/dbraw/zinc/10/50/22/1055105022.db2.gz SSOBCPAAXDZWEF-QGZVFWFLSA-N 2 1 323.484 4.185 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421968 1055106590 /nfs/dbraw/zinc/10/65/90/1055106590.db2.gz UZKXOXGQPJVLTK-KUHUBIRLSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421968 1055106599 /nfs/dbraw/zinc/10/65/99/1055106599.db2.gz UZKXOXGQPJVLTK-KUHUBIRLSA-N 2 1 314.860 4.319 20 0 DIADMP CC[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)CC(F)F ZINC000660307337 1055114673 /nfs/dbraw/zinc/11/46/73/1055114673.db2.gz WIIAXNVZSUUDOC-XYJFISCASA-N 2 1 324.459 4.168 20 0 DIADMP CC(C)CCC[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450216 1055119159 /nfs/dbraw/zinc/11/91/59/1055119159.db2.gz FIWOABFEPSBIPN-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP CC(C)CCC[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450216 1055119164 /nfs/dbraw/zinc/11/91/64/1055119164.db2.gz FIWOABFEPSBIPN-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP CC(C)c1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001236456508 1055124096 /nfs/dbraw/zinc/12/40/96/1055124096.db2.gz FOZNMPVSGOQRMM-UHFFFAOYSA-N 2 1 302.506 4.410 20 0 DIADMP CC(C)(C)C[N@H+](Cc1cccc(Cl)c1F)C1CC[NH2+]CC1 ZINC001236456737 1055124341 /nfs/dbraw/zinc/12/43/41/1055124341.db2.gz GOCNTCFYLOMIOA-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc(Cl)c1F)C1CC[NH2+]CC1 ZINC001236456737 1055124347 /nfs/dbraw/zinc/12/43/47/1055124347.db2.gz GOCNTCFYLOMIOA-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP CC(C)(C)C[N@H+](Cc1csc(Cl)c1)C1CC[NH2+]CC1 ZINC001236456679 1055124872 /nfs/dbraw/zinc/12/48/72/1055124872.db2.gz DIEYYFJJCFZPFD-UHFFFAOYSA-N 2 1 300.899 4.002 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1csc(Cl)c1)C1CC[NH2+]CC1 ZINC001236456679 1055124876 /nfs/dbraw/zinc/12/48/76/1055124876.db2.gz DIEYYFJJCFZPFD-UHFFFAOYSA-N 2 1 300.899 4.002 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc(C)c1F ZINC001236457593 1055125093 /nfs/dbraw/zinc/12/50/93/1055125093.db2.gz OKQJFUIDTSQJAF-UHFFFAOYSA-N 2 1 306.469 4.043 20 0 DIADMP CC(C)(C)C[N@H+](Cc1cc(Cl)ccc1F)C1CC[NH2+]CC1 ZINC001236457518 1055125178 /nfs/dbraw/zinc/12/51/78/1055125178.db2.gz MOHMLIKGTIOWMO-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(Cl)ccc1F)C1CC[NH2+]CC1 ZINC001236457518 1055125183 /nfs/dbraw/zinc/12/51/83/1055125183.db2.gz MOHMLIKGTIOWMO-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP Cc1cccc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1Cl ZINC001236458822 1055127320 /nfs/dbraw/zinc/12/73/20/1055127320.db2.gz AFLDZHIILBKCLI-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP Cc1cccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1Cl ZINC001236458822 1055127325 /nfs/dbraw/zinc/12/73/25/1055127325.db2.gz AFLDZHIILBKCLI-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc2occc21)C1CC[NH2+]CC1 ZINC001236459692 1055127381 /nfs/dbraw/zinc/12/73/81/1055127381.db2.gz XJNAMGMSCPXVEU-UHFFFAOYSA-N 2 1 300.446 4.033 20 0 DIADMP CSc1cc(C)cc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236458931 1055127884 /nfs/dbraw/zinc/12/78/84/1055127884.db2.gz DYRWEHPDFKHASX-UHFFFAOYSA-N 2 1 320.546 4.317 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C(C)C)[C@@H]1CCC[NH2+]C1 ZINC001236468436 1055128693 /nfs/dbraw/zinc/12/86/93/1055128693.db2.gz NITPKPDIHKWEQJ-OAHLLOKOSA-N 2 1 302.487 4.172 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+](C(C)C)[C@@H]1CCC[NH2+]C1 ZINC001236468436 1055128695 /nfs/dbraw/zinc/12/86/95/1055128695.db2.gz NITPKPDIHKWEQJ-OAHLLOKOSA-N 2 1 302.487 4.172 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C[C@H]2CC=CCC2)C2CC[NH2+]CC2)c1 ZINC001236481384 1055138856 /nfs/dbraw/zinc/13/88/56/1055138856.db2.gz VFFWOGAABYOXGM-KRWDZBQOSA-N 2 1 316.464 4.044 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236489917 1055144108 /nfs/dbraw/zinc/14/41/08/1055144108.db2.gz ZOJXEAUAYNPILZ-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP CC/C=C\CCC[N@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236491180 1055144316 /nfs/dbraw/zinc/14/43/16/1055144316.db2.gz AYOVXHFKYNMGTF-PLNGDYQASA-N 2 1 318.480 4.435 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236491180 1055144323 /nfs/dbraw/zinc/14/43/23/1055144323.db2.gz AYOVXHFKYNMGTF-PLNGDYQASA-N 2 1 318.480 4.435 20 0 DIADMP CC/C=C\CC[N@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236492618 1055145799 /nfs/dbraw/zinc/14/57/99/1055145799.db2.gz MWGIJFLDVHMTEY-PLNGDYQASA-N 2 1 304.453 4.044 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236492618 1055145807 /nfs/dbraw/zinc/14/58/07/1055145807.db2.gz MWGIJFLDVHMTEY-PLNGDYQASA-N 2 1 304.453 4.044 20 0 DIADMP Cc1cc(F)ccc1C[N@H+](CCCC(C)C)C1CC[NH2+]CC1 ZINC001236518446 1055158272 /nfs/dbraw/zinc/15/82/72/1055158272.db2.gz SIMJCHPLXZJIAK-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000381337294 1055164234 /nfs/dbraw/zinc/16/42/34/1055164234.db2.gz DGYFLEQMENZJEG-INIZCTEOSA-N 2 1 314.498 4.372 20 0 DIADMP CS[C@@H](C)CC[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236533952 1055165122 /nfs/dbraw/zinc/16/51/22/1055165122.db2.gz LCZPVAHCHUGGJK-XIRDDKMYSA-N 2 1 324.509 4.039 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236541796 1055170373 /nfs/dbraw/zinc/17/03/73/1055170373.db2.gz VARYFDKSIKJVSV-MXVIHJGJSA-N 2 1 314.517 4.429 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3occc3c2)CC2CCC2)CC1 ZINC001236542149 1055170426 /nfs/dbraw/zinc/17/04/26/1055170426.db2.gz ONRMEWQMLQNRQP-WGSAOQKQSA-N 2 1 312.457 4.305 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Cl)cc2)CC2CCC2)CC1 ZINC001236542081 1055171068 /nfs/dbraw/zinc/17/10/68/1055171068.db2.gz SUHONGZSSVZQOF-IYARVYRRSA-N 2 1 306.881 4.212 20 0 DIADMP COc1cc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc1Cl ZINC001236549800 1055177393 /nfs/dbraw/zinc/17/73/93/1055177393.db2.gz CTLSGHRSMYTOFP-WKILWMFISA-N 2 1 324.896 4.077 20 0 DIADMP COc1c(C)cc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236550065 1055177575 /nfs/dbraw/zinc/17/75/75/1055177575.db2.gz GJQHASQELPIQTN-WGSAOQKQSA-N 2 1 318.505 4.040 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550534 1055177658 /nfs/dbraw/zinc/17/76/58/1055177658.db2.gz JYMBMXWKUCCLKT-IYARVYRRSA-N 2 1 320.908 4.439 20 0 DIADMP CC(C)C[N@@H+](Cc1c[nH]c2ccc(F)cc12)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551332 1055179451 /nfs/dbraw/zinc/17/94/51/1055179451.db2.gz PQXPDIMPUZXQRW-QAQDUYKDSA-N 2 1 317.452 4.035 20 0 DIADMP CC(C)C[N@@H+](Cc1coc2ccc(F)cc12)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552588 1055179526 /nfs/dbraw/zinc/17/95/26/1055179526.db2.gz SNOFTSPJRPJWQN-QAQDUYKDSA-N 2 1 318.436 4.300 20 0 DIADMP Cc1cccc2[nH]cc(C[N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)c21 ZINC001236551504 1055179582 /nfs/dbraw/zinc/17/95/82/1055179582.db2.gz QWBCYMILAZMNSJ-IYARVYRRSA-N 2 1 313.489 4.204 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236552005 1055179779 /nfs/dbraw/zinc/17/97/79/1055179779.db2.gz RFBQOJDNPYUMSL-IYARVYRRSA-N 2 1 306.881 4.130 20 0 DIADMP Cc1cc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(F)cc1F ZINC001236550999 1055179795 /nfs/dbraw/zinc/17/97/95/1055179795.db2.gz HPPQITARRDAUBE-WKILWMFISA-N 2 1 310.432 4.001 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2cccc(Cl)c2)CC2CC2)CC1 ZINC001236550957 1055179807 /nfs/dbraw/zinc/17/98/07/1055179807.db2.gz JMQQYUNQVBRFPE-WGSAOQKQSA-N 2 1 320.908 4.255 20 0 DIADMP Cc1ccc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1Cl ZINC001236551849 1055180049 /nfs/dbraw/zinc/18/00/49/1055180049.db2.gz MKWGZXWQSXOSPC-QAQDUYKDSA-N 2 1 308.897 4.376 20 0 DIADMP Cc1c(F)cc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1F ZINC001236552469 1055180059 /nfs/dbraw/zinc/18/00/59/1055180059.db2.gz QQABWMVEUOHXMK-WKILWMFISA-N 2 1 310.432 4.001 20 0 DIADMP Cc1ccc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)c1 ZINC001236550953 1055180214 /nfs/dbraw/zinc/18/02/14/1055180214.db2.gz FSLAADORZWBMAR-QAQDUYKDSA-N 2 1 308.897 4.376 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236551989 1055180387 /nfs/dbraw/zinc/18/03/87/1055180387.db2.gz QOSZHYIDAHQNAR-IYARVYRRSA-N 2 1 320.908 4.439 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc2occc2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551467 1055180408 /nfs/dbraw/zinc/18/04/08/1055180408.db2.gz QOYYKAQEZNKNLI-IYARVYRRSA-N 2 1 300.446 4.161 20 0 DIADMP COc1cc(C)c(C)cc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554790 1055181265 /nfs/dbraw/zinc/18/12/65/1055181265.db2.gz VXOOYJAEGPGTOS-WGSAOQKQSA-N 2 1 318.505 4.040 20 0 DIADMP CCOc1cc(C)ccc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554728 1055181324 /nfs/dbraw/zinc/18/13/24/1055181324.db2.gz SKFLCRPBLMGJCG-WGSAOQKQSA-N 2 1 318.505 4.122 20 0 DIADMP CS[C@H](C)CC[N@@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554675 1055182103 /nfs/dbraw/zinc/18/21/03/1055182103.db2.gz PWIIIYKJLMTJRA-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP Cc1ccccc1C[N@@H+](C[C@H]1CC=CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554336 1055182190 /nfs/dbraw/zinc/18/21/90/1055182190.db2.gz GADFVNIDAQCIFE-JBACZVJFSA-N 2 1 312.501 4.423 20 0 DIADMP CCOc1cc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc1C ZINC001236554686 1055182260 /nfs/dbraw/zinc/18/22/60/1055182260.db2.gz QFYSKQDNCRLKQE-WGSAOQKQSA-N 2 1 318.505 4.122 20 0 DIADMP Cc1cc(C)c(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cn1 ZINC001236566063 1055185955 /nfs/dbraw/zinc/18/59/55/1055185955.db2.gz PVJQXKDCISQEAV-KESTWPANSA-N 2 1 315.505 4.103 20 0 DIADMP CC1(C)C[C@H](C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001236565969 1055186251 /nfs/dbraw/zinc/18/62/51/1055186251.db2.gz SRLVEUKKUOFKKJ-ZHALLVOQSA-N 2 1 322.537 4.096 20 0 DIADMP Cc1c(F)cccc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236566439 1055186394 /nfs/dbraw/zinc/18/63/94/1055186394.db2.gz HOSSSAPWHNZRLI-SAABIXHNSA-N 2 1 304.453 4.149 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cnccc2Cl)C2CCCCC2)CC1 ZINC001236566270 1055186776 /nfs/dbraw/zinc/18/67/76/1055186776.db2.gz VLQQADYJWNEVIX-JCNLHEQBSA-N 2 1 321.896 4.140 20 0 DIADMP CCc1ncc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236566671 1055187762 /nfs/dbraw/zinc/18/77/62/1055187762.db2.gz ZXCBRDITGBPRER-KOMQPUFPSA-N 2 1 321.534 4.110 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236567084 1055188037 /nfs/dbraw/zinc/18/80/37/1055188037.db2.gz SNSQYDPPFGAUNG-UAPYVXQJSA-N 2 1 300.490 4.318 20 0 DIADMP CC1(C)CC[C@H]1[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381886825 1055189128 /nfs/dbraw/zinc/18/91/28/1055189128.db2.gz CAUCDGPDRONEDD-RBUKOAKNSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C)CC[C@H]1[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381886826 1055190381 /nfs/dbraw/zinc/19/03/81/1055190381.db2.gz CAUCDGPDRONEDD-RTBURBONSA-N 2 1 300.490 4.067 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccncc2Cl)C2CCCCC2)CC1 ZINC001236568330 1055190348 /nfs/dbraw/zinc/19/03/48/1055190348.db2.gz VQSDAFDZJMMADB-JCNLHEQBSA-N 2 1 321.896 4.140 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cnc1Cl ZINC001236572385 1055192844 /nfs/dbraw/zinc/19/28/44/1055192844.db2.gz WWMYBBABCNHZQJ-JCNLHEQBSA-N 2 1 321.896 4.058 20 0 DIADMP CCCOc1ccccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572095 1055193176 /nfs/dbraw/zinc/19/31/76/1055193176.db2.gz MRLCKGGCFJBFCL-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP Cc1c(F)cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1F ZINC001236572105 1055193277 /nfs/dbraw/zinc/19/32/77/1055193277.db2.gz RXQJKKMAOMYIIO-JCNLHEQBSA-N 2 1 322.443 4.288 20 0 DIADMP CC(C)Oc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236571736 1055193370 /nfs/dbraw/zinc/19/33/70/1055193370.db2.gz FNJNNMNFOIUMCW-UAPYVXQJSA-N 2 1 316.489 4.098 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236572414 1055193569 /nfs/dbraw/zinc/19/35/69/1055193569.db2.gz XVSXNNYBCGFEBQ-UAPYVXQJSA-N 2 1 304.453 4.149 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3c2CCC3)C2CCCC2)CC1 ZINC001236571802 1055193781 /nfs/dbraw/zinc/19/37/81/1055193781.db2.gz HKNPUOPQSCLJOO-KESTWPANSA-N 2 1 312.501 4.190 20 0 DIADMP CC(C)c1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236573238 1055195194 /nfs/dbraw/zinc/19/51/94/1055195194.db2.gz ZTPLAVFBDMLZJV-KESTWPANSA-N 2 1 300.490 4.434 20 0 DIADMP Cc1[nH]c2ccccc2c1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572924 1055195419 /nfs/dbraw/zinc/19/54/19/1055195419.db2.gz XAPVXNYJGSDRRK-JCNLHEQBSA-N 2 1 311.473 4.101 20 0 DIADMP CCOc1cc(C)ccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236577696 1055196877 /nfs/dbraw/zinc/19/68/77/1055196877.db2.gz ZDTYOJRSODRMEF-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)c3ccoc32)C2CCC2)CC1 ZINC001236576084 1055196946 /nfs/dbraw/zinc/19/69/46/1055196946.db2.gz AQNNHXNZXKVGDE-KOMQPUFPSA-N 2 1 316.420 4.196 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236606875 1055204009 /nfs/dbraw/zinc/20/40/09/1055204009.db2.gz XHBZPWIFFNVJHS-CYBMUJFWSA-N 2 1 324.921 4.026 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236606875 1055204020 /nfs/dbraw/zinc/20/40/20/1055204020.db2.gz XHBZPWIFFNVJHS-CYBMUJFWSA-N 2 1 324.921 4.026 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001236616366 1055205953 /nfs/dbraw/zinc/20/59/53/1055205953.db2.gz MQWSWUZNFJEUCN-IBGZPJMESA-N 2 1 310.466 4.225 20 0 DIADMP c1c2ccccc2sc1C[N@H+]([C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236650405 1055212180 /nfs/dbraw/zinc/21/21/80/1055212180.db2.gz CADCMQZQSLJXRL-QGZVFWFLSA-N 2 1 314.498 4.398 20 0 DIADMP c1c2ccccc2sc1C[N@@H+]([C@@H]1CC[NH2+]C1)C1CCCCC1 ZINC001236650405 1055212188 /nfs/dbraw/zinc/21/21/88/1055212188.db2.gz CADCMQZQSLJXRL-QGZVFWFLSA-N 2 1 314.498 4.398 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)C[C@@H]1CCC[NH2+]C1 ZINC001236661307 1055216664 /nfs/dbraw/zinc/21/66/64/1055216664.db2.gz BVQPSAYSCDWCNE-WOJBJXKFSA-N 2 1 302.506 4.109 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)CCC12CC([NH3+])(C1)C2 ZINC001236661246 1055219032 /nfs/dbraw/zinc/21/90/32/1055219032.db2.gz AJJXGKFJJISNGB-MWXLCCTBSA-N 2 1 314.517 4.381 20 0 DIADMP CS[C@H](C)CC[N@@H+](Cc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236725725 1055240147 /nfs/dbraw/zinc/24/01/47/1055240147.db2.gz DEUKXPAIUYADQF-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236726699 1055244242 /nfs/dbraw/zinc/24/42/42/1055244242.db2.gz NPVIUQJDTYRNGA-MHCKVMFOSA-N 2 1 300.490 4.423 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2cccc(C)c2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236726196 1055245361 /nfs/dbraw/zinc/24/53/61/1055245361.db2.gz GZIBUFMZNZMXPB-WGSAOQKQSA-N 2 1 312.457 4.169 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236741727 1055246681 /nfs/dbraw/zinc/24/66/81/1055246681.db2.gz JEXMQSUGRQUNDN-ATZDWAIDSA-N 2 1 306.469 4.334 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)CC2CCCCC2)CC1 ZINC001236743300 1055248917 /nfs/dbraw/zinc/24/89/17/1055248917.db2.gz XFIRIKICGAAGSS-MXVIHJGJSA-N 2 1 318.480 4.478 20 0 DIADMP CS[C@H](C)CC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236743308 1055248998 /nfs/dbraw/zinc/24/89/98/1055248998.db2.gz XPUOUJYKCOSTCS-ZTFGCOKTSA-N 2 1 324.509 4.039 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)ccn1 ZINC001236755286 1055250593 /nfs/dbraw/zinc/25/05/93/1055250593.db2.gz NGNISURQXUAUHD-MXVIHJGJSA-N 2 1 315.505 4.042 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc(F)c1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236766589 1055251566 /nfs/dbraw/zinc/25/15/66/1055251566.db2.gz AQVJHKDXQCWCAD-SHTZXODSSA-N 2 1 310.432 4.083 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)s1 ZINC001236769032 1055254462 /nfs/dbraw/zinc/25/44/62/1055254462.db2.gz ZMIWNMZIGNKUOV-QAQDUYKDSA-N 2 1 308.535 4.483 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cnc1Cl ZINC001236768460 1055255379 /nfs/dbraw/zinc/25/53/79/1055255379.db2.gz URGGCHZVUHTEJN-WKILWMFISA-N 2 1 323.912 4.161 20 0 DIADMP CCC(CC)[N@@H+](Cc1nc(Cl)ccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781830 1055259407 /nfs/dbraw/zinc/25/94/07/1055259407.db2.gz KGMHCLPENHMIEC-KOMQPUFPSA-N 2 1 323.912 4.304 20 0 DIADMP CCC(CC)[N@@H+](Cc1sccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782572 1055259520 /nfs/dbraw/zinc/25/95/20/1055259520.db2.gz UQXBSLYKEVZHSV-CTYIDZIISA-N 2 1 310.507 4.017 20 0 DIADMP CCC(CC)[N@@H+](CCc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783108 1055259605 /nfs/dbraw/zinc/25/96/05/1055259605.db2.gz PHNMQYULVCILPJ-UAPYVXQJSA-N 2 1 306.469 4.129 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)s1 ZINC001236828990 1055279082 /nfs/dbraw/zinc/27/90/82/1055279082.db2.gz JTWNWSUQFPLHLA-QGTPRVQTSA-N 2 1 306.519 4.040 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1 ZINC001236829503 1055279445 /nfs/dbraw/zinc/27/94/45/1055279445.db2.gz KVJVRIALXGVKKY-PCCBWWKXSA-N 2 1 320.480 4.140 20 0 DIADMP CCC[N@H+](Cc1ccc2c(c1)Cc1ccccc1-2)C[C@@H]1CC[NH2+]C1 ZINC001236835960 1055283382 /nfs/dbraw/zinc/28/33/82/1055283382.db2.gz RHNGRWJEHXREBC-GOSISDBHSA-N 2 1 320.480 4.079 20 0 DIADMP CCC[N@H+](Cc1sc(Cl)c2ccccc21)C[C@H]1CC[NH2+]C1 ZINC001236842896 1055288387 /nfs/dbraw/zinc/28/83/87/1055288387.db2.gz CAYNTSQXZKROJI-ZDUSSCGKSA-N 2 1 322.905 4.376 20 0 DIADMP C[C@@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000764966017 1055306215 /nfs/dbraw/zinc/30/62/15/1055306215.db2.gz XOZLYVHCDGNAEL-CVEARBPZSA-N 2 1 300.556 4.008 20 0 DIADMP Clc1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)ccc1-n1ccnc1 ZINC001236915203 1055315051 /nfs/dbraw/zinc/31/50/51/1055315051.db2.gz ZUORYNANALYXMU-DOTOQJQBSA-N 2 1 315.848 4.290 20 0 DIADMP Clc1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)ccc1-n1ccnc1 ZINC001236915210 1055316610 /nfs/dbraw/zinc/31/66/10/1055316610.db2.gz ZUORYNANALYXMU-WBVHZDCISA-N 2 1 315.848 4.290 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@](C)(C[NH3+])C1 ZINC001237079807 1055361600 /nfs/dbraw/zinc/36/16/00/1055361600.db2.gz BSAIPQWTIJLSPX-NRFANRHFSA-N 2 1 308.469 4.223 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@](C)(C[NH3+])C2)cccc1-c1ccccc1 ZINC001237080193 1055361781 /nfs/dbraw/zinc/36/17/81/1055361781.db2.gz DRKRSPJDYWEZOS-OAQYLSRUSA-N 2 1 308.469 4.223 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccccc2)cc1 ZINC001237081865 1055362071 /nfs/dbraw/zinc/36/20/71/1055362071.db2.gz NCIGDOGYRYCIMU-PRJVBOEPSA-N 2 1 306.453 4.055 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2cccs2)s1 ZINC001237082741 1055362112 /nfs/dbraw/zinc/36/21/12/1055362112.db2.gz WBNWPLOZQAAKBS-AGUYFDCRSA-N 2 1 318.511 4.178 20 0 DIADMP Fc1ccc(C[N@H+](C2CCC2)[C@H]2CCC[NH2+]C2)c2ccccc12 ZINC001237154144 1055386706 /nfs/dbraw/zinc/38/67/06/1055386706.db2.gz KBDDDAZXVCSJDW-KRWDZBQOSA-N 2 1 312.432 4.085 20 0 DIADMP Fc1ccc(C[N@@H+](C2CCC2)[C@H]2CCC[NH2+]C2)c2ccccc12 ZINC001237154144 1055386720 /nfs/dbraw/zinc/38/67/20/1055386720.db2.gz KBDDDAZXVCSJDW-KRWDZBQOSA-N 2 1 312.432 4.085 20 0 DIADMP CC1(C[NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)CCCCC1 ZINC001237275331 1055413416 /nfs/dbraw/zinc/41/34/16/1055413416.db2.gz LPIGWSYPYMKQBL-UHFFFAOYSA-N 2 1 312.501 4.094 20 0 DIADMP CC1=CC[C@H](CC[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)C1(C)C ZINC001237358120 1055438575 /nfs/dbraw/zinc/43/85/75/1055438575.db2.gz CBZXFJNOEJZFRU-LJQANCHMSA-N 2 1 324.512 4.463 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001237359894 1055439114 /nfs/dbraw/zinc/43/91/14/1055439114.db2.gz RIZMPBTXOOXLAL-QGZVFWFLSA-N 2 1 300.490 4.297 20 0 DIADMP CC(C)=CCC[C@H](C)C[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001237358247 1055439778 /nfs/dbraw/zinc/43/97/78/1055439778.db2.gz DQWKOYKQJCNERP-SFHVURJKSA-N 2 1 312.501 4.463 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)cc2)cc1 ZINC001237383103 1055445749 /nfs/dbraw/zinc/44/57/49/1055445749.db2.gz OENYWLMHLPKJDS-RXVVDRJESA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)cc2)cc1 ZINC001237383103 1055445755 /nfs/dbraw/zinc/44/57/55/1055445755.db2.gz OENYWLMHLPKJDS-RXVVDRJESA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)c2)cc1 ZINC001237380196 1055445917 /nfs/dbraw/zinc/44/59/17/1055445917.db2.gz FYHHBLALAFFNMI-NQIIRXRSSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)c2)cc1 ZINC001237380196 1055445925 /nfs/dbraw/zinc/44/59/25/1055445925.db2.gz FYHHBLALAFFNMI-NQIIRXRSSA-N 2 1 322.452 4.053 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)s2)c1 ZINC001237389383 1055446066 /nfs/dbraw/zinc/44/60/66/1055446066.db2.gz FZUJQXGAQAWRLD-HIFRSBDPSA-N 2 1 318.511 4.051 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)s2)c1 ZINC001237389383 1055446072 /nfs/dbraw/zinc/44/60/72/1055446072.db2.gz FZUJQXGAQAWRLD-HIFRSBDPSA-N 2 1 318.511 4.051 20 0 DIADMP Fc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1-c1ccccc1 ZINC001237411014 1055449690 /nfs/dbraw/zinc/44/96/90/1055449690.db2.gz FGSWSOOGTIMRNF-WIYYLYMNSA-N 2 1 324.443 4.067 20 0 DIADMP Fc1ccc(C[N@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1-c1ccccc1 ZINC001237411014 1055449699 /nfs/dbraw/zinc/44/96/99/1055449699.db2.gz FGSWSOOGTIMRNF-WIYYLYMNSA-N 2 1 324.443 4.067 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)c2)cc1 ZINC001237412707 1055449740 /nfs/dbraw/zinc/44/97/40/1055449740.db2.gz HHICBCNSUMSREK-FCHUYYIVSA-N 2 1 320.480 4.236 20 0 DIADMP Fc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1-c1ccccc1 ZINC001237411010 1055451150 /nfs/dbraw/zinc/45/11/50/1055451150.db2.gz FGSWSOOGTIMRNF-NQIIRXRSSA-N 2 1 324.443 4.067 20 0 DIADMP Fc1ccc(C[N@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1-c1ccccc1 ZINC001237411010 1055451155 /nfs/dbraw/zinc/45/11/55/1055451155.db2.gz FGSWSOOGTIMRNF-NQIIRXRSSA-N 2 1 324.443 4.067 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2c(F)cccc12)C1CCN(C)CC1 ZINC001237524114 1055467468 /nfs/dbraw/zinc/46/74/68/1055467468.db2.gz CNVWHMYAZCGLSW-UHFFFAOYSA-N 2 1 314.448 4.284 20 0 DIADMP Cc1c(C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)cccc1-c1ccccc1 ZINC001237585961 1055479890 /nfs/dbraw/zinc/47/98/90/1055479890.db2.gz SNMZUVQTZSQMDM-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP CC[N@@H+]1C[C@@H]2C[NH+](Cc3cccc(-c4ccccc4)c3C)C[C@@H]2C1 ZINC001237587760 1055481018 /nfs/dbraw/zinc/48/10/18/1055481018.db2.gz IOWSGENLPAPPJB-OYRHEFFESA-N 2 1 320.480 4.046 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc3ccccc32)C1 ZINC001620868500 1055495810 /nfs/dbraw/zinc/49/58/10/1055495810.db2.gz FJFPHAUGBAJRQN-SFHVURJKSA-N 2 1 310.485 4.297 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2)C1 ZINC001620868688 1055496004 /nfs/dbraw/zinc/49/60/04/1055496004.db2.gz MGWGWGBTOGWWKQ-IBGZPJMESA-N 2 1 310.485 4.297 20 0 DIADMP CSCc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC001620868435 1055496889 /nfs/dbraw/zinc/49/68/89/1055496889.db2.gz CPJYDPXBPXBVTJ-LJQANCHMSA-N 2 1 320.546 4.007 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccccc1C(F)(F)F ZINC000386561550 1055501031 /nfs/dbraw/zinc/50/10/31/1055501031.db2.gz OBFICUCUMRMSNU-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccccc1C(F)(F)F ZINC000386561550 1055501048 /nfs/dbraw/zinc/50/10/48/1055501048.db2.gz OBFICUCUMRMSNU-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCC[C@H](C(C)(C)C)CC2)CCCO1 ZINC001620899759 1055526272 /nfs/dbraw/zinc/52/62/72/1055526272.db2.gz NJIDZIJYFSMHSN-CEXWTWQISA-N 2 1 324.553 4.072 20 0 DIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H]2CCC[C@H](C(C)(C)C)CC2)CCCO1 ZINC001620899759 1055526288 /nfs/dbraw/zinc/52/62/88/1055526288.db2.gz NJIDZIJYFSMHSN-CEXWTWQISA-N 2 1 324.553 4.072 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@H](F)CC3)cc21 ZINC001237881279 1055547524 /nfs/dbraw/zinc/54/75/24/1055547524.db2.gz QACKDTRMDKJVCD-KRWDZBQOSA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@@H](F)CC3)cc21 ZINC001237881280 1055548882 /nfs/dbraw/zinc/54/88/82/1055548882.db2.gz QACKDTRMDKJVCD-QGZVFWFLSA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C/C=C\c1ccc(F)cc1F ZINC001620945972 1055561456 /nfs/dbraw/zinc/56/14/56/1055561456.db2.gz BRJJXENPYCVBGS-XFHJGTJQSA-N 2 1 322.443 4.078 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC[C@]2(C1)CCC[N@H+](CCCOC)C2 ZINC001278208098 1055630070 /nfs/dbraw/zinc/63/00/70/1055630070.db2.gz SOIUTCZBHCANTG-WOJBJXKFSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCCOC)C2 ZINC001278208098 1055630078 /nfs/dbraw/zinc/63/00/78/1055630078.db2.gz SOIUTCZBHCANTG-WOJBJXKFSA-N 2 1 324.553 4.027 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001620964778 1055667411 /nfs/dbraw/zinc/66/74/11/1055667411.db2.gz FLZJSOYPZGGIIG-KRWDZBQOSA-N 2 1 300.490 4.166 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(F)c(C2CC2)c1)C1CCN(C)CC1 ZINC001238516627 1055676055 /nfs/dbraw/zinc/67/60/55/1055676055.db2.gz PQPVNHSMEYRPLE-UHFFFAOYSA-N 2 1 304.453 4.008 20 0 DIADMP CC(C)(C)[C@H]1CCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001620966791 1055700726 /nfs/dbraw/zinc/70/07/26/1055700726.db2.gz KMEGOJTYJAZGPQ-PMACEKPBSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC[N@@H+]2CCCC2(C)C)C1 ZINC001620967788 1055715302 /nfs/dbraw/zinc/71/53/02/1055715302.db2.gz ZQSGCTAXAJSPFX-SXLOBPIMSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CC[N@H+]2CCCC2(C)C)C1 ZINC001620967788 1055715311 /nfs/dbraw/zinc/71/53/11/1055715311.db2.gz ZQSGCTAXAJSPFX-SXLOBPIMSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+]2CC2CCCCC2)C[C@@H]1C ZINC001620770665 1055941037 /nfs/dbraw/zinc/94/10/37/1055941037.db2.gz ZDNONKCJPPWIND-UMGGQSCQSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000671743760 1055941363 /nfs/dbraw/zinc/94/13/63/1055941363.db2.gz RYJDBGWJMYQJEE-PBPGXSGUSA-N 2 1 300.490 4.065 20 0 DIADMP C[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506604 1055961259 /nfs/dbraw/zinc/96/12/59/1055961259.db2.gz JMUZBJVNPQAWMB-LEWJYISDSA-N 2 1 312.501 4.260 20 0 DIADMP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506604 1055961268 /nfs/dbraw/zinc/96/12/68/1055961268.db2.gz JMUZBJVNPQAWMB-LEWJYISDSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2C[N@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506604 1055961279 /nfs/dbraw/zinc/96/12/79/1055961279.db2.gz JMUZBJVNPQAWMB-LEWJYISDSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506604 1055961293 /nfs/dbraw/zinc/96/12/93/1055961293.db2.gz JMUZBJVNPQAWMB-LEWJYISDSA-N 2 1 312.501 4.260 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)C1CCCCC1 ZINC001620997120 1055965224 /nfs/dbraw/zinc/96/52/24/1055965224.db2.gz XMAHXOBLYVPJIA-MJGOQNOKSA-N 2 1 324.553 4.214 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)C1CCCCC1 ZINC001620997118 1055965293 /nfs/dbraw/zinc/96/52/93/1055965293.db2.gz XMAHXOBLYVPJIA-HKUYNNGSSA-N 2 1 324.553 4.214 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)CSC(C)(C)C)c1 ZINC000765775044 1055994490 /nfs/dbraw/zinc/99/44/90/1055994490.db2.gz JKJPYYSFMQYMLL-OAHLLOKOSA-N 2 1 308.535 4.148 20 0 DIADMP c1cc2cnccc2c(C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001621036826 1055998785 /nfs/dbraw/zinc/99/87/85/1055998785.db2.gz QBFQRYXQWWDRAM-FQEVSTJZSA-N 2 1 323.484 4.122 20 0 DIADMP c1cc2cnccc2c(C[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001621036826 1055998795 /nfs/dbraw/zinc/99/87/95/1055998795.db2.gz QBFQRYXQWWDRAM-FQEVSTJZSA-N 2 1 323.484 4.122 20 0 DIADMP Clc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)o1 ZINC000071009257 1056026630 /nfs/dbraw/zinc/02/66/30/1056026630.db2.gz ZKYNIEYMHWRYEI-UHFFFAOYSA-N 2 1 318.848 4.209 20 0 DIADMP CCC[C@@H](C[NH2+][C@@H]1CC[N@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821213 1056208760 /nfs/dbraw/zinc/20/87/60/1056208760.db2.gz OJTNDPICRRAMOV-LEWJYISDSA-N 2 1 314.517 4.424 20 0 DIADMP CCC[C@@H](C[NH2+][C@@H]1CC[N@@H+](CC2CCCC2)C1)c1ccccc1 ZINC001620821213 1056208775 /nfs/dbraw/zinc/20/87/75/1056208775.db2.gz OJTNDPICRRAMOV-LEWJYISDSA-N 2 1 314.517 4.424 20 0 DIADMP CC[C@H](C)[N@@H+](C)CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614454 1056329208 /nfs/dbraw/zinc/32/92/08/1056329208.db2.gz SJOKGMKAWPRXGJ-HESLUPGFSA-N 2 1 308.432 4.064 20 0 DIADMP CC[C@H](C)[N@H+](C)CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614454 1056329192 /nfs/dbraw/zinc/32/91/92/1056329192.db2.gz SJOKGMKAWPRXGJ-HESLUPGFSA-N 2 1 308.432 4.064 20 0 DIADMP CC[NH+](CC)C[C@@H](C)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474723143 1056343037 /nfs/dbraw/zinc/34/30/37/1056343037.db2.gz DAECDYSIVYPASR-DNDYEEKYSA-N 2 1 308.432 4.064 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(C)cccc2C)CC1 ZINC000303740318 1056410449 /nfs/dbraw/zinc/41/04/49/1056410449.db2.gz IGCMFVXZCOJPKK-UHFFFAOYSA-N 2 1 302.506 4.247 20 0 DIADMP C[NH+](C)Cc1cccc(C2=CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC001240388192 1056472237 /nfs/dbraw/zinc/47/22/37/1056472237.db2.gz CXMQEMPZDCSBJO-UHFFFAOYSA-N 2 1 306.453 4.038 20 0 DIADMP CC(C)([NH3+])c1ccccc1C1=CCC[N@@H+](Cc2ccccc2)C1 ZINC001240389070 1056473523 /nfs/dbraw/zinc/47/35/23/1056473523.db2.gz UKERMZNCJBNXIW-UHFFFAOYSA-N 2 1 306.453 4.170 20 0 DIADMP C[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)CC(C)(C)C ZINC001615392196 1056505742 /nfs/dbraw/zinc/50/57/42/1056505742.db2.gz IRAULSKFGNMVMH-UHFFFAOYSA-N 2 1 316.533 4.309 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC001615540412 1056532195 /nfs/dbraw/zinc/53/21/95/1056532195.db2.gz UVMUVHCEPZQGCO-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615540412 1056532202 /nfs/dbraw/zinc/53/22/02/1056532202.db2.gz UVMUVHCEPZQGCO-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615540412 1056532211 /nfs/dbraw/zinc/53/22/11/1056532211.db2.gz UVMUVHCEPZQGCO-UXHICEINSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(C)c1C ZINC001615595968 1056542515 /nfs/dbraw/zinc/54/25/15/1056542515.db2.gz QMGPPICBWHRTCI-HXUWFJFHSA-N 2 1 314.517 4.146 20 0 DIADMP CN(CC[C@H]1CCCC[N@H+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668609 1056558243 /nfs/dbraw/zinc/55/82/43/1056558243.db2.gz JAUMAGDUPGHHBJ-GOSISDBHSA-N 2 1 318.505 4.170 20 0 DIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668609 1056558256 /nfs/dbraw/zinc/55/82/56/1056558256.db2.gz JAUMAGDUPGHHBJ-GOSISDBHSA-N 2 1 318.505 4.170 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668609 1056558265 /nfs/dbraw/zinc/55/82/65/1056558265.db2.gz JAUMAGDUPGHHBJ-GOSISDBHSA-N 2 1 318.505 4.170 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668609 1056558272 /nfs/dbraw/zinc/55/82/72/1056558272.db2.gz JAUMAGDUPGHHBJ-GOSISDBHSA-N 2 1 318.505 4.170 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668609 1056558282 /nfs/dbraw/zinc/55/82/82/1056558282.db2.gz JAUMAGDUPGHHBJ-GOSISDBHSA-N 2 1 318.505 4.170 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001615665353 1056559272 /nfs/dbraw/zinc/55/92/72/1056559272.db2.gz MXFBHVOEKDBGAS-HMXCVIKNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001615665353 1056559284 /nfs/dbraw/zinc/55/92/84/1056559284.db2.gz MXFBHVOEKDBGAS-HMXCVIKNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001615665353 1056559298 /nfs/dbraw/zinc/55/92/98/1056559298.db2.gz MXFBHVOEKDBGAS-HMXCVIKNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001615665351 1056559635 /nfs/dbraw/zinc/55/96/35/1056559635.db2.gz MXFBHVOEKDBGAS-GIVPXCGWSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001615665351 1056559645 /nfs/dbraw/zinc/55/96/45/1056559645.db2.gz MXFBHVOEKDBGAS-GIVPXCGWSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001615665351 1056559656 /nfs/dbraw/zinc/55/96/56/1056559656.db2.gz MXFBHVOEKDBGAS-GIVPXCGWSA-N 2 1 314.517 4.267 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)o1 ZINC000112710449 1056650673 /nfs/dbraw/zinc/65/06/73/1056650673.db2.gz DSUHZUVPLZTUGC-UHFFFAOYSA-N 2 1 312.457 4.254 20 0 DIADMP COc1ccccc1[C@@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001620831099 1056650824 /nfs/dbraw/zinc/65/08/24/1056650824.db2.gz JGGLKKHSPXLHFM-SJLPKXTDSA-N 2 1 318.505 4.245 20 0 DIADMP Fc1ccc([C@H]2CCC[N@@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC001616576214 1056681393 /nfs/dbraw/zinc/68/13/93/1056681393.db2.gz JUGGWSLJBWGKKY-SFHVURJKSA-N 2 1 318.480 4.271 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC001616622537 1056688836 /nfs/dbraw/zinc/68/88/36/1056688836.db2.gz JEPRWJVHASVXAA-LPHOPBHVSA-N 2 1 304.453 4.131 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)c2ccccc21 ZINC000672806858 1056777550 /nfs/dbraw/zinc/77/75/50/1056777550.db2.gz AYIGFGPXILJGBP-HRCADAONSA-N 2 1 312.432 4.256 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC001617197884 1056791717 /nfs/dbraw/zinc/79/17/17/1056791717.db2.gz FXGPYKUDKGFUHX-LPHOPBHVSA-N 2 1 302.506 4.461 20 0 DIADMP Cc1ccccc1[C@@H](C)[N@H+](CC[C@H]1CCC[NH+]1C)CC(C)C ZINC001617888635 1056897783 /nfs/dbraw/zinc/89/77/83/1056897783.db2.gz UTMLCPFRZNFBCA-RTBURBONSA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH+](CC[C@H]1CCC[N@@H+]1C)CC(C)C ZINC001617888635 1056897792 /nfs/dbraw/zinc/89/77/92/1056897792.db2.gz UTMLCPFRZNFBCA-RTBURBONSA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH+](CC[C@H]1CCC[N@H+]1C)CC(C)C ZINC001617888635 1056897799 /nfs/dbraw/zinc/89/77/99/1056897799.db2.gz UTMLCPFRZNFBCA-RTBURBONSA-N 2 1 302.506 4.498 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCCC[C@@H]2c2ccccc2Cl)CC1 ZINC000657823898 1057019738 /nfs/dbraw/zinc/01/97/38/1057019738.db2.gz PYRVQSMELVHRBH-AEFFLSMTSA-N 2 1 306.881 4.050 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000390791447 1057050084 /nfs/dbraw/zinc/05/00/84/1057050084.db2.gz WTJYVYOLBYSZJC-ICSRJNTNSA-N 2 1 308.469 4.249 20 0 DIADMP c1ccc(C[N@@H+]2CC=C(c3ccc(C[NH+]4CCC4)cc3)CC2)cc1 ZINC001241506388 1057077713 /nfs/dbraw/zinc/07/77/13/1057077713.db2.gz DOTSQAGWPWVSIU-UHFFFAOYSA-N 2 1 318.464 4.182 20 0 DIADMP C[NH+](C)Cc1cc(C2=CC[N@@H+](Cc3ccccc3)CC2)ccc1F ZINC001241508101 1057078184 /nfs/dbraw/zinc/07/81/84/1057078184.db2.gz ZTOSCVPXSMJORY-UHFFFAOYSA-N 2 1 324.443 4.177 20 0 DIADMP C[NH+](C)Cc1cccc(C2=CC[N@@H+](Cc3ccccc3)CC2)c1F ZINC001241507868 1057078873 /nfs/dbraw/zinc/07/88/73/1057078873.db2.gz SIRLVMNFTPVOFW-UHFFFAOYSA-N 2 1 324.443 4.177 20 0 DIADMP C[N@H+]1CCC=C(c2ccc(C(F)(F)F)cc2C[NH+]2CCCC2)C1 ZINC001241571593 1057094226 /nfs/dbraw/zinc/09/42/26/1057094226.db2.gz AMHVZPCAUMGFSO-UHFFFAOYSA-N 2 1 324.390 4.020 20 0 DIADMP Cc1cc(N)[nH+]cc1-c1cccc2c1C[N@H+](Cc1ccccc1)C2 ZINC001242090206 1057260417 /nfs/dbraw/zinc/26/04/17/1057260417.db2.gz PVUDYCYTJCDCPP-UHFFFAOYSA-N 2 1 315.420 4.155 20 0 DIADMP Cc1cc(N)[nH+]cc1-c1cccc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001242090206 1057260423 /nfs/dbraw/zinc/26/04/23/1057260423.db2.gz PVUDYCYTJCDCPP-UHFFFAOYSA-N 2 1 315.420 4.155 20 0 DIADMP CC[N@H+]1CCc2cc(-c3cccc(C[NH+]4CCCC4)c3)ccc2C1 ZINC001242119441 1057269135 /nfs/dbraw/zinc/26/91/35/1057269135.db2.gz VTFRJZGNKJKURC-UHFFFAOYSA-N 2 1 320.480 4.327 20 0 DIADMP CCOC(=[NH2+])c1cccc(-c2cccc(C[NH+]3CCCC3)c2)c1 ZINC001242122854 1057270123 /nfs/dbraw/zinc/27/01/23/1057270123.db2.gz PSKMOUXUVPUHDD-UHFFFAOYSA-N 2 1 308.425 4.311 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCCOC(C)(C)C)CC1 ZINC000675641493 1057390598 /nfs/dbraw/zinc/39/05/98/1057390598.db2.gz JORSXIADVGDCKQ-GOSISDBHSA-N 2 1 324.553 4.168 20 0 DIADMP CC[N@H+]1CCc2cc(C3=CC[C@H]([NH+]4CCCC4)CC3)ccc2C1 ZINC001242694823 1057450288 /nfs/dbraw/zinc/45/02/88/1057450288.db2.gz NTYDZGVGHJSQTM-NRFANRHFSA-N 2 1 310.485 4.096 20 0 DIADMP C1=CC[C@H](C[NH+]2CCC3(CC[N@H+](C4CCCC4)C3)CC2)CC1 ZINC001278386540 1058024872 /nfs/dbraw/zinc/02/48/72/1058024872.db2.gz QFANJYYNYJXSPV-SFHVURJKSA-N 2 1 302.506 4.073 20 0 DIADMP C[NH2+]Cc1cccc(-c2ccc3[nH]c4cc[nH+]cc4c3c2)c1F ZINC001244862308 1058059555 /nfs/dbraw/zinc/05/95/55/1058059555.db2.gz CHZLRCLPAHHSFZ-UHFFFAOYSA-N 2 1 305.356 4.242 20 0 DIADMP CC[N@H+]1CCc2cc(-c3ccc([C@H]4CCC[NH2+]4)cc3)ccc2C1 ZINC001245350153 1058149982 /nfs/dbraw/zinc/14/99/82/1058149982.db2.gz RFTUQKUDYRZUHG-OAQYLSRUSA-N 2 1 306.453 4.156 20 0 DIADMP CC[N@H+]1CCc2cc(-c3ccc([C@@H]4CCC[NH2+]4)cc3)ccc2C1 ZINC001245350152 1058150002 /nfs/dbraw/zinc/15/00/02/1058150002.db2.gz RFTUQKUDYRZUHG-NRFANRHFSA-N 2 1 306.453 4.156 20 0 DIADMP C[N@H+]1CC[C@@H](c2ccc(-c3ccc([C@@H]4CCC[NH2+]4)cc3)cc2)C1 ZINC001245355655 1058150996 /nfs/dbraw/zinc/15/09/96/1058150996.db2.gz JPOWGFSYHNKZCH-RTWAWAEBSA-N 2 1 306.453 4.197 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001548928495 1058275288 /nfs/dbraw/zinc/27/52/88/1058275288.db2.gz NMWGINZDYYBLST-YXIVMFJDSA-N 2 1 324.443 4.155 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@H](c3ccncc3)C3CCC3)CC[NH2+]2)cc1 ZINC001550351846 1058338963 /nfs/dbraw/zinc/33/89/63/1058338963.db2.gz SLDUAVMSHINFEF-ACRUOGEOSA-N 2 1 321.468 4.006 20 0 DIADMP Cc1ccc(C2([NH2+][C@@H]3CC[C@@H](c4[nH+]ccn4C)C3)CCC2)cc1 ZINC001550512887 1058341580 /nfs/dbraw/zinc/34/15/80/1058341580.db2.gz IULPOMOJSPRALO-SJLPKXTDSA-N 2 1 309.457 4.034 20 0 DIADMP FC1CC([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)(c2ccccc2)C1 ZINC001552312468 1058433250 /nfs/dbraw/zinc/43/32/50/1058433250.db2.gz PWABGAUPIBYHBV-OMYXNUHHSA-N 2 1 324.443 4.097 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC001246065843 1058658738 /nfs/dbraw/zinc/65/87/38/1058658738.db2.gz NGKXNBIPTDQBRT-PKOBYXMFSA-N 2 1 304.453 4.097 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246063187 1058660076 /nfs/dbraw/zinc/66/00/76/1058660076.db2.gz AVEQQSJIVRYDMA-BIGGFVEDSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)c1 ZINC001246071194 1058662694 /nfs/dbraw/zinc/66/26/94/1058662694.db2.gz ITBDBOSIZMLSMH-UYAOXDASSA-N 2 1 312.432 4.025 20 0 DIADMP C[C@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1ccc(Cl)cc1Cl ZINC001246074974 1058666366 /nfs/dbraw/zinc/66/63/66/1058666366.db2.gz HNNVQOJNLSNCBI-MXWKQRLJSA-N 2 1 301.261 4.173 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076568 1058667105 /nfs/dbraw/zinc/66/71/05/1058667105.db2.gz PBXVPVGHLQFXGB-HOTGVXAUSA-N 2 1 306.881 4.085 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1Cl ZINC001246076917 1058667258 /nfs/dbraw/zinc/66/72/58/1058667258.db2.gz QDIRPWFSZVULHQ-RUZUBIRVSA-N 2 1 313.272 4.317 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246076320 1058667694 /nfs/dbraw/zinc/66/76/94/1058667694.db2.gz NIKANTKHPDHPJV-DETPVDSQSA-N 2 1 315.288 4.421 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)C[C@H](CC)[NH2+]1 ZINC001246078874 1058669677 /nfs/dbraw/zinc/66/96/77/1058669677.db2.gz XRSRVRNPETVOOE-FVQHAEBGSA-N 2 1 306.881 4.228 20 0 DIADMP Fc1cc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)ccc1Cl ZINC001246087561 1058669786 /nfs/dbraw/zinc/66/97/86/1058669786.db2.gz PASFSYKRKSGWHZ-MAUKXSAKSA-N 2 1 318.823 4.062 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246084117 1058670631 /nfs/dbraw/zinc/67/06/31/1058670631.db2.gz WBOVVCUOBPCGBM-AEFFLSMTSA-N 2 1 304.453 4.240 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(Cl)c2F)CC[NH2+]1 ZINC001246104447 1058677640 /nfs/dbraw/zinc/67/76/40/1058677640.db2.gz JRNHYSYUSMAQLV-RDBSUJKOSA-N 2 1 312.860 4.441 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](C)c2cccc(Cl)c2F)C[C@@H](CC)[NH2+]1 ZINC001246107724 1058681194 /nfs/dbraw/zinc/68/11/94/1058681194.db2.gz UMLAZFXKQMBNJA-JHJVBQTASA-N 2 1 312.860 4.439 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(Cl)c2F)C[C@H](CC)[NH2+]1 ZINC001246107726 1058681744 /nfs/dbraw/zinc/68/17/44/1058681744.db2.gz UMLAZFXKQMBNJA-MQYQWHSLSA-N 2 1 312.860 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H](C)c2cccs2)CC[NH2+]1 ZINC001246114554 1058684438 /nfs/dbraw/zinc/68/44/38/1058684438.db2.gz NNRWIRNLTUAKSM-UNEWFSDZSA-N 2 1 318.461 4.340 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](C)C2)CC[NH2+]1 ZINC001246115320 1058684566 /nfs/dbraw/zinc/68/45/66/1058684566.db2.gz HGWZQDNFEAWLSK-TWILYEHCSA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246155204 1058702887 /nfs/dbraw/zinc/70/28/87/1058702887.db2.gz VSZPBEVLAXDWDO-CABCVRRESA-N 2 1 315.288 4.250 20 0 DIADMP CCC1CCC([NH2+][C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CC1 ZINC001246171213 1058715439 /nfs/dbraw/zinc/71/54/39/1058715439.db2.gz KXOAEXHTLJFKPM-YFYIHBKUSA-N 2 1 318.480 4.486 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2)CC[NH2+]1 ZINC001246176797 1058718160 /nfs/dbraw/zinc/71/81/60/1058718160.db2.gz QHTDZJZVOHGYJR-ZTNFWEORSA-N 2 1 312.432 4.278 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CCC2CCCCC2)CC[NH2+]1 ZINC001246177285 1058723727 /nfs/dbraw/zinc/72/37/27/1058723727.db2.gz IKPCGCRWMAFYAC-ICSRJNTNSA-N 2 1 318.480 4.487 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@@H]1CCCC[NH2+]1 ZINC001246182261 1058727931 /nfs/dbraw/zinc/72/79/31/1058727931.db2.gz ZLEVECZKQQUFCR-NQIIRXRSSA-N 2 1 322.496 4.329 20 0 DIADMP CC[C@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246190279 1058730718 /nfs/dbraw/zinc/73/07/18/1058730718.db2.gz GINANHNIWUXFFF-ROUUACIJSA-N 2 1 310.441 4.099 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246196896 1058736619 /nfs/dbraw/zinc/73/66/19/1058736619.db2.gz WUNSSYANLHCODU-KBPBESRZSA-N 2 1 315.288 4.394 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246200979 1058741039 /nfs/dbraw/zinc/74/10/39/1058741039.db2.gz SWMIVTRYIXTDHM-MUJYYYPQSA-N 2 1 304.437 4.019 20 0 DIADMP Cc1cc(F)cc(C)c1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246201062 1058741815 /nfs/dbraw/zinc/74/18/15/1058741815.db2.gz UKLOTLWBZMTELK-AZUAARDMSA-N 2 1 312.432 4.025 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C[C@]1(C)CC[NH2+]CC1(F)F ZINC001246223379 1058747569 /nfs/dbraw/zinc/74/75/69/1058747569.db2.gz VPARPBNKOAYOOZ-MSOLQXFVSA-N 2 1 324.459 4.012 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246229891 1058752060 /nfs/dbraw/zinc/75/20/60/1058752060.db2.gz MUBVEESJBGITSV-MGFONVBGSA-N 2 1 316.464 4.096 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246230901 1058752287 /nfs/dbraw/zinc/75/22/87/1058752287.db2.gz ASERINBTSDFOBV-IEZWGBDMSA-N 2 1 306.469 4.486 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]C2(c3cccc(Cl)c3)CC2)C[C@H](CC)[NH2+]1 ZINC001246237298 1058759725 /nfs/dbraw/zinc/75/97/25/1058759725.db2.gz NNJJCJSGHKVTGD-FVQHAEBGSA-N 2 1 306.881 4.228 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)cc(Cl)c1 ZINC001246255269 1058775075 /nfs/dbraw/zinc/77/50/75/1058775075.db2.gz VGJZPNFVNJYKRA-HGGPSHQYSA-N 2 1 313.272 4.317 20 0 DIADMP c1oc2ccccc2c1CC[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246261893 1058779571 /nfs/dbraw/zinc/77/95/71/1058779571.db2.gz ONULXGTWKSZJQI-ICSRJNTNSA-N 2 1 320.436 4.058 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c2ccccc21 ZINC001246260331 1058781952 /nfs/dbraw/zinc/78/19/52/1058781952.db2.gz RZDLTYRSCVDZIZ-GWKIZSTFSA-N 2 1 306.453 4.318 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cc(F)ccc1F ZINC001246271661 1058783389 /nfs/dbraw/zinc/78/33/89/1058783389.db2.gz WTMCIEVZLOYKRH-COXVUDFISA-N 2 1 310.432 4.172 20 0 DIADMP CCC[NH2+]CC[NH2+][C@H](C)CC(c1ccccc1)c1ccccc1 ZINC001246269916 1058783961 /nfs/dbraw/zinc/78/39/61/1058783961.db2.gz NQVLMHKJXJEFCB-GOSISDBHSA-N 2 1 310.485 4.186 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)C)C1)c1ccccc1F ZINC001246274325 1058786593 /nfs/dbraw/zinc/78/65/93/1058786593.db2.gz WBDDZQZTYPYZAA-IPELMVKDSA-N 2 1 306.469 4.279 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cc(F)ccc1F ZINC001246271663 1058787604 /nfs/dbraw/zinc/78/76/04/1058787604.db2.gz WTMCIEVZLOYKRH-JQFCIGGWSA-N 2 1 310.432 4.172 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)c(F)c1 ZINC001246281903 1058799189 /nfs/dbraw/zinc/79/91/89/1058799189.db2.gz ADPBCZQMZACVQD-NRXGSXMXSA-N 2 1 316.395 4.109 20 0 DIADMP Cc1cc(C)cc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246297866 1058812748 /nfs/dbraw/zinc/81/27/48/1058812748.db2.gz QGRMPUHLNALICQ-QMMLZNLJSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1ccc(C[C@H]([NH2+][C@@H]2CC[C@@H](C)NC2)c2ccccc2)cc1 ZINC001246338903 1058846711 /nfs/dbraw/zinc/84/67/11/1058846711.db2.gz NFWYEJSSSIINCJ-UIFIKXQLSA-N 2 1 308.469 4.009 20 0 DIADMP FC(F)(F)[C@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246340802 1058847210 /nfs/dbraw/zinc/84/72/10/1058847210.db2.gz LTPOWMVAMJCJNZ-GJZGRUSLSA-N 2 1 318.427 4.010 20 0 DIADMP Cc1ccc(C[C@H]([NH2+][C@H]2CC[C@@H](C)NC2)c2ccccc2)cc1 ZINC001246338900 1058847785 /nfs/dbraw/zinc/84/77/85/1058847785.db2.gz NFWYEJSSSIINCJ-QMMLZNLJSA-N 2 1 308.469 4.009 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246345103 1058858285 /nfs/dbraw/zinc/85/82/85/1058858285.db2.gz UJMQSOCQNGVURP-VXKWHMMOSA-N 2 1 322.496 4.435 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246349712 1058860680 /nfs/dbraw/zinc/86/06/80/1058860680.db2.gz NYOYWEOCMOCUCK-RTBURBONSA-N 2 1 312.432 4.144 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246351177 1058861524 /nfs/dbraw/zinc/86/15/24/1058861524.db2.gz SDMHOFXYABEVGS-RYRKJORJSA-N 2 1 304.453 4.096 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+]C2(c3ccccc3F)CCC2)CC[NH2+]1 ZINC001246362607 1058868772 /nfs/dbraw/zinc/86/87/72/1058868772.db2.gz BIARBGDQODBXQV-CVEARBPZSA-N 2 1 304.453 4.105 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]Cc3cccc(C4CC4)c3)CC[NH2+]2)cc1 ZINC001246361803 1058868960 /nfs/dbraw/zinc/86/89/60/1058868960.db2.gz JPPHADNNSHLGQC-LEWJYISDSA-N 2 1 306.453 4.147 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H](C)CC2)CC[NH2+]1 ZINC001246363642 1058871424 /nfs/dbraw/zinc/87/14/24/1058871424.db2.gz QYOLWRVKKXHAFU-WCMCAJIFSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1ccccc1CC(C)(C)[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246373934 1058879572 /nfs/dbraw/zinc/87/95/72/1058879572.db2.gz RXQUKUDVVFSPKJ-SFTDATJTSA-N 2 1 322.496 4.399 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](c2ccncc2Cl)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246391767 1058896300 /nfs/dbraw/zinc/89/63/00/1058896300.db2.gz GUXGMHUEFVHTRM-HBUWYVDXSA-N 2 1 321.896 4.085 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccncc2Cl)C2CC2)CC[NH2+]1 ZINC001246398147 1058900411 /nfs/dbraw/zinc/90/04/11/1058900411.db2.gz UWZZBBCTEJLKEU-RVKKMQEKSA-N 2 1 321.896 4.087 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](c2cncc(Cl)c2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246401010 1058905479 /nfs/dbraw/zinc/90/54/79/1058905479.db2.gz QUBFULLMNXGRMA-MLHJIOFPSA-N 2 1 321.896 4.085 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246408659 1058910315 /nfs/dbraw/zinc/91/03/15/1058910315.db2.gz VOLOFWJCBVRWMX-UXPWSPDFSA-N 2 1 318.480 4.423 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C(C)(C)CC2CCC2)CC[NH2+]1 ZINC001246411799 1058914653 /nfs/dbraw/zinc/91/46/53/1058914653.db2.gz VZDSKHQBFSDIHO-HKUYNNGSSA-N 2 1 318.480 4.486 20 0 DIADMP Cc1ccccc1C(C)(C)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246440510 1058933696 /nfs/dbraw/zinc/93/36/96/1058933696.db2.gz VFUGNOWZQKLZRL-UYAOXDASSA-N 2 1 308.469 4.313 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cn2)C2CC2)CC[NH2+]1 ZINC001246457552 1058942993 /nfs/dbraw/zinc/94/29/93/1058942993.db2.gz NEMVXBHDDOVKOQ-NUJGCVRESA-N 2 1 321.896 4.087 20 0 DIADMP CC[C@@]1([NH2+][C@@H](C)CCc2ccc(Cl)c(Cl)c2)CC[NH2+]C1 ZINC001246459781 1058945833 /nfs/dbraw/zinc/94/58/33/1058945833.db2.gz GQVWTVFUEJAGMH-BLLLJJGKSA-N 2 1 315.288 4.046 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C[NH2+]1 ZINC001246459551 1058945998 /nfs/dbraw/zinc/94/59/98/1058945998.db2.gz BAJPCOBQPNQACB-HUUCEWRRSA-N 3 1 300.471 4.186 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cn2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246462485 1058948777 /nfs/dbraw/zinc/94/87/77/1058948777.db2.gz ZKWDLZLRYIXWDO-LHHMISFZSA-N 2 1 321.896 4.085 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+]CC[C@H]1CC[NH2+]CC1(F)F ZINC001246486529 1058963255 /nfs/dbraw/zinc/96/32/55/1058963255.db2.gz KDTAEZJHIGNPDA-QZTJIDSGSA-N 2 1 324.459 4.012 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+]CC[C@H]1CC[NH2+]CC1(F)F ZINC001246486527 1058963818 /nfs/dbraw/zinc/96/38/18/1058963818.db2.gz KDTAEZJHIGNPDA-MSOLQXFVSA-N 2 1 324.459 4.012 20 0 DIADMP FC1(F)C[NH2+]CC[C@H]1CC[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246491863 1058965257 /nfs/dbraw/zinc/96/52/57/1058965257.db2.gz UVTBFMOMYARCNA-HNNXBMFYSA-N 2 1 314.464 4.104 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@H](C)c2cc(F)cc(Cl)c2)CC[NH2+]1 ZINC001246491978 1058965343 /nfs/dbraw/zinc/96/53/43/1058965343.db2.gz UYYPFFPGIDNBGN-OAUYIBNBSA-N 2 1 312.860 4.441 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)cc(Cl)c2)CC[NH2+]1 ZINC001246491975 1058967604 /nfs/dbraw/zinc/96/76/04/1058967604.db2.gz UYYPFFPGIDNBGN-DQYPLSBCSA-N 2 1 312.860 4.441 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)C1CCCCC1 ZINC001246491749 1058968039 /nfs/dbraw/zinc/96/80/39/1058968039.db2.gz SXQJVFDEOLCIHL-AABGKKOBSA-N 2 1 300.490 4.428 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H]1CCc2c(Cl)cccc2C1 ZINC001246494125 1058968787 /nfs/dbraw/zinc/96/87/87/1058968787.db2.gz DRHHHGDIVABPHU-OAHLLOKOSA-N 2 1 308.897 4.085 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246497067 1058970846 /nfs/dbraw/zinc/97/08/46/1058970846.db2.gz GACAOJKQXCQWHF-BVGQSLNGSA-N 2 1 322.443 4.099 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H]2CCOc3ccc(Cl)cc32)C[C@H](CC)[NH2+]1 ZINC001246511579 1058976578 /nfs/dbraw/zinc/97/65/78/1058976578.db2.gz JXLLVJXFZJNFGV-HWMZRRJGSA-N 2 1 322.880 4.062 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H](C)Cc1c(F)cccc1Cl ZINC001246505195 1058976989 /nfs/dbraw/zinc/97/69/89/1058976989.db2.gz RFSLPESIDKFUHN-CYBMUJFWSA-N 2 1 314.876 4.297 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H]2CCOc3ccc(Cl)cc32)CC[NH2+]1 ZINC001246508255 1058978335 /nfs/dbraw/zinc/97/83/35/1058978335.db2.gz BQOPBQOOJGBVFZ-INMHGKMJSA-N 2 1 322.880 4.064 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H]2CCOc3ccc(Cl)cc32)C[C@H](CC)[NH2+]1 ZINC001246511604 1058979779 /nfs/dbraw/zinc/97/97/79/1058979779.db2.gz JXLLVJXFZJNFGV-WBTNSWJXSA-N 2 1 322.880 4.062 20 0 DIADMP CC(C)[N@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246520240 1058980608 /nfs/dbraw/zinc/98/06/08/1058980608.db2.gz SFBFGERDJWGOJE-NHCUHLMSSA-N 2 1 308.469 4.390 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246520240 1058980626 /nfs/dbraw/zinc/98/06/26/1058980626.db2.gz SFBFGERDJWGOJE-NHCUHLMSSA-N 2 1 308.469 4.390 20 0 DIADMP CC(C)[N@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246520239 1058981258 /nfs/dbraw/zinc/98/12/58/1058981258.db2.gz SFBFGERDJWGOJE-LEWJYISDSA-N 2 1 308.469 4.390 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246520239 1058981280 /nfs/dbraw/zinc/98/12/80/1058981280.db2.gz SFBFGERDJWGOJE-LEWJYISDSA-N 2 1 308.469 4.390 20 0 DIADMP CC[N@@H+](C1CCCCC1)[C@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246533150 1058986299 /nfs/dbraw/zinc/98/62/99/1058986299.db2.gz TTYWYYFIABNKJG-QUCCMNQESA-N 2 1 300.490 4.004 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)c1 ZINC001246536162 1058986473 /nfs/dbraw/zinc/98/64/73/1058986473.db2.gz CHLJJKWQKKUGDG-KBWCOIMZSA-N 2 1 312.501 4.444 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001246523683 1058986602 /nfs/dbraw/zinc/98/66/02/1058986602.db2.gz ONFDLOSWYJVAPW-HXUWFJFHSA-N 2 1 314.517 4.109 20 0 DIADMP CCC[N@H+](CC1CC1)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532468 1058987461 /nfs/dbraw/zinc/98/74/61/1058987461.db2.gz QOHGVXNKFHOYBV-MJGOQNOKSA-N 2 1 304.453 4.049 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532468 1058987472 /nfs/dbraw/zinc/98/74/72/1058987472.db2.gz QOHGVXNKFHOYBV-MJGOQNOKSA-N 2 1 304.453 4.049 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246526417 1058987656 /nfs/dbraw/zinc/98/76/56/1058987656.db2.gz WSPRQWXNSUMFNF-WKCHPHFGSA-N 2 1 320.480 4.381 20 0 DIADMP C[C@H]1CC([N@@H+](C)C(c2ccccc2)c2ccccc2)C[C@H](C)[NH2+]1 ZINC001246526918 1058988409 /nfs/dbraw/zinc/98/84/09/1058988409.db2.gz DEXZRDVNHGFESA-IRXDYDNUSA-N 2 1 308.469 4.237 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530812 1058989756 /nfs/dbraw/zinc/98/97/56/1058989756.db2.gz QFDWRTADPPSBKF-VQTJNVASSA-N 2 1 308.469 4.238 20 0 DIADMP Clc1ccc2c(c1)C[N@@H+](C1CCC3(CCC[NH2+]C3)CC1)CC2 ZINC001246540948 1058993203 /nfs/dbraw/zinc/99/32/03/1058993203.db2.gz UHDOLONGDYKAAN-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001246556943 1058998020 /nfs/dbraw/zinc/99/80/20/1058998020.db2.gz IOOVIEKXBRKZEZ-YSIASYRMSA-N 2 1 302.506 4.095 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+]([C@H](C)CC(C)(C)SCc2ccco2)C1 ZINC001246546999 1059001323 /nfs/dbraw/zinc/00/13/23/1059001323.db2.gz FMYHYRWRTJTBNV-HZPDHXFCSA-N 2 1 324.534 4.001 20 0 DIADMP [NH3+][C@@H]1CCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001246548165 1059001477 /nfs/dbraw/zinc/00/14/77/1059001477.db2.gz RTAFJLOBYMWUMQ-IIIMJFFVSA-N 2 1 306.881 4.179 20 0 DIADMP C[C@H]1C[N@H+](C2CCC(Cc3ccccc3)CC2)CCC[C@H]1C[NH3+] ZINC001246563418 1059004955 /nfs/dbraw/zinc/00/49/55/1059004955.db2.gz QUPHXSPJKBOBGW-AFVILVPDSA-N 2 1 314.517 4.095 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)CCC[C@H]1C[NH3+] ZINC001246561708 1059005336 /nfs/dbraw/zinc/00/53/36/1059005336.db2.gz KFWMZLXNSOOJHZ-LMCOJAPRSA-N 2 1 300.490 4.020 20 0 DIADMP C[C@@H]1CC[N@H+](C2CCC(Cc3ccccc3)CC2)CC[C@H]1C[NH3+] ZINC001246561431 1059006860 /nfs/dbraw/zinc/00/68/60/1059006860.db2.gz SNPRLJSNRPUSEK-PPXMBRMGSA-N 2 1 314.517 4.095 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001246578559 1059009278 /nfs/dbraw/zinc/00/92/78/1059009278.db2.gz SAAKPNLUYPTVPB-UXHICEINSA-N 2 1 302.506 4.239 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001246582566 1059009600 /nfs/dbraw/zinc/00/96/00/1059009600.db2.gz NTSIWTNZXNFYOT-JKSUJKDBSA-N 2 1 324.534 4.131 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001246581774 1059011673 /nfs/dbraw/zinc/01/16/73/1059011673.db2.gz AMEAVHPKDGXVOO-YLJYHZDGSA-N 2 1 302.506 4.033 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC[NH2+]1 ZINC001246593166 1059016924 /nfs/dbraw/zinc/01/69/24/1059016924.db2.gz ANBSTMMBMDYRJV-ICSRJNTNSA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246602909 1059021790 /nfs/dbraw/zinc/02/17/90/1059021790.db2.gz DTYYJDRUDWCRSO-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246604625 1059024156 /nfs/dbraw/zinc/02/41/56/1059024156.db2.gz HPWOWKPGKYWMBV-RTWAWAEBSA-N 2 1 314.517 4.396 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@@H+]3CCC[C@@]34CCC[NH2+]CC4)C2)cc1 ZINC001246608693 1059025523 /nfs/dbraw/zinc/02/55/23/1059025523.db2.gz VBOLUJNPKYJPSC-QHAWAJNXSA-N 2 1 312.501 4.321 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@H+]3CCC[C@]4(CCC[NH2+]C4)C3)C2)cc1 ZINC001246610640 1059028596 /nfs/dbraw/zinc/02/85/96/1059028596.db2.gz QSMTZDDAIMYWJT-HKBOAZHASA-N 2 1 312.501 4.178 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001246609081 1059030034 /nfs/dbraw/zinc/03/00/34/1059030034.db2.gz KPDFJDKXQOWRCM-NHCUHLMSSA-N 2 1 314.517 4.254 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246608629 1059030588 /nfs/dbraw/zinc/03/05/88/1059030588.db2.gz USPQPGRSATYXNM-KBXCAEBGSA-N 2 1 324.871 4.018 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2CCC3(CCC3)CC2)CC[NH2+]1 ZINC001246623503 1059030950 /nfs/dbraw/zinc/03/09/50/1059030950.db2.gz UEGQAOBYIVSBEM-HKUYNNGSSA-N 2 1 316.464 4.193 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@H+]3CCC[C@]4(CCCC[NH2+]4)C3)C2)cc1 ZINC001246616249 1059035975 /nfs/dbraw/zinc/03/59/75/1059035975.db2.gz UYLYAORUGYELNB-NJDAHSKKSA-N 2 1 312.501 4.321 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246629341 1059037109 /nfs/dbraw/zinc/03/71/09/1059037109.db2.gz YWPHCZSXJZHJHJ-NSHGMRRFSA-N 2 1 314.517 4.136 20 0 DIADMP CCCCCC[C@@H](C)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246623844 1059037413 /nfs/dbraw/zinc/03/74/13/1059037413.db2.gz NTRJOODZROMBQI-MJGOQNOKSA-N 2 1 300.490 4.034 20 0 DIADMP CCCC[C@@H](CCC)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625071 1059039232 /nfs/dbraw/zinc/03/92/32/1059039232.db2.gz QYCGWQWCHHRCOB-MOPGFXCFSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246633877 1059039910 /nfs/dbraw/zinc/03/99/10/1059039910.db2.gz MZQJXOKEEGHACU-RDTXWAMCSA-N 2 1 324.871 4.018 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246633877 1059039935 /nfs/dbraw/zinc/03/99/35/1059039935.db2.gz MZQJXOKEEGHACU-RDTXWAMCSA-N 2 1 324.871 4.018 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246636281 1059042842 /nfs/dbraw/zinc/04/28/42/1059042842.db2.gz ULHIMBUZPQVXSO-RTWAWAEBSA-N 2 1 314.517 4.396 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@@H+]2CCCC[C@]23CC[NH2+]C3)CC1 ZINC001246644044 1059048204 /nfs/dbraw/zinc/04/82/04/1059048204.db2.gz PCPWSGNCKMQKAQ-KITAHSCOSA-N 2 1 324.512 4.031 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@@H+]2CCCC[C@]23CCC[NH2+]C3)cc1 ZINC001246649544 1059054674 /nfs/dbraw/zinc/05/46/74/1059054674.db2.gz CQCDNMBLDLNIJR-IEBWSBKVSA-N 2 1 318.530 4.084 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCCC[C@]23CCC[NH2+]C3)cc1 ZINC001246649544 1059054696 /nfs/dbraw/zinc/05/46/96/1059054696.db2.gz CQCDNMBLDLNIJR-IEBWSBKVSA-N 2 1 318.530 4.084 20 0 DIADMP c1ccc(C[C@H]2C[C@H]([NH+]3CCC4(CCCC4)CC3)CC[NH2+]2)cc1 ZINC001246654279 1059055261 /nfs/dbraw/zinc/05/52/61/1059055261.db2.gz JNXABMNHGVMNMH-VQTJNVASSA-N 2 1 312.501 4.006 20 0 DIADMP FC(F)(F)CCC[N@@H+]1CCC[C@@]2(CC[NH+](C3CCCC3)C2)C1 ZINC001278460808 1059057947 /nfs/dbraw/zinc/05/79/47/1059057947.db2.gz FGMTXKGZRGTTIU-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[N@H+]1CCC[C@@]2(CC[NH+](C3CCCC3)C2)C1 ZINC001278460808 1059057964 /nfs/dbraw/zinc/05/79/64/1059057964.db2.gz FGMTXKGZRGTTIU-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CCC[C@@]2(CC[N@@H+](C3CCCC3)C2)C1 ZINC001278460808 1059057981 /nfs/dbraw/zinc/05/79/81/1059057981.db2.gz FGMTXKGZRGTTIU-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CCC[C@@]2(CC[N@H+](C3CCCC3)C2)C1 ZINC001278460808 1059057999 /nfs/dbraw/zinc/05/79/99/1059057999.db2.gz FGMTXKGZRGTTIU-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP CCCCC1CC[NH+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246681730 1059061181 /nfs/dbraw/zinc/06/11/81/1059061181.db2.gz PUYWCPWNHWGDHT-UXHICEINSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246677124 1059061233 /nfs/dbraw/zinc/06/12/33/1059061233.db2.gz BVLSHEKPGCILNP-WFXMLNOXSA-N 2 1 308.469 4.390 20 0 DIADMP CC[C@H](CC(C)C)[N@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1 ZINC001246676868 1059061740 /nfs/dbraw/zinc/06/17/40/1059061740.db2.gz UODLPBRZPGGZKF-VAMGGRTRSA-N 2 1 300.490 4.033 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001246678043 1059064956 /nfs/dbraw/zinc/06/49/56/1059064956.db2.gz MBIPSYQJYZKXBG-QHAWAJNXSA-N 2 1 314.517 4.109 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1C1CCC2(CCC[NH2+]C2)CC1 ZINC001246682180 1059065304 /nfs/dbraw/zinc/06/53/04/1059065304.db2.gz TZTCGXGBXRNZEC-VEDCXYSMSA-N 2 1 312.501 4.444 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688363 1059067098 /nfs/dbraw/zinc/06/70/98/1059067098.db2.gz GTMGMQAKTQJMOZ-BBRMVZONSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688363 1059067116 /nfs/dbraw/zinc/06/71/16/1059067116.db2.gz GTMGMQAKTQJMOZ-BBRMVZONSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246686331 1059069059 /nfs/dbraw/zinc/06/90/59/1059069059.db2.gz RNKHLAAKZBDGDO-NRSPTQNISA-N 2 1 312.501 4.200 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@]3(C2)C[NH2+]CC[C@H]3F)CC1 ZINC001246687705 1059069312 /nfs/dbraw/zinc/06/93/12/1059069312.db2.gz DWNHXORARDGOAY-HTPOPCQBSA-N 2 1 310.501 4.005 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)C1C[C@@H]2C=C[C@H](C1)[NH2+]2 ZINC001246683762 1059070562 /nfs/dbraw/zinc/07/05/62/1059070562.db2.gz SVFZRXJROGMAHA-HNYYDBCASA-N 2 1 318.464 4.309 20 0 DIADMP CCC[N@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246775509 1059073915 /nfs/dbraw/zinc/07/39/15/1059073915.db2.gz IXQDUSXHTOSYKD-LEWJYISDSA-N 2 1 308.469 4.392 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246775509 1059073930 /nfs/dbraw/zinc/07/39/30/1059073930.db2.gz IXQDUSXHTOSYKD-LEWJYISDSA-N 2 1 308.469 4.392 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246775317 1059074226 /nfs/dbraw/zinc/07/42/26/1059074226.db2.gz JFPQMWGUUPWFFU-NJYVYQBISA-N 2 1 314.517 4.252 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246773824 1059074417 /nfs/dbraw/zinc/07/44/17/1059074417.db2.gz CUWUQKOPQFUDMK-IBGZPJMESA-N 2 1 300.490 4.354 20 0 DIADMP C[N@H+](Cc1cccc(Cl)c1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246769392 1059074845 /nfs/dbraw/zinc/07/48/45/1059074845.db2.gz JROGNRMJSWIAQC-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246769392 1059074865 /nfs/dbraw/zinc/07/48/65/1059074865.db2.gz JROGNRMJSWIAQC-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCCCC[C@@H]2C)CC[NH2+]1 ZINC001246767245 1059075267 /nfs/dbraw/zinc/07/52/67/1059075267.db2.gz AWHBVMDHQDQYRK-IEZWGBDMSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCCCC[C@@H]2C)CC[NH2+]1 ZINC001246767245 1059075285 /nfs/dbraw/zinc/07/52/85/1059075285.db2.gz AWHBVMDHQDQYRK-IEZWGBDMSA-N 2 1 304.453 4.192 20 0 DIADMP CCC[N@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246775514 1059076595 /nfs/dbraw/zinc/07/65/95/1059076595.db2.gz IXQDUSXHTOSYKD-RTWAWAEBSA-N 2 1 308.469 4.392 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246775514 1059076613 /nfs/dbraw/zinc/07/66/13/1059076613.db2.gz IXQDUSXHTOSYKD-RTWAWAEBSA-N 2 1 308.469 4.392 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(C)cc2)C[C@H](CC)[NH2+]1 ZINC001246780981 1059077142 /nfs/dbraw/zinc/07/71/42/1059077142.db2.gz MPWSRLMATHRPMD-FUMNGEBKSA-N 2 1 300.490 4.441 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246775617 1059078401 /nfs/dbraw/zinc/07/84/01/1059078401.db2.gz IZQNTDAOIAMFLQ-QYZOEREBSA-N 2 1 300.490 4.033 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(OC)cc2)C[C@H](CC)[NH2+]1 ZINC001246783154 1059079231 /nfs/dbraw/zinc/07/92/31/1059079231.db2.gz WSUSULINNXTGAM-DMUMMCEESA-N 2 1 316.489 4.141 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2ccc(OC)cc2)C[C@@H](CC)[NH2+]1 ZINC001246783156 1059080064 /nfs/dbraw/zinc/08/00/64/1059080064.db2.gz WSUSULINNXTGAM-HLIPFELVSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H](C[NH3+])C1 ZINC001246779441 1059081066 /nfs/dbraw/zinc/08/10/66/1059081066.db2.gz GYAWZHONPAFBCA-MOPGFXCFSA-N 2 1 322.496 4.268 20 0 DIADMP C[N@@H+]([C@H]1CCN[C@@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783535 1059081264 /nfs/dbraw/zinc/08/12/64/1059081264.db2.gz ONUNQJCSNMQWTP-QUCGMDCGSA-N 2 1 324.512 4.380 20 0 DIADMP C[N@H+]([C@H]1CC[NH2+][C@@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783535 1059081278 /nfs/dbraw/zinc/08/12/78/1059081278.db2.gz ONUNQJCSNMQWTP-QUCGMDCGSA-N 2 1 324.512 4.380 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783535 1059081300 /nfs/dbraw/zinc/08/13/00/1059081300.db2.gz ONUNQJCSNMQWTP-QUCGMDCGSA-N 2 1 324.512 4.380 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(C)cc2)C[C@H](CC)[NH2+]1 ZINC001246780992 1059081690 /nfs/dbraw/zinc/08/16/90/1059081690.db2.gz MPWSRLMATHRPMD-IYWMVGAKSA-N 2 1 300.490 4.441 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC[NH2+]1 ZINC001246783816 1059085818 /nfs/dbraw/zinc/08/58/18/1059085818.db2.gz FBBQKRLCLXAHIL-OKZBNKHCSA-N 2 1 306.881 4.254 20 0 DIADMP c1ccc(C[C@@H]2C[C@@H]([N@H+]3CCC[C@H]3c3ccccc3)CC[NH2+]2)cc1 ZINC001246784127 1059086280 /nfs/dbraw/zinc/08/62/80/1059086280.db2.gz FBOGUIHOMKJARI-FSSWDIPSSA-N 2 1 320.480 4.187 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H](C)[C@H]2C)CC[NH2+]1 ZINC001246786926 1059086655 /nfs/dbraw/zinc/08/66/55/1059086655.db2.gz BFNDGEHZMNLAFC-KOJWFEOWSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@H]2C)CC[NH2+]1 ZINC001246786926 1059086674 /nfs/dbraw/zinc/08/66/74/1059086674.db2.gz BFNDGEHZMNLAFC-KOJWFEOWSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783856 1059088770 /nfs/dbraw/zinc/08/87/70/1059088770.db2.gz QILIASOQZSTOOE-MAUKXSAKSA-N 2 1 318.461 4.121 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783856 1059088796 /nfs/dbraw/zinc/08/87/96/1059088796.db2.gz QILIASOQZSTOOE-MAUKXSAKSA-N 2 1 318.461 4.121 20 0 DIADMP c1ccc(C[C@@H]2CC[N@@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246791645 1059091704 /nfs/dbraw/zinc/09/17/04/1059091704.db2.gz LKTAXNZUADDJRK-KSEOMHKRSA-N 2 1 320.480 4.044 20 0 DIADMP c1ccc(C[C@@H]2CC[N@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246791645 1059091731 /nfs/dbraw/zinc/09/17/31/1059091731.db2.gz LKTAXNZUADDJRK-KSEOMHKRSA-N 2 1 320.480 4.044 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788764 1059092226 /nfs/dbraw/zinc/09/22/26/1059092226.db2.gz IZHKNPDLYHUVIF-PKOBYXMFSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788764 1059092247 /nfs/dbraw/zinc/09/22/47/1059092247.db2.gz IZHKNPDLYHUVIF-PKOBYXMFSA-N 2 1 304.453 4.048 20 0 DIADMP Fc1ccc(F)c([C@@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246792140 1059092515 /nfs/dbraw/zinc/09/25/15/1059092515.db2.gz NPKAIGXILJVJCM-QAPCUYQASA-N 2 1 320.427 4.024 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2OC)CC[NH2+]1 ZINC001246790888 1059092958 /nfs/dbraw/zinc/09/29/58/1059092958.db2.gz IERNEZWKEYEETR-AOIWGVFYSA-N 2 1 316.489 4.143 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001246793249 1059095340 /nfs/dbraw/zinc/09/53/40/1059095340.db2.gz BXZPPAZGGIOKHX-HXUWFJFHSA-N 2 1 302.506 4.109 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1C1CCC2(C[NH2+]C2)CC1 ZINC001246793564 1059095564 /nfs/dbraw/zinc/09/55/64/1059095564.db2.gz UDFNDZXSWDIMNE-KRWDZBQOSA-N 2 1 304.865 4.009 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246796035 1059098386 /nfs/dbraw/zinc/09/83/86/1059098386.db2.gz KMZXGMUDALFIOX-LPHOPBHVSA-N 2 1 316.464 4.418 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+]2CCSC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246807472 1059099742 /nfs/dbraw/zinc/09/97/42/1059099742.db2.gz KCJZOOQTDZGMTL-QRVBRYPASA-N 2 1 318.530 4.087 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCSC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246807472 1059099764 /nfs/dbraw/zinc/09/97/64/1059099764.db2.gz KCJZOOQTDZGMTL-QRVBRYPASA-N 2 1 318.530 4.087 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246798233 1059100875 /nfs/dbraw/zinc/10/08/75/1059100875.db2.gz MTKRCIWLFINNLG-QRVBRYPASA-N 2 1 304.453 4.273 20 0 DIADMP [NH3+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246805700 1059101262 /nfs/dbraw/zinc/10/12/62/1059101262.db2.gz SGLJGLZNVKHNJV-PDTIQJOESA-N 2 1 318.892 4.320 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246804304 1059102276 /nfs/dbraw/zinc/10/22/76/1059102276.db2.gz FWAXRVKTHMYNIB-SJBKTWHCSA-N 2 1 320.480 4.165 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246800414 1059102817 /nfs/dbraw/zinc/10/28/17/1059102817.db2.gz XKHYNZZXBMYBTR-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCSC[C@H]2c2ccccc2)C[C@H](CC)[NH2+]1 ZINC001246806682 1059103222 /nfs/dbraw/zinc/10/32/22/1059103222.db2.gz HREACBCWCHGTCT-MANSERQUSA-N 2 1 318.530 4.086 20 0 DIADMP C[N@@H+](Cc1cccc2cccnc21)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246800709 1059103303 /nfs/dbraw/zinc/10/33/03/1059103303.db2.gz GDKIVFLEQQSNES-LJQANCHMSA-N 2 1 323.484 4.122 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2CCCCCCC2)CC[NH2+]1 ZINC001246815270 1059105194 /nfs/dbraw/zinc/10/51/94/1059105194.db2.gz WVDUCIPTCSPAQV-PKOBYXMFSA-N 2 1 304.453 4.193 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@H+](C2CCC3(CC[NH2+]C3)CC2)C1 ZINC001246811082 1059105610 /nfs/dbraw/zinc/10/56/10/1059105610.db2.gz RNHPZCCKXKTACW-LYGPFTKASA-N 2 1 318.892 4.052 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)C[C@H](CC)[NH2+]1 ZINC001246809842 1059105914 /nfs/dbraw/zinc/10/59/14/1059105914.db2.gz KXRVRYPDTDLWRG-WCXIOVBPSA-N 2 1 320.908 4.439 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](C)CCc2ccc(Cl)cc2)C[C@H](CC)[NH2+]1 ZINC001246813005 1059105978 /nfs/dbraw/zinc/10/59/78/1059105978.db2.gz HHXBBJHDGRHOPN-BCDXTJNWSA-N 2 1 308.897 4.124 20 0 DIADMP Clc1ccc([C@H]2CCC[N@@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821827 1059110766 /nfs/dbraw/zinc/11/07/66/1059110766.db2.gz JMXYHCTWXKPTPS-XJFOESAGSA-N 2 1 310.894 4.212 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821827 1059110775 /nfs/dbraw/zinc/11/07/75/1059110775.db2.gz JMXYHCTWXKPTPS-XJFOESAGSA-N 2 1 310.894 4.212 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](C)CCc2cccc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246822379 1059111924 /nfs/dbraw/zinc/11/19/24/1059111924.db2.gz KPDFZRJWUQHENC-PIIMJCKOSA-N 2 1 308.897 4.124 20 0 DIADMP C[NH2+]C1CCC([N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001246836670 1059113911 /nfs/dbraw/zinc/11/39/11/1059113911.db2.gz BEWXCXABELWIKH-UHFFFAOYSA-N 2 1 322.496 4.262 20 0 DIADMP CC[N@H+](Cc1ccc(F)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838436 1059120187 /nfs/dbraw/zinc/12/01/87/1059120187.db2.gz BVVNIHKRNGXUQX-WOJBJXKFSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838436 1059120200 /nfs/dbraw/zinc/12/02/00/1059120200.db2.gz BVVNIHKRNGXUQX-WOJBJXKFSA-N 2 1 312.432 4.141 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843323 1059121751 /nfs/dbraw/zinc/12/17/51/1059121751.db2.gz JKCBPCUVFRYXLQ-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843323 1059121766 /nfs/dbraw/zinc/12/17/66/1059121766.db2.gz JKCBPCUVFRYXLQ-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H]1CC([N@H+](C)Cc2ccccc2Oc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246845651 1059123799 /nfs/dbraw/zinc/12/37/99/1059123799.db2.gz QAZDBSAIZFTEHA-IRXDYDNUSA-N 2 1 324.468 4.440 20 0 DIADMP C[C@H]1CC([N@@H+](C)Cc2ccccc2Oc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246845651 1059123812 /nfs/dbraw/zinc/12/38/12/1059123812.db2.gz QAZDBSAIZFTEHA-IRXDYDNUSA-N 2 1 324.468 4.440 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246846474 1059127787 /nfs/dbraw/zinc/12/77/87/1059127787.db2.gz ALPNFBJCVCUJOK-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP Clc1cccc2c1CC[N@@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246850002 1059127989 /nfs/dbraw/zinc/12/79/89/1059127989.db2.gz SSPDSVXJMQNVKZ-INIZCTEOSA-N 2 1 318.892 4.153 20 0 DIADMP Clc1cccc2c1CC[N@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246850002 1059127999 /nfs/dbraw/zinc/12/79/99/1059127999.db2.gz SSPDSVXJMQNVKZ-INIZCTEOSA-N 2 1 318.892 4.153 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852137 1059131481 /nfs/dbraw/zinc/13/14/81/1059131481.db2.gz MVXCMQBINYJGBB-NXHRZFHOSA-N 2 1 320.908 4.296 20 0 DIADMP Clc1ccc([C@H]2CC[N@H+]([C@H]3CCC4(C3)CC[NH2+]CC4)C2)cc1 ZINC001246855186 1059132720 /nfs/dbraw/zinc/13/27/20/1059132720.db2.gz VXVBADJADFKYNV-WMZOPIPTSA-N 2 1 318.892 4.052 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852152 1059133034 /nfs/dbraw/zinc/13/30/34/1059133034.db2.gz NFEJXGNWYQNTGI-QRQLOZEOSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@@H+](C1CCC(C(C)(C)C)CC1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246856169 1059133585 /nfs/dbraw/zinc/13/35/85/1059133585.db2.gz ZBLRLHRDSYFGDI-BZWMRVRASA-N 2 1 306.538 4.445 20 0 DIADMP Clc1cccc2c1C[N@@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866746 1059135456 /nfs/dbraw/zinc/13/54/56/1059135456.db2.gz CUIXZJNDUDUVDA-OAHLLOKOSA-N 2 1 304.865 4.111 20 0 DIADMP Clc1cccc2c1C[N@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866746 1059135467 /nfs/dbraw/zinc/13/54/67/1059135467.db2.gz CUIXZJNDUDUVDA-OAHLLOKOSA-N 2 1 304.865 4.111 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246863751 1059137664 /nfs/dbraw/zinc/13/76/64/1059137664.db2.gz GIUMMILGSHYJNG-AZUAARDMSA-N 2 1 312.501 4.451 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@H+]2CCC[C@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246865382 1059137831 /nfs/dbraw/zinc/13/78/31/1059137831.db2.gz UHUQBVLVVHTLPQ-UFYCRDLUSA-N 2 1 300.490 4.177 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246865044 1059138700 /nfs/dbraw/zinc/13/87/00/1059138700.db2.gz XPMPEKSSVKISLW-PKOBYXMFSA-N 2 1 314.517 4.338 20 0 DIADMP c1ccc(C2=CC[N@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)cc1 ZINC001246859336 1059138989 /nfs/dbraw/zinc/13/89/89/1059138989.db2.gz NQVIIWIEQYGNJA-FGZHOGPDSA-N 2 1 318.464 4.269 20 0 DIADMP c1ccc(C2=CC[N@@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)cc1 ZINC001246859336 1059138997 /nfs/dbraw/zinc/13/89/97/1059138997.db2.gz NQVIIWIEQYGNJA-FGZHOGPDSA-N 2 1 318.464 4.269 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC[NH2+]1 ZINC001246871106 1059142179 /nfs/dbraw/zinc/14/21/79/1059142179.db2.gz NXVAYKVLLDHNHH-YJLNNSPDSA-N 2 1 320.908 4.078 20 0 DIADMP C1C[C@H](C2CCCCC2)[N@H+]([C@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246867484 1059142813 /nfs/dbraw/zinc/14/28/13/1059142813.db2.gz XYQGUUWGYUOTOR-RBUKOAKNSA-N 2 1 304.522 4.486 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246879880 1059145926 /nfs/dbraw/zinc/14/59/26/1059145926.db2.gz PXOFYWJCBKOVKG-RDTXWAMCSA-N 2 1 324.871 4.223 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886429 1059148132 /nfs/dbraw/zinc/14/81/32/1059148132.db2.gz KPXHCDNHQIEFJL-WBAXXEDZSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886429 1059148143 /nfs/dbraw/zinc/14/81/43/1059148143.db2.gz KPXHCDNHQIEFJL-WBAXXEDZSA-N 2 1 322.443 4.268 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2C(C)C)CCN1 ZINC001246885251 1059149765 /nfs/dbraw/zinc/14/97/65/1059149765.db2.gz DFXUFUCCJMOMJN-NEWSRXKRSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H]2C(C)C)CC[NH2+]1 ZINC001246885251 1059149771 /nfs/dbraw/zinc/14/97/71/1059149771.db2.gz DFXUFUCCJMOMJN-NEWSRXKRSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2C(C)C)CC[NH2+]1 ZINC001246885251 1059149774 /nfs/dbraw/zinc/14/97/74/1059149774.db2.gz DFXUFUCCJMOMJN-NEWSRXKRSA-N 2 1 304.453 4.048 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c1 ZINC001246888477 1059155600 /nfs/dbraw/zinc/15/56/00/1059155600.db2.gz VZKBZSDNXDDJGX-XBMUEBEBSA-N 2 1 318.892 4.399 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC001246887336 1059156302 /nfs/dbraw/zinc/15/63/02/1059156302.db2.gz KSSOMCGIHZGLKQ-IRXDYDNUSA-N 2 1 304.865 4.152 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[NH2+]1 ZINC001246896005 1059159320 /nfs/dbraw/zinc/15/93/20/1059159320.db2.gz RSYWSAIAWIDVRJ-DUPRYPCISA-N 2 1 316.464 4.049 20 0 DIADMP Fc1ccc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246896364 1059160691 /nfs/dbraw/zinc/16/06/91/1059160691.db2.gz XOIGMZCMAXRNQW-PCCBWWKXSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246896364 1059160693 /nfs/dbraw/zinc/16/06/93/1059160693.db2.gz XOIGMZCMAXRNQW-PCCBWWKXSA-N 2 1 324.443 4.456 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246903060 1059162650 /nfs/dbraw/zinc/16/26/50/1059162650.db2.gz ICZDMFPHOYZHMX-IAGOWNOFSA-N 2 1 308.897 4.329 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246904620 1059162706 /nfs/dbraw/zinc/16/27/06/1059162706.db2.gz HXBBFZZNXZICQC-OALUTQOASA-N 2 1 324.468 4.441 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246903061 1059162813 /nfs/dbraw/zinc/16/28/13/1059162813.db2.gz ICZDMFPHOYZHMX-IRXDYDNUSA-N 2 1 308.897 4.329 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246900954 1059164798 /nfs/dbraw/zinc/16/47/98/1059164798.db2.gz JOEYUDSJZWVPHQ-QGZVFWFLSA-N 2 1 306.881 4.084 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246907243 1059166200 /nfs/dbraw/zinc/16/62/00/1059166200.db2.gz UIIAPSOZDPCPIU-SGZDXZSOSA-N 2 1 300.490 4.337 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246906980 1059166247 /nfs/dbraw/zinc/16/62/47/1059166247.db2.gz SZBNPIBHEVRIPS-OAHLLOKOSA-N 2 1 314.395 4.058 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246906843 1059166545 /nfs/dbraw/zinc/16/65/45/1059166545.db2.gz RUURYNKXDWIJJU-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2C3CCCC2CCC3)CC[NH2+]1 ZINC001246905488 1059167377 /nfs/dbraw/zinc/16/73/77/1059167377.db2.gz MRLDDMUOWXVYRX-ZZVGESKWSA-N 2 1 316.464 4.334 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246907224 1059167762 /nfs/dbraw/zinc/16/77/62/1059167762.db2.gz IRCZUIJRBXVMGQ-UHFFFAOYSA-N 2 1 300.490 4.129 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246907123 1059168867 /nfs/dbraw/zinc/16/88/67/1059168867.db2.gz IKZNBPWAZDITHN-LJQANCHMSA-N 2 1 300.490 4.048 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246911461 1059170949 /nfs/dbraw/zinc/17/09/49/1059170949.db2.gz PMOSLYSWFKTWFQ-BPLDGKMQSA-N 2 1 312.910 4.022 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1Cl)C1CCC([NH2+]C)CC1 ZINC001246911949 1059171613 /nfs/dbraw/zinc/17/16/13/1059171613.db2.gz PRMBGMNCEVEIMC-UHFFFAOYSA-N 2 1 315.288 4.346 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246908826 1059171682 /nfs/dbraw/zinc/17/16/82/1059171682.db2.gz NKGSRAPJMGNTAB-RKVPGOIHSA-N 2 1 306.881 4.255 20 0 DIADMP CC(C)CCC[C@@H](C)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246911822 1059171952 /nfs/dbraw/zinc/17/19/52/1059171952.db2.gz CPDUDWHKEIVDKI-GOSISDBHSA-N 2 1 302.506 4.455 20 0 DIADMP CC1(C)CCC[C@@H]([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C1 ZINC001246911292 1059172348 /nfs/dbraw/zinc/17/23/48/1059172348.db2.gz BFJJHMXYWXEPAS-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP C[NH2+]C1CCC([N@H+]2CCCC[C@H]2c2ccc(C)c(C)c2)CC1 ZINC001246910495 1059172659 /nfs/dbraw/zinc/17/26/59/1059172659.db2.gz UJGWNVMYCQNRNU-MHJFOBGBSA-N 2 1 300.490 4.361 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246916904 1059176125 /nfs/dbraw/zinc/17/61/25/1059176125.db2.gz UMXWCJOFBJVZIO-HKUYNNGSSA-N 2 1 302.506 4.455 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC001246917406 1059176577 /nfs/dbraw/zinc/17/65/77/1059176577.db2.gz CUANCDHSVHRJEA-AEFFLSMTSA-N 2 1 320.546 4.161 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC001246917406 1059176581 /nfs/dbraw/zinc/17/65/81/1059176581.db2.gz CUANCDHSVHRJEA-AEFFLSMTSA-N 2 1 320.546 4.161 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CCC([NH2+]C)CC1 ZINC001246917868 1059177771 /nfs/dbraw/zinc/17/77/71/1059177771.db2.gz YBFNAGLTINQUIV-UHFFFAOYSA-N 2 1 314.395 4.058 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932148 1059181512 /nfs/dbraw/zinc/18/15/12/1059181512.db2.gz FIKCSNOFFDOURJ-IRXDYDNUSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246937858 1059186026 /nfs/dbraw/zinc/18/60/26/1059186026.db2.gz NDZUPLFFUPKWLG-AEFFLSMTSA-N 2 1 318.480 4.001 20 0 DIADMP [NH3+][C@@H]1CC[N@H+]([C@H]2CCCC3(CCCCC3)C2)C[C@H]1C(F)(F)F ZINC001246940800 1059186443 /nfs/dbraw/zinc/18/64/43/1059186443.db2.gz VKDQMZGYNJUSRS-RRFJBIMHSA-N 2 1 318.427 4.091 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246936712 1059186497 /nfs/dbraw/zinc/18/64/97/1059186497.db2.gz YCZGLPSTPDRZRF-KRWDZBQOSA-N 2 1 306.469 4.204 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@@H]([NH3+])[C@H](C(F)(F)F)C2)CC1 ZINC001246942992 1059188085 /nfs/dbraw/zinc/18/80/85/1059188085.db2.gz YSCZDMGRRDYHAS-NEXFUWMNSA-N 2 1 320.443 4.193 20 0 DIADMP CC(C)(C)C[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001246945635 1059189537 /nfs/dbraw/zinc/18/95/37/1059189537.db2.gz HLKPKAKUMNRGFU-HIFRSBDPSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246942786 1059189742 /nfs/dbraw/zinc/18/97/42/1059189742.db2.gz IGBPRXFYBFEPGR-QHAWAJNXSA-N 2 1 312.501 4.363 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246945082 1059190670 /nfs/dbraw/zinc/19/06/70/1059190670.db2.gz FLQBTFZJDXIDQS-HNAYVOBHSA-N 2 1 320.908 4.473 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](C(C)C)C2)c1 ZINC001246943546 1059190897 /nfs/dbraw/zinc/19/08/97/1059190897.db2.gz LSKFRQZDTOAXEP-AABGKKOBSA-N 2 1 300.490 4.217 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246945088 1059191059 /nfs/dbraw/zinc/19/10/59/1059191059.db2.gz FLQBTFZJDXIDQS-KXBFYZLASA-N 2 1 320.908 4.473 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246945553 1059191200 /nfs/dbraw/zinc/19/12/00/1059191200.db2.gz ZIOHXRVJSXVBRC-OXQOHEQNSA-N 2 1 318.480 4.206 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246943972 1059191251 /nfs/dbraw/zinc/19/12/51/1059191251.db2.gz SPOSRYSASDBNFJ-GOSISDBHSA-N 2 1 306.469 4.349 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246945076 1059191281 /nfs/dbraw/zinc/19/12/81/1059191281.db2.gz FLQBTFZJDXIDQS-BEFAXECRSA-N 2 1 320.908 4.473 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246949587 1059194663 /nfs/dbraw/zinc/19/46/63/1059194663.db2.gz AOJWFGLFFUVRHY-YOEHRIQHSA-N 2 1 306.881 4.083 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC[NH2+]1 ZINC001246946710 1059195010 /nfs/dbraw/zinc/19/50/10/1059195010.db2.gz HOTCNZPWJBPNQC-KZNAEPCWSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246947057 1059195680 /nfs/dbraw/zinc/19/56/80/1059195680.db2.gz SPZPGWNMOGCIRE-BEFAXECRSA-N 2 1 320.908 4.473 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)C1 ZINC001246947260 1059196021 /nfs/dbraw/zinc/19/60/21/1059196021.db2.gz SPZPGWNMOGCIRE-KXBFYZLASA-N 2 1 320.908 4.473 20 0 DIADMP CC[C@H]1CC[C@@H]([N@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956173 1059198054 /nfs/dbraw/zinc/19/80/54/1059198054.db2.gz QPRPPPSAFGGNPB-KBXCAEBGSA-N 2 1 322.443 4.098 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956173 1059198069 /nfs/dbraw/zinc/19/80/69/1059198069.db2.gz QPRPPPSAFGGNPB-KBXCAEBGSA-N 2 1 322.443 4.098 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246956247 1059200984 /nfs/dbraw/zinc/20/09/84/1059200984.db2.gz XCJPGZZCWMAJHS-QAPCUYQASA-N 2 1 320.908 4.473 20 0 DIADMP Cc1ccc(C[N@@H+]([C@@H]2CCC(C)(C)C2)C2CC[NH2+]CC2)c(F)c1 ZINC001246954812 1059201838 /nfs/dbraw/zinc/20/18/38/1059201838.db2.gz HFXGJWPTGBEOQF-GOSISDBHSA-N 2 1 318.480 4.267 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246956743 1059206068 /nfs/dbraw/zinc/20/60/68/1059206068.db2.gz UHIJJUNBQDXZIG-QGZVFWFLSA-N 2 1 324.459 4.488 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246956646 1059206434 /nfs/dbraw/zinc/20/64/34/1059206434.db2.gz ZKVMSIWLLCYMTH-ZWKOTPCHSA-N 2 1 317.521 4.096 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CC[NH2+][C@H](C(C)C)C2)c1C ZINC001246966616 1059210467 /nfs/dbraw/zinc/21/04/67/1059210467.db2.gz LBUUGFUBVWWHEI-UXHICEINSA-N 2 1 300.490 4.044 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1ccc(OC)cc1)C1CC[NH2+]CC1 ZINC001246965525 1059210887 /nfs/dbraw/zinc/21/08/87/1059210887.db2.gz PIMQQUORVOXRQI-QGZVFWFLSA-N 2 1 318.505 4.218 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@@H](C)C1 ZINC001246966269 1059211724 /nfs/dbraw/zinc/21/17/24/1059211724.db2.gz VXLDBVKHZWMACJ-FOIQADDNSA-N 2 1 318.480 4.267 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2CCC3(C2)CC[NH2+]CC3)c1C ZINC001246967341 1059212503 /nfs/dbraw/zinc/21/25/03/1059212503.db2.gz MOHIMVISTHXJNE-FQEVSTJZSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+]([C@@H]1CCC(C)(C)C1)C1CC[NH2+]CC1 ZINC001246965794 1059213392 /nfs/dbraw/zinc/21/33/92/1059213392.db2.gz SFGUQLSDBYNLJO-LJQANCHMSA-N 2 1 318.480 4.267 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@@H](C)C1 ZINC001246966275 1059214058 /nfs/dbraw/zinc/21/40/58/1059214058.db2.gz VXLDBVKHZWMACJ-QRWLVFNGSA-N 2 1 318.480 4.267 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246974122 1059216687 /nfs/dbraw/zinc/21/66/87/1059216687.db2.gz HYLHIOIZLGYYDF-ZDUSSCGKSA-N 2 1 324.871 4.017 20 0 DIADMP CCSC[C@H](C)[N@@H+](Cc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246974701 1059218188 /nfs/dbraw/zinc/21/81/88/1059218188.db2.gz RFKJXMXTFNQQTP-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP CCC[N@@H+](C[C@@H]1CC[NH2+]C1)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246971969 1059219494 /nfs/dbraw/zinc/21/94/94/1059219494.db2.gz CECCWWYTTAMZET-RLLQIKCJSA-N 2 1 300.490 4.034 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001246971306 1059219739 /nfs/dbraw/zinc/21/97/39/1059219739.db2.gz FMMZRSOTWSGMIV-UXHICEINSA-N 2 1 314.517 4.252 20 0 DIADMP CCC(CC)[N@@H+]([C@H](C)c1ccccc1)[C@H]1CSC2(C[NH2+]C2)C1 ZINC001246976155 1059219802 /nfs/dbraw/zinc/21/98/02/1059219802.db2.gz YFVMSCIJYRGKFW-CRAIPNDOSA-N 2 1 318.530 4.086 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)C1C[C@@H]2C=C[C@H](C1)[NH2+]2 ZINC001246980060 1059222279 /nfs/dbraw/zinc/22/22/79/1059222279.db2.gz QNYZTYCTRNFJDI-JQKXYWIWSA-N 2 1 312.501 4.169 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H](CCc3ccccc3)C2)CC[NH2+]1 ZINC001246980675 1059222859 /nfs/dbraw/zinc/22/28/59/1059222859.db2.gz RJICDHTUKNXQGQ-HKBOAZHASA-N 2 1 314.517 4.108 20 0 DIADMP c1ccc([C@H]2CCC[C@H]([N@@H+](C3CCC3)C3CC[NH2+]CC3)C2)cc1 ZINC001246978414 1059223089 /nfs/dbraw/zinc/22/30/89/1059223089.db2.gz UEGPWYCQJORWOW-RXVVDRJESA-N 2 1 312.501 4.319 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@H]12 ZINC001246978242 1059223409 /nfs/dbraw/zinc/22/34/09/1059223409.db2.gz VRGQSJYZUWZMBG-HMJZBIJNSA-N 2 1 318.892 4.035 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246976951 1059225215 /nfs/dbraw/zinc/22/52/15/1059225215.db2.gz GREWROPBYJSKLZ-JSXRDJHFSA-N 2 1 314.517 4.108 20 0 DIADMP Fc1cc(F)cc([C@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001247000314 1059229276 /nfs/dbraw/zinc/22/92/76/1059229276.db2.gz HKUSWEKOTXUGLA-IPMKNSEASA-N 2 1 320.427 4.024 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001246999304 1059230247 /nfs/dbraw/zinc/23/02/47/1059230247.db2.gz ASXBYEZVECENTR-PKOBYXMFSA-N 2 1 314.517 4.338 20 0 DIADMP C[NH2+]CC[C@H](C)[N@@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC001246993541 1059230447 /nfs/dbraw/zinc/23/04/47/1059230447.db2.gz TZMTUFUOZHUNNA-BBRMVZONSA-N 2 1 314.395 4.230 20 0 DIADMP C[NH2+]CC[C@H](C)[N@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC001246993541 1059230464 /nfs/dbraw/zinc/23/04/64/1059230464.db2.gz TZMTUFUOZHUNNA-BBRMVZONSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@H]1c2ccccc2CC[N@@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246988865 1059230544 /nfs/dbraw/zinc/23/05/44/1059230544.db2.gz ZOLGGBYPYHCFBW-LDQXTDLNSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246988865 1059230563 /nfs/dbraw/zinc/23/05/63/1059230563.db2.gz ZOLGGBYPYHCFBW-LDQXTDLNSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001247005239 1059232129 /nfs/dbraw/zinc/23/21/29/1059232129.db2.gz VJKYXEAJCUMUNM-NKELODKYSA-N 2 1 320.908 4.427 20 0 DIADMP CC(C)CCC[C@@H](C)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247006115 1059232225 /nfs/dbraw/zinc/23/22/25/1059232225.db2.gz SSWVDEPZYDTHKI-GOSISDBHSA-N 2 1 314.517 4.338 20 0 DIADMP CCCC[C@@H](CC)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247007929 1059233803 /nfs/dbraw/zinc/23/38/03/1059233803.db2.gz ZHLIFYCQCBTIGW-GOSISDBHSA-N 2 1 300.490 4.092 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001247006668 1059233853 /nfs/dbraw/zinc/23/38/53/1059233853.db2.gz XPNJLKGTBGVGOT-FCGDIQPGSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001247006668 1059233874 /nfs/dbraw/zinc/23/38/74/1059233874.db2.gz XPNJLKGTBGVGOT-FCGDIQPGSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@H]1CC([N@H+]2CCC[C@@H]2c2ccccc2C)C[C@H](CC)[NH2+]1 ZINC001247006001 1059234001 /nfs/dbraw/zinc/23/40/01/1059234001.db2.gz WDOBBRCLISVURK-ABSDTBQOSA-N 2 1 300.490 4.441 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001247006682 1059235327 /nfs/dbraw/zinc/23/53/27/1059235327.db2.gz XPNJLKGTBGVGOT-YDZRNGNQSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001247006682 1059235344 /nfs/dbraw/zinc/23/53/44/1059235344.db2.gz XPNJLKGTBGVGOT-YDZRNGNQSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247014933 1059242082 /nfs/dbraw/zinc/24/20/82/1059242082.db2.gz MMVCCSIMPZIWRR-HXUWFJFHSA-N 2 1 320.480 4.102 20 0 DIADMP Cc1cc(F)ccc1C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001559509571 1059300215 /nfs/dbraw/zinc/30/02/15/1059300215.db2.gz ZLJIZRDGLRRZNE-SFHVURJKSA-N 2 1 318.480 4.078 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001559509571 1059300232 /nfs/dbraw/zinc/30/02/32/1059300232.db2.gz ZLJIZRDGLRRZNE-SFHVURJKSA-N 2 1 318.480 4.078 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC001559510473 1059303987 /nfs/dbraw/zinc/30/39/87/1059303987.db2.gz IVQURWFSXMFUAA-GOSISDBHSA-N 2 1 300.490 4.295 20 0 DIADMP C1=C(CC[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)CCCC1 ZINC001559524668 1059323271 /nfs/dbraw/zinc/32/32/71/1059323271.db2.gz MBSHSUUUOGNZBT-FQEVSTJZSA-N 2 1 304.522 4.465 20 0 DIADMP CC[C@@H](C)C[N@@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001559541085 1059345667 /nfs/dbraw/zinc/34/56/67/1059345667.db2.gz HZNYKIWLDRRZHL-LJQANCHMSA-N 2 1 316.533 4.309 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc2ccccc21)C[C@@H]1CCC[NH+](C)C1 ZINC001559557972 1059374085 /nfs/dbraw/zinc/37/40/85/1059374085.db2.gz LGLUHQGDEKJQHI-OAHLLOKOSA-N 2 1 316.876 4.267 20 0 DIADMP C[NH+](Cc1cc(Cl)cc2ccccc21)C[C@@H]1CCC[N@H+](C)C1 ZINC001559557972 1059374103 /nfs/dbraw/zinc/37/41/03/1059374103.db2.gz LGLUHQGDEKJQHI-OAHLLOKOSA-N 2 1 316.876 4.267 20 0 DIADMP C[NH+](Cc1cc(Cl)cc2ccccc21)C[C@@H]1CCC[N@@H+](C)C1 ZINC001559557972 1059374127 /nfs/dbraw/zinc/37/41/27/1059374127.db2.gz LGLUHQGDEKJQHI-OAHLLOKOSA-N 2 1 316.876 4.267 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1CCCCCC1 ZINC001559565556 1059393430 /nfs/dbraw/zinc/39/34/30/1059393430.db2.gz NDCGWEYRFZQESR-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCCCCC1 ZINC001559565556 1059393457 /nfs/dbraw/zinc/39/34/57/1059393457.db2.gz NDCGWEYRFZQESR-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCCCCC1 ZINC001559565556 1059393481 /nfs/dbraw/zinc/39/34/81/1059393481.db2.gz NDCGWEYRFZQESR-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2F)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573237 1059404172 /nfs/dbraw/zinc/40/41/72/1059404172.db2.gz ADPAISJPGJESIU-LPHOPBHVSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573237 1059404181 /nfs/dbraw/zinc/40/41/81/1059404181.db2.gz ADPAISJPGJESIU-LPHOPBHVSA-N 2 1 304.453 4.085 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CC4CCCC4)CC[C@@H]32)cc1 ZINC001559594757 1059427408 /nfs/dbraw/zinc/42/74/08/1059427408.db2.gz TVRDHPIFMPZJNT-SFTDATJTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CC4CCCC4)CC[C@@H]32)cc1 ZINC001559594757 1059427415 /nfs/dbraw/zinc/42/74/15/1059427415.db2.gz TVRDHPIFMPZJNT-SFTDATJTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CC4CCCC4)CC[C@@H]32)cc1 ZINC001559594757 1059427425 /nfs/dbraw/zinc/42/74/25/1059427425.db2.gz TVRDHPIFMPZJNT-SFTDATJTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CCC4CCC4)CC[C@@H]32)cc1 ZINC001559594556 1059428094 /nfs/dbraw/zinc/42/80/94/1059428094.db2.gz QWSWEJJBQHCTPL-RTWAWAEBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CCC4CCC4)CC[C@@H]32)cc1 ZINC001559594556 1059428107 /nfs/dbraw/zinc/42/81/07/1059428107.db2.gz QWSWEJJBQHCTPL-RTWAWAEBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CCC4CCC4)CC[C@@H]32)cc1 ZINC001559594556 1059428119 /nfs/dbraw/zinc/42/81/19/1059428119.db2.gz QWSWEJJBQHCTPL-RTWAWAEBSA-N 2 1 312.501 4.163 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(OC(C)(C)C)c2)[C@@H](C)C1 ZINC001559600772 1059434146 /nfs/dbraw/zinc/43/41/46/1059434146.db2.gz HCHPYRMYCXQWFX-LPHOPBHVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@@H](C)C1 ZINC001559600772 1059434154 /nfs/dbraw/zinc/43/41/54/1059434154.db2.gz HCHPYRMYCXQWFX-LPHOPBHVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@@H](C)C1 ZINC001559600772 1059434175 /nfs/dbraw/zinc/43/41/75/1059434175.db2.gz HCHPYRMYCXQWFX-LPHOPBHVSA-N 2 1 318.505 4.026 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C[C@H]2CC3CCC2CC3)cc1 ZINC001559712127 1059539189 /nfs/dbraw/zinc/53/91/89/1059539189.db2.gz BXWCPXJKSMZSEM-RRWXTXHCSA-N 2 1 300.490 4.006 20 0 DIADMP Cc1c2ccccc2sc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001559729564 1059561794 /nfs/dbraw/zinc/56/17/94/1059561794.db2.gz BKEPHXKFMZZPJC-HUUCEWRRSA-N 2 1 302.487 4.345 20 0 DIADMP CC(C)=CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001559818010 1059652770 /nfs/dbraw/zinc/65/27/70/1059652770.db2.gz BZXOCRYDWQFJQV-KRWDZBQOSA-N 2 1 306.519 4.167 20 0 DIADMP CC(C)=CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001559818010 1059652780 /nfs/dbraw/zinc/65/27/80/1059652780.db2.gz BZXOCRYDWQFJQV-KRWDZBQOSA-N 2 1 306.519 4.167 20 0 DIADMP CC(C)=CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC001559818010 1059652787 /nfs/dbraw/zinc/65/27/87/1059652787.db2.gz BZXOCRYDWQFJQV-KRWDZBQOSA-N 2 1 306.519 4.167 20 0 DIADMP CC(C)=CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C)s2)C1 ZINC001559818010 1059652790 /nfs/dbraw/zinc/65/27/90/1059652790.db2.gz BZXOCRYDWQFJQV-KRWDZBQOSA-N 2 1 306.519 4.167 20 0 DIADMP CC(C)=CCC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001559870090 1059689406 /nfs/dbraw/zinc/68/94/06/1059689406.db2.gz NFFSTIYYJXPTSP-UHFFFAOYSA-N 2 1 312.501 4.331 20 0 DIADMP Cc1cccc(C)c1C[N@H+](CC[C@@H]1CCC[NH+]1C)CC(C)C ZINC001559935517 1059748499 /nfs/dbraw/zinc/74/84/99/1059748499.db2.gz MEAYCYDPEKPCTD-IBGZPJMESA-N 2 1 302.506 4.246 20 0 DIADMP Cc1cccc(C)c1C[NH+](CC[C@@H]1CCC[N@@H+]1C)CC(C)C ZINC001559935517 1059748519 /nfs/dbraw/zinc/74/85/19/1059748519.db2.gz MEAYCYDPEKPCTD-IBGZPJMESA-N 2 1 302.506 4.246 20 0 DIADMP Cc1cccc(C)c1C[NH+](CC[C@@H]1CCC[N@H+]1C)CC(C)C ZINC001559935517 1059748537 /nfs/dbraw/zinc/74/85/37/1059748537.db2.gz MEAYCYDPEKPCTD-IBGZPJMESA-N 2 1 302.506 4.246 20 0 DIADMP C[N@@H+]1C[C@]2(C)C[NH+](Cc3ccc(C4CCCC4)cc3)C[C@]2(C)C1 ZINC001560044082 1059854992 /nfs/dbraw/zinc/85/49/92/1059854992.db2.gz SZFHEEZEIJAQGI-OYRHEFFESA-N 2 1 312.501 4.118 20 0 DIADMP C[N@H+]1C[C@]2(C)C[NH+](Cc3ccc(C4CCCC4)cc3)C[C@]2(C)C1 ZINC001560044082 1059855019 /nfs/dbraw/zinc/85/50/19/1059855019.db2.gz SZFHEEZEIJAQGI-OYRHEFFESA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+]1C[C@]2(C)C[N@H+](Cc3ccc(C4CCCC4)cc3)C[C@]2(C)C1 ZINC001560044082 1059855043 /nfs/dbraw/zinc/85/50/43/1059855043.db2.gz SZFHEEZEIJAQGI-OYRHEFFESA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+]1C[C@]2(C)C[N@@H+](Cc3ccc(C4CCCC4)cc3)C[C@]2(C)C1 ZINC001560044082 1059855064 /nfs/dbraw/zinc/85/50/64/1059855064.db2.gz SZFHEEZEIJAQGI-OYRHEFFESA-N 2 1 312.501 4.118 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)C[C@@H](C)C1 ZINC001560109182 1059915273 /nfs/dbraw/zinc/91/52/73/1059915273.db2.gz VQZBYKQQUQNVBT-HCXYKTFWSA-N 2 1 315.505 4.055 20 0 DIADMP Cc1cccc([C@@H](C)[NH+]2CCC(C)([NH+]3CCCCC3)CC2)c1 ZINC001560126252 1059932114 /nfs/dbraw/zinc/93/21/14/1059932114.db2.gz DQOSKZSFJGKWKG-GOSISDBHSA-N 2 1 300.490 4.396 20 0 DIADMP c1cc(C[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C2CC2)co1 ZINC001560175244 1059967615 /nfs/dbraw/zinc/96/76/15/1059967615.db2.gz KOQIDGKRHGFGEX-UHFFFAOYSA-N 2 1 324.468 4.430 20 0 DIADMP Cc1cc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)cs1 ZINC001248804703 1059989396 /nfs/dbraw/zinc/98/93/96/1059989396.db2.gz RJZSCOHOMBJSHQ-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP Cc1cc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)cs1 ZINC001248804703 1059989417 /nfs/dbraw/zinc/98/94/17/1059989417.db2.gz RJZSCOHOMBJSHQ-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP CC(C)CCC[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC001560266231 1060037335 /nfs/dbraw/zinc/03/73/35/1060037335.db2.gz UGOLQMLFFHKHAH-SFHVURJKSA-N 2 1 302.506 4.444 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@H](C)[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266644 1060039401 /nfs/dbraw/zinc/03/94/01/1060039401.db2.gz LAQRBNBDFWJMEJ-WSTZPKSXSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@H](C)[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266644 1060039417 /nfs/dbraw/zinc/03/94/17/1060039417.db2.gz LAQRBNBDFWJMEJ-WSTZPKSXSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)c1ccc(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001560269576 1060041966 /nfs/dbraw/zinc/04/19/66/1060041966.db2.gz IUFDFHGVJRAJTG-HDICACEKSA-N 2 1 302.506 4.268 20 0 DIADMP C[NH+](C)[C@H](C[NH2+]CC(C)(C)c1ccccc1)C1CCCCC1 ZINC001560270082 1060042974 /nfs/dbraw/zinc/04/29/74/1060042974.db2.gz FGSQOWQANHDXQO-LJQANCHMSA-N 2 1 302.506 4.064 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)c1Cl ZINC001560274091 1060050585 /nfs/dbraw/zinc/05/05/85/1060050585.db2.gz CKBMWJJOJJERJX-GFCCVEGCSA-N 2 1 315.288 4.123 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)c1 ZINC001560347659 1060132432 /nfs/dbraw/zinc/13/24/32/1060132432.db2.gz UKGJINBIEYBVJM-IAGOWNOFSA-N 2 1 302.506 4.441 20 0 DIADMP C[C@@H](CC[NH2+]Cc1cnc(C2CCCC2)s1)[NH+]1CCCCC1 ZINC001560436742 1060227299 /nfs/dbraw/zinc/22/72/99/1060227299.db2.gz PLCPNKYGAPWUAL-HNNXBMFYSA-N 2 1 321.534 4.155 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)CNc1nc2ccccc2[nH]1 ZINC001560467060 1060258440 /nfs/dbraw/zinc/25/84/40/1060258440.db2.gz NHKCYJVKCCKCAH-UHFFFAOYSA-N 2 1 322.456 4.133 20 0 DIADMP C[N@H+](Cc1ccccc1)CC(C)(C)CNc1[nH]c2ccccc2[nH+]1 ZINC001560467060 1060258456 /nfs/dbraw/zinc/25/84/56/1060258456.db2.gz NHKCYJVKCCKCAH-UHFFFAOYSA-N 2 1 322.456 4.133 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)CNc1[nH]c2ccccc2[nH+]1 ZINC001560467060 1060258476 /nfs/dbraw/zinc/25/84/76/1060258476.db2.gz NHKCYJVKCCKCAH-UHFFFAOYSA-N 2 1 322.456 4.133 20 0 DIADMP CCc1cccc(C[NH2+]CCC[N@H+](CC)C2CCCCC2)c1 ZINC001560524429 1060324341 /nfs/dbraw/zinc/32/43/41/1060324341.db2.gz KWSAZNZGQDHDEO-UHFFFAOYSA-N 2 1 302.506 4.383 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cc(C)cc(C)c1)C1CCCCC1 ZINC001560524671 1060324583 /nfs/dbraw/zinc/32/45/83/1060324583.db2.gz WNDKPXIBTHPCIX-UHFFFAOYSA-N 2 1 302.506 4.438 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC[C@@H]2C=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001560576910 1060392384 /nfs/dbraw/zinc/39/23/84/1060392384.db2.gz UDOWUAJMFBPSAC-SFHLNBCPSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC[C@@H]2C=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001560576910 1060392403 /nfs/dbraw/zinc/39/24/03/1060392403.db2.gz UDOWUAJMFBPSAC-SFHLNBCPSA-N 2 1 312.501 4.376 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632822 1060445503 /nfs/dbraw/zinc/44/55/03/1060445503.db2.gz ZTBVUOFTOPNSBN-YJJPMGAVSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632822 1060445516 /nfs/dbraw/zinc/44/55/16/1060445516.db2.gz ZTBVUOFTOPNSBN-YJJPMGAVSA-N 2 1 312.501 4.043 20 0 DIADMP CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560644097 1060464136 /nfs/dbraw/zinc/46/41/36/1060464136.db2.gz HTCKFMRCHZILTO-IVAOSVALSA-N 2 1 312.501 4.055 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CC2CC[NH+](CC)CC2)o1 ZINC001560647245 1060469905 /nfs/dbraw/zinc/46/99/05/1060469905.db2.gz SXCAXAYZXXNQDE-APWZRJJASA-N 2 1 318.505 4.347 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC001560653562 1060475944 /nfs/dbraw/zinc/47/59/44/1060475944.db2.gz WKMRQFXKAMIWGV-LJQANCHMSA-N 2 1 322.496 4.436 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC001560653562 1060475951 /nfs/dbraw/zinc/47/59/51/1060475951.db2.gz WKMRQFXKAMIWGV-LJQANCHMSA-N 2 1 322.496 4.436 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC001560653562 1060475962 /nfs/dbraw/zinc/47/59/62/1060475962.db2.gz WKMRQFXKAMIWGV-LJQANCHMSA-N 2 1 322.496 4.436 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccc(Cl)cc1 ZINC001560803614 1060663714 /nfs/dbraw/zinc/66/37/14/1060663714.db2.gz BBVUXKAHZUTXLL-SZVBFZGTSA-N 2 1 322.924 4.371 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1 ZINC001560804274 1060665484 /nfs/dbraw/zinc/66/54/84/1060665484.db2.gz XYXSYVOMLHFUSE-JLSDUUJJSA-N 2 1 308.897 4.296 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(C2CC2)cc1 ZINC001560813352 1060671123 /nfs/dbraw/zinc/67/11/23/1060671123.db2.gz VSJFWKIAQSVNLN-UHFFFAOYSA-N 2 1 311.473 4.235 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(C2CC2)cc1 ZINC001560813352 1060671134 /nfs/dbraw/zinc/67/11/34/1060671134.db2.gz VSJFWKIAQSVNLN-UHFFFAOYSA-N 2 1 311.473 4.235 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001560871863 1060733916 /nfs/dbraw/zinc/73/39/16/1060733916.db2.gz UNXJRDZMMCGHNW-NHCUHLMSSA-N 2 1 312.501 4.377 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC001560877891 1060737645 /nfs/dbraw/zinc/73/76/45/1060737645.db2.gz GMLBTQDZMJOFDB-RLLQIKCJSA-N 2 1 300.490 4.034 20 0 DIADMP CCc1ccc(C[N@H+](CC(C)C)CC2CC[NH+](CC)CC2)cc1 ZINC001560899485 1060761365 /nfs/dbraw/zinc/76/13/65/1060761365.db2.gz VKYUPUBHINPOCR-UHFFFAOYSA-N 2 1 316.533 4.439 20 0 DIADMP C[C@H](C[N@@H+]1CCCC[C@@H]1[C@@H](C)C[NH+](C)C)c1cccc(Cl)c1 ZINC001560948291 1060813082 /nfs/dbraw/zinc/81/30/82/1060813082.db2.gz SSHSTDNUBPMAMZ-JTDSTZFVSA-N 2 1 322.924 4.496 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CC[C@@H]2[C@H](CC[N@@H+]2C)C1 ZINC001560972099 1060835517 /nfs/dbraw/zinc/83/55/17/1060835517.db2.gz CUGPDBFQINBTMI-DENIHFKCSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC001560972099 1060835523 /nfs/dbraw/zinc/83/55/23/1060835523.db2.gz CUGPDBFQINBTMI-DENIHFKCSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@@H]2[C@H](CC[NH+]2C)C1 ZINC001560972099 1060835529 /nfs/dbraw/zinc/83/55/29/1060835529.db2.gz CUGPDBFQINBTMI-DENIHFKCSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CC[C@@H]2[C@@H](CC[N@@H+]2C)C1 ZINC001560972101 1060835638 /nfs/dbraw/zinc/83/56/38/1060835638.db2.gz CUGPDBFQINBTMI-SIKLNZKXSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC001560972101 1060835643 /nfs/dbraw/zinc/83/56/43/1060835643.db2.gz CUGPDBFQINBTMI-SIKLNZKXSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@@H]2[C@@H](CC[NH+]2C)C1 ZINC001560972101 1060835652 /nfs/dbraw/zinc/83/56/52/1060835652.db2.gz CUGPDBFQINBTMI-SIKLNZKXSA-N 2 1 320.480 4.188 20 0 DIADMP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ncc(C(C)(C)C)s1 ZINC001560982629 1060847389 /nfs/dbraw/zinc/84/73/89/1060847389.db2.gz BZMIGJMQMCUWGK-UHFFFAOYSA-N 2 1 323.550 4.139 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ncc(C(C)(C)C)s1 ZINC001560982629 1060847403 /nfs/dbraw/zinc/84/74/03/1060847403.db2.gz BZMIGJMQMCUWGK-UHFFFAOYSA-N 2 1 323.550 4.139 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001561001685 1060861132 /nfs/dbraw/zinc/86/11/32/1060861132.db2.gz BUVLNWJYRRKODD-YQQQUEKLSA-N 2 1 308.469 4.117 20 0 DIADMP CC(C)=CCC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219761 1060996892 /nfs/dbraw/zinc/99/68/92/1060996892.db2.gz MUXJAXSHZUVXBY-LEWJYISDSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219761 1060996907 /nfs/dbraw/zinc/99/69/07/1060996907.db2.gz MUXJAXSHZUVXBY-LEWJYISDSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219761 1060996918 /nfs/dbraw/zinc/99/69/18/1060996918.db2.gz MUXJAXSHZUVXBY-LEWJYISDSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC001473219442 1060999229 /nfs/dbraw/zinc/99/92/29/1060999229.db2.gz HHFFIBDZTBYHTG-FFZOFVMBSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC001473219442 1060999253 /nfs/dbraw/zinc/99/92/53/1060999253.db2.gz HHFFIBDZTBYHTG-FFZOFVMBSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC001473219442 1060999266 /nfs/dbraw/zinc/99/92/66/1060999266.db2.gz HHFFIBDZTBYHTG-FFZOFVMBSA-N 2 1 300.490 4.287 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001462183220 1061001452 /nfs/dbraw/zinc/00/14/52/1061001452.db2.gz YHRGSJVIEBBWLO-FKPGQJDZSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001462183220 1061001467 /nfs/dbraw/zinc/00/14/67/1061001467.db2.gz YHRGSJVIEBBWLO-FKPGQJDZSA-N 2 1 312.501 4.380 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001473229630 1061007962 /nfs/dbraw/zinc/00/79/62/1061007962.db2.gz CPYGJXRHOSKXNZ-WOJBJXKFSA-N 2 1 300.490 4.120 20 0 DIADMP CC[N@H+](CCC[NH+]1CCCC1)Cc1ccccc1C(F)(F)F ZINC001462199523 1061020297 /nfs/dbraw/zinc/02/02/97/1061020297.db2.gz NGRUAUORKWYLTM-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1ccccc1C(F)(F)F ZINC001462199523 1061020312 /nfs/dbraw/zinc/02/03/12/1061020312.db2.gz NGRUAUORKWYLTM-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462215794 1061031969 /nfs/dbraw/zinc/03/19/69/1061031969.db2.gz BPJAJHWCEALMOF-UFYCRDLUSA-N 2 1 300.490 4.095 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001462215794 1061031986 /nfs/dbraw/zinc/03/19/86/1061031986.db2.gz BPJAJHWCEALMOF-UFYCRDLUSA-N 2 1 300.490 4.095 20 0 DIADMP CC(C)[C@@H](C[NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC001462222083 1061037389 /nfs/dbraw/zinc/03/73/89/1061037389.db2.gz MRRCKDZITSCLIL-LJQANCHMSA-N 2 1 320.908 4.296 20 0 DIADMP CCCc1ccc([C@H]([NH2+]CCCc2c[nH+]cn2C)C(C)C)cc1 ZINC001473299583 1061065624 /nfs/dbraw/zinc/06/56/24/1061065624.db2.gz ODSUZOVBGDYHOY-HXUWFJFHSA-N 2 1 313.489 4.292 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC001473307861 1061070466 /nfs/dbraw/zinc/07/04/66/1061070466.db2.gz UEOWUZDRZDAUDG-UHFFFAOYSA-N 2 1 322.496 4.462 20 0 DIADMP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC001462307651 1061093685 /nfs/dbraw/zinc/09/36/85/1061093685.db2.gz AEZFRONIHASYQP-KRWDZBQOSA-N 2 1 308.897 4.125 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCCC[C@H]1c1ccccc1)C1CC1 ZINC001462310010 1061096637 /nfs/dbraw/zinc/09/66/37/1061096637.db2.gz MEDKQQVMXCZKJD-PMACEKPBSA-N 2 1 300.490 4.177 20 0 DIADMP CC[N@@H+](CCC[NH2+]C[C@@H]1CCc2ccccc21)C1CCCCC1 ZINC001462408219 1061154539 /nfs/dbraw/zinc/15/45/39/1061154539.db2.gz NRAPVXPOTPQKEM-IBGZPJMESA-N 2 1 314.517 4.351 20 0 DIADMP CCC[C@H](C)CCC[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001473428305 1061155259 /nfs/dbraw/zinc/15/52/59/1061155259.db2.gz PIINUQBPQYHOCB-INIZCTEOSA-N 2 1 304.478 4.450 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC(C)(C)C3)C2)s1 ZINC001473455342 1061169739 /nfs/dbraw/zinc/16/97/39/1061169739.db2.gz JHESAERNHYUDLW-MRXNPFEDSA-N 2 1 320.546 4.246 20 0 DIADMP CC[C@H](C)[C@H](C)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001473465349 1061174478 /nfs/dbraw/zinc/17/44/78/1061174478.db2.gz OLNHJJIGQCUBDZ-BJLQDIEVSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001473465349 1061174484 /nfs/dbraw/zinc/17/44/84/1061174484.db2.gz OLNHJJIGQCUBDZ-BJLQDIEVSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001473465349 1061174489 /nfs/dbraw/zinc/17/44/89/1061174489.db2.gz OLNHJJIGQCUBDZ-BJLQDIEVSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]CC2CCC(c3ccccc3)CC2)C1 ZINC001462443645 1061177628 /nfs/dbraw/zinc/17/76/28/1061177628.db2.gz YOVIMIWGGQVCLL-OBXNSHGQSA-N 2 1 314.517 4.282 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001462451954 1061181884 /nfs/dbraw/zinc/18/18/84/1061181884.db2.gz JDYOMRMRHVECLO-QUCCMNQESA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001462451954 1061181891 /nfs/dbraw/zinc/18/18/91/1061181891.db2.gz JDYOMRMRHVECLO-QUCCMNQESA-N 2 1 302.506 4.207 20 0 DIADMP C[NH+]1CCC([NH2+][C@H](c2ccc(F)cc2)C2CCCCC2)CC1 ZINC001462511626 1061218926 /nfs/dbraw/zinc/21/89/26/1061218926.db2.gz XYOVXLAXDBSQDL-IBGZPJMESA-N 2 1 304.453 4.131 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H](c2ccc(F)cc2)C2CCCCC2)CC1 ZINC001462511629 1061219575 /nfs/dbraw/zinc/21/95/75/1061219575.db2.gz XYOVXLAXDBSQDL-LJQANCHMSA-N 2 1 304.453 4.131 20 0 DIADMP CC(C)CCCCNc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC001462534366 1061243793 /nfs/dbraw/zinc/24/37/93/1061243793.db2.gz FUJSUAGDCIFLHD-HXUWFJFHSA-N 2 1 315.505 4.209 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC001473586264 1061276671 /nfs/dbraw/zinc/27/66/71/1061276671.db2.gz FOCMEWMKGREUCB-OAHLLOKOSA-N 2 1 315.848 4.008 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001462627439 1061307516 /nfs/dbraw/zinc/30/75/16/1061307516.db2.gz JSQBUQDJSNOJJL-UYAOXDASSA-N 2 1 312.501 4.380 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001462627439 1061307533 /nfs/dbraw/zinc/30/75/33/1061307533.db2.gz JSQBUQDJSNOJJL-UYAOXDASSA-N 2 1 312.501 4.380 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@@H](C)[C@H]1CC1(F)F)c1ccccc1 ZINC001462673061 1061332385 /nfs/dbraw/zinc/33/23/85/1061332385.db2.gz HTLQQRWDCHUDSD-UAGQMJEPSA-N 2 1 310.432 4.093 20 0 DIADMP CCCCCC[NH+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473718858 1061368382 /nfs/dbraw/zinc/36/83/82/1061368382.db2.gz QQICHCHLZSDGEI-NHCUHLMSSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)C[C@H](C)[N@@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719608 1061369825 /nfs/dbraw/zinc/36/98/25/1061369825.db2.gz YCYYNTDQPOHCDO-SESVDKBCSA-N 2 1 314.517 4.265 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719608 1061369845 /nfs/dbraw/zinc/36/98/45/1061369845.db2.gz YCYYNTDQPOHCDO-SESVDKBCSA-N 2 1 314.517 4.265 20 0 DIADMP CC(C)C[C@H](C)[NH+]1C[C@@]2(C)C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719608 1061369863 /nfs/dbraw/zinc/36/98/63/1061369863.db2.gz YCYYNTDQPOHCDO-SESVDKBCSA-N 2 1 314.517 4.265 20 0 DIADMP CC(C)C[C@H](C)[NH+]1C[C@@]2(C)C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719608 1061369881 /nfs/dbraw/zinc/36/98/81/1061369881.db2.gz YCYYNTDQPOHCDO-SESVDKBCSA-N 2 1 314.517 4.265 20 0 DIADMP CC(C)C[C@@H](C)[N@@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719607 1061370775 /nfs/dbraw/zinc/37/07/75/1061370775.db2.gz YCYYNTDQPOHCDO-NRSPTQNISA-N 2 1 314.517 4.265 20 0 DIADMP CC(C)C[C@@H](C)[N@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719607 1061370787 /nfs/dbraw/zinc/37/07/87/1061370787.db2.gz YCYYNTDQPOHCDO-NRSPTQNISA-N 2 1 314.517 4.265 20 0 DIADMP CC(C)C[C@@H](C)[NH+]1C[C@@]2(C)C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719607 1061370800 /nfs/dbraw/zinc/37/08/00/1061370800.db2.gz YCYYNTDQPOHCDO-NRSPTQNISA-N 2 1 314.517 4.265 20 0 DIADMP CC(C)C[C@@H](C)[NH+]1C[C@@]2(C)C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719607 1061370812 /nfs/dbraw/zinc/37/08/12/1061370812.db2.gz YCYYNTDQPOHCDO-NRSPTQNISA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC001473759937 1061396065 /nfs/dbraw/zinc/39/60/65/1061396065.db2.gz SJANJUWOHPZHDN-GJZGRUSLSA-N 2 1 315.848 4.007 20 0 DIADMP CCCc1cccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)c1 ZINC001473910215 1061458992 /nfs/dbraw/zinc/45/89/92/1061458992.db2.gz GSNBRFISDQBQRX-UHFFFAOYSA-N 2 1 302.506 4.383 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccccc1C1CC1 ZINC001473937466 1061481538 /nfs/dbraw/zinc/48/15/38/1061481538.db2.gz VIOBLEWRYATQQD-KRWDZBQOSA-N 2 1 300.490 4.308 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC001473980196 1061524293 /nfs/dbraw/zinc/52/42/93/1061524293.db2.gz RHPMBJQUQNFBLU-VQTJNVASSA-N 2 1 314.517 4.109 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001473989278 1061530214 /nfs/dbraw/zinc/53/02/14/1061530214.db2.gz ZFLGDGPBHOFNSG-OAQYLSRUSA-N 2 1 314.517 4.178 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001473989278 1061530228 /nfs/dbraw/zinc/53/02/28/1061530228.db2.gz ZFLGDGPBHOFNSG-OAQYLSRUSA-N 2 1 314.517 4.178 20 0 DIADMP CC[C@H](C[NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccccc1 ZINC001473988234 1061530295 /nfs/dbraw/zinc/53/02/95/1061530295.db2.gz GOLANZAXBPNXRP-HXUWFJFHSA-N 2 1 310.485 4.422 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1 ZINC001473987773 1061531792 /nfs/dbraw/zinc/53/17/92/1061531792.db2.gz NDYVIMPFWUBCHP-IHPCNDPISA-N 2 1 302.506 4.423 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1 ZINC001473987775 1061533035 /nfs/dbraw/zinc/53/30/35/1061533035.db2.gz NDYVIMPFWUBCHP-YSIASYRMSA-N 2 1 302.506 4.423 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)c1 ZINC001474015644 1061557325 /nfs/dbraw/zinc/55/73/25/1061557325.db2.gz DFYFBKICDKPOIN-MBOZVWFJSA-N 2 1 302.506 4.441 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC001253094562 1061798774 /nfs/dbraw/zinc/79/87/74/1061798774.db2.gz FFYSAOGFGTVYCW-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270087 1061838179 /nfs/dbraw/zinc/83/81/79/1061838179.db2.gz SGCIAVSTXMXBGT-HKUYNNGSSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270087 1061838190 /nfs/dbraw/zinc/83/81/90/1061838190.db2.gz SGCIAVSTXMXBGT-HKUYNNGSSA-N 2 1 314.517 4.455 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@@H]1CCC[NH+](C)C1 ZINC001474334624 1061930403 /nfs/dbraw/zinc/93/04/03/1061930403.db2.gz VTKJTLXEHOLJFV-QGZVFWFLSA-N 2 1 322.452 4.360 20 0 DIADMP C[NH+](Cc1ccc2oc3ccccc3c2c1)C[C@@H]1CCC[N@H+](C)C1 ZINC001474334624 1061930422 /nfs/dbraw/zinc/93/04/22/1061930422.db2.gz VTKJTLXEHOLJFV-QGZVFWFLSA-N 2 1 322.452 4.360 20 0 DIADMP C[NH+](Cc1ccc2oc3ccccc3c2c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC001474334624 1061930459 /nfs/dbraw/zinc/93/04/59/1061930459.db2.gz VTKJTLXEHOLJFV-QGZVFWFLSA-N 2 1 322.452 4.360 20 0 DIADMP CC[NH+](CC)CCO[C@H]1CC[N@@H+](C[C@H](C)CC2CCCCC2)C1 ZINC001474348451 1061955115 /nfs/dbraw/zinc/95/51/15/1061955115.db2.gz IKAHSKNJBDUVJR-QUCCMNQESA-N 2 1 324.553 4.026 20 0 DIADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](C[C@@H](C)CC2CCCCC2)C1 ZINC001474348449 1061958158 /nfs/dbraw/zinc/95/81/58/1061958158.db2.gz IKAHSKNJBDUVJR-AZUAARDMSA-N 2 1 324.553 4.026 20 0 DIADMP C[C@H]1CC[N@@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001474380726 1062026471 /nfs/dbraw/zinc/02/64/71/1062026471.db2.gz AALLARJSTYTKJT-RXVVDRJESA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001474380726 1062026495 /nfs/dbraw/zinc/02/64/95/1062026495.db2.gz AALLARJSTYTKJT-RXVVDRJESA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H]1CC[NH+](C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001474380726 1062026514 /nfs/dbraw/zinc/02/65/14/1062026514.db2.gz AALLARJSTYTKJT-RXVVDRJESA-N 2 1 314.517 4.267 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCCC2)C2CCC(F)(F)CC2)CC1 ZINC001254215935 1062054032 /nfs/dbraw/zinc/05/40/32/1062054032.db2.gz VWEPLIYTLVOYHH-CTYIDZIISA-N 2 1 300.437 4.079 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCCc2ccccc2)CC1 ZINC001459318040 1062084193 /nfs/dbraw/zinc/08/41/93/1062084193.db2.gz MNXGRSPUNBLXNX-UHFFFAOYSA-N 2 1 316.533 4.453 20 0 DIADMP CC1([NH2+]C2CCC3(CC3)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC001254440000 1062101973 /nfs/dbraw/zinc/10/19/73/1062101973.db2.gz LQKQVVIOCUVXGB-UHFFFAOYSA-N 2 1 312.501 4.354 20 0 DIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)C1CCC2(CC2)CC1 ZINC001254449575 1062111247 /nfs/dbraw/zinc/11/12/47/1062111247.db2.gz QNRZRFVWEZLSBJ-UHFFFAOYSA-N 2 1 304.522 4.438 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001474435988 1062112444 /nfs/dbraw/zinc/11/24/44/1062112444.db2.gz RYDLXPLHYIOHRV-MANSERQUSA-N 2 1 306.538 4.444 20 0 DIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)C1CCc2ccccc2CC1 ZINC001254456415 1062115970 /nfs/dbraw/zinc/11/59/70/1062115970.db2.gz ZJWWPVPLPSBSOA-XUTJKUGGSA-N 2 1 314.517 4.162 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001474439999 1062116922 /nfs/dbraw/zinc/11/69/22/1062116922.db2.gz DAYMVCAGMHGVIJ-MJGOQNOKSA-N 2 1 300.490 4.380 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001474439999 1062116935 /nfs/dbraw/zinc/11/69/35/1062116935.db2.gz DAYMVCAGMHGVIJ-MJGOQNOKSA-N 2 1 300.490 4.380 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001254486627 1062127806 /nfs/dbraw/zinc/12/78/06/1062127806.db2.gz FITCZHWNGVJUKC-MXEMCNAFSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001254486627 1062127817 /nfs/dbraw/zinc/12/78/17/1062127817.db2.gz FITCZHWNGVJUKC-MXEMCNAFSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001254486628 1062128921 /nfs/dbraw/zinc/12/89/21/1062128921.db2.gz FITCZHWNGVJUKC-NCYKPQTJSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001254486628 1062128929 /nfs/dbraw/zinc/12/89/29/1062128929.db2.gz FITCZHWNGVJUKC-NCYKPQTJSA-N 2 1 314.517 4.393 20 0 DIADMP CC[N@@H+](Cc1ccoc1)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001459415850 1062136043 /nfs/dbraw/zinc/13/60/43/1062136043.db2.gz OREAUDKRTLCAEY-UHFFFAOYSA-N 2 1 312.457 4.288 20 0 DIADMP CC(C)c1cccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC001459436148 1062143819 /nfs/dbraw/zinc/14/38/19/1062143819.db2.gz BGWQGASSFHIUPN-UHFFFAOYSA-N 2 1 302.506 4.362 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[N@@H+](C)CC1)c1cc(Cl)cc(Cl)c1 ZINC001254506496 1062149548 /nfs/dbraw/zinc/14/95/48/1062149548.db2.gz SZAHLTQAQYQEQV-NHYWBVRUSA-N 2 1 301.261 4.128 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001254510814 1062149965 /nfs/dbraw/zinc/14/99/65/1062149965.db2.gz QSYFGXSIXFTKBF-MOPGFXCFSA-N 2 1 304.453 4.131 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C(C)(C)c2ccccc2C(F)(F)F)CC1 ZINC001254510533 1062150255 /nfs/dbraw/zinc/15/02/55/1062150255.db2.gz XOEANYCZQLEWPT-CYBMUJFWSA-N 2 1 314.395 4.014 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+]2CCC(CCCc3ccccc3)CC2)CC1 ZINC001254517617 1062156360 /nfs/dbraw/zinc/15/63/60/1062156360.db2.gz XEYJYGVQAMOUSK-NRFANRHFSA-N 2 1 314.517 4.206 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+]2CCC(c3cccc(Cl)c3)CC2)CC1 ZINC001254518957 1062156983 /nfs/dbraw/zinc/15/69/83/1062156983.db2.gz FQTYGZITUNRSJU-SFHVURJKSA-N 2 1 306.881 4.004 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC001474477627 1062157591 /nfs/dbraw/zinc/15/75/91/1062157591.db2.gz WMIRSFFPTQZFOM-UHFFFAOYSA-N 2 1 318.505 4.193 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+]2CCC(c3ccccc3Cl)CC2)CC1 ZINC001254530592 1062160973 /nfs/dbraw/zinc/16/09/73/1062160973.db2.gz ZDGJMLPNSKLEGM-INIZCTEOSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001254524831 1062161850 /nfs/dbraw/zinc/16/18/50/1062161850.db2.gz CMMLDORXQMRUSJ-JOCHJYFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+]1CCC[C@@H]([N@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001254524831 1062161873 /nfs/dbraw/zinc/16/18/73/1062161873.db2.gz CMMLDORXQMRUSJ-JOCHJYFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+]1CCC[C@@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001254524831 1062161884 /nfs/dbraw/zinc/16/18/84/1062161884.db2.gz CMMLDORXQMRUSJ-JOCHJYFZSA-N 2 1 322.496 4.216 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC001474508063 1062190367 /nfs/dbraw/zinc/19/03/67/1062190367.db2.gz HFOBVKDRCFBABM-UFYCRDLUSA-N 2 1 300.490 4.177 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC001474508063 1062190374 /nfs/dbraw/zinc/19/03/74/1062190374.db2.gz HFOBVKDRCFBABM-UFYCRDLUSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CCN1C ZINC001459617674 1062250454 /nfs/dbraw/zinc/25/04/54/1062250454.db2.gz XQBIZNCOGGSRHX-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@@H+]1C ZINC001459617674 1062250471 /nfs/dbraw/zinc/25/04/71/1062250471.db2.gz XQBIZNCOGGSRHX-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@H+]1C ZINC001459617674 1062250490 /nfs/dbraw/zinc/25/04/90/1062250490.db2.gz XQBIZNCOGGSRHX-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617674 1062250498 /nfs/dbraw/zinc/25/04/98/1062250498.db2.gz XQBIZNCOGGSRHX-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617674 1062250516 /nfs/dbraw/zinc/25/05/16/1062250516.db2.gz XQBIZNCOGGSRHX-MAUKXSAKSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CCN1C ZINC001459617677 1062251420 /nfs/dbraw/zinc/25/14/20/1062251420.db2.gz XQBIZNCOGGSRHX-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@@H+]1C ZINC001459617677 1062251439 /nfs/dbraw/zinc/25/14/39/1062251439.db2.gz XQBIZNCOGGSRHX-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@H+]1C ZINC001459617677 1062251460 /nfs/dbraw/zinc/25/14/60/1062251460.db2.gz XQBIZNCOGGSRHX-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617677 1062251480 /nfs/dbraw/zinc/25/14/80/1062251480.db2.gz XQBIZNCOGGSRHX-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617677 1062251499 /nfs/dbraw/zinc/25/14/99/1062251499.db2.gz XQBIZNCOGGSRHX-YJBOKZPZSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)CC1 ZINC001474566910 1062272223 /nfs/dbraw/zinc/27/22/23/1062272223.db2.gz UIXOTYIWJKTPRM-FQEVSTJZSA-N 2 1 312.501 4.336 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001255099710 1062315100 /nfs/dbraw/zinc/31/51/00/1062315100.db2.gz RQZHWLDTCKDNRQ-OXJNMPFZSA-N 2 1 319.452 4.108 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136867 1062328892 /nfs/dbraw/zinc/32/88/92/1062328892.db2.gz OGZSPOQFYZNKQN-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136867 1062328916 /nfs/dbraw/zinc/32/89/16/1062328916.db2.gz OGZSPOQFYZNKQN-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136867 1062328935 /nfs/dbraw/zinc/32/89/35/1062328935.db2.gz OGZSPOQFYZNKQN-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC[C@@H]4CCC[C@H]4C2)C3)cc1 ZINC001255141929 1062334022 /nfs/dbraw/zinc/33/40/22/1062334022.db2.gz ORORQTJRBOWPBJ-RTOMLYRKSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CC[C@@H]4CCC[C@H]4C2)C3)cc1 ZINC001255141929 1062334040 /nfs/dbraw/zinc/33/40/40/1062334040.db2.gz ORORQTJRBOWPBJ-RTOMLYRKSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CC[C@@H]4CCC[C@H]4C2)C3)cc1 ZINC001255141929 1062334060 /nfs/dbraw/zinc/33/40/60/1062334060.db2.gz ORORQTJRBOWPBJ-RTOMLYRKSA-N 2 1 324.512 4.304 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255146432 1062335274 /nfs/dbraw/zinc/33/52/74/1062335274.db2.gz GPFKHWBXLKYUEM-UJZAFDIWSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255146432 1062335295 /nfs/dbraw/zinc/33/52/95/1062335295.db2.gz GPFKHWBXLKYUEM-UJZAFDIWSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146432 1062335317 /nfs/dbraw/zinc/33/53/17/1062335317.db2.gz GPFKHWBXLKYUEM-UJZAFDIWSA-N 2 1 312.501 4.160 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC4(CCCC4)C2)C3)cc1 ZINC001255143281 1062339887 /nfs/dbraw/zinc/33/98/87/1062339887.db2.gz JMFJSTICXWOHGY-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCC4(CCCC4)C2)C3)cc1 ZINC001255143281 1062339912 /nfs/dbraw/zinc/33/99/12/1062339912.db2.gz JMFJSTICXWOHGY-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCC4(CCCC4)C2)C3)cc1 ZINC001255143281 1062339932 /nfs/dbraw/zinc/33/99/32/1062339932.db2.gz JMFJSTICXWOHGY-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP CC[NH+](CC)CCC[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC001459731672 1062342568 /nfs/dbraw/zinc/34/25/68/1062342568.db2.gz DYBPGIIQLZXHAP-UHFFFAOYSA-N 2 1 308.469 4.420 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC001459731672 1062342590 /nfs/dbraw/zinc/34/25/90/1062342590.db2.gz DYBPGIIQLZXHAP-UHFFFAOYSA-N 2 1 308.469 4.420 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001474634015 1062356489 /nfs/dbraw/zinc/35/64/89/1062356489.db2.gz OBQANPFCWNWSAR-IEBWSBKVSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001474634015 1062356513 /nfs/dbraw/zinc/35/65/13/1062356513.db2.gz OBQANPFCWNWSAR-IEBWSBKVSA-N 2 1 300.490 4.004 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)C2)cc1 ZINC001474634292 1062356924 /nfs/dbraw/zinc/35/69/24/1062356924.db2.gz QYRSIQIOEBFIGB-AVAKVYKDSA-N 2 1 316.464 4.068 20 0 DIADMP Fc1ccc(C2CC([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)C2)cc1 ZINC001474634292 1062356940 /nfs/dbraw/zinc/35/69/40/1062356940.db2.gz QYRSIQIOEBFIGB-AVAKVYKDSA-N 2 1 316.464 4.068 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001474634013 1062357703 /nfs/dbraw/zinc/35/77/03/1062357703.db2.gz OBQANPFCWNWSAR-HKUYNNGSSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001474634013 1062357722 /nfs/dbraw/zinc/35/77/22/1062357722.db2.gz OBQANPFCWNWSAR-HKUYNNGSSA-N 2 1 300.490 4.004 20 0 DIADMP CCCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255316557 1062391281 /nfs/dbraw/zinc/39/12/81/1062391281.db2.gz ZGBZIHWIUMIMBD-FRYIKTPZSA-N 2 1 300.490 4.350 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1cccc(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255318615 1062394755 /nfs/dbraw/zinc/39/47/55/1062394755.db2.gz AKAYGIOVJNCANG-WDSOQIARSA-N 2 1 318.505 4.346 20 0 DIADMP C([NH2+]C1CCC2(CSC2)CC1)[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001474671625 1062403481 /nfs/dbraw/zinc/40/34/81/1062403481.db2.gz VYGOBEHGLTVLKQ-SFHVURJKSA-N 2 1 322.562 4.049 20 0 DIADMP C([NH2+]C1CCC2(CSC2)CC1)[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001474671625 1062403485 /nfs/dbraw/zinc/40/34/85/1062403485.db2.gz VYGOBEHGLTVLKQ-SFHVURJKSA-N 2 1 322.562 4.049 20 0 DIADMP CCCC[C@@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001255333080 1062406701 /nfs/dbraw/zinc/40/67/01/1062406701.db2.gz UKMNQBAIOXYMEG-QGZVFWFLSA-N 2 1 300.490 4.088 20 0 DIADMP CCCC[C@@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001255333080 1062406714 /nfs/dbraw/zinc/40/67/14/1062406714.db2.gz UKMNQBAIOXYMEG-QGZVFWFLSA-N 2 1 300.490 4.088 20 0 DIADMP CC1([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCCCC1 ZINC001255380363 1062422609 /nfs/dbraw/zinc/42/26/09/1062422609.db2.gz JNEVNRLCWMZJOL-LJQANCHMSA-N 2 1 300.490 4.354 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255380005 1062423382 /nfs/dbraw/zinc/42/33/82/1062423382.db2.gz YVXWCCGVVQVBBF-QFIPXVFZSA-N 2 1 322.496 4.182 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccc(O)c1 ZINC001255383959 1062423712 /nfs/dbraw/zinc/42/37/12/1062423712.db2.gz QJSTVSBOEDIUGD-PXNSSMCTSA-N 2 1 324.468 4.098 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccc(O)cc1 ZINC001255384986 1062424744 /nfs/dbraw/zinc/42/47/44/1062424744.db2.gz DEUMUKGJLXHRTL-FXAWDEMLSA-N 2 1 324.468 4.098 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@H]3C[C@@H]3c3ccccc3)CC2)cc1 ZINC001255385514 1062425065 /nfs/dbraw/zinc/42/50/65/1062425065.db2.gz IFOOQAYJNADVCQ-BDTNDASRSA-N 2 1 320.480 4.187 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH2+]CC3CCCCC3)CC2)cc1 ZINC001255378762 1062425363 /nfs/dbraw/zinc/42/53/63/1062425363.db2.gz PFQWZCTWHOGTDT-FQEVSTJZSA-N 2 1 300.490 4.211 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255390489 1062427559 /nfs/dbraw/zinc/42/75/59/1062427559.db2.gz HYZUXCAWIIJEGK-OALUTQOASA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255397072 1062433485 /nfs/dbraw/zinc/43/34/85/1062433485.db2.gz DPUMOJVSMCRGFY-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255397072 1062433495 /nfs/dbraw/zinc/43/34/95/1062433495.db2.gz DPUMOJVSMCRGFY-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255397072 1062433501 /nfs/dbraw/zinc/43/35/01/1062433501.db2.gz DPUMOJVSMCRGFY-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@H]1CCC[NH+](Cc3ccccc3)CC1)C2 ZINC001255398959 1062435118 /nfs/dbraw/zinc/43/51/18/1062435118.db2.gz NKPZIQGIIMSPLD-NRFANRHFSA-N 2 1 320.480 4.365 20 0 DIADMP Cc1cccc2c1C[NH+]([C@H]1CCC[N@H+](Cc3ccccc3)CC1)C2 ZINC001255398959 1062435133 /nfs/dbraw/zinc/43/51/33/1062435133.db2.gz NKPZIQGIIMSPLD-NRFANRHFSA-N 2 1 320.480 4.365 20 0 DIADMP Cc1cccc2c1C[NH+]([C@H]1CCC[N@@H+](Cc3ccccc3)CC1)C2 ZINC001255398959 1062435145 /nfs/dbraw/zinc/43/51/45/1062435145.db2.gz NKPZIQGIIMSPLD-NRFANRHFSA-N 2 1 320.480 4.365 20 0 DIADMP C[C@@H]1CC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001255403227 1062437691 /nfs/dbraw/zinc/43/76/91/1062437691.db2.gz BQXIEOZUARKHFE-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001255403227 1062437700 /nfs/dbraw/zinc/43/77/00/1062437700.db2.gz BQXIEOZUARKHFE-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001255403227 1062437711 /nfs/dbraw/zinc/43/77/11/1062437711.db2.gz BQXIEOZUARKHFE-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CC4(C3)CCCCC4)CC2)cc1 ZINC001255408309 1062440645 /nfs/dbraw/zinc/44/06/45/1062440645.db2.gz KCWPJRVCOYZBLV-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)[C@H]2CCc3c2cccc3F)cc1 ZINC001459878858 1062466726 /nfs/dbraw/zinc/46/67/26/1062466726.db2.gz SIODHDJUVGDHKU-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC1CC(C)(C)C1 ZINC001459876436 1062467405 /nfs/dbraw/zinc/46/74/05/1062467405.db2.gz HQEIRIQJDNTVBQ-UHFFFAOYSA-N 2 1 315.505 4.056 20 0 DIADMP Cc1cccc([C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C(C)C)c1 ZINC001255677487 1062511515 /nfs/dbraw/zinc/51/15/15/1062511515.db2.gz VRAHVWLQIIOMIT-RAFMOHDBSA-N 2 1 300.490 4.297 20 0 DIADMP Cc1cccc([C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)C(C)C)c1 ZINC001255677487 1062511534 /nfs/dbraw/zinc/51/15/34/1062511534.db2.gz VRAHVWLQIIOMIT-RAFMOHDBSA-N 2 1 300.490 4.297 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001255710148 1062532071 /nfs/dbraw/zinc/53/20/71/1062532071.db2.gz SZZFNQBLEIKZST-ZBFHGGJFSA-N 2 1 318.427 4.058 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255725994 1062547168 /nfs/dbraw/zinc/54/71/68/1062547168.db2.gz ZRGYCVYSOODSNY-HOCLYGCPSA-N 2 1 320.443 4.304 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H](C)CSc2ccc(F)cc2)[C@H](C)C1 ZINC001255737454 1062562523 /nfs/dbraw/zinc/56/25/23/1062562523.db2.gz ICQVTYMHUZDDGX-RKVPGOIHSA-N 2 1 324.509 4.015 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH+]2CCC([NH+]3CCCC3)CC2)cc1 ZINC001255759943 1062583338 /nfs/dbraw/zinc/58/33/38/1062583338.db2.gz FFMZRIUVNORNEM-QGZVFWFLSA-N 2 1 318.530 4.036 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH2+][C@H](CC[NH+](C)C)c1ccccc1 ZINC001255830700 1062615747 /nfs/dbraw/zinc/61/57/47/1062615747.db2.gz RNWYJYWJDTYFDB-OXJNMPFZSA-N 2 1 314.448 4.039 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@@H](C)CC(C)C)C2)s1 ZINC001460073704 1062618914 /nfs/dbraw/zinc/61/89/14/1062618914.db2.gz PILGGVAEXCRNPB-WMZOPIPTSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@@H](C)CC(C)C)C2)s1 ZINC001460073704 1062618923 /nfs/dbraw/zinc/61/89/23/1062618923.db2.gz PILGGVAEXCRNPB-WMZOPIPTSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C[C@@H](C)CC(C)C)C2)s1 ZINC001460073704 1062618932 /nfs/dbraw/zinc/61/89/32/1062618932.db2.gz PILGGVAEXCRNPB-WMZOPIPTSA-N 2 1 322.562 4.492 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255837107 1062621338 /nfs/dbraw/zinc/62/13/38/1062621338.db2.gz AYGUDOXZVAFNHJ-SZMVWBNQSA-N 2 1 320.496 4.375 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001255851467 1062633259 /nfs/dbraw/zinc/63/32/59/1062633259.db2.gz OYLMPLXLZZREKL-PKOBYXMFSA-N 2 1 318.480 4.097 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CCCCCC2)CC1 ZINC001255883296 1062654360 /nfs/dbraw/zinc/65/43/60/1062654360.db2.gz WXYLIALHNSMVSB-KESTWPANSA-N 2 1 300.490 4.481 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CCCCCC1 ZINC001255892300 1062658854 /nfs/dbraw/zinc/65/88/54/1062658854.db2.gz GKEKVXAWEZUELG-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC001255892300 1062658867 /nfs/dbraw/zinc/65/88/67/1062658867.db2.gz GKEKVXAWEZUELG-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC001255892300 1062658877 /nfs/dbraw/zinc/65/88/77/1062658877.db2.gz GKEKVXAWEZUELG-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC001255946535 1062664958 /nfs/dbraw/zinc/66/49/58/1062664958.db2.gz WFGWVQWWSFGZKC-CHWSQXEVSA-N 2 1 300.849 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)c(F)c1 ZINC001255945735 1062666448 /nfs/dbraw/zinc/66/64/48/1062666448.db2.gz NAIPWGXQYWRYKL-CHWSQXEVSA-N 2 1 300.849 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cccc(OCC2CCC2)c1 ZINC001255950494 1062669485 /nfs/dbraw/zinc/66/94/85/1062669485.db2.gz IHGHYJXOQWGTOD-KRWDZBQOSA-N 2 1 318.505 4.076 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H]1CCCc2c(F)cc(F)cc21 ZINC001255954906 1062670694 /nfs/dbraw/zinc/67/06/94/1062670694.db2.gz KLSPWAXORDGGSL-ACJLOTCBSA-N 2 1 310.432 4.052 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(F)ccc1C(F)(F)F ZINC001255947941 1062671047 /nfs/dbraw/zinc/67/10/47/1062671047.db2.gz ZKSPIPTXPYAZJS-GFCCVEGCSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001255963881 1062673228 /nfs/dbraw/zinc/67/32/28/1062673228.db2.gz MEFZRPFWONNZCA-CQSZACIVSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001255963881 1062673277 /nfs/dbraw/zinc/67/32/77/1062673277.db2.gz MEFZRPFWONNZCA-CQSZACIVSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001255968330 1062673408 /nfs/dbraw/zinc/67/34/08/1062673408.db2.gz XVIJETAKHCBRIV-NVXWUHKLSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001255968330 1062673424 /nfs/dbraw/zinc/67/34/24/1062673424.db2.gz XVIJETAKHCBRIV-NVXWUHKLSA-N 2 1 308.897 4.250 20 0 DIADMP Clc1ccc(C2CC[NH+](C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC001256076208 1062698886 /nfs/dbraw/zinc/69/88/86/1062698886.db2.gz WEUZYRHQQWWUDC-UHFFFAOYSA-N 2 1 318.892 4.146 20 0 DIADMP CC[NH+]1CCC([N@H+](C)[C@@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256118215 1062715484 /nfs/dbraw/zinc/71/54/84/1062715484.db2.gz KCHMZHLQMSTYBP-AZUAARDMSA-N 2 1 300.490 4.129 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)[C@@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256118215 1062715504 /nfs/dbraw/zinc/71/55/04/1062715504.db2.gz KCHMZHLQMSTYBP-AZUAARDMSA-N 2 1 300.490 4.129 20 0 DIADMP CC(C)CC[C@@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001256360110 1062784477 /nfs/dbraw/zinc/78/44/77/1062784477.db2.gz CUPYUAPMDTZCSH-GOSISDBHSA-N 2 1 302.506 4.455 20 0 DIADMP Cc1csc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256520482 1062840984 /nfs/dbraw/zinc/84/09/84/1062840984.db2.gz PPPWXBVOESDHQK-WMZOPIPTSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1csc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256520482 1062841001 /nfs/dbraw/zinc/84/10/01/1062841001.db2.gz PPPWXBVOESDHQK-WMZOPIPTSA-N 2 1 314.498 4.199 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528217 1062849511 /nfs/dbraw/zinc/84/95/11/1062849511.db2.gz CMHKPILGQYXBEX-QGZVKYPTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528217 1062849532 /nfs/dbraw/zinc/84/95/32/1062849532.db2.gz CMHKPILGQYXBEX-QGZVKYPTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256536871 1062851897 /nfs/dbraw/zinc/85/18/97/1062851897.db2.gz GXCTWAHDZDMERA-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256536871 1062851920 /nfs/dbraw/zinc/85/19/20/1062851920.db2.gz GXCTWAHDZDMERA-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536871 1062851940 /nfs/dbraw/zinc/85/19/40/1062851940.db2.gz GXCTWAHDZDMERA-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536871 1062851961 /nfs/dbraw/zinc/85/19/61/1062851961.db2.gz GXCTWAHDZDMERA-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@H]3CCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535865 1062852097 /nfs/dbraw/zinc/85/20/97/1062852097.db2.gz BBDIMPUGBYAADB-CWJKEVGVSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CC[C@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535865 1062852120 /nfs/dbraw/zinc/85/21/20/1062852120.db2.gz BBDIMPUGBYAADB-CWJKEVGVSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CC[C@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535865 1062852138 /nfs/dbraw/zinc/85/21/38/1062852138.db2.gz BBDIMPUGBYAADB-CWJKEVGVSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256535843 1062853493 /nfs/dbraw/zinc/85/34/93/1062853493.db2.gz DWKYBXHZHOQGAT-AVRDEDQJSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535843 1062853511 /nfs/dbraw/zinc/85/35/11/1062853511.db2.gz DWKYBXHZHOQGAT-AVRDEDQJSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535843 1062853537 /nfs/dbraw/zinc/85/35/37/1062853537.db2.gz DWKYBXHZHOQGAT-AVRDEDQJSA-N 2 1 320.480 4.098 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCc3ccccc3C2)CC[NH+]1Cc1ccccc1 ZINC001256535843 1062853558 /nfs/dbraw/zinc/85/35/58/1062853558.db2.gz DWKYBXHZHOQGAT-AVRDEDQJSA-N 2 1 320.480 4.098 20 0 DIADMP CCCC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC001256535198 1062855783 /nfs/dbraw/zinc/85/57/83/1062855783.db2.gz XOHFSUCQOSRBSS-IEBWSBKVSA-N 2 1 300.490 4.352 20 0 DIADMP CCCC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC001256535198 1062855806 /nfs/dbraw/zinc/85/58/06/1062855806.db2.gz XOHFSUCQOSRBSS-IEBWSBKVSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256529373 1062857372 /nfs/dbraw/zinc/85/73/72/1062857372.db2.gz TVSLXEURTJDKPT-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256529373 1062857392 /nfs/dbraw/zinc/85/73/92/1062857392.db2.gz TVSLXEURTJDKPT-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1cccc2c1C[NH+]([C@@H]1CC[N@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536792 1062857461 /nfs/dbraw/zinc/85/74/61/1062857461.db2.gz FWKVWUZLUCQKRO-WIYYLYMNSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[NH+]([C@@H]1CC[N@@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536792 1062857483 /nfs/dbraw/zinc/85/74/83/1062857483.db2.gz FWKVWUZLUCQKRO-WIYYLYMNSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@@H]1CC[NH+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536792 1062857497 /nfs/dbraw/zinc/85/74/97/1062857497.db2.gz FWKVWUZLUCQKRO-WIYYLYMNSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@@H]1CC[NH+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536792 1062857516 /nfs/dbraw/zinc/85/75/16/1062857516.db2.gz FWKVWUZLUCQKRO-WIYYLYMNSA-N 2 1 320.480 4.364 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@@](C)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536781 1062857581 /nfs/dbraw/zinc/85/75/81/1062857581.db2.gz FUWSAOWHRUPILU-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@@](C)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536781 1062857582 /nfs/dbraw/zinc/85/75/82/1062857582.db2.gz FUWSAOWHRUPILU-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536781 1062857583 /nfs/dbraw/zinc/85/75/83/1062857583.db2.gz FUWSAOWHRUPILU-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC[C@@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536781 1062857584 /nfs/dbraw/zinc/85/75/84/1062857584.db2.gz FUWSAOWHRUPILU-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCCC[C@@H]2C)CC[N@@H+]1Cc1ccccc1 ZINC001256548161 1062870004 /nfs/dbraw/zinc/87/00/04/1062870004.db2.gz AMRLEMRIKFDNLZ-NLWGTHIKSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCCC[C@@H]2C)CC[N@H+]1Cc1ccccc1 ZINC001256548161 1062870026 /nfs/dbraw/zinc/87/00/26/1062870026.db2.gz AMRLEMRIKFDNLZ-NLWGTHIKSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCCCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548161 1062870045 /nfs/dbraw/zinc/87/00/45/1062870045.db2.gz AMRLEMRIKFDNLZ-NLWGTHIKSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCCCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548161 1062870058 /nfs/dbraw/zinc/87/00/58/1062870058.db2.gz AMRLEMRIKFDNLZ-NLWGTHIKSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256555732 1062884454 /nfs/dbraw/zinc/88/44/54/1062884454.db2.gz WACMRBGVTQTDNZ-STZQEDGTSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256555732 1062884478 /nfs/dbraw/zinc/88/44/78/1062884478.db2.gz WACMRBGVTQTDNZ-STZQEDGTSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CC[C@@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555732 1062884497 /nfs/dbraw/zinc/88/44/97/1062884497.db2.gz WACMRBGVTQTDNZ-STZQEDGTSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CC[C@@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555732 1062884518 /nfs/dbraw/zinc/88/45/18/1062884518.db2.gz WACMRBGVTQTDNZ-STZQEDGTSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(F)cc(Cl)c1 ZINC001256567209 1062891203 /nfs/dbraw/zinc/89/12/03/1062891203.db2.gz UPEQLRSYOPGVRO-GFCCVEGCSA-N 2 1 312.860 4.393 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccncc1 ZINC001256603682 1062913388 /nfs/dbraw/zinc/91/33/88/1062913388.db2.gz FHIGETLPBMYSSW-OAQYLSRUSA-N 2 1 323.484 4.033 20 0 DIADMP CC(C)(C)C1CC[NH+](C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001256603891 1062913647 /nfs/dbraw/zinc/91/36/47/1062913647.db2.gz JZOMZIUKFFFPOH-UHFFFAOYSA-N 2 1 314.517 4.409 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2CCC(C)(C)C2CC2)CC1 ZINC001460628432 1062947572 /nfs/dbraw/zinc/94/75/72/1062947572.db2.gz VPXBPTCKGYJMTM-IBGZPJMESA-N 2 1 306.538 4.399 20 0 DIADMP CCCc1ccc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)cc1 ZINC001460670335 1062976400 /nfs/dbraw/zinc/97/64/00/1062976400.db2.gz HDRMHSWZBZUNQC-UHFFFAOYSA-N 2 1 316.533 4.439 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001460670420 1062977065 /nfs/dbraw/zinc/97/70/65/1062977065.db2.gz ITODTNFMKPHMKF-UHFFFAOYSA-N 2 1 302.506 4.103 20 0 DIADMP CCC1CCC([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC1 ZINC001256869811 1063022981 /nfs/dbraw/zinc/02/29/81/1063022981.db2.gz TYYAJPIOWHFQTN-UHFFFAOYSA-N 2 1 304.453 4.044 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256895326 1063032089 /nfs/dbraw/zinc/03/20/89/1063032089.db2.gz AVBYZWNXSPMTIV-PKOBYXMFSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256895326 1063032108 /nfs/dbraw/zinc/03/21/08/1063032108.db2.gz AVBYZWNXSPMTIV-PKOBYXMFSA-N 2 1 300.490 4.004 20 0 DIADMP Clc1ccc(CCC[NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC001256899962 1063033531 /nfs/dbraw/zinc/03/35/31/1063033531.db2.gz YCZSSALYLOHALW-GOSISDBHSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1ccc(CCC[NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC001256899962 1063033550 /nfs/dbraw/zinc/03/35/50/1063033550.db2.gz YCZSSALYLOHALW-GOSISDBHSA-N 2 1 320.908 4.269 20 0 DIADMP CC(C)(Cc1ccccc1F)[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256906255 1063044321 /nfs/dbraw/zinc/04/43/21/1063044321.db2.gz YXZKVZJFWDBEMN-KRWDZBQOSA-N 2 1 318.480 4.143 20 0 DIADMP CC(C)(Cc1ccccc1F)[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256906255 1063044342 /nfs/dbraw/zinc/04/43/42/1063044342.db2.gz YXZKVZJFWDBEMN-KRWDZBQOSA-N 2 1 318.480 4.143 20 0 DIADMP FC(F)(F)[C@H]1CC[C@H]([NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)CC1 ZINC001256910909 1063046526 /nfs/dbraw/zinc/04/65/26/1063046526.db2.gz FRCCHYIWCNCSBQ-RBSFLKMASA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@H]1CC[C@H]([NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)CC1 ZINC001256910909 1063046544 /nfs/dbraw/zinc/04/65/44/1063046544.db2.gz FRCCHYIWCNCSBQ-RBSFLKMASA-N 2 1 318.427 4.104 20 0 DIADMP CCCC[N@H+](CCCc1c[nH+]cn1C)Cc1c(C)oc(C)c1C ZINC001460812891 1063077716 /nfs/dbraw/zinc/07/77/16/1063077716.db2.gz FEEJNEKCKFSTLR-UHFFFAOYSA-N 2 1 317.477 4.173 20 0 DIADMP CCCC[N@@H+](CCCc1c[nH+]cn1C)Cc1c(C)oc(C)c1C ZINC001460812891 1063077734 /nfs/dbraw/zinc/07/77/34/1063077734.db2.gz FEEJNEKCKFSTLR-UHFFFAOYSA-N 2 1 317.477 4.173 20 0 DIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001257204335 1063136951 /nfs/dbraw/zinc/13/69/51/1063136951.db2.gz DXAMTCKLBUYPJO-UHFFFAOYSA-N 2 1 324.468 4.441 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001257212896 1063144200 /nfs/dbraw/zinc/14/42/00/1063144200.db2.gz BSCSYGPIXAYFDZ-UHFFFAOYSA-N 2 1 318.892 4.302 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001257212896 1063144210 /nfs/dbraw/zinc/14/42/10/1063144210.db2.gz BSCSYGPIXAYFDZ-UHFFFAOYSA-N 2 1 318.892 4.302 20 0 DIADMP CCC[C@@H](CC)[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001257267982 1063171078 /nfs/dbraw/zinc/17/10/78/1063171078.db2.gz CPRXCBPXWNUWOB-GOSISDBHSA-N 2 1 306.469 4.301 20 0 DIADMP CCC[C@@H](CC)[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001257267982 1063171086 /nfs/dbraw/zinc/17/10/86/1063171086.db2.gz CPRXCBPXWNUWOB-GOSISDBHSA-N 2 1 306.469 4.301 20 0 DIADMP CCC(CC)[NH+]1CCC([NH3+])(c2cccc(C(F)(F)F)c2)CC1 ZINC001257291652 1063182266 /nfs/dbraw/zinc/18/22/66/1063182266.db2.gz RZJTXYVAXYVPCD-UHFFFAOYSA-N 2 1 314.395 4.144 20 0 DIADMP CCC(CC)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001257295664 1063187854 /nfs/dbraw/zinc/18/78/54/1063187854.db2.gz AFABBTOCCRZGBA-GOSISDBHSA-N 2 1 304.478 4.145 20 0 DIADMP CC(C)[C@H](C[NH2+]C1CCC2(CCC2)CC1)[NH+]1CCC(C)CC1 ZINC001461042848 1063208174 /nfs/dbraw/zinc/20/81/74/1063208174.db2.gz GSKIZIRURHRRPZ-IBGZPJMESA-N 2 1 306.538 4.445 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001257328685 1063211864 /nfs/dbraw/zinc/21/18/64/1063211864.db2.gz SPSZWCFZHCAHFF-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257328685 1063211884 /nfs/dbraw/zinc/21/18/84/1063211884.db2.gz SPSZWCFZHCAHFF-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257328685 1063211899 /nfs/dbraw/zinc/21/18/99/1063211899.db2.gz SPSZWCFZHCAHFF-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP CCCC(CCC)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001257330305 1063212913 /nfs/dbraw/zinc/21/29/13/1063212913.db2.gz IORHZVBQMLOEJN-UHFFFAOYSA-N 2 1 302.506 4.252 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257333431 1063214034 /nfs/dbraw/zinc/21/40/34/1063214034.db2.gz GVXHRLQSLTYYJV-RUCARUNLSA-N 2 1 303.494 4.122 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1C ZINC001461049568 1063215165 /nfs/dbraw/zinc/21/51/65/1063215165.db2.gz GLJOUTCXNDPQSG-LJQANCHMSA-N 2 1 302.506 4.356 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC001461052614 1063217710 /nfs/dbraw/zinc/21/77/10/1063217710.db2.gz QXYFTPFUTWPKJQ-MRXNPFEDSA-N 2 1 314.473 4.485 20 0 DIADMP CCCC(CCC)N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001257337559 1063217596 /nfs/dbraw/zinc/21/75/96/1063217596.db2.gz YJWMRNZZBAEJAK-MRXNPFEDSA-N 2 1 320.525 4.069 20 0 DIADMP CC[C@@H](C[NH2+]C[C@@H](C1CCCCC1)[NH+](C)C)c1ccccc1 ZINC001461050733 1063218747 /nfs/dbraw/zinc/21/87/47/1063218747.db2.gz MLAJEXVIKOJQJQ-PXNSSMCTSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@H](C[NH2+]C[C@@H](C1CCCCC1)[NH+](C)C)c1ccccc1 ZINC001461050734 1063218832 /nfs/dbraw/zinc/21/88/32/1063218832.db2.gz MLAJEXVIKOJQJQ-XLIONFOSSA-N 2 1 302.506 4.280 20 0 DIADMP CCCCCC[C@H](C)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001257362131 1063232175 /nfs/dbraw/zinc/23/21/75/1063232175.db2.gz WGQMUADFODQVJR-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCC[C@@H](C)CC2)cc1F ZINC001461097028 1063249553 /nfs/dbraw/zinc/24/95/53/1063249553.db2.gz ADKFSPFNSPRHCM-PBHICJAKSA-N 2 1 315.436 4.378 20 0 DIADMP CCC[N@@H+]1C[C@@H]2C[NH+](C3CCC(C(C)(C)CC)CC3)C[C@@H]2C1 ZINC001257408058 1063259187 /nfs/dbraw/zinc/25/91/87/1063259187.db2.gz XHAMVUGZOYACRA-LPOKXYRGSA-N 2 1 306.538 4.255 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@H+](C3CCC(C(C)(C)CC)CC3)C[C@@H]2C1 ZINC001257408058 1063259205 /nfs/dbraw/zinc/25/92/05/1063259205.db2.gz XHAMVUGZOYACRA-LPOKXYRGSA-N 2 1 306.538 4.255 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@@H+](C3CCC(C(C)(C)CC)CC3)C[C@@H]2C1 ZINC001257408058 1063259228 /nfs/dbraw/zinc/25/92/28/1063259228.db2.gz XHAMVUGZOYACRA-LPOKXYRGSA-N 2 1 306.538 4.255 20 0 DIADMP CC[C@H](C)[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001257438685 1063277015 /nfs/dbraw/zinc/27/70/15/1063277015.db2.gz BDMKTFWMCPBZQY-LAQRGFTBSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001257438685 1063277034 /nfs/dbraw/zinc/27/70/34/1063277034.db2.gz BDMKTFWMCPBZQY-LAQRGFTBSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001257438685 1063277054 /nfs/dbraw/zinc/27/70/54/1063277054.db2.gz BDMKTFWMCPBZQY-LAQRGFTBSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@@H](C)[NH+]1CCC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1 ZINC001257447834 1063281131 /nfs/dbraw/zinc/28/11/31/1063281131.db2.gz MAVUWFNSXFTPEO-CYBMUJFWSA-N 2 1 314.395 4.058 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](C2CCCCC2)CC1 ZINC001257459675 1063288820 /nfs/dbraw/zinc/28/88/20/1063288820.db2.gz ISEHRLOVZUPIAN-UHFFFAOYSA-N 2 1 300.490 4.306 20 0 DIADMP CCC[C@H](C)CC[C@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257476163 1063298289 /nfs/dbraw/zinc/29/82/89/1063298289.db2.gz OFYROPWURCUNOP-VJANTYMQSA-N 2 1 324.553 4.342 20 0 DIADMP CCC[C@@H](C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC001461170790 1063309220 /nfs/dbraw/zinc/30/92/20/1063309220.db2.gz MVGMKCZSPNHLCU-ICSRJNTNSA-N 2 1 302.506 4.280 20 0 DIADMP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)c1C ZINC001461173838 1063310514 /nfs/dbraw/zinc/31/05/14/1063310514.db2.gz WXQNDNKUWOODSM-QGZVFWFLSA-N 2 1 313.489 4.056 20 0 DIADMP CCCCC[C@H](C)N[C@H](C[NH3+])c1ccc(Br)cc1 ZINC001257501534 1063312039 /nfs/dbraw/zinc/31/20/39/1063312039.db2.gz BKIVENPUXMTACZ-SWLSCSKDSA-N 2 1 313.283 4.007 20 0 DIADMP CCCCC[C@H](C)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257517691 1063325917 /nfs/dbraw/zinc/32/59/17/1063325917.db2.gz ZGLUAUDWBFXSHS-AZUAARDMSA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@H](C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257517691 1063325936 /nfs/dbraw/zinc/32/59/36/1063325936.db2.gz ZGLUAUDWBFXSHS-AZUAARDMSA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@H](C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257517691 1063325958 /nfs/dbraw/zinc/32/59/58/1063325958.db2.gz ZGLUAUDWBFXSHS-AZUAARDMSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(C)cc(C)c2)CC1 ZINC001473110586 1063410421 /nfs/dbraw/zinc/41/04/21/1063410421.db2.gz DHUWTPPUXUYVJF-UHFFFAOYSA-N 2 1 302.506 4.247 20 0 DIADMP CC(C)OC1CCC([N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001257875872 1063417686 /nfs/dbraw/zinc/41/76/86/1063417686.db2.gz ZRFPLISROHPGRS-POSCCBCBSA-N 2 1 324.553 4.341 20 0 DIADMP CCC[N@@H+](CCC[NH+]1CCCCC1)[C@@H]1CCc2ccccc21 ZINC001473125748 1063429991 /nfs/dbraw/zinc/42/99/91/1063429991.db2.gz UXKDEGNXWUQUCR-HXUWFJFHSA-N 2 1 300.490 4.262 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC3CCCCCC3)C2)CC1 ZINC001473133463 1063442084 /nfs/dbraw/zinc/44/20/84/1063442084.db2.gz XAZMVMCPSIWTBW-FQEVSTJZSA-N 2 1 306.538 4.401 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC001257996346 1063454334 /nfs/dbraw/zinc/45/43/34/1063454334.db2.gz ZVAIDIUBARDITE-GHOZHQTGSA-N 2 1 314.517 4.421 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC001257996348 1063454465 /nfs/dbraw/zinc/45/44/65/1063454465.db2.gz ZVAIDIUBARDITE-VWEINGBSSA-N 2 1 314.517 4.421 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC001257996349 1063455480 /nfs/dbraw/zinc/45/54/80/1063455480.db2.gz ZVAIDIUBARDITE-WYNBGMTASA-N 2 1 314.517 4.421 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](CC2CC2)c2ccccc2F)CC1 ZINC001258007945 1063463159 /nfs/dbraw/zinc/46/31/59/1063463159.db2.gz XQTFMWNXZYLIFW-FQEVSTJZSA-N 2 1 318.480 4.377 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccccc2F)CC1 ZINC001258014722 1063465281 /nfs/dbraw/zinc/46/52/81/1063465281.db2.gz RONFIMCMLIXIMC-LJQANCHMSA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccccc2F)CC1 ZINC001258014722 1063465299 /nfs/dbraw/zinc/46/52/99/1063465299.db2.gz RONFIMCMLIXIMC-LJQANCHMSA-N 2 1 304.453 4.083 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@@H+]2C2CC[NH+](CC(C)C)CC2)cc1 ZINC001258014689 1063465845 /nfs/dbraw/zinc/46/58/45/1063465845.db2.gz QHPDHRACALBWCR-FQEVSTJZSA-N 2 1 300.490 4.252 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](CCc1ccc(Cl)cc1)CC1CC1 ZINC001473160130 1063466745 /nfs/dbraw/zinc/46/67/45/1063466745.db2.gz GCFPZEKQNQVKBY-IBGZPJMESA-N 2 1 320.908 4.079 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC001473160130 1063466753 /nfs/dbraw/zinc/46/67/53/1063466753.db2.gz GCFPZEKQNQVKBY-IBGZPJMESA-N 2 1 320.908 4.079 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC001473160130 1063466762 /nfs/dbraw/zinc/46/67/62/1063466762.db2.gz GCFPZEKQNQVKBY-IBGZPJMESA-N 2 1 320.908 4.079 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001473169871 1063473758 /nfs/dbraw/zinc/47/37/58/1063473758.db2.gz HXYLIHAFACVFAX-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001473169871 1063473773 /nfs/dbraw/zinc/47/37/73/1063473773.db2.gz HXYLIHAFACVFAX-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001473169871 1063473781 /nfs/dbraw/zinc/47/37/81/1063473781.db2.gz HXYLIHAFACVFAX-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+]([C@H](C)C[C@@H](C)CC(C)C)CC1 ZINC001258075256 1063502726 /nfs/dbraw/zinc/50/27/26/1063502726.db2.gz TXKWKJCLWDYXPS-NSHGMRRFSA-N 2 1 324.553 4.022 20 0 DIADMP COc1ccccc1C1([NH3+])CC[NH+]([C@H](C)CCC=C(C)C)CC1 ZINC001258085665 1063507456 /nfs/dbraw/zinc/50/74/56/1063507456.db2.gz NVASMEVNGIUCIY-QGZVFWFLSA-N 2 1 316.489 4.080 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258088198 1063509963 /nfs/dbraw/zinc/50/99/63/1063509963.db2.gz QUXUZULGULMMSO-MISYRCLQSA-N 2 1 315.505 4.288 20 0 DIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc(F)c(F)c1 ZINC001461443101 1063511103 /nfs/dbraw/zinc/51/11/03/1063511103.db2.gz HSIQDKZORPEZGM-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP Cc1ccccc1C[N@@H+](C)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258141723 1063531075 /nfs/dbraw/zinc/53/10/75/1063531075.db2.gz NOWQYDVINCGDQM-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP Cc1ccccc1C[N@H+](C)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258141723 1063531095 /nfs/dbraw/zinc/53/10/95/1063531095.db2.gz NOWQYDVINCGDQM-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP CCC[C@H]1CCCC[N@@H+]1C1CC[NH+](CCc2ccccc2)CC1 ZINC001258145844 1063533218 /nfs/dbraw/zinc/53/32/18/1063533218.db2.gz MLMPPPHMTVNVJT-FQEVSTJZSA-N 2 1 314.517 4.348 20 0 DIADMP CCC[C@H]1CCCC[N@H+]1C1CC[NH+](CCc2ccccc2)CC1 ZINC001258145844 1063533238 /nfs/dbraw/zinc/53/32/38/1063533238.db2.gz MLMPPPHMTVNVJT-FQEVSTJZSA-N 2 1 314.517 4.348 20 0 DIADMP CCC1([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CCCCC1 ZINC001258136075 1063533444 /nfs/dbraw/zinc/53/34/44/1063533444.db2.gz ZXYRHLCJGHEITR-UHFFFAOYSA-N 2 1 314.517 4.396 20 0 DIADMP C[C@@H]1CC([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C[C@@H](C)C1 ZINC001258155358 1063534990 /nfs/dbraw/zinc/53/49/90/1063534990.db2.gz DEJYECZJKONQDX-GJZGRUSLSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@H]1CC([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C[C@H](C)C1 ZINC001258167251 1063538819 /nfs/dbraw/zinc/53/88/19/1063538819.db2.gz HYCPLRVTBQGVGS-QWFCFKBJSA-N 2 1 314.517 4.265 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)CC1(C)C ZINC001461507686 1063542710 /nfs/dbraw/zinc/54/27/10/1063542710.db2.gz SJSVWDWTWJBTMG-MRXNPFEDSA-N 2 1 306.881 4.182 20 0 DIADMP C[C@@H](Cc1ccco1)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258182914 1063548594 /nfs/dbraw/zinc/54/85/94/1063548594.db2.gz ZBTMCGKPCSGBLJ-BQFCYCMXSA-N 2 1 304.478 4.115 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC001461518598 1063549923 /nfs/dbraw/zinc/54/99/23/1063549923.db2.gz BGNUZHKZVXXXMX-RTRPANQVSA-N 2 1 322.443 4.078 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccnc2)C2CCCCCCC2)CC1 ZINC001258237584 1063577782 /nfs/dbraw/zinc/57/77/82/1063577782.db2.gz PGOKFLWGWIRYMC-KESTWPANSA-N 2 1 315.505 4.266 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2CCC([NH3+])(c3ccccc3F)CC2)C1 ZINC001258279694 1063584607 /nfs/dbraw/zinc/58/46/07/1063584607.db2.gz NOKNGENRLQXCQO-HNNXBMFYSA-N 2 1 304.453 4.044 20 0 DIADMP CC1(C)CCC[C@H]([N@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285509 1063587431 /nfs/dbraw/zinc/58/74/31/1063587431.db2.gz MOICOTCICNTSGJ-BBWFWOEESA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC[C@H]([N@@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285509 1063587443 /nfs/dbraw/zinc/58/74/43/1063587443.db2.gz MOICOTCICNTSGJ-BBWFWOEESA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2C[C@H]3C[N@@H+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285509 1063587446 /nfs/dbraw/zinc/58/74/46/1063587446.db2.gz MOICOTCICNTSGJ-BBWFWOEESA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2C[C@H]3C[N@H+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285509 1063587459 /nfs/dbraw/zinc/58/74/59/1063587459.db2.gz MOICOTCICNTSGJ-BBWFWOEESA-N 2 1 318.530 4.081 20 0 DIADMP C[C@H](C[NH+]1CCCC1)[NH2+][C@@H](C)CC(C)(C)SCc1ccco1 ZINC001258295845 1063594003 /nfs/dbraw/zinc/59/40/03/1063594003.db2.gz QYIZBRBZBBDKEI-JKSUJKDBSA-N 2 1 324.534 4.144 20 0 DIADMP CC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)CC(C)(C)SCc1ccco1 ZINC001258298063 1063596209 /nfs/dbraw/zinc/59/62/09/1063596209.db2.gz KBFPOPWDYMRDRO-CVEARBPZSA-N 2 1 324.534 4.144 20 0 DIADMP CC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)CC(C)(C)SCc1ccco1 ZINC001258298063 1063596220 /nfs/dbraw/zinc/59/62/20/1063596220.db2.gz KBFPOPWDYMRDRO-CVEARBPZSA-N 2 1 324.534 4.144 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)CC1 ZINC001461591226 1063599319 /nfs/dbraw/zinc/59/93/19/1063599319.db2.gz YCEFSEZZWHWPFG-PBASOCQRSA-N 2 1 314.517 4.280 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258315146 1063606016 /nfs/dbraw/zinc/60/60/16/1063606016.db2.gz KANYZYPSOKIUBF-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258330639 1063614658 /nfs/dbraw/zinc/61/46/58/1063614658.db2.gz ZTRSKLMLYSXVFF-JYJNAYRXSA-N 2 1 300.556 4.135 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001258346558 1063619872 /nfs/dbraw/zinc/61/98/72/1063619872.db2.gz SZEWOGHJGCJKHU-IKGGRYGDSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258346558 1063619875 /nfs/dbraw/zinc/61/98/75/1063619875.db2.gz SZEWOGHJGCJKHU-IKGGRYGDSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001258346558 1063619881 /nfs/dbraw/zinc/61/98/81/1063619881.db2.gz SZEWOGHJGCJKHU-IKGGRYGDSA-N 2 1 312.567 4.245 20 0 DIADMP CCCCC[C@@H](CC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258433261 1063650053 /nfs/dbraw/zinc/65/00/53/1063650053.db2.gz WPNXDDLJODELTI-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP CCCCC[C@@H](CC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258434590 1063651764 /nfs/dbraw/zinc/65/17/64/1063651764.db2.gz NZXJMJRNKINLIM-QGZVFWFLSA-N 2 1 318.505 4.304 20 0 DIADMP CCCCC[C@H](CC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258442382 1063656094 /nfs/dbraw/zinc/65/60/94/1063656094.db2.gz DUONWSYZPGRAHJ-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP CCCCC[C@@H](CC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258444427 1063656532 /nfs/dbraw/zinc/65/65/32/1063656532.db2.gz WZINXTJYASYMBA-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP C[C@H](CC1CC1)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258453071 1063661684 /nfs/dbraw/zinc/66/16/84/1063661684.db2.gz IFKHXLNBGOOGQY-ZTFGCOKTSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@@H](CC1CC1)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001258463633 1063667125 /nfs/dbraw/zinc/66/71/25/1063667125.db2.gz BGSLARXJEKNZPI-KRWDZBQOSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@]1(C)CC1(C)C ZINC001461725382 1063680318 /nfs/dbraw/zinc/68/03/18/1063680318.db2.gz DUTLLRZXAINWHT-FQEVSTJZSA-N 2 1 302.506 4.170 20 0 DIADMP CCCC1CCC([NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)CC1 ZINC001258532207 1063684646 /nfs/dbraw/zinc/68/46/46/1063684646.db2.gz RFSNFRPNOQCVMW-UHFFFAOYSA-N 2 1 315.505 4.288 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258596981 1063699558 /nfs/dbraw/zinc/69/95/58/1063699558.db2.gz CUTRCTNWWSZTOM-GUDVDZBRSA-N 2 1 300.490 4.337 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001258597199 1063700948 /nfs/dbraw/zinc/70/09/48/1063700948.db2.gz FECPIYJWCYLVFN-AWEZNQCLSA-N 2 1 306.881 4.169 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258598579 1063702309 /nfs/dbraw/zinc/70/23/09/1063702309.db2.gz UZPAYRXQMDGZAL-FHWLQOOXSA-N 2 1 318.480 4.476 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001258605361 1063705760 /nfs/dbraw/zinc/70/57/60/1063705760.db2.gz HMGQDKNNQAXSSF-SFHVURJKSA-N 2 1 316.489 4.146 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCC(C)(C)C1 ZINC001258607906 1063707117 /nfs/dbraw/zinc/70/71/17/1063707117.db2.gz UJIRQFPROGTXPC-OALUTQOASA-N 2 1 300.490 4.019 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258688300 1063754055 /nfs/dbraw/zinc/75/40/55/1063754055.db2.gz OAKIIQGWVMEUHC-YJBOKZPZSA-N 2 1 315.505 4.163 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H]2C[C@@H](C)CC(C)(C)C2)CC1 ZINC001258697396 1063757106 /nfs/dbraw/zinc/75/71/06/1063757106.db2.gz PSWACLCLNOLRNO-NVXWUHKLSA-N 2 1 315.505 4.144 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258697398 1063757714 /nfs/dbraw/zinc/75/77/14/1063757714.db2.gz PSWACLCLNOLRNO-RDJZCZTQSA-N 2 1 315.505 4.144 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001258710802 1063768290 /nfs/dbraw/zinc/76/82/90/1063768290.db2.gz WGRRWPACVXXJTM-HMXCVIKNSA-N 2 1 316.533 4.496 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001258714520 1063770710 /nfs/dbraw/zinc/77/07/10/1063770710.db2.gz QGYUGCJESSINAI-OAQYLSRUSA-N 2 1 314.517 4.347 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001258713304 1063771374 /nfs/dbraw/zinc/77/13/74/1063771374.db2.gz FMBLHUVTCHQQEN-HXUWFJFHSA-N 2 1 314.517 4.206 20 0 DIADMP CCCC[C@H](CCC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258763792 1063810819 /nfs/dbraw/zinc/81/08/19/1063810819.db2.gz CRUWACQMHMMMFU-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001258774062 1063815347 /nfs/dbraw/zinc/81/53/47/1063815347.db2.gz ICICUUAUBLVQRP-GOSISDBHSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001258774062 1063815357 /nfs/dbraw/zinc/81/53/57/1063815357.db2.gz ICICUUAUBLVQRP-GOSISDBHSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001258774259 1063815747 /nfs/dbraw/zinc/81/57/47/1063815747.db2.gz LKHSODCZPSOWOX-SFHVURJKSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001258774259 1063815768 /nfs/dbraw/zinc/81/57/68/1063815768.db2.gz LKHSODCZPSOWOX-SFHVURJKSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC001258775521 1063817176 /nfs/dbraw/zinc/81/71/76/1063817176.db2.gz RPYCGYLDHIQPJE-MRXNPFEDSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H](CCc3ccccc3)C2)CC1 ZINC001258778182 1063819015 /nfs/dbraw/zinc/81/90/15/1063819015.db2.gz YPYFAJNBIIKJKQ-FQEVSTJZSA-N 2 1 314.517 4.206 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001258781810 1063819553 /nfs/dbraw/zinc/81/95/53/1063819553.db2.gz FWRFSGHBBXKETO-QUCCMNQESA-N 2 1 316.533 4.498 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786912 1063826936 /nfs/dbraw/zinc/82/69/36/1063826936.db2.gz PSGMXCFKGDAOQV-RSPOEFSDSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258791541 1063827858 /nfs/dbraw/zinc/82/78/58/1063827858.db2.gz BYHWMGWXDGRRMW-NVXWUHKLSA-N 2 1 303.494 4.144 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258791514 1063830096 /nfs/dbraw/zinc/83/00/96/1063830096.db2.gz SKRLGNPNDINTJT-KSZLIROESA-N 2 1 324.553 4.213 20 0 DIADMP CC[C@H](C)C[C@H](CC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258799772 1063833873 /nfs/dbraw/zinc/83/38/73/1063833873.db2.gz IDDDPEXLZKZXSS-RDJZCZTQSA-N 2 1 303.494 4.163 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](C2CCC(C(C)C)CC2)CC1 ZINC001258803636 1063836778 /nfs/dbraw/zinc/83/67/78/1063836778.db2.gz DMHMOMNVCVJAPA-UHFFFAOYSA-N 2 1 315.505 4.144 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813193 1063842012 /nfs/dbraw/zinc/84/20/12/1063842012.db2.gz PMFHFHMSEQFIQI-MVJPYGJCSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001258825521 1063850901 /nfs/dbraw/zinc/85/09/01/1063850901.db2.gz WWHWATZONGHQFL-MJGOQNOKSA-N 2 1 316.489 4.146 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258841965 1063862582 /nfs/dbraw/zinc/86/25/82/1063862582.db2.gz CILPLKDZWQHWIC-QWFCFKBJSA-N 2 1 300.490 4.132 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001258848496 1063863755 /nfs/dbraw/zinc/86/37/55/1063863755.db2.gz GDKRWNFRFGUKSE-NHCUHLMSSA-N 2 1 314.517 4.348 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258844027 1063863904 /nfs/dbraw/zinc/86/39/04/1063863904.db2.gz LSOJOUCRTXMBIL-UFYCRDLUSA-N 2 1 302.506 4.236 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC1 ZINC001462041659 1063898049 /nfs/dbraw/zinc/89/80/49/1063898049.db2.gz WRWQPEQKNHNCAO-UHFFFAOYSA-N 2 1 312.501 4.358 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC1 ZINC001462041659 1063898060 /nfs/dbraw/zinc/89/80/60/1063898060.db2.gz WRWQPEQKNHNCAO-UHFFFAOYSA-N 2 1 312.501 4.358 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C2CC3(CC3(F)F)C2)cc1 ZINC001261603802 1063939432 /nfs/dbraw/zinc/93/94/32/1063939432.db2.gz XWHCEKCBNZSZDG-VWDMACCTSA-N 2 1 317.383 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@@H](C[NH2+][C@@H]3CCC[C@@H]4C[C@@H]43)C2)cc1 ZINC000378965526 1063982941 /nfs/dbraw/zinc/98/29/41/1063982941.db2.gz UERFFAUBMPZUJW-JSXRDJHFSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379632652 1063984132 /nfs/dbraw/zinc/98/41/32/1063984132.db2.gz NUODOBAHRSWFBC-KNQAVFIVSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379632652 1063984148 /nfs/dbraw/zinc/98/41/48/1063984148.db2.gz NUODOBAHRSWFBC-KNQAVFIVSA-N 2 1 322.496 4.446 20 0 DIADMP CC(C)C([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000379624634 1063984228 /nfs/dbraw/zinc/98/42/28/1063984228.db2.gz DQIPEKOYAWBRCA-IEBWSBKVSA-N 2 1 302.506 4.310 20 0 DIADMP CC(C)C([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000379624634 1063984231 /nfs/dbraw/zinc/98/42/31/1063984231.db2.gz DQIPEKOYAWBRCA-IEBWSBKVSA-N 2 1 302.506 4.310 20 0 DIADMP C[C@@H](CC[NH2+]C1C[C@H](C)C[C@@H](C)C1)[N@@H+](C)Cc1ccccc1 ZINC000379641168 1063984636 /nfs/dbraw/zinc/98/46/36/1063984636.db2.gz CUILQDOWKUXLHS-KURKYZTESA-N 2 1 302.506 4.311 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[C@H](C)C1 ZINC000379632765 1063985069 /nfs/dbraw/zinc/98/50/69/1063985069.db2.gz SSGNZPKEECAQPT-VLFNSIGCSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)[C@H](C)C1 ZINC000379632765 1063985071 /nfs/dbraw/zinc/98/50/71/1063985071.db2.gz SSGNZPKEECAQPT-VLFNSIGCSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[C@H]1C ZINC000379621914 1063985121 /nfs/dbraw/zinc/98/51/21/1063985121.db2.gz GBZYUWOCJHAGJQ-AJGRXUDCSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[C@H]1C ZINC000379621914 1063985126 /nfs/dbraw/zinc/98/51/26/1063985126.db2.gz GBZYUWOCJHAGJQ-AJGRXUDCSA-N 2 1 314.517 4.454 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380945862 1063988948 /nfs/dbraw/zinc/98/89/48/1063988948.db2.gz OTJMELRVBAKCPP-RTBURBONSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC000383512345 1064003249 /nfs/dbraw/zinc/00/32/49/1064003249.db2.gz GYJAYEKEUZGKNG-QIJUGHKUSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC000383512345 1064003252 /nfs/dbraw/zinc/00/32/52/1064003252.db2.gz GYJAYEKEUZGKNG-QIJUGHKUSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000383512345 1064003257 /nfs/dbraw/zinc/00/32/57/1064003257.db2.gz GYJAYEKEUZGKNG-QIJUGHKUSA-N 2 1 320.480 4.202 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000390587237 1064164420 /nfs/dbraw/zinc/16/44/20/1064164420.db2.gz RHTAEVBOGDIJKD-LYBXBRPPSA-N 2 1 314.517 4.455 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000390587237 1064164426 /nfs/dbraw/zinc/16/44/26/1064164426.db2.gz RHTAEVBOGDIJKD-LYBXBRPPSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H](CC1CCC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390615767 1064165316 /nfs/dbraw/zinc/16/53/16/1064165316.db2.gz YDNKPGOSVRKXII-PXNSSMCTSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H](CC1CCC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390615767 1064165320 /nfs/dbraw/zinc/16/53/20/1064165320.db2.gz YDNKPGOSVRKXII-PXNSSMCTSA-N 2 1 314.517 4.455 20 0 DIADMP CCCCCC[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390773882 1064169000 /nfs/dbraw/zinc/16/90/00/1064169000.db2.gz LOZJVFABEGQPSE-UYAOXDASSA-N 2 1 302.506 4.457 20 0 DIADMP c1ccc(C2CCC([N@H+]3CCC[C@@]4(CCC[NH2+]C4)C3)CC2)cc1 ZINC000391011239 1064178182 /nfs/dbraw/zinc/17/81/82/1064178182.db2.gz XAUUPVCJHGTKBW-XVAXZDLZSA-N 2 1 312.501 4.178 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)c2ccccc12 ZINC001279443717 1064351082 /nfs/dbraw/zinc/35/10/82/1064351082.db2.gz DAOHOFAUHMRRCU-NRFANRHFSA-N 2 1 308.469 4.066 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c2ccccc12 ZINC001279443717 1064351094 /nfs/dbraw/zinc/35/10/94/1064351094.db2.gz DAOHOFAUHMRRCU-NRFANRHFSA-N 2 1 308.469 4.066 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c2ccccc12 ZINC001279443717 1064351107 /nfs/dbraw/zinc/35/11/07/1064351107.db2.gz DAOHOFAUHMRRCU-NRFANRHFSA-N 2 1 308.469 4.066 20 0 DIADMP CC/C=C\CCC[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccc[nH]3)C2)C1 ZINC001279485306 1064354577 /nfs/dbraw/zinc/35/45/77/1064354577.db2.gz AEBUIKKYAVXFBF-HZQHCPKGSA-N 2 1 315.505 4.049 20 0 DIADMP CC/C=C\CCC[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccc[nH]3)C2)C1 ZINC001279485306 1064354581 /nfs/dbraw/zinc/35/45/81/1064354581.db2.gz AEBUIKKYAVXFBF-HZQHCPKGSA-N 2 1 315.505 4.049 20 0 DIADMP CC/C=C\CCC[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccc[nH]3)C2)C1 ZINC001279485306 1064354588 /nfs/dbraw/zinc/35/45/88/1064354588.db2.gz AEBUIKKYAVXFBF-HZQHCPKGSA-N 2 1 315.505 4.049 20 0 DIADMP CC/C=C\CCC[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccc[nH]3)C2)C1 ZINC001279485306 1064354606 /nfs/dbraw/zinc/35/46/06/1064354606.db2.gz AEBUIKKYAVXFBF-HZQHCPKGSA-N 2 1 315.505 4.049 20 0 DIADMP c1c[nH]c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CCC2CCCCC2)c1 ZINC001279586709 1064358702 /nfs/dbraw/zinc/35/87/02/1064358702.db2.gz GRONRBNMJNEDJP-IHWFROFDSA-N 2 1 315.505 4.070 20 0 DIADMP C[N@H+]1CCCC2(CC[NH+](CCCc3cccc(Cl)c3)CC2)C1 ZINC001279632986 1064361860 /nfs/dbraw/zinc/36/18/60/1064361860.db2.gz WKIZHAHIUMNFRI-UHFFFAOYSA-N 2 1 320.908 4.080 20 0 DIADMP CC(C)Oc1cccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000817888770 1064413160 /nfs/dbraw/zinc/41/31/60/1064413160.db2.gz OGIGEHOOVYWFSO-TZIWHRDSSA-N 2 1 324.468 4.057 20 0 DIADMP Fc1cccc(C2([NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)CCC2)c1 ZINC000647802321 1064416050 /nfs/dbraw/zinc/41/60/50/1064416050.db2.gz JCQPTIPZJYUCTM-PMACEKPBSA-N 2 1 324.443 4.288 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC001307433855 1065394463 /nfs/dbraw/zinc/39/44/63/1065394463.db2.gz LSARWBWKLIZZOJ-GXTWGEPZSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CC[C@H]1CCC[NH+]1C ZINC001307433855 1065394476 /nfs/dbraw/zinc/39/44/76/1065394476.db2.gz LSARWBWKLIZZOJ-GXTWGEPZSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@H]1CCC[N@@H+]1C ZINC001307433855 1065394492 /nfs/dbraw/zinc/39/44/92/1065394492.db2.gz LSARWBWKLIZZOJ-GXTWGEPZSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@H]1CCC[N@H+]1C ZINC001307433855 1065394509 /nfs/dbraw/zinc/39/45/09/1065394509.db2.gz LSARWBWKLIZZOJ-GXTWGEPZSA-N 2 1 315.288 4.471 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1CC1CCCCC1 ZINC001307440764 1065402485 /nfs/dbraw/zinc/40/24/85/1065402485.db2.gz ROIBOQPSFGRKHP-LJQANCHMSA-N 2 1 303.494 4.407 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1CC1CCCCC1 ZINC001307440764 1065402491 /nfs/dbraw/zinc/40/24/91/1065402491.db2.gz ROIBOQPSFGRKHP-LJQANCHMSA-N 2 1 303.494 4.407 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3CF)C2)CC1 ZINC001307440720 1065402717 /nfs/dbraw/zinc/40/27/17/1065402717.db2.gz SGBWWUSZJSTJGY-GOSISDBHSA-N 2 1 318.480 4.100 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3CF)C2)CC1 ZINC001307440720 1065402723 /nfs/dbraw/zinc/40/27/23/1065402723.db2.gz SGBWWUSZJSTJGY-GOSISDBHSA-N 2 1 318.480 4.100 20 0 DIADMP C[C@H]1CC[N@@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)[C@H]1C ZINC001307524424 1065461220 /nfs/dbraw/zinc/46/12/20/1065461220.db2.gz UFXLNAUTUWEIFD-OALUTQOASA-N 2 1 314.517 4.062 20 0 DIADMP Cc1ccc(C)c([C@H]2CCC[N@H+]2CCC[NH+]2CCCCC2)c1 ZINC001307581659 1065496431 /nfs/dbraw/zinc/49/64/31/1065496431.db2.gz BKALMJGPYKJQNS-HXUWFJFHSA-N 2 1 300.490 4.316 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC001307581458 1065497008 /nfs/dbraw/zinc/49/70/08/1065497008.db2.gz UDZCVDFUNXOYFI-FQEVSTJZSA-N 2 1 302.506 4.206 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001307593433 1065503660 /nfs/dbraw/zinc/50/36/60/1065503660.db2.gz ZDYDRGDKUFKUNI-TZIWHRDSSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001307593433 1065503671 /nfs/dbraw/zinc/50/36/71/1065503671.db2.gz ZDYDRGDKUFKUNI-TZIWHRDSSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001307593433 1065503679 /nfs/dbraw/zinc/50/36/79/1065503679.db2.gz ZDYDRGDKUFKUNI-TZIWHRDSSA-N 2 1 312.501 4.088 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@@H]1CCCc1ccccc1 ZINC001307601771 1065507383 /nfs/dbraw/zinc/50/73/83/1065507383.db2.gz ABVWBSZXSVSNOI-NHCUHLMSSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@@H]1CCCc1ccccc1 ZINC001307601771 1065507395 /nfs/dbraw/zinc/50/73/95/1065507395.db2.gz ABVWBSZXSVSNOI-NHCUHLMSSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@@H]1CCCc1ccccc1 ZINC001307601771 1065507406 /nfs/dbraw/zinc/50/74/06/1065507406.db2.gz ABVWBSZXSVSNOI-NHCUHLMSSA-N 2 1 314.517 4.348 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)C1CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001307670005 1065554582 /nfs/dbraw/zinc/55/45/82/1065554582.db2.gz OXQMRPXTUVULGV-ZHALLVOQSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H]([NH2+]CC1CCC2(CC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001307670753 1065554778 /nfs/dbraw/zinc/55/47/78/1065554778.db2.gz SYQCNGBCJFUODY-AEFFLSMTSA-N 2 1 304.522 4.199 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CC(C)(C)CCc2ccccc21 ZINC001307715712 1065581900 /nfs/dbraw/zinc/58/19/00/1065581900.db2.gz MIGFPELKJKOKRE-IBGZPJMESA-N 2 1 311.473 4.275 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC2CCC(C)(C)CC2)CC1 ZINC001307723287 1065585810 /nfs/dbraw/zinc/58/58/10/1065585810.db2.gz IERUZIYJRCGLIW-UHFFFAOYSA-N 2 1 316.489 4.450 20 0 DIADMP CCc1ccc(C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC001307786008 1065618986 /nfs/dbraw/zinc/61/89/86/1065618986.db2.gz RTUDCYVMDGEEEW-UHFFFAOYSA-N 2 1 308.469 4.003 20 0 DIADMP c1cc(C[NH+]2CCCCC2)ccc1C[N@H+]1CC[C@H](C2CCC2)C1 ZINC001307845824 1065650360 /nfs/dbraw/zinc/65/03/60/1065650360.db2.gz UQQYINCUFQDLLY-NRFANRHFSA-N 2 1 312.501 4.295 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2C[C@H]2CCCC[C@H]2C)CC1 ZINC001308001739 1065719314 /nfs/dbraw/zinc/71/93/14/1065719314.db2.gz HCWHZUOJADDBPY-AQNXPRMDSA-N 2 1 306.538 4.399 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC001308180605 1065791881 /nfs/dbraw/zinc/79/18/81/1065791881.db2.gz NHEFCKSPJMGDEP-OAQYLSRUSA-N 2 1 320.480 4.282 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC001308180605 1065791892 /nfs/dbraw/zinc/79/18/92/1065791892.db2.gz NHEFCKSPJMGDEP-OAQYLSRUSA-N 2 1 320.480 4.282 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[NH2+]CCC[N@@H+](C)Cc1ccccc1 ZINC001308187090 1065796833 /nfs/dbraw/zinc/79/68/33/1065796833.db2.gz QNJWAZCZQVYTAN-ICSRJNTNSA-N 2 1 300.490 4.091 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCCc2ccccc2C1)Cc1ccccc1 ZINC001308187119 1065797418 /nfs/dbraw/zinc/79/74/18/1065797418.db2.gz RVMJZLANDJJGDP-QFIPXVFZSA-N 2 1 322.496 4.046 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC001308199280 1065806831 /nfs/dbraw/zinc/80/68/31/1065806831.db2.gz JEJVUWRYSYQMEL-MBOZVWFJSA-N 2 1 300.490 4.339 20 0 DIADMP Cc1cc(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1Cl ZINC001308202292 1065808523 /nfs/dbraw/zinc/80/85/23/1065808523.db2.gz BTIRDOCPMUFPQF-GASCZTMLSA-N 2 1 308.897 4.106 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC001308255014 1065858070 /nfs/dbraw/zinc/85/80/70/1065858070.db2.gz WPFAJOMBFPITOL-OALUTQOASA-N 2 1 322.537 4.113 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC001308255014 1065858085 /nfs/dbraw/zinc/85/80/85/1065858085.db2.gz WPFAJOMBFPITOL-OALUTQOASA-N 2 1 322.537 4.113 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC001308339192 1065923689 /nfs/dbraw/zinc/92/36/89/1065923689.db2.gz YGZXNPRDGNRPHO-QGZVFWFLSA-N 2 1 322.924 4.414 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)c(C)c1 ZINC001308491819 1066024038 /nfs/dbraw/zinc/02/40/38/1066024038.db2.gz ACXPMYDXIHQQEV-FQEVSTJZSA-N 2 1 314.517 4.499 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)c(C)c1 ZINC001308491819 1066024045 /nfs/dbraw/zinc/02/40/45/1066024045.db2.gz ACXPMYDXIHQQEV-FQEVSTJZSA-N 2 1 314.517 4.499 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001308547959 1066062189 /nfs/dbraw/zinc/06/21/89/1066062189.db2.gz JLOVFKAJWPWVIL-QNDFHXLGSA-N 2 1 312.501 4.065 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cnc(-c2cccs2)s1 ZINC001308555535 1066066641 /nfs/dbraw/zinc/06/66/41/1066066641.db2.gz RWHOLBZNJAVQCC-CYBMUJFWSA-N 2 1 323.531 4.082 20 0 DIADMP CCC[N@H+](Cc1ccnn1-c1cc[nH+]cc1)CC1CCCCC1 ZINC001308613689 1066119523 /nfs/dbraw/zinc/11/95/23/1066119523.db2.gz LULSBTWRBSJNLB-UHFFFAOYSA-N 2 1 312.461 4.060 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1(C)CCCC1 ZINC001308628523 1066124245 /nfs/dbraw/zinc/12/42/45/1066124245.db2.gz APCYXDQJJQFBQB-LJQANCHMSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(C)CCCC1 ZINC001308628523 1066124247 /nfs/dbraw/zinc/12/42/47/1066124247.db2.gz APCYXDQJJQFBQB-LJQANCHMSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001308634210 1066129294 /nfs/dbraw/zinc/12/92/94/1066129294.db2.gz GDEAACGREIMYDS-UMSONDCASA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C1CCC1 ZINC001308634049 1066129324 /nfs/dbraw/zinc/12/93/24/1066129324.db2.gz DGOASYGZTKDGFJ-NASSWSRMSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]([NH2+]Cc1coc2ccccc12)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001308681810 1066154074 /nfs/dbraw/zinc/15/40/74/1066154074.db2.gz XFAAPSGKQOIGQB-CVEARBPZSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@@]1(C[NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@@H+](Cc2ccccc2)C1 ZINC001308729010 1066203788 /nfs/dbraw/zinc/20/37/88/1066203788.db2.gz VIOSBGWZLGZARF-TUFLPTIASA-N 2 1 312.501 4.067 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]C2CCC(C3CCCCC3)CC2)C1 ZINC001308740382 1066212754 /nfs/dbraw/zinc/21/27/54/1066212754.db2.gz JIPTZYKYXYSGTQ-KKXNLOMOSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]C2CCC(C3CCCCC3)CC2)C1 ZINC001308740383 1066213695 /nfs/dbraw/zinc/21/36/95/1066213695.db2.gz JIPTZYKYXYSGTQ-QHGAOEGBSA-N 2 1 306.538 4.445 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1CCC[C@H](CC)C1 ZINC001308743504 1066218333 /nfs/dbraw/zinc/21/83/33/1066218333.db2.gz IUGJKJHMDYDPBV-ZWKOTPCHSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1CCC[C@H](CC)C1 ZINC001308743504 1066218337 /nfs/dbraw/zinc/21/83/37/1066218337.db2.gz IUGJKJHMDYDPBV-ZWKOTPCHSA-N 2 1 305.510 4.374 20 0 DIADMP CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308772730 1066245240 /nfs/dbraw/zinc/24/52/40/1066245240.db2.gz WIHQRASXJFHRSS-KCLUMXDGSA-N 2 1 314.517 4.313 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+]CCCc1c(F)cccc1Cl ZINC001308796674 1066274231 /nfs/dbraw/zinc/27/42/31/1066274231.db2.gz RVWICDHOKJNDAH-AWEZNQCLSA-N 2 1 314.876 4.122 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+]CCCc1c(F)cccc1Cl ZINC001308796674 1066274238 /nfs/dbraw/zinc/27/42/38/1066274238.db2.gz RVWICDHOKJNDAH-AWEZNQCLSA-N 2 1 314.876 4.122 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001308801903 1066278659 /nfs/dbraw/zinc/27/86/59/1066278659.db2.gz QHIFZKKEZDNEAL-KBPBESRZSA-N 2 1 316.942 4.433 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001308801903 1066278667 /nfs/dbraw/zinc/27/86/67/1066278667.db2.gz QHIFZKKEZDNEAL-KBPBESRZSA-N 2 1 316.942 4.433 20 0 DIADMP CC[N@@H+](CCC[NH2+]CC1(OC)CCCCCC1)C1CCCCC1 ZINC001308852650 1066334218 /nfs/dbraw/zinc/33/42/18/1066334218.db2.gz RQDCJYROSLXQIM-UHFFFAOYSA-N 2 1 324.553 4.360 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC001308863996 1066345398 /nfs/dbraw/zinc/34/53/98/1066345398.db2.gz OPQUYGDXAZVQLL-LZQZEXGQSA-N 2 1 320.908 4.298 20 0 DIADMP CCCCCC[N@H+](Cc1ccc(C)o1)CC1CC[NH+](C)CC1 ZINC001308948369 1066413329 /nfs/dbraw/zinc/41/33/29/1066413329.db2.gz ZAFWKEWKWOPCJJ-UHFFFAOYSA-N 2 1 306.494 4.312 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668565 541305868 /nfs/dbraw/zinc/30/58/68/541305868.db2.gz MSXBMWMUWJGUOZ-APWZRJJASA-N 2 1 304.478 4.139 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668565 541305872 /nfs/dbraw/zinc/30/58/72/541305872.db2.gz MSXBMWMUWJGUOZ-APWZRJJASA-N 2 1 304.478 4.139 20 0 DIADMP c1c[nH+]c(C2CC[NH+](Cc3ccc(Oc4ccccc4)o3)CC2)[nH]1 ZINC000272588783 130043538 /nfs/dbraw/zinc/04/35/38/130043538.db2.gz RQAXKAMWKGQGFA-UHFFFAOYSA-N 2 1 323.396 4.175 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Cl)ccc1Cl ZINC000275553029 130336441 /nfs/dbraw/zinc/33/64/41/130336441.db2.gz NLQPYXUGZHLXTN-NEPJUHHUSA-N 2 1 324.255 4.103 20 0 DIADMP Cn1ccnc1[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000340202734 131153076 /nfs/dbraw/zinc/15/30/76/131153076.db2.gz PHWNWWHYYZQOTE-FQEVSTJZSA-N 2 1 317.436 4.077 20 0 DIADMP Cc1ccnc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000286011526 131215017 /nfs/dbraw/zinc/21/50/17/131215017.db2.gz JGNWCQFPTRJSQR-KRWDZBQOSA-N 2 1 311.473 4.081 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000289273449 131370409 /nfs/dbraw/zinc/37/04/09/131370409.db2.gz PKMNSQFPGDIGLF-LJQANCHMSA-N 2 1 322.456 4.039 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1nccc2ccccc21 ZINC000290770941 131515837 /nfs/dbraw/zinc/51/58/37/131515837.db2.gz SFSIFNVZMLSKRP-INIZCTEOSA-N 2 1 323.484 4.292 20 0 DIADMP Cc1ccccc1C[N@@H+](CCCn1ccnc1)Cc1ccccc1 ZINC000343322428 335081459 /nfs/dbraw/zinc/08/14/59/335081459.db2.gz QJDGZOJMXLDNNG-UHFFFAOYSA-N 2 1 319.452 4.284 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccccc1F ZINC000180713635 331576312 /nfs/dbraw/zinc/57/63/12/331576312.db2.gz UYDUIQOQXRXGCP-IBGZPJMESA-N 2 1 304.453 4.273 20 0 DIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2nc(CCC)cs2)CC1 ZINC000426048998 335095428 /nfs/dbraw/zinc/09/54/28/335095428.db2.gz VUQPDBXYSKGHDH-UHFFFAOYSA-N 2 1 323.550 4.040 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2nc(CCC)cs2)CC1 ZINC000426048998 335095429 /nfs/dbraw/zinc/09/54/29/335095429.db2.gz VUQPDBXYSKGHDH-UHFFFAOYSA-N 2 1 323.550 4.040 20 0 DIADMP CC(C)c1cc(N2CCC[N@H+](C(C)(C)C)CC2)nc(C(C)C)n1 ZINC000536389032 332237308 /nfs/dbraw/zinc/23/73/08/332237308.db2.gz NJBVORAFXDEZHW-UHFFFAOYSA-N 2 1 318.509 4.034 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)CCC2 ZINC000536423685 332242117 /nfs/dbraw/zinc/24/21/17/332242117.db2.gz GAKJEVVANMSAKE-QKYXUNIQSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)CCC2 ZINC000536423685 332242118 /nfs/dbraw/zinc/24/21/18/332242118.db2.gz GAKJEVVANMSAKE-QKYXUNIQSA-N 2 1 300.490 4.260 20 0 DIADMP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000097465634 335096438 /nfs/dbraw/zinc/09/64/38/335096438.db2.gz GSWKQCRCWQVQPZ-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000097465634 335096439 /nfs/dbraw/zinc/09/64/39/335096439.db2.gz GSWKQCRCWQVQPZ-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CN1CC[C@H]([NH2+]Cc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000559722571 332277876 /nfs/dbraw/zinc/27/78/76/332277876.db2.gz XXKPDWAMMVNKAC-HKUYNNGSSA-N 2 1 314.860 4.265 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000559744070 332278752 /nfs/dbraw/zinc/27/87/52/332278752.db2.gz VCIMETOGZABZPT-BVSLBCMMSA-N 2 1 320.480 4.407 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000559744070 332278754 /nfs/dbraw/zinc/27/87/54/332278754.db2.gz VCIMETOGZABZPT-BVSLBCMMSA-N 2 1 320.480 4.407 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)C[C@@H]1c1ccccc1 ZINC000559766056 332279704 /nfs/dbraw/zinc/27/97/04/332279704.db2.gz FHQDWXKZFZPAJT-KTIPNOMGSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)C[C@@H]1c1ccccc1 ZINC000559766056 332279705 /nfs/dbraw/zinc/27/97/05/332279705.db2.gz FHQDWXKZFZPAJT-KTIPNOMGSA-N 2 1 312.501 4.380 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559866665 332287043 /nfs/dbraw/zinc/28/70/43/332287043.db2.gz WMMSQNWQRLMICT-AFYVEPGGSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559866665 332287045 /nfs/dbraw/zinc/28/70/45/332287045.db2.gz WMMSQNWQRLMICT-AFYVEPGGSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559866670 332287122 /nfs/dbraw/zinc/28/71/22/332287122.db2.gz WMMSQNWQRLMICT-FRYIKTPZSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559866670 332287123 /nfs/dbraw/zinc/28/71/23/332287123.db2.gz WMMSQNWQRLMICT-FRYIKTPZSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559866676 332287284 /nfs/dbraw/zinc/28/72/84/332287284.db2.gz WMMSQNWQRLMICT-VBSBHUPXSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000559866676 332287285 /nfs/dbraw/zinc/28/72/85/332287285.db2.gz WMMSQNWQRLMICT-VBSBHUPXSA-N 2 1 300.490 4.380 20 0 DIADMP CC1=CC[C@@H]([NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000559913324 332292530 /nfs/dbraw/zinc/29/25/30/332292530.db2.gz IIXFGKRRBSGGAI-JYRKZWEQSA-N 2 1 312.501 4.231 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CC1 ZINC000560484139 332345030 /nfs/dbraw/zinc/34/50/30/332345030.db2.gz BBRJWUMULJQQTC-SOLBZPMBSA-N 2 1 304.503 4.219 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000560484139 332345032 /nfs/dbraw/zinc/34/50/32/332345032.db2.gz BBRJWUMULJQQTC-SOLBZPMBSA-N 2 1 304.503 4.219 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CC1 ZINC000560484140 332345224 /nfs/dbraw/zinc/34/52/24/332345224.db2.gz BBRJWUMULJQQTC-XYJFISCASA-N 2 1 304.503 4.219 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000560484140 332345226 /nfs/dbraw/zinc/34/52/26/332345226.db2.gz BBRJWUMULJQQTC-XYJFISCASA-N 2 1 304.503 4.219 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+]C1(c2ccc(Cl)cc2)CCCCC1 ZINC000570246384 332729536 /nfs/dbraw/zinc/72/95/36/332729536.db2.gz JLSJRQRSYXNXBQ-UHFFFAOYSA-N 2 1 317.864 4.065 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526055575 333051689 /nfs/dbraw/zinc/05/16/89/333051689.db2.gz HIDDYIOIVGRRQI-FUTAKVPZSA-N 2 1 306.881 4.017 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526055575 333051691 /nfs/dbraw/zinc/05/16/91/333051691.db2.gz HIDDYIOIVGRRQI-FUTAKVPZSA-N 2 1 306.881 4.017 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526055576 333051729 /nfs/dbraw/zinc/05/17/29/333051729.db2.gz HIDDYIOIVGRRQI-KEGWNNHHSA-N 2 1 306.881 4.017 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526055576 333051730 /nfs/dbraw/zinc/05/17/30/333051730.db2.gz HIDDYIOIVGRRQI-KEGWNNHHSA-N 2 1 306.881 4.017 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)C1 ZINC000462676954 333072617 /nfs/dbraw/zinc/07/26/17/333072617.db2.gz ORFXGDZJLUWPKO-HLIPFELVSA-N 2 1 300.490 4.339 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000314082533 333086183 /nfs/dbraw/zinc/08/61/83/333086183.db2.gz DQYKLGXPFXITEV-GOSISDBHSA-N 2 1 306.881 4.254 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C\c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000526056646 333095897 /nfs/dbraw/zinc/09/58/97/333095897.db2.gz CWSTUIHTTUWWCI-YMTSHVIYSA-N 2 1 306.881 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C\c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000526056646 333095899 /nfs/dbraw/zinc/09/58/99/333095899.db2.gz CWSTUIHTTUWWCI-YMTSHVIYSA-N 2 1 306.881 4.015 20 0 DIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056697 333096519 /nfs/dbraw/zinc/09/65/19/333096519.db2.gz QXVFWRSPQIPELH-LHRDXKRPSA-N 2 1 318.892 4.017 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056697 333096520 /nfs/dbraw/zinc/09/65/20/333096520.db2.gz QXVFWRSPQIPELH-LHRDXKRPSA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056697 333096521 /nfs/dbraw/zinc/09/65/21/333096521.db2.gz QXVFWRSPQIPELH-LHRDXKRPSA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056697 333096523 /nfs/dbraw/zinc/09/65/23/333096523.db2.gz QXVFWRSPQIPELH-LHRDXKRPSA-N 2 1 318.892 4.017 20 0 DIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056698 333096659 /nfs/dbraw/zinc/09/66/59/333096659.db2.gz QXVFWRSPQIPELH-ZMUQKWFASA-N 2 1 318.892 4.017 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056698 333096660 /nfs/dbraw/zinc/09/66/60/333096660.db2.gz QXVFWRSPQIPELH-ZMUQKWFASA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056698 333096662 /nfs/dbraw/zinc/09/66/62/333096662.db2.gz QXVFWRSPQIPELH-ZMUQKWFASA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056698 333096664 /nfs/dbraw/zinc/09/66/64/333096664.db2.gz QXVFWRSPQIPELH-ZMUQKWFASA-N 2 1 318.892 4.017 20 0 DIADMP Cc1ccc2c(C)cc(N3CC[C@@H](C4CC[NH+](C)CC4)C3)[nH+]c2c1 ZINC000460948407 333119046 /nfs/dbraw/zinc/11/90/46/333119046.db2.gz VXESRMWMHWQMPQ-GOSISDBHSA-N 2 1 323.484 4.020 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C[C@H](C)c1cccc(Cl)c1 ZINC000188017375 333156743 /nfs/dbraw/zinc/15/67/43/333156743.db2.gz HEKRRJBYFCMTAL-AWEZNQCLSA-N 2 1 305.853 4.018 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840353 333284061 /nfs/dbraw/zinc/28/40/61/333284061.db2.gz YKKYGMNWFQJMEK-ROUUACIJSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840353 333284063 /nfs/dbraw/zinc/28/40/63/333284063.db2.gz YKKYGMNWFQJMEK-ROUUACIJSA-N 2 1 318.480 4.331 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000497829237 333297435 /nfs/dbraw/zinc/29/74/35/333297435.db2.gz RBONCHHGSWMTFL-HNAYVOBHSA-N 2 1 314.473 4.451 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497843049 333300203 /nfs/dbraw/zinc/30/02/03/333300203.db2.gz MVENSFBRYHFZAZ-KRWDZBQOSA-N 2 1 320.480 4.466 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497843049 333300205 /nfs/dbraw/zinc/30/02/05/333300205.db2.gz MVENSFBRYHFZAZ-KRWDZBQOSA-N 2 1 320.480 4.466 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390565374 333300856 /nfs/dbraw/zinc/30/08/56/333300856.db2.gz BJECZBSKAIWAJF-QRQLOZEOSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390565374 333300857 /nfs/dbraw/zinc/30/08/57/333300857.db2.gz BJECZBSKAIWAJF-QRQLOZEOSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cn1 ZINC000497850382 333301110 /nfs/dbraw/zinc/30/11/10/333301110.db2.gz ZDQDBMKTIKRGCS-QFBILLFUSA-N 2 1 321.484 4.162 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cn1 ZINC000497851905 333301567 /nfs/dbraw/zinc/30/15/67/333301567.db2.gz HPSLGVMAFIIPRM-LPHOPBHVSA-N 2 1 321.484 4.020 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594277 333305157 /nfs/dbraw/zinc/30/51/57/333305157.db2.gz GYHBWWKNHHTOSM-BHIYHBOVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594277 333305158 /nfs/dbraw/zinc/30/51/58/333305158.db2.gz GYHBWWKNHHTOSM-BHIYHBOVSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000390638350 333308723 /nfs/dbraw/zinc/30/87/23/333308723.db2.gz HOPGRYRJMGMKBN-OAQYLSRUSA-N 2 1 322.496 4.262 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390681191 333314741 /nfs/dbraw/zinc/31/47/41/333314741.db2.gz VWRLHOJUUKMUIQ-WNTWWTRPSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697163 333315713 /nfs/dbraw/zinc/31/57/13/333315713.db2.gz RYJWPSVBBFUWJL-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697163 333315714 /nfs/dbraw/zinc/31/57/14/333315714.db2.gz RYJWPSVBBFUWJL-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP Cc1cscc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463243496 333360981 /nfs/dbraw/zinc/36/09/81/333360981.db2.gz SMBADKSBXQLTLL-LPHOPBHVSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)NCCC[N@H+](C)C(C)C ZINC000221922437 333379877 /nfs/dbraw/zinc/37/98/77/333379877.db2.gz OXIBRFGTOTTWRZ-ZDUSSCGKSA-N 2 1 311.539 4.130 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCC[N@@H+](C)C(C)C ZINC000221922437 333379878 /nfs/dbraw/zinc/37/98/78/333379878.db2.gz OXIBRFGTOTTWRZ-ZDUSSCGKSA-N 2 1 311.539 4.130 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCC[N@H+](C)C(C)C ZINC000221922437 333379879 /nfs/dbraw/zinc/37/98/79/333379879.db2.gz OXIBRFGTOTTWRZ-ZDUSSCGKSA-N 2 1 311.539 4.130 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390788141 333393584 /nfs/dbraw/zinc/39/35/84/333393584.db2.gz ACNPIMCSRAGFMW-NBYUQASBSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]CC1CCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390800892 333394349 /nfs/dbraw/zinc/39/43/49/333394349.db2.gz ORZBQRLSFPUEOF-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000391364619 333458160 /nfs/dbraw/zinc/45/81/60/333458160.db2.gz METCCEOOONCXTI-RXVVDRJESA-N 2 1 314.517 4.252 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000338010245 333467906 /nfs/dbraw/zinc/46/79/06/333467906.db2.gz KHVXQFJOUALREA-VIFPVBQESA-N 2 1 318.273 4.301 20 0 DIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000531737431 333551973 /nfs/dbraw/zinc/55/19/73/333551973.db2.gz OLBBSMVTCPCXPG-MRXNPFEDSA-N 2 1 316.489 4.061 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+]C3(C4CCC4)CCC3)CC2)cc1 ZINC000414170419 333907451 /nfs/dbraw/zinc/90/74/51/333907451.db2.gz BZBBKVDIUBETFT-UHFFFAOYSA-N 2 1 312.501 4.006 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000343422744 335163763 /nfs/dbraw/zinc/16/37/63/335163763.db2.gz QIYXIGYKCMFYPN-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414668481 334063068 /nfs/dbraw/zinc/06/30/68/334063068.db2.gz AAWFGEVARXPRED-MGPQQGTHSA-N 2 1 314.395 4.086 20 0 DIADMP Clc1cccc([C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccccc2)c1 ZINC000415081892 334272937 /nfs/dbraw/zinc/27/29/37/334272937.db2.gz CQBQBWIFNIJWNP-MOPGFXCFSA-N 2 1 314.860 4.161 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415095231 334280981 /nfs/dbraw/zinc/28/09/81/334280981.db2.gz YZBXZZXJXHLRAI-WUHBCXKYSA-N 2 1 306.453 4.003 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCSc4ccccc43)CC[NH2+]2)cc1 ZINC000415098530 334281235 /nfs/dbraw/zinc/28/12/35/334281235.db2.gz FMLWEEQLIFEJKQ-QRQLOZEOSA-N 2 1 324.493 4.306 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCC1 ZINC000531962010 334312500 /nfs/dbraw/zinc/31/25/00/334312500.db2.gz GNWDZAOZKUBCTA-RKVPGOIHSA-N 2 1 320.908 4.080 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC)c(Cl)c2)CC1 ZINC000531961976 334312538 /nfs/dbraw/zinc/31/25/38/334312538.db2.gz DTBZLADZROWMKR-AWEZNQCLSA-N 2 1 324.896 4.264 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000531970792 334331231 /nfs/dbraw/zinc/33/12/31/334331231.db2.gz PXULOTCNJNCEQE-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)C1 ZINC000531970663 334331278 /nfs/dbraw/zinc/33/12/78/334331278.db2.gz DWHSDABLJDZOJF-IRLDBZIGSA-N 2 1 322.496 4.292 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)C1 ZINC000531970665 334331340 /nfs/dbraw/zinc/33/13/40/334331340.db2.gz DWHSDABLJDZOJF-UNMCSNQZSA-N 2 1 322.496 4.292 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc3cc(F)ccc3o2)CC1 ZINC000535083210 334366448 /nfs/dbraw/zinc/36/64/48/334366448.db2.gz RHVJBUZBLWWOCB-UHFFFAOYSA-N 2 1 318.436 4.124 20 0 DIADMP C/C(=C\c1ccccc1)C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000535083084 334366464 /nfs/dbraw/zinc/36/64/64/334366464.db2.gz JGEGRHQUXGCQKJ-NBVRZTHBSA-N 2 1 300.490 4.142 20 0 DIADMP C/C(=C/c1ccccc1)C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000535083077 334366491 /nfs/dbraw/zinc/36/64/91/334366491.db2.gz JGEGRHQUXGCQKJ-JXAWBTAJSA-N 2 1 300.490 4.142 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000345283790 335313469 /nfs/dbraw/zinc/31/34/69/335313469.db2.gz BLCZVFVILVNPOV-FSPWUOQZSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000345283790 335313470 /nfs/dbraw/zinc/31/34/70/335313470.db2.gz BLCZVFVILVNPOV-FSPWUOQZSA-N 2 1 306.881 4.254 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000345693320 335342377 /nfs/dbraw/zinc/34/23/77/335342377.db2.gz QLQZSKSHZKTZBC-SFHVURJKSA-N 2 1 306.881 4.255 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000346312067 335398984 /nfs/dbraw/zinc/39/89/84/335398984.db2.gz OJBOIJSBRVISOS-LLVKDONJSA-N 2 1 312.244 4.191 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000346312067 335398986 /nfs/dbraw/zinc/39/89/86/335398986.db2.gz OJBOIJSBRVISOS-LLVKDONJSA-N 2 1 312.244 4.191 20 0 DIADMP C[C@H](CC[NH2+][C@@H]1CCSc2ccccc21)[NH+]1CCCCC1 ZINC000346869182 335451495 /nfs/dbraw/zinc/45/14/95/335451495.db2.gz TXATZRSFSFQVSY-NVXWUHKLSA-N 2 1 304.503 4.078 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCC2 ZINC000535622838 335694794 /nfs/dbraw/zinc/69/47/94/335694794.db2.gz JLZLIDNSZOSQJZ-OAQYLSRUSA-N 2 1 312.501 4.404 20 0 DIADMP CCc1oc2ccccc2c1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000520660109 336002904 /nfs/dbraw/zinc/00/29/04/336002904.db2.gz DVVFBWZXZZGPIN-XYPWUTKMSA-N 2 1 312.457 4.052 20 0 DIADMP CCc1oc2ccccc2c1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000520660109 336002905 /nfs/dbraw/zinc/00/29/05/336002905.db2.gz DVVFBWZXZZGPIN-XYPWUTKMSA-N 2 1 312.457 4.052 20 0 DIADMP CCc1oc2ccccc2c1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000520660109 336002906 /nfs/dbraw/zinc/00/29/06/336002906.db2.gz DVVFBWZXZZGPIN-XYPWUTKMSA-N 2 1 312.457 4.052 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C3(C4CCC4)CCC3)CC23CC3)cc1 ZINC000583630549 336007525 /nfs/dbraw/zinc/00/75/25/336007525.db2.gz HLZDJOOYKIRWEW-FQEVSTJZSA-N 2 1 324.512 4.496 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C3(C4CCC4)CCC3)CC23CC3)cc1 ZINC000583630549 336007527 /nfs/dbraw/zinc/00/75/27/336007527.db2.gz HLZDJOOYKIRWEW-FQEVSTJZSA-N 2 1 324.512 4.496 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1cccc(O)c1 ZINC000192035253 336016647 /nfs/dbraw/zinc/01/66/47/336016647.db2.gz YTSOPTORALKPIU-MDZRGWNJSA-N 2 1 316.489 4.086 20 0 DIADMP Cc1sccc1CN(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000351447708 336035692 /nfs/dbraw/zinc/03/56/92/336035692.db2.gz DMWXPRPXNDRUKH-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@](C)(c2ccccc2)CC1 ZINC000352210324 336203103 /nfs/dbraw/zinc/20/31/03/336203103.db2.gz FZSCOYBGQKNIKF-FQEVSTJZSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@](C)(c2ccccc2)CC1 ZINC000352210324 336203104 /nfs/dbraw/zinc/20/31/04/336203104.db2.gz FZSCOYBGQKNIKF-FQEVSTJZSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000352799816 336238550 /nfs/dbraw/zinc/23/85/50/336238550.db2.gz GMCUYFMCXDUXIE-YLJYHZDGSA-N 2 1 311.473 4.445 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000352799816 336238551 /nfs/dbraw/zinc/23/85/51/336238551.db2.gz GMCUYFMCXDUXIE-YLJYHZDGSA-N 2 1 311.473 4.445 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1Cl ZINC000532482764 336251606 /nfs/dbraw/zinc/25/16/06/336251606.db2.gz BPFKSDDASRIQDD-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000192705873 336258978 /nfs/dbraw/zinc/25/89/78/336258978.db2.gz UTIRAUQWGIVIKY-QDLKPRKASA-N 2 1 300.490 4.031 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000532737701 336268926 /nfs/dbraw/zinc/26/89/26/336268926.db2.gz MOOLAICBTKJHNQ-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000532737701 336268927 /nfs/dbraw/zinc/26/89/27/336268927.db2.gz MOOLAICBTKJHNQ-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000532737701 336268928 /nfs/dbraw/zinc/26/89/28/336268928.db2.gz MOOLAICBTKJHNQ-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000532737701 336268929 /nfs/dbraw/zinc/26/89/29/336268929.db2.gz MOOLAICBTKJHNQ-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000532737701 336268930 /nfs/dbraw/zinc/26/89/30/336268930.db2.gz MOOLAICBTKJHNQ-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000532737701 336268931 /nfs/dbraw/zinc/26/89/31/336268931.db2.gz MOOLAICBTKJHNQ-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+][C@@H](C)c1cnc2ccsc2c1 ZINC000482231103 336284312 /nfs/dbraw/zinc/28/43/12/336284312.db2.gz LWEYBWWVZPGPFX-HNNXBMFYSA-N 2 1 319.518 4.459 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000417994413 336287232 /nfs/dbraw/zinc/28/72/32/336287232.db2.gz YVNKARUWPISPKG-MCNSAMFCSA-N 2 1 312.501 4.033 20 0 DIADMP Cc1cc(NCc2ccccc2C[N@H+]2CCCC[C@@H]2C)nc(C)[nH+]1 ZINC000301095682 336289772 /nfs/dbraw/zinc/28/97/72/336289772.db2.gz MJPZKSWQIGPUNA-INIZCTEOSA-N 2 1 324.472 4.080 20 0 DIADMP Cc1cc(NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)nc(C)[nH+]1 ZINC000301095682 336289773 /nfs/dbraw/zinc/28/97/73/336289773.db2.gz MJPZKSWQIGPUNA-INIZCTEOSA-N 2 1 324.472 4.080 20 0 DIADMP Cc1cc(NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)nc(C)n1 ZINC000301129281 336291381 /nfs/dbraw/zinc/29/13/81/336291381.db2.gz ZBMWGHHCXFHLAV-INIZCTEOSA-N 2 1 324.472 4.080 20 0 DIADMP Cc1cc(NCc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)nc(C)[nH+]1 ZINC000301129281 336291382 /nfs/dbraw/zinc/29/13/82/336291382.db2.gz ZBMWGHHCXFHLAV-INIZCTEOSA-N 2 1 324.472 4.080 20 0 DIADMP Cc1cc(NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)nc(C)[nH+]1 ZINC000301129281 336291383 /nfs/dbraw/zinc/29/13/83/336291383.db2.gz ZBMWGHHCXFHLAV-INIZCTEOSA-N 2 1 324.472 4.080 20 0 DIADMP C[N@@H+]1CCC[C@H](CNc2cc[nH+]cc2Cl)[C@@H]1c1cccs1 ZINC000301554278 336314545 /nfs/dbraw/zinc/31/45/45/336314545.db2.gz MYJIZTRPDBDOFM-MLGOLLRUSA-N 2 1 321.877 4.292 20 0 DIADMP C[N@H+]1CCC[C@H](CNc2cc[nH+]cc2Cl)[C@@H]1c1cccs1 ZINC000301554278 336314546 /nfs/dbraw/zinc/31/45/46/336314546.db2.gz MYJIZTRPDBDOFM-MLGOLLRUSA-N 2 1 321.877 4.292 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]2CCF)CC1 ZINC000514104868 336352623 /nfs/dbraw/zinc/35/26/23/336352623.db2.gz NCAHQNIEHZJKRS-YLJYHZDGSA-N 2 1 318.480 4.077 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCC[C@H]2CCF)CC1 ZINC000514104866 336352641 /nfs/dbraw/zinc/35/26/41/336352641.db2.gz NCAHQNIEHZJKRS-PXNSSMCTSA-N 2 1 318.480 4.077 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000152443252 336384467 /nfs/dbraw/zinc/38/44/67/336384467.db2.gz JMGQLVPDFBGHPR-CVEARBPZSA-N 2 1 318.530 4.322 20 0 DIADMP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610538 336386249 /nfs/dbraw/zinc/38/62/49/336386249.db2.gz ZRXPORAFUSPHFY-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610538 336386250 /nfs/dbraw/zinc/38/62/50/336386250.db2.gz ZRXPORAFUSPHFY-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610538 336386251 /nfs/dbraw/zinc/38/62/51/336386251.db2.gz ZRXPORAFUSPHFY-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2c(Cl)oc3ccccc32)C1 ZINC000514610538 336386252 /nfs/dbraw/zinc/38/62/52/336386252.db2.gz ZRXPORAFUSPHFY-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](C)C(F)(F)F)cc1 ZINC000359541898 336676877 /nfs/dbraw/zinc/67/68/77/336676877.db2.gz SFNOEHKDINQLGV-NEPJUHHUSA-N 2 1 311.351 4.030 20 0 DIADMP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC000360849144 336724445 /nfs/dbraw/zinc/72/44/45/336724445.db2.gz XOJAKMWMWOFIJV-GJZGRUSLSA-N 2 1 318.436 4.030 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+]Cc1cc2cc(F)ccc2o1 ZINC000360944556 336728638 /nfs/dbraw/zinc/72/86/38/336728638.db2.gz NOWYSYRVDKVQNG-UHFFFAOYSA-N 2 1 306.425 4.174 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000193507864 337033078 /nfs/dbraw/zinc/03/30/78/337033078.db2.gz RDUWNCQZPVINSP-CABCVRRESA-N 2 1 312.457 4.130 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000193507864 337033079 /nfs/dbraw/zinc/03/30/79/337033079.db2.gz RDUWNCQZPVINSP-CABCVRRESA-N 2 1 312.457 4.130 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1cc2cc(Cl)ccc2o1 ZINC000377798942 337061394 /nfs/dbraw/zinc/06/13/94/337061394.db2.gz OTMIXEXWTDIPRW-GWCFXTLKSA-N 2 1 315.804 4.017 20 0 DIADMP Cc1nc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000178111407 337162431 /nfs/dbraw/zinc/16/24/31/337162431.db2.gz IZHMHGBIBYLRBM-QLFBSQMISA-N 2 1 323.550 4.169 20 0 DIADMP C[C@H](NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccoc1 ZINC000178795166 337165016 /nfs/dbraw/zinc/16/50/16/337165016.db2.gz VWQNLKMBKLMREJ-VBQJREDUSA-N 2 1 304.459 4.075 20 0 DIADMP C[C@H](NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccoc1 ZINC000178795166 337165017 /nfs/dbraw/zinc/16/50/17/337165017.db2.gz VWQNLKMBKLMREJ-VBQJREDUSA-N 2 1 304.459 4.075 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000180404074 337174243 /nfs/dbraw/zinc/17/42/43/337174243.db2.gz DICGJKZTMQGGHS-QGZVFWFLSA-N 2 1 322.880 4.016 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CCCC3)C2)s1 ZINC000582872089 337209495 /nfs/dbraw/zinc/20/94/95/337209495.db2.gz TYOODNUXXJRDMJ-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CCCC3)C2)s1 ZINC000582872089 337209496 /nfs/dbraw/zinc/20/94/96/337209496.db2.gz TYOODNUXXJRDMJ-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CCCC3)C2)s1 ZINC000582872089 337209497 /nfs/dbraw/zinc/20/94/97/337209497.db2.gz TYOODNUXXJRDMJ-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP CC[NH2+]CCC[NH2+][C@H](C)c1ccc2ccccc2c1OC(F)F ZINC000582958549 337218559 /nfs/dbraw/zinc/21/85/59/337218559.db2.gz AAWIFRLRIBPSRJ-CYBMUJFWSA-N 2 1 322.399 4.091 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)CCc2ccc(Cl)s2)C1 ZINC000582991793 337223204 /nfs/dbraw/zinc/22/32/04/337223204.db2.gz FZSNVGUHWLNSJJ-ZIAGYGMSSA-N 2 1 314.926 4.043 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCC2CCCC2)C3)cc1 ZINC000499144269 337285139 /nfs/dbraw/zinc/28/51/39/337285139.db2.gz WRGWMNYRHSDNQY-WKCHPHFGSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000398017790 337303878 /nfs/dbraw/zinc/30/38/78/337303878.db2.gz IGCOJWUXCONTTL-VOQZNFBZSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000398017790 337303879 /nfs/dbraw/zinc/30/38/79/337303879.db2.gz IGCOJWUXCONTTL-VOQZNFBZSA-N 2 1 320.480 4.174 20 0 DIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398020090 337304615 /nfs/dbraw/zinc/30/46/15/337304615.db2.gz JPKFGJFMNGBCPS-DNVCBOLYSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cc2ccccc2s1 ZINC000525952588 337308992 /nfs/dbraw/zinc/30/89/92/337308992.db2.gz YXBJCKZQDATNMC-HOCLYGCPSA-N 2 1 302.487 4.426 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2F)cc1 ZINC000086279127 337310344 /nfs/dbraw/zinc/31/03/44/337310344.db2.gz JVNBJFJTUMVBTN-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000422714634 337684019 /nfs/dbraw/zinc/68/40/19/337684019.db2.gz RGHYHOIBAWXKFW-MBDNFAEBSA-N 2 1 320.480 4.406 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000422735412 337684585 /nfs/dbraw/zinc/68/45/85/337684585.db2.gz UQDQDOILUOCISP-QMMLZNLJSA-N 2 1 308.469 4.091 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422735410 337684601 /nfs/dbraw/zinc/68/46/01/337684601.db2.gz UQDQDOILUOCISP-DUXKGJEZSA-N 2 1 308.469 4.091 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC000422829672 337688289 /nfs/dbraw/zinc/68/82/89/337688289.db2.gz HPUXFPFHRXKDGL-UXHICEINSA-N 2 1 308.469 4.047 20 0 DIADMP CCCCOc1cccc(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000422886979 337690018 /nfs/dbraw/zinc/69/00/18/337690018.db2.gz AHFIUFRDJVJOBG-UXHICEINSA-N 2 1 310.441 4.100 20 0 DIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000422935217 337692444 /nfs/dbraw/zinc/69/24/44/337692444.db2.gz DJDQXPCQIZLXFJ-MKBNYLNASA-N 2 1 308.878 4.206 20 0 DIADMP C[C@@H]([NH2+]C1CCC(C)(c2ccccc2)CC1)c1c[nH+]ccc1N ZINC000422990280 337693764 /nfs/dbraw/zinc/69/37/64/337693764.db2.gz NCQLBTSVSBJQHD-XRTORIHISA-N 2 1 309.457 4.045 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000422968489 337695210 /nfs/dbraw/zinc/69/52/10/337695210.db2.gz RGHYHOIBAWXKFW-CIAFKFPVSA-N 2 1 320.480 4.406 20 0 DIADMP C[C@@H]([NH3+])C[C@H](C)[NH2+]C1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423082202 337698543 /nfs/dbraw/zinc/69/85/43/337698543.db2.gz WMHDAJYYIVUASK-ZJUUUORDSA-N 2 1 320.786 4.063 20 0 DIADMP [NH3+][C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)c2ccccc21 ZINC000423167859 337702230 /nfs/dbraw/zinc/70/22/30/337702230.db2.gz FWDGRIVKIXAHST-VJUNAUMWSA-N 2 1 316.807 4.069 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc2cc(Cl)ccc2o1 ZINC000423339575 337712877 /nfs/dbraw/zinc/71/28/77/337712877.db2.gz LIYJIVNMGLGZIA-SJCJKPOMSA-N 2 1 306.837 4.127 20 0 DIADMP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000423383989 337717890 /nfs/dbraw/zinc/71/78/90/337717890.db2.gz FVHAOTMRFYDPSF-MDASCCDHSA-N 2 1 314.860 4.017 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2C[C@H]2C2CC2)CC1 ZINC000527663169 337756961 /nfs/dbraw/zinc/75/69/61/337756961.db2.gz XUOWNEIOADTIDO-GQSCTRQFSA-N 2 1 312.501 4.236 20 0 DIADMP c1cn2c([nH+]1)CC[C@@H](C[NH2+][C@@H]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC000527695189 337760347 /nfs/dbraw/zinc/76/03/47/337760347.db2.gz LUPJUPQPPIGSDA-DFQSSKMNSA-N 2 1 323.484 4.152 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000120544459 337876576 /nfs/dbraw/zinc/87/65/76/337876576.db2.gz LKUVWVXQCKQLJD-AWEZNQCLSA-N 2 1 304.478 4.045 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]CCn1cc[nH+]c1C ZINC000537292276 337928491 /nfs/dbraw/zinc/92/84/91/337928491.db2.gz HIEWXGKYUZCYEK-CQSZACIVSA-N 2 1 311.429 4.159 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)o1 ZINC000123086210 337943324 /nfs/dbraw/zinc/94/33/24/337943324.db2.gz DCNDUUMKWBLURJ-INIZCTEOSA-N 2 1 312.457 4.289 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000315017358 337979236 /nfs/dbraw/zinc/97/92/36/337979236.db2.gz KTMRRMOTEISDTA-KGLIPLIRSA-N 2 1 323.550 4.132 20 0 DIADMP Cc1ccc(N2CCC([NH2+]CCCC3CCCCC3)CC2)[nH+]c1 ZINC000428278924 338045264 /nfs/dbraw/zinc/04/52/64/338045264.db2.gz GKTBWEMWUWVPQI-UHFFFAOYSA-N 2 1 315.505 4.309 20 0 DIADMP CC1(C)CC([NH2+]Cc2ccc(C(F)(F)F)s2)CC(C)(C)[NH2+]1 ZINC000428857333 338062709 /nfs/dbraw/zinc/06/27/09/338062709.db2.gz RWPVVASBUZBWPI-UHFFFAOYSA-N 2 1 320.424 4.166 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000429228696 338074017 /nfs/dbraw/zinc/07/40/17/338074017.db2.gz ATCRDBAXVZYXLY-IBGZPJMESA-N 2 1 311.473 4.235 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000429228696 338074018 /nfs/dbraw/zinc/07/40/18/338074018.db2.gz ATCRDBAXVZYXLY-IBGZPJMESA-N 2 1 311.473 4.235 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]CCSCc1ccccc1 ZINC000430749739 338113450 /nfs/dbraw/zinc/11/34/50/338113450.db2.gz LHXXICNTXGYLRX-GOSISDBHSA-N 2 1 320.546 4.164 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]CCSCc2ccccc2)C1 ZINC000430750460 338113500 /nfs/dbraw/zinc/11/35/00/338113500.db2.gz NWSMAEOXKUGMPI-GOSISDBHSA-N 2 1 320.546 4.022 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000431332103 338128232 /nfs/dbraw/zinc/12/82/32/338128232.db2.gz IWEKAGSNLZHFSO-FCEWJHQRSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000431332103 338128233 /nfs/dbraw/zinc/12/82/33/338128233.db2.gz IWEKAGSNLZHFSO-FCEWJHQRSA-N 2 1 316.489 4.096 20 0 DIADMP C[C@@H](CCSc1ccccc1)[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000431602031 338134379 /nfs/dbraw/zinc/13/43/79/338134379.db2.gz DUGZULAPOCUNCZ-KRWDZBQOSA-N 2 1 318.530 4.118 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431606571 338134598 /nfs/dbraw/zinc/13/45/98/338134598.db2.gz FNMNEBOERJVBRP-ZWKOTPCHSA-N 2 1 320.546 4.221 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)cs2)CC1 ZINC000432793395 338168211 /nfs/dbraw/zinc/16/82/11/338168211.db2.gz ONWKBTLSMOAYML-GOSISDBHSA-N 2 1 314.498 4.331 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1)c1cccc(O)c1 ZINC000433045081 338178178 /nfs/dbraw/zinc/17/81/78/338178178.db2.gz DCVHOVNAYTVMAP-RZQQEMMASA-N 2 1 316.489 4.086 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434681399 338223388 /nfs/dbraw/zinc/22/33/88/338223388.db2.gz NYTNNNPNKDWMDI-UHFFFAOYSA-N 2 1 323.484 4.216 20 0 DIADMP CC1(C)CCc2ccccc2[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000436307937 338268280 /nfs/dbraw/zinc/26/82/80/338268280.db2.gz OTVQBBKUBNIBOY-WSTZPKSXSA-N 2 1 312.501 4.307 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000436312121 338268540 /nfs/dbraw/zinc/26/85/40/338268540.db2.gz JRERLDIJFHQYLA-HLAWJBBLSA-N 2 1 314.517 4.280 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437593466 338315495 /nfs/dbraw/zinc/31/54/95/338315495.db2.gz NXHBUJXHKVDYHX-RTWAWAEBSA-N 2 1 314.517 4.301 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000437593466 338315496 /nfs/dbraw/zinc/31/54/96/338315496.db2.gz NXHBUJXHKVDYHX-RTWAWAEBSA-N 2 1 314.517 4.301 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437786847 338321464 /nfs/dbraw/zinc/32/14/64/338321464.db2.gz PEUBGAXNEKAISO-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000437786847 338321465 /nfs/dbraw/zinc/32/14/65/338321465.db2.gz PEUBGAXNEKAISO-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438109474 338332234 /nfs/dbraw/zinc/33/22/34/338332234.db2.gz OILQFDJLBUDPRC-SESVDKBCSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438109474 338332235 /nfs/dbraw/zinc/33/22/35/338332235.db2.gz OILQFDJLBUDPRC-SESVDKBCSA-N 2 1 314.517 4.161 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438109474 338332236 /nfs/dbraw/zinc/33/22/36/338332236.db2.gz OILQFDJLBUDPRC-SESVDKBCSA-N 2 1 314.517 4.161 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438198213 338336289 /nfs/dbraw/zinc/33/62/89/338336289.db2.gz GQOOFBYDMIBZDL-HLAWJBBLSA-N 2 1 314.517 4.207 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](CC(c2ccccc2)c2ccccc2)C1 ZINC000438849130 338353819 /nfs/dbraw/zinc/35/38/19/338353819.db2.gz DDCBEZNGWSLUER-LJQANCHMSA-N 2 1 322.496 4.092 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000438849130 338353820 /nfs/dbraw/zinc/35/38/20/338353820.db2.gz DDCBEZNGWSLUER-LJQANCHMSA-N 2 1 322.496 4.092 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000438849130 338353821 /nfs/dbraw/zinc/35/38/21/338353821.db2.gz DDCBEZNGWSLUER-LJQANCHMSA-N 2 1 322.496 4.092 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H](C)Cc2ccccc2)CC1 ZINC000447093252 338545185 /nfs/dbraw/zinc/54/51/85/338545185.db2.gz IBSFAFHDOAEZKF-QGZVFWFLSA-N 2 1 324.468 4.112 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449061600 338589392 /nfs/dbraw/zinc/58/93/92/338589392.db2.gz GSYMVIIFXZNEAR-YJBOKZPZSA-N 2 1 306.881 4.050 20 0 DIADMP c1csc(C2(C[NH2+]C3CC[NH+](C4CC4)CC3)CCCCC2)c1 ZINC000459451932 339029952 /nfs/dbraw/zinc/02/99/52/339029952.db2.gz XMZBXKGZXUIRRI-UHFFFAOYSA-N 2 1 318.530 4.166 20 0 DIADMP Clc1cccc([C@H]2CC[C@@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)c1 ZINC000459563491 339035949 /nfs/dbraw/zinc/03/59/49/339035949.db2.gz QOOSEDLORGQCBZ-MAUKXSAKSA-N 2 1 318.892 4.193 20 0 DIADMP C[C@H](CCc1ccc(Cl)s1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459723575 339044420 /nfs/dbraw/zinc/04/44/20/339044420.db2.gz AECILRUJFIDFOA-KGLIPLIRSA-N 2 1 314.926 4.044 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082578 339058410 /nfs/dbraw/zinc/05/84/10/339058410.db2.gz IFYCSBTZNBGSSV-CZUORRHYSA-N 2 1 312.860 4.252 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082578 339058411 /nfs/dbraw/zinc/05/84/11/339058411.db2.gz IFYCSBTZNBGSSV-CZUORRHYSA-N 2 1 312.860 4.252 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082577 339058432 /nfs/dbraw/zinc/05/84/32/339058432.db2.gz IFYCSBTZNBGSSV-CJNGLKHVSA-N 2 1 312.860 4.252 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082577 339058433 /nfs/dbraw/zinc/05/84/33/339058433.db2.gz IFYCSBTZNBGSSV-CJNGLKHVSA-N 2 1 312.860 4.252 20 0 DIADMP CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000462356022 339076596 /nfs/dbraw/zinc/07/65/96/339076596.db2.gz CNZRDQKRLOSIJD-RDJZCZTQSA-N 2 1 315.436 4.378 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)C1 ZINC000462672793 339083747 /nfs/dbraw/zinc/08/37/47/339083747.db2.gz GGKFJBZUFYNFFI-FUHIMQAGSA-N 2 1 300.490 4.197 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000462780840 339088151 /nfs/dbraw/zinc/08/81/51/339088151.db2.gz ZOCGEDZRURRZMM-HMXCVIKNSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H](CNc1cc[nH+]c2ccsc21)[N@H+](C)Cc1ccccc1 ZINC000462839593 339093783 /nfs/dbraw/zinc/09/37/83/339093783.db2.gz NOLYUMTVYNVPOM-CQSZACIVSA-N 2 1 311.454 4.229 20 0 DIADMP C[C@H](CNc1cc[nH+]c2ccsc21)[N@@H+](C)Cc1ccccc1 ZINC000462839593 339093784 /nfs/dbraw/zinc/09/37/84/339093784.db2.gz NOLYUMTVYNVPOM-CQSZACIVSA-N 2 1 311.454 4.229 20 0 DIADMP C[NH+](C)[C@@H](CNc1cc[nH+]c2ccsc21)c1cccc(F)c1 ZINC000462917437 339098043 /nfs/dbraw/zinc/09/80/43/339098043.db2.gz SYVBUIOQZKIZEU-INIZCTEOSA-N 2 1 315.417 4.150 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC23CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000463235048 339110877 /nfs/dbraw/zinc/11/08/77/339110877.db2.gz FHSYNXMSPHSTCD-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC000463235048 339110878 /nfs/dbraw/zinc/11/08/78/339110878.db2.gz FHSYNXMSPHSTCD-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463249087 339111992 /nfs/dbraw/zinc/11/19/92/339111992.db2.gz YDURHIZOBWIRLA-PIKOESSRSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463249087 339111993 /nfs/dbraw/zinc/11/19/93/339111993.db2.gz YDURHIZOBWIRLA-PIKOESSRSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2C[C@H](c3ccccc3)C2(C)C)C1 ZINC000464082608 339133681 /nfs/dbraw/zinc/13/36/81/339133681.db2.gz PEAPKWNVMKDVPO-RLLQIKCJSA-N 2 1 314.517 4.279 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000464773422 339152526 /nfs/dbraw/zinc/15/25/26/339152526.db2.gz HERJGENKNNGPSH-KRWDZBQOSA-N 2 1 320.480 4.420 20 0 DIADMP C[N@@H+](CCC1CCCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831336 339155847 /nfs/dbraw/zinc/15/58/47/339155847.db2.gz NSBGMNNCVVGMPV-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCC1CCCC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464831336 339155848 /nfs/dbraw/zinc/15/58/48/339155848.db2.gz NSBGMNNCVVGMPV-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCC1CCCC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464831336 339155849 /nfs/dbraw/zinc/15/58/49/339155849.db2.gz NSBGMNNCVVGMPV-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCc1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000464832245 339155918 /nfs/dbraw/zinc/15/59/18/339155918.db2.gz CUJBTZFDCUVLQW-JOCHJYFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000464832245 339155919 /nfs/dbraw/zinc/15/59/19/339155919.db2.gz CUJBTZFDCUVLQW-JOCHJYFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000464832245 339155920 /nfs/dbraw/zinc/15/59/20/339155920.db2.gz CUJBTZFDCUVLQW-JOCHJYFZSA-N 2 1 322.496 4.203 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000464836038 339156193 /nfs/dbraw/zinc/15/61/93/339156193.db2.gz JBFUTZYGVWWJOG-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cc(C)cc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000464836038 339156194 /nfs/dbraw/zinc/15/61/94/339156194.db2.gz JBFUTZYGVWWJOG-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cc(C)cc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000464836038 339156195 /nfs/dbraw/zinc/15/61/95/339156195.db2.gz JBFUTZYGVWWJOG-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCC[C@H](C)C1 ZINC000466459481 339205908 /nfs/dbraw/zinc/20/59/08/339205908.db2.gz YRFUQDIWOFTXNY-QRNKSROTSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000466459481 339205909 /nfs/dbraw/zinc/20/59/09/339205909.db2.gz YRFUQDIWOFTXNY-QRNKSROTSA-N 2 1 320.443 4.065 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C1CCC2(CCCCC2)CC1 ZINC000466741565 339215253 /nfs/dbraw/zinc/21/52/53/339215253.db2.gz ADRILHQMRNBBME-MRXNPFEDSA-N 2 1 303.494 4.310 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]C1(Cc2ccccc2)CCCCC1 ZINC000467177167 339227433 /nfs/dbraw/zinc/22/74/33/339227433.db2.gz SUVQDPGIGPIWSP-UHFFFAOYSA-N 2 1 311.473 4.117 20 0 DIADMP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]CC[NH+](C(C)C)C(C)C)C1 ZINC000467306454 339230837 /nfs/dbraw/zinc/23/08/37/339230837.db2.gz BDFLVGJGTXCVCC-RTBURBONSA-N 2 1 317.521 4.125 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000467435423 339238513 /nfs/dbraw/zinc/23/85/13/339238513.db2.gz YDQUSKDSGOWTNY-SUDKHIMOSA-N 2 1 324.871 4.043 20 0 DIADMP C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1Cc1cccc2nccn21 ZINC000467550615 339242115 /nfs/dbraw/zinc/24/21/15/339242115.db2.gz LXARIXHXCHMAQJ-AEFFLSMTSA-N 2 1 305.425 4.102 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1ccc(C(F)(F)F)cc1)C(C)C ZINC000467765186 339246229 /nfs/dbraw/zinc/24/62/29/339246229.db2.gz AYCOPXSWVQYPQD-UHFFFAOYSA-N 2 1 316.411 4.304 20 0 DIADMP c1ccc(CC[C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000468357030 339260529 /nfs/dbraw/zinc/26/05/29/339260529.db2.gz ODVPOGKOOWAOIX-WOZUAGRISA-N 2 1 312.501 4.004 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)C[C@@H]1C ZINC000468392714 339261502 /nfs/dbraw/zinc/26/15/02/339261502.db2.gz PCFJQQPEDMVEFJ-LBDPXKHJSA-N 2 1 320.443 4.160 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CC2CCC(C(F)(F)F)CC2)C[C@@H]1C ZINC000468392714 339261503 /nfs/dbraw/zinc/26/15/03/339261503.db2.gz PCFJQQPEDMVEFJ-LBDPXKHJSA-N 2 1 320.443 4.160 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CC2CCC(C(F)(F)F)CC2)C[C@@H]1C ZINC000468392714 339261504 /nfs/dbraw/zinc/26/15/04/339261504.db2.gz PCFJQQPEDMVEFJ-LBDPXKHJSA-N 2 1 320.443 4.160 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468404066 339262101 /nfs/dbraw/zinc/26/21/01/339262101.db2.gz AWMCQEUSGSCCFE-SFHVURJKSA-N 2 1 306.881 4.099 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468404066 339262102 /nfs/dbraw/zinc/26/21/02/339262102.db2.gz AWMCQEUSGSCCFE-SFHVURJKSA-N 2 1 306.881 4.099 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)c1csc(Cl)c1)[NH+]1CCCCC1 ZINC000468794990 339271061 /nfs/dbraw/zinc/27/10/61/339271061.db2.gz CGDFXDHAMMRIEW-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)c1csc(Cl)c1)[NH+]1CCCCC1 ZINC000468794807 339271095 /nfs/dbraw/zinc/27/10/95/339271095.db2.gz CGDFXDHAMMRIEW-CHWSQXEVSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1csc(Cl)c1 ZINC000468847860 339272556 /nfs/dbraw/zinc/27/25/56/339272556.db2.gz GJLQRLMFVQSEGS-GFCCVEGCSA-N 2 1 300.899 4.174 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CCCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC000469158964 339281780 /nfs/dbraw/zinc/28/17/80/339281780.db2.gz WOEVIAQHCDSIAH-YLJYHZDGSA-N 2 1 302.506 4.063 20 0 DIADMP CC(C)c1ccc(CC[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000469349870 339286679 /nfs/dbraw/zinc/28/66/79/339286679.db2.gz ZSZJHRRJDKDFDL-UHFFFAOYSA-N 2 1 302.506 4.157 20 0 DIADMP C[C@@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@@H]1CCC[NH2+]C1 ZINC000469876119 339303454 /nfs/dbraw/zinc/30/34/54/339303454.db2.gz QERHTLHTPJJYNW-FUHWJXTLSA-N 2 1 314.498 4.311 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000470000566 339307886 /nfs/dbraw/zinc/30/78/86/339307886.db2.gz SPSCCHRSXIMPDI-CYBMUJFWSA-N 2 1 320.889 4.110 20 0 DIADMP FC(F)c1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764489 339327038 /nfs/dbraw/zinc/32/70/38/339327038.db2.gz JKQHUYYYAMZHMM-AEFFLSMTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764489 339327039 /nfs/dbraw/zinc/32/70/39/339327039.db2.gz JKQHUYYYAMZHMM-AEFFLSMTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000470764489 339327040 /nfs/dbraw/zinc/32/70/40/339327040.db2.gz JKQHUYYYAMZHMM-AEFFLSMTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000470764489 339327041 /nfs/dbraw/zinc/32/70/41/339327041.db2.gz JKQHUYYYAMZHMM-AEFFLSMTSA-N 2 1 320.427 4.073 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470956892 339332975 /nfs/dbraw/zinc/33/29/75/339332975.db2.gz FCJMJCJTEAZYIO-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470956892 339332973 /nfs/dbraw/zinc/33/29/73/339332973.db2.gz FCJMJCJTEAZYIO-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470956892 339332974 /nfs/dbraw/zinc/33/29/74/339332974.db2.gz FCJMJCJTEAZYIO-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470956892 339332976 /nfs/dbraw/zinc/33/29/76/339332976.db2.gz FCJMJCJTEAZYIO-ZBFHGGJFSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(Cc3ccccc3)CCCCC2)CC[N@H+]1C ZINC000471591816 339348558 /nfs/dbraw/zinc/34/85/58/339348558.db2.gz AIVGKDIHQHKZOO-UYAOXDASSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(Cc2ccccc2)CCCCC1 ZINC000471593999 339348652 /nfs/dbraw/zinc/34/86/52/339348652.db2.gz NVOADCOBCGLGIO-ICSRJNTNSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(Cc2ccccc2)CCCCC1 ZINC000471594001 339348668 /nfs/dbraw/zinc/34/86/68/339348668.db2.gz NVOADCOBCGLGIO-QUCCMNQESA-N 2 1 314.517 4.109 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000472727389 339376519 /nfs/dbraw/zinc/37/65/19/339376519.db2.gz GFGFJFCQMBSSFV-SJLPKXTDSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000472727389 339376520 /nfs/dbraw/zinc/37/65/20/339376520.db2.gz GFGFJFCQMBSSFV-SJLPKXTDSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000472727389 339376521 /nfs/dbraw/zinc/37/65/21/339376521.db2.gz GFGFJFCQMBSSFV-SJLPKXTDSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)CC1 ZINC000473143245 339382684 /nfs/dbraw/zinc/38/26/84/339382684.db2.gz LQSOAAXZWUBIGS-UHFFFAOYSA-N 2 1 313.489 4.091 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)CC1 ZINC000473143245 339382685 /nfs/dbraw/zinc/38/26/85/339382685.db2.gz LQSOAAXZWUBIGS-UHFFFAOYSA-N 2 1 313.489 4.091 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149861 339383047 /nfs/dbraw/zinc/38/30/47/339383047.db2.gz YJWOYDZULYEXMK-CRAIPNDOSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149861 339383048 /nfs/dbraw/zinc/38/30/48/339383048.db2.gz YJWOYDZULYEXMK-CRAIPNDOSA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149861 339383049 /nfs/dbraw/zinc/38/30/49/339383049.db2.gz YJWOYDZULYEXMK-CRAIPNDOSA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C ZINC000473149861 339383050 /nfs/dbraw/zinc/38/30/50/339383050.db2.gz YJWOYDZULYEXMK-CRAIPNDOSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149866 339383133 /nfs/dbraw/zinc/38/31/33/339383133.db2.gz YJWOYDZULYEXMK-YJBOKZPZSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149866 339383134 /nfs/dbraw/zinc/38/31/34/339383134.db2.gz YJWOYDZULYEXMK-YJBOKZPZSA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149866 339383135 /nfs/dbraw/zinc/38/31/35/339383135.db2.gz YJWOYDZULYEXMK-YJBOKZPZSA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149866 339383136 /nfs/dbraw/zinc/38/31/36/339383136.db2.gz YJWOYDZULYEXMK-YJBOKZPZSA-N 2 1 313.489 4.089 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)C1CCC(F)(F)CC1 ZINC000474047169 339398951 /nfs/dbraw/zinc/39/89/51/339398951.db2.gz PEXYVHALPXFUIG-CVEARBPZSA-N 2 1 316.480 4.302 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc(Cl)s1 ZINC000477909410 339504108 /nfs/dbraw/zinc/50/41/08/339504108.db2.gz DHPZWGQOQTVBOD-LBPRGKRZSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc(Cl)s1 ZINC000477909406 339504117 /nfs/dbraw/zinc/50/41/17/339504117.db2.gz DHPZWGQOQTVBOD-GFCCVEGCSA-N 2 1 300.899 4.174 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000480153035 339560805 /nfs/dbraw/zinc/56/08/05/339560805.db2.gz ZWZYILYXHMREBI-RLFYNMQTSA-N 2 1 323.912 4.286 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H](C1CCCCC1)[NH+](C)C ZINC000480219148 339563905 /nfs/dbraw/zinc/56/39/05/339563905.db2.gz CIFDRHULGTVGDZ-DZGCQCFKSA-N 2 1 308.432 4.208 20 0 DIADMP CCC[C@H](C)[C@@H](CC)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000484147369 339681990 /nfs/dbraw/zinc/68/19/90/339681990.db2.gz RXLMHDWNBOAJNQ-FUHWJXTLSA-N 2 1 303.494 4.163 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000484316250 339684836 /nfs/dbraw/zinc/68/48/36/339684836.db2.gz YHDSIACOSSORFB-JENIJYKNSA-N 2 1 320.525 4.015 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000484316253 339684883 /nfs/dbraw/zinc/68/48/83/339684883.db2.gz YHDSIACOSSORFB-ZIFCJYIRSA-N 2 1 320.525 4.015 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c(C)s1 ZINC000498909340 340025472 /nfs/dbraw/zinc/02/54/72/340025472.db2.gz HRLRUDFETYYNMX-GOSISDBHSA-N 2 1 320.546 4.309 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c(C)s1 ZINC000498909340 340025473 /nfs/dbraw/zinc/02/54/73/340025473.db2.gz HRLRUDFETYYNMX-GOSISDBHSA-N 2 1 320.546 4.309 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000498928801 340026309 /nfs/dbraw/zinc/02/63/09/340026309.db2.gz JOCHOIQWCUZRGU-CVEARBPZSA-N 2 1 306.453 4.219 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499143299 340031039 /nfs/dbraw/zinc/03/10/39/340031039.db2.gz SZCYOCOQTWQIPV-JFHUYLGKSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000499149248 340031174 /nfs/dbraw/zinc/03/11/74/340031174.db2.gz SSQNDJQVROLEAC-PPQDBTBKSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499247581 340033120 /nfs/dbraw/zinc/03/31/20/340033120.db2.gz VWRLHOJUUKMUIQ-YMQHIKHWSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCNc1cc[nH+]c2cc(F)ccc12 ZINC000500439660 340058748 /nfs/dbraw/zinc/05/87/48/340058748.db2.gz HDPGUZGPJZEWET-AWEZNQCLSA-N 2 1 301.409 4.050 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCNc1cc[nH+]c2cc(F)ccc12 ZINC000500439662 340058796 /nfs/dbraw/zinc/05/87/96/340058796.db2.gz HDPGUZGPJZEWET-CQSZACIVSA-N 2 1 301.409 4.050 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCCNc2cc[nH+]c3cc(F)ccc23)C1 ZINC000500472639 340059931 /nfs/dbraw/zinc/05/99/31/340059931.db2.gz XXAZUQYYVRVHKS-OAHLLOKOSA-N 2 1 315.436 4.298 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc(Cl)s2)C1 ZINC000500563608 340062376 /nfs/dbraw/zinc/06/23/76/340062376.db2.gz YGEIMJJATZMZGS-OKILXGFUSA-N 2 1 314.926 4.249 20 0 DIADMP C(C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006800 340072084 /nfs/dbraw/zinc/07/20/84/340072084.db2.gz KJFCWGUFLUQDGC-APWZRJJASA-N 2 1 322.562 4.001 20 0 DIADMP C(C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006800 340072085 /nfs/dbraw/zinc/07/20/85/340072085.db2.gz KJFCWGUFLUQDGC-APWZRJJASA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006800 340072086 /nfs/dbraw/zinc/07/20/86/340072086.db2.gz KJFCWGUFLUQDGC-APWZRJJASA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006800 340072087 /nfs/dbraw/zinc/07/20/87/340072087.db2.gz KJFCWGUFLUQDGC-APWZRJJASA-N 2 1 322.562 4.001 20 0 DIADMP Cc1ccccc1[C@@H](C)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501067566 340073662 /nfs/dbraw/zinc/07/36/62/340073662.db2.gz JALRFYDFCZCUFJ-GOSISDBHSA-N 2 1 323.484 4.299 20 0 DIADMP C[C@]12C[C@H]1CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000502257992 340097963 /nfs/dbraw/zinc/09/79/63/340097963.db2.gz TUCUPTNXVPAZAQ-GLEIMRJVSA-N 2 1 324.512 4.350 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)CC[N@@H+]1Cc1ccccc1 ZINC000502267785 340098201 /nfs/dbraw/zinc/09/82/01/340098201.db2.gz JURQZAXUEJCBHD-MLZLACJZSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)CC[N@H+]1Cc1ccccc1 ZINC000502267785 340098202 /nfs/dbraw/zinc/09/82/02/340098202.db2.gz JURQZAXUEJCBHD-MLZLACJZSA-N 2 1 312.501 4.208 20 0 DIADMP Cc1cc([C@H](C)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476751 340105325 /nfs/dbraw/zinc/10/53/25/340105325.db2.gz YUJSEDINBYZPEV-HLLBOEOZSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)oc1C ZINC000502476751 340105326 /nfs/dbraw/zinc/10/53/26/340105326.db2.gz YUJSEDINBYZPEV-HLLBOEOZSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476751 340105327 /nfs/dbraw/zinc/10/53/27/340105327.db2.gz YUJSEDINBYZPEV-HLLBOEOZSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476753 340105331 /nfs/dbraw/zinc/10/53/31/340105331.db2.gz YUJSEDINBYZPEV-VYDXJSESSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)oc1C ZINC000502476753 340105332 /nfs/dbraw/zinc/10/53/32/340105332.db2.gz YUJSEDINBYZPEV-VYDXJSESSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476753 340105333 /nfs/dbraw/zinc/10/53/33/340105333.db2.gz YUJSEDINBYZPEV-VYDXJSESSA-N 2 1 304.478 4.200 20 0 DIADMP CC[C@H]1C[C@]1([NH2+]CCCCn1cc[nH+]c1C)c1cccc(C)c1 ZINC000502514868 340106579 /nfs/dbraw/zinc/10/65/79/340106579.db2.gz XDPWRVPNDZCVDP-AZUAARDMSA-N 2 1 311.473 4.195 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1CC[C@H]1CCC[NH+]1C ZINC000502693373 340110690 /nfs/dbraw/zinc/11/06/90/340110690.db2.gz HYRRMAQKQHQDRX-VAMGGRTRSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[NH+]1CC[C@H]1CCC[N@@H+]1C ZINC000502693373 340110691 /nfs/dbraw/zinc/11/06/91/340110691.db2.gz HYRRMAQKQHQDRX-VAMGGRTRSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[NH+]1CC[C@H]1CCC[N@H+]1C ZINC000502693373 340110692 /nfs/dbraw/zinc/11/06/92/340110692.db2.gz HYRRMAQKQHQDRX-VAMGGRTRSA-N 2 1 300.490 4.129 20 0 DIADMP CCCC[N@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1F ZINC000502691473 340110737 /nfs/dbraw/zinc/11/07/37/340110737.db2.gz JJKZWJYMTBHAGJ-UHFFFAOYSA-N 2 1 317.452 4.413 20 0 DIADMP CCCC[N@@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1F ZINC000502691473 340110738 /nfs/dbraw/zinc/11/07/38/340110738.db2.gz JJKZWJYMTBHAGJ-UHFFFAOYSA-N 2 1 317.452 4.413 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC[C@H]1CCC[NH+]1C ZINC000502703031 340111472 /nfs/dbraw/zinc/11/14/72/340111472.db2.gz UPTXRQXOIJPLEG-CZUORRHYSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccc(Cl)c(Cl)c2)C[C@@H]1n1ccnc1 ZINC000503063490 340120048 /nfs/dbraw/zinc/12/00/48/340120048.db2.gz MVUHJHPGPQHIGX-WBMJQRKESA-N 2 1 324.255 4.273 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C[C@@H]1n1ccnc1 ZINC000503063490 340120049 /nfs/dbraw/zinc/12/00/49/340120049.db2.gz MVUHJHPGPQHIGX-WBMJQRKESA-N 2 1 324.255 4.273 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2ccccc2)C(C)(C)C1 ZINC000503096410 340120953 /nfs/dbraw/zinc/12/09/53/340120953.db2.gz QQDDDYSTTANNCF-IBGZPJMESA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2ccccc2)C(C)(C)C1 ZINC000503096410 340120954 /nfs/dbraw/zinc/12/09/54/340120954.db2.gz QQDDDYSTTANNCF-IBGZPJMESA-N 2 1 311.473 4.097 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H]3C[C@@H]3c3ccccc3)CC2)cc1 ZINC000503240230 340123764 /nfs/dbraw/zinc/12/37/64/340123764.db2.gz FTJPUGWSAQOBCK-IFMALSPDSA-N 2 1 320.480 4.044 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000503370048 340126508 /nfs/dbraw/zinc/12/65/08/340126508.db2.gz DNZANBUJKBUXJT-KSSFIOAISA-N 2 1 317.864 4.150 20 0 DIADMP CCc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C(C)C)cc1 ZINC000506127771 340186474 /nfs/dbraw/zinc/18/64/74/340186474.db2.gz TYVNRGSLTHIOIL-XUVXKRRUSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476027 340195238 /nfs/dbraw/zinc/19/52/38/340195238.db2.gz ZXNWTSMERIFAPW-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476027 340195239 /nfs/dbraw/zinc/19/52/39/340195239.db2.gz ZXNWTSMERIFAPW-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1cccc(F)c1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506476027 340195240 /nfs/dbraw/zinc/19/52/40/340195240.db2.gz ZXNWTSMERIFAPW-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1cccc(F)c1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506476027 340195241 /nfs/dbraw/zinc/19/52/41/340195241.db2.gz ZXNWTSMERIFAPW-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473441 340195289 /nfs/dbraw/zinc/19/52/89/340195289.db2.gz IXSADCWJCYKNJW-YJBOKZPZSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473441 340195290 /nfs/dbraw/zinc/19/52/90/340195290.db2.gz IXSADCWJCYKNJW-YJBOKZPZSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473441 340195291 /nfs/dbraw/zinc/19/52/91/340195291.db2.gz IXSADCWJCYKNJW-YJBOKZPZSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473441 340195292 /nfs/dbraw/zinc/19/52/92/340195292.db2.gz IXSADCWJCYKNJW-YJBOKZPZSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473438 340195298 /nfs/dbraw/zinc/19/52/98/340195298.db2.gz IXSADCWJCYKNJW-CRAIPNDOSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473438 340195299 /nfs/dbraw/zinc/19/52/99/340195299.db2.gz IXSADCWJCYKNJW-CRAIPNDOSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473438 340195300 /nfs/dbraw/zinc/19/53/00/340195300.db2.gz IXSADCWJCYKNJW-CRAIPNDOSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c(C)s1 ZINC000506473438 340195301 /nfs/dbraw/zinc/19/53/01/340195301.db2.gz IXSADCWJCYKNJW-CRAIPNDOSA-N 2 1 320.546 4.451 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc3cc[nH]c32)CC1 ZINC000506878595 340203091 /nfs/dbraw/zinc/20/30/91/340203091.db2.gz ZSCVGVFLQMHWJN-UHFFFAOYSA-N 2 1 313.489 4.112 20 0 DIADMP CCc1cccnc1[C@@H](C)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000507485112 340222178 /nfs/dbraw/zinc/22/21/78/340222178.db2.gz KTMCVRVDJRUNTM-FGTMMUONSA-N 2 1 317.521 4.053 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000507533094 340224687 /nfs/dbraw/zinc/22/46/87/340224687.db2.gz SVFXFAUKGYTLOE-OALUTQOASA-N 2 1 324.553 4.072 20 0 DIADMP CC(C)C[C@@H](C)C[C@@H](C)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000507533100 340224692 /nfs/dbraw/zinc/22/46/92/340224692.db2.gz SVFXFAUKGYTLOE-RTBURBONSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1cccc(CC[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508711784 340251331 /nfs/dbraw/zinc/25/13/31/340251331.db2.gz PEJUFHLPHGOLLH-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508711790 340251374 /nfs/dbraw/zinc/25/13/74/340251374.db2.gz PEJUFHLPHGOLLH-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000508720379 340251495 /nfs/dbraw/zinc/25/14/95/340251495.db2.gz RIWADGFUYNTLAC-NEWSRXKRSA-N 2 1 302.506 4.311 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665837 340276268 /nfs/dbraw/zinc/27/62/68/340276268.db2.gz LXVANEPNBMVMMU-UKRRQHHQSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665837 340276269 /nfs/dbraw/zinc/27/62/69/340276269.db2.gz LXVANEPNBMVMMU-UKRRQHHQSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665837 340276270 /nfs/dbraw/zinc/27/62/70/340276270.db2.gz LXVANEPNBMVMMU-UKRRQHHQSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665837 340276271 /nfs/dbraw/zinc/27/62/71/340276271.db2.gz LXVANEPNBMVMMU-UKRRQHHQSA-N 2 1 314.395 4.010 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC000509956828 340283796 /nfs/dbraw/zinc/28/37/96/340283796.db2.gz JBALPZRVGJHPQI-NSISKUIASA-N 2 1 311.473 4.144 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC000509956826 340283864 /nfs/dbraw/zinc/28/38/64/340283864.db2.gz JBALPZRVGJHPQI-LSTHTHJFSA-N 2 1 311.473 4.144 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000510122125 340289642 /nfs/dbraw/zinc/28/96/42/340289642.db2.gz SOXNWNCXDNINDC-IBGZPJMESA-N 2 1 322.496 4.140 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000510467118 340300343 /nfs/dbraw/zinc/30/03/43/340300343.db2.gz GPYFTOBLTJSSRO-UHFFFAOYSA-N 2 1 315.288 4.300 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000510467118 340300344 /nfs/dbraw/zinc/30/03/44/340300344.db2.gz GPYFTOBLTJSSRO-UHFFFAOYSA-N 2 1 315.288 4.300 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCC[C@H]2CCCF)C1 ZINC000510694892 340307088 /nfs/dbraw/zinc/30/70/88/340307088.db2.gz LTGPMOPUMYRITH-ZSYWTGECSA-N 2 1 312.517 4.253 20 0 DIADMP Cc1cccc([C@H]([NH2+]CC2=CC[N@@H+](C)CC2)c2cccc(F)c2)c1 ZINC000510704638 340307366 /nfs/dbraw/zinc/30/73/66/340307366.db2.gz OHZGYEJWGWNIKL-NRFANRHFSA-N 2 1 324.443 4.075 20 0 DIADMP Cc1cccc([C@@H]([NH2+]CC2=CC[N@@H+](C)CC2)c2cccc(F)c2)c1 ZINC000510704640 340307381 /nfs/dbraw/zinc/30/73/81/340307381.db2.gz OHZGYEJWGWNIKL-OAQYLSRUSA-N 2 1 324.443 4.075 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000510737014 340308864 /nfs/dbraw/zinc/30/88/64/340308864.db2.gz QYIFPUXPBQJAHX-WOJBJXKFSA-N 2 1 300.490 4.195 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2CCCF)c1 ZINC000510738306 340308892 /nfs/dbraw/zinc/30/88/92/340308892.db2.gz UTQWNQLKFLJHTJ-RBUKOAKNSA-N 2 1 306.469 4.146 20 0 DIADMP C(=C/c1ccccc1)\C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303176528 340309595 /nfs/dbraw/zinc/30/95/95/340309595.db2.gz JQFRCPPYPZQWSA-HSRJRILOSA-N 2 1 312.501 4.288 20 0 DIADMP C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303176528 340309596 /nfs/dbraw/zinc/30/95/96/340309596.db2.gz JQFRCPPYPZQWSA-HSRJRILOSA-N 2 1 312.501 4.288 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000510755197 340309896 /nfs/dbraw/zinc/30/98/96/340309896.db2.gz VTXZYSJXQHMRMM-RZXSNQJFSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000510755197 340309897 /nfs/dbraw/zinc/30/98/97/340309897.db2.gz VTXZYSJXQHMRMM-RZXSNQJFSA-N 2 1 312.501 4.065 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC000511001242 340317757 /nfs/dbraw/zinc/31/77/57/340317757.db2.gz QPSFWEIKBNSNGR-HXUWFJFHSA-N 2 1 311.473 4.493 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000511132128 340321925 /nfs/dbraw/zinc/32/19/25/340321925.db2.gz RNGJWGYWNQLQEX-APWZRJJASA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000511132128 340321926 /nfs/dbraw/zinc/32/19/26/340321926.db2.gz RNGJWGYWNQLQEX-APWZRJJASA-N 2 1 320.546 4.349 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(SC(C)C)cc2)[C@H](C)C1 ZINC000511132128 340321927 /nfs/dbraw/zinc/32/19/27/340321927.db2.gz RNGJWGYWNQLQEX-APWZRJJASA-N 2 1 320.546 4.349 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000511149260 340322440 /nfs/dbraw/zinc/32/24/40/340322440.db2.gz FQNSVWKAHGALOL-DOTOQJQBSA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000511149260 340322441 /nfs/dbraw/zinc/32/24/41/340322441.db2.gz FQNSVWKAHGALOL-DOTOQJQBSA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000511149260 340322442 /nfs/dbraw/zinc/32/24/42/340322442.db2.gz FQNSVWKAHGALOL-DOTOQJQBSA-N 2 1 306.519 4.102 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000511896141 340342211 /nfs/dbraw/zinc/34/22/11/340342211.db2.gz ZXAJMWKZRJYIJJ-PWRODBHTSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000511896141 340342212 /nfs/dbraw/zinc/34/22/12/340342212.db2.gz ZXAJMWKZRJYIJJ-PWRODBHTSA-N 2 1 323.484 4.240 20 0 DIADMP CC(C)CC[C@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C(C)(C)C ZINC000512038140 340346335 /nfs/dbraw/zinc/34/63/35/340346335.db2.gz IRCIXTFWLYNLRW-HNNXBMFYSA-N 2 1 311.539 4.145 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)s1 ZINC000512170632 340350828 /nfs/dbraw/zinc/35/08/28/340350828.db2.gz STDIXDYKYDSVSW-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)s1 ZINC000512170632 340350829 /nfs/dbraw/zinc/35/08/29/340350829.db2.gz STDIXDYKYDSVSW-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)s1 ZINC000512170632 340350830 /nfs/dbraw/zinc/35/08/30/340350830.db2.gz STDIXDYKYDSVSW-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)s1 ZINC000512170632 340350831 /nfs/dbraw/zinc/35/08/31/340350831.db2.gz STDIXDYKYDSVSW-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000512212671 340352469 /nfs/dbraw/zinc/35/24/69/340352469.db2.gz OBMYVIUSZGJFMR-SJORKVTESA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000512212671 340352470 /nfs/dbraw/zinc/35/24/70/340352470.db2.gz OBMYVIUSZGJFMR-SJORKVTESA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000512212671 340352471 /nfs/dbraw/zinc/35/24/71/340352471.db2.gz OBMYVIUSZGJFMR-SJORKVTESA-N 2 1 306.519 4.143 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512316489 340356537 /nfs/dbraw/zinc/35/65/37/340356537.db2.gz ZKKPTLDHDPZVAK-FIKGOQFSSA-N 2 1 312.501 4.225 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CC2 ZINC000512317530 340356798 /nfs/dbraw/zinc/35/67/98/340356798.db2.gz CPZPGAMVEBNJFP-HGHGUNKESA-N 2 1 312.501 4.225 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512334074 340357607 /nfs/dbraw/zinc/35/76/07/340357607.db2.gz ZIGZWMDTWRRKES-AVYPCKFXSA-N 2 1 316.464 4.056 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173908667 340377389 /nfs/dbraw/zinc/37/73/89/340377389.db2.gz ZJFXHCXOWBLTIP-UONOGXRCSA-N 2 1 314.395 4.040 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173908667 340377387 /nfs/dbraw/zinc/37/73/87/340377387.db2.gz ZJFXHCXOWBLTIP-UONOGXRCSA-N 2 1 314.395 4.040 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173908667 340377388 /nfs/dbraw/zinc/37/73/88/340377388.db2.gz ZJFXHCXOWBLTIP-UONOGXRCSA-N 2 1 314.395 4.040 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2csc(Cl)c2)CC1 ZINC000191155970 340550696 /nfs/dbraw/zinc/55/06/96/340550696.db2.gz ZWEVTPMRIWNSFC-GFCCVEGCSA-N 2 1 300.899 4.173 20 0 DIADMP CC[C@H](C)C[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237118717 340668201 /nfs/dbraw/zinc/66/82/01/340668201.db2.gz XFRPXLOPYGHBFL-ZWKOTPCHSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000237534167 340671984 /nfs/dbraw/zinc/67/19/84/340671984.db2.gz DVOWEMRHWZRVLO-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)C2CC(F)(F)C2)CC1 ZINC000529550898 340762534 /nfs/dbraw/zinc/76/25/34/340762534.db2.gz QOGYNTSMMLGVGD-LSDHHAIUSA-N 2 1 322.443 4.235 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(F)cc1Cl ZINC000037232528 340777517 /nfs/dbraw/zinc/77/75/17/340777517.db2.gz XMIPJJOHCKJYMX-LLVKDONJSA-N 2 1 312.860 4.439 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC000539508970 340888587 /nfs/dbraw/zinc/88/85/87/340888587.db2.gz DXEOLHFTVCTYEK-SJORKVTESA-N 2 1 313.489 4.174 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1Cl ZINC000542488258 341009964 /nfs/dbraw/zinc/00/99/64/341009964.db2.gz GNIFFKYZVDJCCV-CABCVRRESA-N 2 1 324.896 4.264 20 0 DIADMP Cc1cccc(CCC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000542529543 341012322 /nfs/dbraw/zinc/01/23/22/341012322.db2.gz IYVRVQVQTRJONI-UYAOXDASSA-N 2 1 314.517 4.170 20 0 DIADMP Cc1cccc(CCC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000542529541 341012369 /nfs/dbraw/zinc/01/23/69/341012369.db2.gz IYVRVQVQTRJONI-ICSRJNTNSA-N 2 1 314.517 4.170 20 0 DIADMP CC[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(Cl)s1 ZINC000542557139 341013258 /nfs/dbraw/zinc/01/32/58/341013258.db2.gz ZZUBMQVRCUKTES-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP CC[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(Cl)s1 ZINC000542557136 341013370 /nfs/dbraw/zinc/01/33/70/341013370.db2.gz ZZUBMQVRCUKTES-CHWSQXEVSA-N 2 1 300.899 4.317 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668571 341016431 /nfs/dbraw/zinc/01/64/31/341016431.db2.gz MSXBMWMUWJGUOZ-VQIMIIECSA-N 2 1 304.478 4.139 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CCC2)o1 ZINC000542668571 341016432 /nfs/dbraw/zinc/01/64/32/341016432.db2.gz MSXBMWMUWJGUOZ-VQIMIIECSA-N 2 1 304.478 4.139 20 0 DIADMP CCc1cnccc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000542840603 341022886 /nfs/dbraw/zinc/02/28/86/341022886.db2.gz BXRJXFLXMICPOO-MRXNPFEDSA-N 2 1 315.505 4.092 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000543207299 341036899 /nfs/dbraw/zinc/03/68/99/341036899.db2.gz CITABJVYQUMLNS-ZWKOTPCHSA-N 2 1 300.490 4.289 20 0 DIADMP CCC[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cccnc1 ZINC000543609028 341051059 /nfs/dbraw/zinc/05/10/59/341051059.db2.gz TZOASLATYRXTLO-LJQANCHMSA-N 2 1 303.494 4.167 20 0 DIADMP CCC[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cccnc1 ZINC000543609028 341051060 /nfs/dbraw/zinc/05/10/60/341051060.db2.gz TZOASLATYRXTLO-LJQANCHMSA-N 2 1 303.494 4.167 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707157 341054560 /nfs/dbraw/zinc/05/45/60/341054560.db2.gz BYJZGAHKVIXKLK-HNAYVOBHSA-N 2 1 314.473 4.451 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707157 341054561 /nfs/dbraw/zinc/05/45/61/341054561.db2.gz BYJZGAHKVIXKLK-HNAYVOBHSA-N 2 1 314.473 4.451 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)c(F)c1 ZINC000543775009 341058085 /nfs/dbraw/zinc/05/80/85/341058085.db2.gz HDKVZBVIEDTXNL-DNVCBOLYSA-N 2 1 324.459 4.372 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)c(F)c1 ZINC000543775012 341058145 /nfs/dbraw/zinc/05/81/45/341058145.db2.gz HDKVZBVIEDTXNL-KXBFYZLASA-N 2 1 324.459 4.372 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCc2ccsc2)C1 ZINC000543960085 341064197 /nfs/dbraw/zinc/06/41/97/341064197.db2.gz SFCMYOMHOSAAHA-IEBWSBKVSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCc2ccsc2)C1 ZINC000543960085 341064198 /nfs/dbraw/zinc/06/41/98/341064198.db2.gz SFCMYOMHOSAAHA-IEBWSBKVSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCc2ccsc2)C1 ZINC000543960085 341064199 /nfs/dbraw/zinc/06/41/99/341064199.db2.gz SFCMYOMHOSAAHA-IEBWSBKVSA-N 2 1 320.546 4.267 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC[C@H]2CCCCO2)CC1)CC(C)C ZINC000544400686 341080412 /nfs/dbraw/zinc/08/04/12/341080412.db2.gz LDUMJBWVFHHHPI-HXUWFJFHSA-N 2 1 324.553 4.026 20 0 DIADMP Cc1ccccc1C1CC[NH+](CC[C@H]2CCCC[N@@H+]2C)CC1 ZINC000544532092 341085092 /nfs/dbraw/zinc/08/50/92/341085092.db2.gz VRWCUTUHCMWMBM-LJQANCHMSA-N 2 1 300.490 4.049 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568772 341086135 /nfs/dbraw/zinc/08/61/35/341086135.db2.gz ANUFWQNBGDMCNA-VQIMIIECSA-N 2 1 304.478 4.141 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568772 341086136 /nfs/dbraw/zinc/08/61/36/341086136.db2.gz ANUFWQNBGDMCNA-VQIMIIECSA-N 2 1 304.478 4.141 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578318 341086859 /nfs/dbraw/zinc/08/68/59/341086859.db2.gz ZNYLXUROAACWQL-JKSUJKDBSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578318 341086860 /nfs/dbraw/zinc/08/68/60/341086860.db2.gz ZNYLXUROAACWQL-JKSUJKDBSA-N 2 1 314.498 4.408 20 0 DIADMP Cc1ccc2[nH+]ccc(N3CCC(C[N@H+](C)C(C)C)CC3)c2c1 ZINC000544814458 341094560 /nfs/dbraw/zinc/09/45/60/341094560.db2.gz ZQUQVZNIIVZYIC-UHFFFAOYSA-N 2 1 311.473 4.100 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)cc2)c1 ZINC000546164583 341155376 /nfs/dbraw/zinc/15/53/76/341155376.db2.gz FKKZPDJUOOESGZ-DYESRHJHSA-N 2 1 308.469 4.234 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000564319772 341211275 /nfs/dbraw/zinc/21/12/75/341211275.db2.gz YUTARVFEIUWENL-AYBZRNKSSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]([NH2+]C1CCC(F)(F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547827889 341235708 /nfs/dbraw/zinc/23/57/08/341235708.db2.gz XKCBKJBUKKILDY-WBVHZDCISA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154531 341249801 /nfs/dbraw/zinc/24/98/01/341249801.db2.gz ABLJTDIIFPXQCF-IZBJGVDFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]CC1(C2CC2)CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481909 341263165 /nfs/dbraw/zinc/26/31/65/341263165.db2.gz ODKADGBGCHLCJA-HKUYNNGSSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@@H+]1C ZINC000548721907 341270713 /nfs/dbraw/zinc/27/07/13/341270713.db2.gz DAFCTDJJPAMHOK-QUWFBVPJSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000548721907 341270714 /nfs/dbraw/zinc/27/07/14/341270714.db2.gz DAFCTDJJPAMHOK-QUWFBVPJSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721907 341270715 /nfs/dbraw/zinc/27/07/15/341270715.db2.gz DAFCTDJJPAMHOK-QUWFBVPJSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721907 341270716 /nfs/dbraw/zinc/27/07/16/341270716.db2.gz DAFCTDJJPAMHOK-QUWFBVPJSA-N 2 1 314.517 4.375 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000549764284 341302530 /nfs/dbraw/zinc/30/25/30/341302530.db2.gz PCXLHONQNBIYAR-WCQYABFASA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000549764284 341302531 /nfs/dbraw/zinc/30/25/31/341302531.db2.gz PCXLHONQNBIYAR-WCQYABFASA-N 2 1 322.905 4.435 20 0 DIADMP Fc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000245736694 341312458 /nfs/dbraw/zinc/31/24/58/341312458.db2.gz QYPGBAMNWAUNRV-WKCHPHFGSA-N 2 1 324.443 4.111 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550610748 341319320 /nfs/dbraw/zinc/31/93/20/341319320.db2.gz RLWOKSFYOFRFTD-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2)C[C@H]1c1ccccc1 ZINC000550610748 341319321 /nfs/dbraw/zinc/31/93/21/341319321.db2.gz RLWOKSFYOFRFTD-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000550621477 341319818 /nfs/dbraw/zinc/31/98/18/341319818.db2.gz CBPNBLDFCUWAIS-NHCUHLMSSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000550621477 341319819 /nfs/dbraw/zinc/31/98/19/341319819.db2.gz CBPNBLDFCUWAIS-NHCUHLMSSA-N 2 1 308.469 4.229 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665989 341320966 /nfs/dbraw/zinc/32/09/66/341320966.db2.gz SOUZWXKIRGRMHA-LWASTNQWSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665989 341320967 /nfs/dbraw/zinc/32/09/67/341320967.db2.gz SOUZWXKIRGRMHA-LWASTNQWSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665991 341321047 /nfs/dbraw/zinc/32/10/47/341321047.db2.gz SOUZWXKIRGRMHA-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665991 341321048 /nfs/dbraw/zinc/32/10/48/341321048.db2.gz SOUZWXKIRGRMHA-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550700454 341321591 /nfs/dbraw/zinc/32/15/91/341321591.db2.gz JYHGREONGCSFSP-IRLDBZIGSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cccc(C)c1CC[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550700454 341321592 /nfs/dbraw/zinc/32/15/92/341321592.db2.gz JYHGREONGCSFSP-IRLDBZIGSA-N 2 1 322.496 4.271 20 0 DIADMP CC(C)[C@@](C)(Cc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000550919545 341326737 /nfs/dbraw/zinc/32/67/37/341326737.db2.gz SCDKKWUTNKCOFT-ATZDWAIDSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@@](C)(Cc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000550919545 341326738 /nfs/dbraw/zinc/32/67/38/341326738.db2.gz SCDKKWUTNKCOFT-ATZDWAIDSA-N 2 1 322.924 4.370 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)CCCC2)c(C)c1 ZINC000550921562 341326851 /nfs/dbraw/zinc/32/68/51/341326851.db2.gz SHUQADWNEYFZRV-RBUKOAKNSA-N 2 1 314.517 4.188 20 0 DIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551010302 341329142 /nfs/dbraw/zinc/32/91/42/341329142.db2.gz ZRXOXWKIQNTPGD-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551010302 341329143 /nfs/dbraw/zinc/32/91/43/341329143.db2.gz ZRXOXWKIQNTPGD-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C2CCCCC2)C[C@@H]1c1ccccc1 ZINC000551086016 341331209 /nfs/dbraw/zinc/33/12/09/341331209.db2.gz LOIINUSQXGIERH-DOIPELPJSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C2CCCCC2)C[C@@H]1c1ccccc1 ZINC000551086016 341331210 /nfs/dbraw/zinc/33/12/10/341331210.db2.gz LOIINUSQXGIERH-DOIPELPJSA-N 2 1 312.501 4.380 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000551086195 341331217 /nfs/dbraw/zinc/33/12/17/341331217.db2.gz NDVGKVCWDKAETA-OALUTQOASA-N 2 1 300.490 4.382 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000551086195 341331218 /nfs/dbraw/zinc/33/12/18/341331218.db2.gz NDVGKVCWDKAETA-OALUTQOASA-N 2 1 300.490 4.382 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551309937 341338078 /nfs/dbraw/zinc/33/80/78/341338078.db2.gz ZPCLHQQWQWAOKW-WQUXRXDGSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C)cc1Cl ZINC000551529472 341343949 /nfs/dbraw/zinc/34/39/49/341343949.db2.gz CAZFSWPWIBUKEL-UONOGXRCSA-N 2 1 312.885 4.118 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2CC=CCC2)[C@@H]1c1cccs1 ZINC000246488951 341350547 /nfs/dbraw/zinc/35/05/47/341350547.db2.gz AOIGORQUFUMFEQ-JFIYKMOQSA-N 2 1 304.503 4.077 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@@H]2CC=CCC2)[C@@H]1c1cccs1 ZINC000246488951 341350548 /nfs/dbraw/zinc/35/05/48/341350548.db2.gz AOIGORQUFUMFEQ-JFIYKMOQSA-N 2 1 304.503 4.077 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@H]2CC=CCC2)[C@H]1c1cccs1 ZINC000246488975 341350602 /nfs/dbraw/zinc/35/06/02/341350602.db2.gz AOIGORQUFUMFEQ-NUJGCVRESA-N 2 1 304.503 4.077 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@@H]2CC=CCC2)[C@H]1c1cccs1 ZINC000246488975 341350603 /nfs/dbraw/zinc/35/06/03/341350603.db2.gz AOIGORQUFUMFEQ-NUJGCVRESA-N 2 1 304.503 4.077 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccoc1 ZINC000247067511 341360530 /nfs/dbraw/zinc/36/05/30/341360530.db2.gz OCZCCIHRMDKLDO-IAGOWNOFSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248409910 341376937 /nfs/dbraw/zinc/37/69/37/341376937.db2.gz XIBVETZKLCZBTH-UVFQYZLESA-N 2 1 316.464 4.056 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)Cc1ccccc1 ZINC000248595358 341380725 /nfs/dbraw/zinc/38/07/25/341380725.db2.gz SOAFFUZRXIYMSS-BJLQDIEVSA-N 2 1 314.517 4.108 20 0 DIADMP Clc1ccc(C2([NH2+]C3CC[NH+](C4CCCC4)CC3)CC2)cc1 ZINC000554209654 341446652 /nfs/dbraw/zinc/44/66/52/341446652.db2.gz MFRQXMXWGWZHDG-UHFFFAOYSA-N 2 1 318.892 4.326 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cc(F)cc(F)c1 ZINC000157537079 341640046 /nfs/dbraw/zinc/64/00/46/341640046.db2.gz KCGVFKCSTKTHFP-CQSZACIVSA-N 2 1 322.443 4.413 20 0 DIADMP CCC[C@H]([NH2+]CCCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000338008573 521157046 /nfs/dbraw/zinc/15/70/46/521157046.db2.gz PBLAOKLXTHEKAL-KRWDZBQOSA-N 2 1 305.853 4.366 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCCc4ccccc43)CC2)[nH+]c1 ZINC000163522261 524942722 /nfs/dbraw/zinc/94/27/22/524942722.db2.gz VWLIYHGRXYIMNC-HXUWFJFHSA-N 2 1 321.468 4.026 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCCn2cc[nH+]c2C)c2ccccc12 ZINC000338006949 525150025 /nfs/dbraw/zinc/15/00/25/525150025.db2.gz DWVOUXYJPGDLAW-OAHLLOKOSA-N 2 1 323.440 4.094 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC[NH+]2CCCCC2)c2ccsc2S1 ZINC000336826413 525436131 /nfs/dbraw/zinc/43/61/31/525436131.db2.gz OCOADFDDTOEWPT-HIFRSBDPSA-N 2 1 310.532 4.139 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1cccnc1 ZINC000264898270 525521065 /nfs/dbraw/zinc/52/10/65/525521065.db2.gz VGCXFVPZZFQMLI-QZTJIDSGSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1ccc([C@@H]([NH2+]CCCn2cc[nH+]c2C)C2CCCC2)o1 ZINC000338026091 525771986 /nfs/dbraw/zinc/77/19/86/525771986.db2.gz ZNBCEKMDSPUXFH-SFHVURJKSA-N 2 1 301.434 4.004 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)o1 ZINC000158143071 525934661 /nfs/dbraw/zinc/93/46/61/525934661.db2.gz DMYBHOXZQCZOQB-GJZGRUSLSA-N 2 1 309.413 4.494 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)CCCn1cc[nH+]c1C ZINC000127615705 526679900 /nfs/dbraw/zinc/67/99/00/526679900.db2.gz UODJAHKGKVSMJD-AWEZNQCLSA-N 2 1 320.506 4.163 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)CCCn1cc[nH+]c1C ZINC000127615705 526679905 /nfs/dbraw/zinc/67/99/05/526679905.db2.gz UODJAHKGKVSMJD-AWEZNQCLSA-N 2 1 320.506 4.163 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(SC(C)C)cc1 ZINC000338025708 527422029 /nfs/dbraw/zinc/42/20/29/527422029.db2.gz IRTXDFSKTJWVPI-HNNXBMFYSA-N 2 1 317.502 4.433 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000338009259 527422172 /nfs/dbraw/zinc/42/21/72/527422172.db2.gz BSAYIYVRIVTUQL-NSHDSACASA-N 2 1 312.244 4.239 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCc2ccc(C(C)C)cc21 ZINC000338023328 527422200 /nfs/dbraw/zinc/42/22/00/527422200.db2.gz RXRFVECWEFJVLS-FQEVSTJZSA-N 2 1 311.473 4.372 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000338008412 527422728 /nfs/dbraw/zinc/42/27/28/527422728.db2.gz SSRNFAXNAXTTQN-QGZVFWFLSA-N 2 1 303.475 4.164 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000338017684 527422842 /nfs/dbraw/zinc/42/28/42/527422842.db2.gz OOUNOFXPGTUCDQ-NSHDSACASA-N 2 1 312.244 4.239 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000338328766 527431017 /nfs/dbraw/zinc/43/10/17/527431017.db2.gz IWZQZQWEBINMEI-UHFFFAOYSA-N 2 1 323.465 4.133 20 0 DIADMP Cc1cc2ccccc2c(N2CCCC[C@@H]2CC[NH+]2CCCC2)[nH+]1 ZINC001165046868 721973048 /nfs/dbraw/zinc/97/30/48/721973048.db2.gz CKNBIICXLPKVQT-LJQANCHMSA-N 2 1 323.484 4.388 20 0 DIADMP CCCC[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000423298791 1042705635 /nfs/dbraw/zinc/70/56/35/1042705635.db2.gz ANJQNIQDUBAUOY-HNNXBMFYSA-N 2 1 301.261 4.034 20 0 DIADMP CCCCCOc1ccc(C[NH2+]C[C@H]2CC[N@H+](C(C)C)C2)cc1 ZINC000319960746 1035577697 /nfs/dbraw/zinc/57/76/97/1035577697.db2.gz BBBOFWDSKZXBLS-LJQANCHMSA-N 2 1 318.505 4.076 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1F ZINC000643547315 1035604130 /nfs/dbraw/zinc/60/41/30/1035604130.db2.gz CQRMCWOBABUDKS-WFASDCNBSA-N 2 1 310.844 4.195 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(-c2ccccc2)s1 ZINC000530460130 1035622896 /nfs/dbraw/zinc/62/28/96/1035622896.db2.gz GSZUSKDNLGOGRL-AWEZNQCLSA-N 2 1 311.454 4.042 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)C1 ZINC000314916520 1035930217 /nfs/dbraw/zinc/93/02/17/1035930217.db2.gz MLUXUGMOIVXOOP-YZGWKJHDSA-N 2 1 300.490 4.033 20 0 DIADMP Clc1ccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC000037318622 1036020111 /nfs/dbraw/zinc/02/01/11/1036020111.db2.gz ACVPJVRWBGYFHA-GOSISDBHSA-N 2 1 304.865 4.008 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]CC1(C)CCC1 ZINC001648791922 1036059968 /nfs/dbraw/zinc/05/99/68/1036059968.db2.gz FJWDCRWQHMXSIG-KRWDZBQOSA-N 2 1 300.490 4.341 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C[C@@H]2CC=CCC2)C1 ZINC001648792537 1036080375 /nfs/dbraw/zinc/08/03/75/1036080375.db2.gz PTKDOYJVJYPDDU-RBUKOAKNSA-N 2 1 312.501 4.364 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccccc1F ZINC000180713654 1036083024 /nfs/dbraw/zinc/08/30/24/1036083024.db2.gz UYDUIQOQXRXGCP-LJQANCHMSA-N 2 1 304.453 4.273 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001204448454 1036219215 /nfs/dbraw/zinc/21/92/15/1036219215.db2.gz AAYRUWXDDXHVEH-UHFFFAOYSA-N 2 1 322.496 4.436 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccsc1 ZINC000398123898 1036243278 /nfs/dbraw/zinc/24/32/78/1036243278.db2.gz HSWQHDDKVNMQRG-GJYPPUQNSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccsc1 ZINC000398123898 1036243290 /nfs/dbraw/zinc/24/32/90/1036243290.db2.gz HSWQHDDKVNMQRG-GJYPPUQNSA-N 2 1 314.498 4.309 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](CCc1ccccc1F)C1CCCC1 ZINC001167248270 1036317241 /nfs/dbraw/zinc/31/72/41/1036317241.db2.gz KUQYDARMPVOPER-SFHVURJKSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](CCc1ccccc1F)C1CCCC1 ZINC001167248270 1036317262 /nfs/dbraw/zinc/31/72/62/1036317262.db2.gz KUQYDARMPVOPER-SFHVURJKSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](CCc1ccccc1F)C1CCCC1 ZINC001167248270 1036317283 /nfs/dbraw/zinc/31/72/83/1036317283.db2.gz KUQYDARMPVOPER-SFHVURJKSA-N 2 1 318.480 4.097 20 0 DIADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)o1 ZINC000237459741 1036380688 /nfs/dbraw/zinc/38/06/88/1036380688.db2.gz NSMVTUSSRXAKLQ-SOLBZPMBSA-N 2 1 304.478 4.147 20 0 DIADMP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648811682 1036493969 /nfs/dbraw/zinc/49/39/69/1036493969.db2.gz VBKVSEAWMOWSJM-NYUBLWNDSA-N 2 1 314.517 4.443 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648811681 1036494715 /nfs/dbraw/zinc/49/47/15/1036494715.db2.gz VBKVSEAWMOWSJM-IIMDRIAPSA-N 2 1 314.517 4.443 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648811680 1036494902 /nfs/dbraw/zinc/49/49/02/1036494902.db2.gz VBKVSEAWMOWSJM-BMQTXXJKSA-N 2 1 314.517 4.443 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(-c2ccccc2)o1 ZINC000121517968 1036582417 /nfs/dbraw/zinc/58/24/17/1036582417.db2.gz WFSWBLWHKTXKKB-HOTGVXAUSA-N 2 1 323.440 4.438 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCCC2CC2)CC1 ZINC001167306357 1036582444 /nfs/dbraw/zinc/58/24/44/1036582444.db2.gz DFUQHBIXBOOXRI-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@H]2CCCC[C@@H]2C)CC1 ZINC001648826621 1036604426 /nfs/dbraw/zinc/60/44/26/1036604426.db2.gz LVLJRLYAJOVLEJ-PKOBYXMFSA-N 2 1 314.517 4.375 20 0 DIADMP c1cn(-c2ccc(C[N@H+](CC3CC3)C3CCCCC3)cc2)cn1 ZINC001167313196 1036649824 /nfs/dbraw/zinc/64/98/24/1036649824.db2.gz FSQHBJCFJACOKI-UHFFFAOYSA-N 2 1 309.457 4.417 20 0 DIADMP CC(C)C([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)C ZINC000683693044 1036718130 /nfs/dbraw/zinc/71/81/30/1036718130.db2.gz ZQIYIXPNMGVMFA-ACDBMABISA-N 2 1 314.517 4.452 20 0 DIADMP CC(F)(F)CCC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001167326739 1036740435 /nfs/dbraw/zinc/74/04/35/1036740435.db2.gz PURJMUQIJQUVHS-MRXNPFEDSA-N 2 1 302.453 4.010 20 0 DIADMP CC(F)(F)CCC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001167326738 1036740611 /nfs/dbraw/zinc/74/06/11/1036740611.db2.gz PURJMUQIJQUVHS-INIZCTEOSA-N 2 1 302.453 4.010 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[NH2+]1 ZINC001210499517 1036746731 /nfs/dbraw/zinc/74/67/31/1036746731.db2.gz UUTLIHQBJNSBJZ-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[NH2+]1 ZINC001210499517 1036746749 /nfs/dbraw/zinc/74/67/49/1036746749.db2.gz UUTLIHQBJNSBJZ-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447935256 1036747751 /nfs/dbraw/zinc/74/77/51/1036747751.db2.gz FSZWEUHQXPPNEM-HNNXBMFYSA-N 2 1 323.550 4.185 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC(C)(C)C1 ZINC000398014163 1037083631 /nfs/dbraw/zinc/08/36/31/1037083631.db2.gz FJPYLHDIXVHKNN-BHIYHBOVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC(C)(C)C1 ZINC000398014163 1037083638 /nfs/dbraw/zinc/08/36/38/1037083638.db2.gz FJPYLHDIXVHKNN-BHIYHBOVSA-N 2 1 300.490 4.065 20 0 DIADMP CCCC(CCC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398022335 1037084482 /nfs/dbraw/zinc/08/44/82/1037084482.db2.gz KQBBNHXVXALLQB-FXAWDEMLSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC(CCC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398022335 1037084500 /nfs/dbraw/zinc/08/45/00/1037084500.db2.gz KQBBNHXVXALLQB-FXAWDEMLSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCCCCC1 ZINC000398020336 1037085682 /nfs/dbraw/zinc/08/56/82/1037085682.db2.gz JVUXGEFLWVMDQP-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCCCCC1 ZINC000398020336 1037085692 /nfs/dbraw/zinc/08/56/92/1037085692.db2.gz JVUXGEFLWVMDQP-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001167424232 1037226314 /nfs/dbraw/zinc/22/63/14/1037226314.db2.gz FDUZZPJIDIYLKQ-BBWFWOEESA-N 2 1 316.480 4.254 20 0 DIADMP CC[C@H](CC(F)F)C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001167424232 1037226331 /nfs/dbraw/zinc/22/63/31/1037226331.db2.gz FDUZZPJIDIYLKQ-BBWFWOEESA-N 2 1 316.480 4.254 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001167429132 1037244253 /nfs/dbraw/zinc/24/42/53/1037244253.db2.gz GVULMYQIGBNOLG-IBGZPJMESA-N 2 1 322.496 4.456 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398158520 1037244313 /nfs/dbraw/zinc/24/43/13/1037244313.db2.gz FLELBWBAXSOULH-FXAWDEMLSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398158520 1037244317 /nfs/dbraw/zinc/24/43/17/1037244317.db2.gz FLELBWBAXSOULH-FXAWDEMLSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C[C@@H](C)C1 ZINC000398194339 1037278987 /nfs/dbraw/zinc/27/89/87/1037278987.db2.gz NKYXQLXPRCBQML-SQAAOVBZSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C[C@@H](C)C1 ZINC000398194339 1037279005 /nfs/dbraw/zinc/27/90/05/1037279005.db2.gz NKYXQLXPRCBQML-SQAAOVBZSA-N 2 1 314.517 4.311 20 0 DIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(-c4ccccc4)o3)C2)CC1 ZINC000581218094 1037480593 /nfs/dbraw/zinc/48/05/93/1037480593.db2.gz LPSNACDGHIBRAF-LJQANCHMSA-N 2 1 324.468 4.110 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(Cl)cc1C ZINC000581753271 1037968412 /nfs/dbraw/zinc/96/84/12/1037968412.db2.gz QJZAYNJFJDVJOB-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(Cl)cc1C ZINC000581753271 1037968430 /nfs/dbraw/zinc/96/84/30/1037968430.db2.gz QJZAYNJFJDVJOB-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP Cc1ncc([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000090418590 1038114220 /nfs/dbraw/zinc/11/42/20/1038114220.db2.gz YODARWXGXNPQJE-LSDHHAIUSA-N 2 1 317.502 4.013 20 0 DIADMP Cc1ncc([C@@H](C)[NH2+]CC[C@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000090418590 1038114230 /nfs/dbraw/zinc/11/42/30/1038114230.db2.gz YODARWXGXNPQJE-LSDHHAIUSA-N 2 1 317.502 4.013 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000604902874 1038460218 /nfs/dbraw/zinc/46/02/18/1038460218.db2.gz GKLKTWFFZFZKGC-UXHICEINSA-N 2 1 314.517 4.234 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000604885063 1038463267 /nfs/dbraw/zinc/46/32/67/1038463267.db2.gz FFWWUABVLJJYNP-HSALFYBXSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000604885063 1038463269 /nfs/dbraw/zinc/46/32/69/1038463269.db2.gz FFWWUABVLJJYNP-HSALFYBXSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000604885063 1038463273 /nfs/dbraw/zinc/46/32/73/1038463273.db2.gz FFWWUABVLJJYNP-HSALFYBXSA-N 2 1 314.517 4.377 20 0 DIADMP CC(C[NH+](C)Cc1cccs1)C[N@H+](C)Cc1cccs1 ZINC000605572669 1038536275 /nfs/dbraw/zinc/53/62/75/1038536275.db2.gz CYGJXUXZROYOCX-UHFFFAOYSA-N 2 1 308.516 4.010 20 0 DIADMP CC(C[NH+](C)Cc1cccs1)C[N@@H+](C)Cc1cccs1 ZINC000605572669 1038536281 /nfs/dbraw/zinc/53/62/81/1038536281.db2.gz CYGJXUXZROYOCX-UHFFFAOYSA-N 2 1 308.516 4.010 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000657314421 1038555733 /nfs/dbraw/zinc/55/57/33/1038555733.db2.gz VIWKTSWWBVRQPF-QZTJIDSGSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000657314421 1038555738 /nfs/dbraw/zinc/55/57/38/1038555738.db2.gz VIWKTSWWBVRQPF-QZTJIDSGSA-N 2 1 312.482 4.132 20 0 DIADMP CCc1cccc2cc(C[NH2+]CCCCn3cc[nH+]c3C)oc21 ZINC000657374635 1038620742 /nfs/dbraw/zinc/62/07/42/1038620742.db2.gz OTJLLZPKAAJEEI-UHFFFAOYSA-N 2 1 311.429 4.070 20 0 DIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CCC1 ZINC000684836053 1038642445 /nfs/dbraw/zinc/64/24/45/1038642445.db2.gz OZBHOCWLMCIQNS-PBPGXSGUSA-N 2 1 300.490 4.208 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468235177 1038661504 /nfs/dbraw/zinc/66/15/04/1038661504.db2.gz OVKXWAXHNFZCCT-KXBFYZLASA-N 2 1 318.892 4.278 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468235177 1038661508 /nfs/dbraw/zinc/66/15/08/1038661508.db2.gz OVKXWAXHNFZCCT-KXBFYZLASA-N 2 1 318.892 4.278 20 0 DIADMP C[N@H+](Cc1ccc(C(C)(C)C)s1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000582426313 1038664226 /nfs/dbraw/zinc/66/42/26/1038664226.db2.gz JVTSMPCVSBIEMS-YIONKMFJSA-N 2 1 306.519 4.103 20 0 DIADMP C[N@@H+](Cc1ccc(C(C)(C)C)s1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000582426313 1038664230 /nfs/dbraw/zinc/66/42/30/1038664230.db2.gz JVTSMPCVSBIEMS-YIONKMFJSA-N 2 1 306.519 4.103 20 0 DIADMP C[NH+](Cc1ccc(C(C)(C)C)s1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000582426313 1038664234 /nfs/dbraw/zinc/66/42/34/1038664234.db2.gz JVTSMPCVSBIEMS-YIONKMFJSA-N 2 1 306.519 4.103 20 0 DIADMP C[NH+](Cc1ccc(C(C)(C)C)s1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000582426313 1038664238 /nfs/dbraw/zinc/66/42/38/1038664238.db2.gz JVTSMPCVSBIEMS-YIONKMFJSA-N 2 1 306.519 4.103 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC[C@@H]2C[C@H]2C2CC2)CC1)CC1CC1 ZINC001168423289 1038699183 /nfs/dbraw/zinc/69/91/83/1038699183.db2.gz GUZQQGCECFRRJH-RTWAWAEBSA-N 2 1 318.549 4.257 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3cccnc32)c1 ZINC000684954939 1038738988 /nfs/dbraw/zinc/73/89/88/1038738988.db2.gz FGHYAVGYKYTGFH-HXUWFJFHSA-N 2 1 323.484 4.089 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000608061572 1038760822 /nfs/dbraw/zinc/76/08/22/1038760822.db2.gz ZBDFHWPUAVWLRR-CJNGLKHVSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000608061572 1038760831 /nfs/dbraw/zinc/76/08/31/1038760831.db2.gz ZBDFHWPUAVWLRR-CJNGLKHVSA-N 2 1 318.461 4.127 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000342865924 1038934821 /nfs/dbraw/zinc/93/48/21/1038934821.db2.gz XUIROTRKWVGVQJ-GOSISDBHSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000342865924 1038934830 /nfs/dbraw/zinc/93/48/30/1038934830.db2.gz XUIROTRKWVGVQJ-GOSISDBHSA-N 2 1 319.399 4.087 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@]2(C)CC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000657670695 1038981390 /nfs/dbraw/zinc/98/13/90/1038981390.db2.gz NMJTZOOURUQGJZ-NXHRZFHOSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@]2(C)CC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000657670695 1038981404 /nfs/dbraw/zinc/98/14/04/1038981404.db2.gz NMJTZOOURUQGJZ-NXHRZFHOSA-N 2 1 322.443 4.065 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCSCc2ccccc2)C[C@@H]1C ZINC000534138985 1038993772 /nfs/dbraw/zinc/99/37/72/1038993772.db2.gz XKPRSTHLOYXUDK-PKOBYXMFSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCSCc2ccccc2)C[C@@H]1C ZINC000534138985 1038993780 /nfs/dbraw/zinc/99/37/80/1038993780.db2.gz XKPRSTHLOYXUDK-PKOBYXMFSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCSCc2ccccc2)C[C@@H]1C ZINC000534138985 1038993798 /nfs/dbraw/zinc/99/37/98/1038993798.db2.gz XKPRSTHLOYXUDK-PKOBYXMFSA-N 2 1 320.546 4.115 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(Cl)c(F)c1 ZINC000534328986 1039027804 /nfs/dbraw/zinc/02/78/04/1039027804.db2.gz SFKOOTIYWOLZCH-LBPRGKRZSA-N 2 1 310.844 4.147 20 0 DIADMP CC1(C)CC[C@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc21 ZINC000090972743 1039029467 /nfs/dbraw/zinc/02/94/67/1039029467.db2.gz NKJNKMFLBYDKNT-KZNAEPCWSA-N 2 1 312.501 4.058 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH+]2CCC(Cc3ccccc3)CC2)c2ccccc21 ZINC000261618829 1039089057 /nfs/dbraw/zinc/08/90/57/1039089057.db2.gz BWTIBKQWHXCFSB-SFTDATJTSA-N 2 1 306.453 4.086 20 0 DIADMP CSc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCC2 ZINC000647281206 1039220984 /nfs/dbraw/zinc/22/09/84/1039220984.db2.gz BSMCONAQPXLFQM-IBGZPJMESA-N 2 1 316.514 4.002 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]3CCC(C)(C)c4cccc2c43)CC[N@@H+]1C ZINC000539558569 1039288817 /nfs/dbraw/zinc/28/88/17/1039288817.db2.gz KOBOZIKTTJWHMK-NNFUDEMPSA-N 2 1 312.501 4.359 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]3CCC(C)(C)c4cccc2c43)CC[N@H+]1C ZINC000539558569 1039288821 /nfs/dbraw/zinc/28/88/21/1039288821.db2.gz KOBOZIKTTJWHMK-NNFUDEMPSA-N 2 1 312.501 4.359 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756774 1039306669 /nfs/dbraw/zinc/30/66/69/1039306669.db2.gz IIOVFXRCUQXRQD-WOJBJXKFSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756774 1039306685 /nfs/dbraw/zinc/30/66/85/1039306685.db2.gz IIOVFXRCUQXRQD-WOJBJXKFSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2cccs2)CC1 ZINC000539824347 1039340031 /nfs/dbraw/zinc/34/00/31/1039340031.db2.gz AAOLMKSPANNZOC-INIZCTEOSA-N 2 1 306.519 4.225 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC000539849837 1039369117 /nfs/dbraw/zinc/36/91/17/1039369117.db2.gz NNUFWFLRNRHWKX-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000539849837 1039369136 /nfs/dbraw/zinc/36/91/36/1039369136.db2.gz NNUFWFLRNRHWKX-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2cccs2)CC1)CC1CC1 ZINC000539957957 1039396666 /nfs/dbraw/zinc/39/66/66/1039396666.db2.gz VVRALWSPZGDKSN-UHFFFAOYSA-N 2 1 306.519 4.082 20 0 DIADMP Cc1cnc([C@H](C)[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)o1 ZINC000540052838 1039410643 /nfs/dbraw/zinc/41/06/43/1039410643.db2.gz KQKFQJRPQQTPCF-WBVHZDCISA-N 2 1 319.493 4.021 20 0 DIADMP Cc1cnc([C@H](C)[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)o1 ZINC000540052838 1039410651 /nfs/dbraw/zinc/41/06/51/1039410651.db2.gz KQKFQJRPQQTPCF-WBVHZDCISA-N 2 1 319.493 4.021 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000540261590 1039464495 /nfs/dbraw/zinc/46/44/95/1039464495.db2.gz JHORQZNOTKANCE-KBXCAEBGSA-N 2 1 306.881 4.111 20 0 DIADMP CCC[C@@H](C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000540507357 1039507197 /nfs/dbraw/zinc/50/71/97/1039507197.db2.gz MYHPOIZGLIARIM-IBGZPJMESA-N 2 1 302.506 4.375 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C ZINC000540521477 1039510007 /nfs/dbraw/zinc/51/00/07/1039510007.db2.gz RHFWTQKAQHQZNE-DOPJRALCSA-N 2 1 317.864 4.222 20 0 DIADMP CCc1ccc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)o1 ZINC000151219192 1039515859 /nfs/dbraw/zinc/51/58/59/1039515859.db2.gz IREOCEDEYZDOJB-CQSZACIVSA-N 2 1 309.413 4.187 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000540609086 1039528031 /nfs/dbraw/zinc/52/80/31/1039528031.db2.gz XFLKVMNITFNTBF-KRWDZBQOSA-N 2 1 312.482 4.130 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCc3ccccc32)C[C@H]1c1ccccc1 ZINC000584060192 1039586115 /nfs/dbraw/zinc/58/61/15/1039586115.db2.gz PICHGEWJPWVZGB-ONTIZHBOSA-N 2 1 320.480 4.142 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCc3ccccc32)C[C@H]1c1ccccc1 ZINC000584060192 1039586133 /nfs/dbraw/zinc/58/61/33/1039586133.db2.gz PICHGEWJPWVZGB-ONTIZHBOSA-N 2 1 320.480 4.142 20 0 DIADMP c1cc2cc[nH+]cc2c(NC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000540984417 1039603189 /nfs/dbraw/zinc/60/31/89/1039603189.db2.gz BJQIQCVXLALXJK-UHFFFAOYSA-N 2 1 309.457 4.444 20 0 DIADMP Cc1ccccc1CCC[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541601902 1039716366 /nfs/dbraw/zinc/71/63/66/1039716366.db2.gz VWESNWHALOUMTI-AZUAARDMSA-N 2 1 314.517 4.170 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081633843 1039724609 /nfs/dbraw/zinc/72/46/09/1039724609.db2.gz FCJMJCJTEAZYIO-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081633843 1039724625 /nfs/dbraw/zinc/72/46/25/1039724625.db2.gz FCJMJCJTEAZYIO-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000081633843 1039724640 /nfs/dbraw/zinc/72/46/40/1039724640.db2.gz FCJMJCJTEAZYIO-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081633843 1039724656 /nfs/dbraw/zinc/72/46/56/1039724656.db2.gz FCJMJCJTEAZYIO-GDBMZVCRSA-N 2 1 306.881 4.065 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccnc1 ZINC000541744396 1039737584 /nfs/dbraw/zinc/73/75/84/1039737584.db2.gz HDWILKBWFRQOMR-WSTZPKSXSA-N 2 1 317.521 4.271 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)C(C)(C)C(F)F)c1 ZINC000657858036 1039761224 /nfs/dbraw/zinc/76/12/24/1039761224.db2.gz WFBFUJINVMCAEA-AWEZNQCLSA-N 2 1 312.448 4.296 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000657859182 1039772792 /nfs/dbraw/zinc/77/27/92/1039772792.db2.gz QLHCECJGAUUQCV-NVXWUHKLSA-N 2 1 324.459 4.168 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCc2ccsc2)CC1 ZINC000542090913 1039790320 /nfs/dbraw/zinc/79/03/20/1039790320.db2.gz PVTSPCGIVADNQL-UHFFFAOYSA-N 2 1 308.535 4.125 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc3cnccc3o2)c1 ZINC000657872923 1039965968 /nfs/dbraw/zinc/96/59/68/1039965968.db2.gz UMSKJJGNSZMUTK-HNNXBMFYSA-N 2 1 323.440 4.130 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21)c1cccc(OC(F)F)c1 ZINC000261883968 1039984529 /nfs/dbraw/zinc/98/45/29/1039984529.db2.gz MWSOBKLSHWOMFQ-JECHBYEQSA-N 2 1 318.367 4.083 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCSCC2)[C@@H]1c1cccs1 ZINC000657886382 1039995219 /nfs/dbraw/zinc/99/52/19/1039995219.db2.gz FJJHPQMQAZNKPF-HLLBOEOZSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCSCC2)[C@@H]1c1cccs1 ZINC000657886382 1039995239 /nfs/dbraw/zinc/99/52/39/1039995239.db2.gz FJJHPQMQAZNKPF-HLLBOEOZSA-N 2 1 324.559 4.006 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCSCC2)CC1 ZINC000657890628 1040039645 /nfs/dbraw/zinc/03/96/45/1040039645.db2.gz WFHURZDIOINQOU-WMZOPIPTSA-N 2 1 318.530 4.087 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000685424835 1040040063 /nfs/dbraw/zinc/04/00/63/1040040063.db2.gz HNCHWTIBNANQKX-XYJFISCASA-N 2 1 308.535 4.403 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000685424835 1040040075 /nfs/dbraw/zinc/04/00/75/1040040075.db2.gz HNCHWTIBNANQKX-XYJFISCASA-N 2 1 308.535 4.403 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000685424833 1040041157 /nfs/dbraw/zinc/04/11/57/1040041157.db2.gz HNCHWTIBNANQKX-JZXOWHBKSA-N 2 1 308.535 4.403 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000685424833 1040041168 /nfs/dbraw/zinc/04/11/68/1040041168.db2.gz HNCHWTIBNANQKX-JZXOWHBKSA-N 2 1 308.535 4.403 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000685443149 1040049394 /nfs/dbraw/zinc/04/93/94/1040049394.db2.gz QTOGOUVLCVWCFC-MQEZQYLSSA-N 2 1 314.517 4.373 20 0 DIADMP CC(C)C[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000685443149 1040049412 /nfs/dbraw/zinc/04/94/12/1040049412.db2.gz QTOGOUVLCVWCFC-MQEZQYLSSA-N 2 1 314.517 4.373 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccccc1C1CC1 ZINC000685462744 1040064303 /nfs/dbraw/zinc/06/43/03/1040064303.db2.gz JSFBZQDRRINTQC-UHFFFAOYSA-N 2 1 311.473 4.235 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccccc1C1CC1 ZINC000685462744 1040064320 /nfs/dbraw/zinc/06/43/20/1040064320.db2.gz JSFBZQDRRINTQC-UHFFFAOYSA-N 2 1 311.473 4.235 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]C2CCC(c3ccc(F)cc3)CC2)[C@@H](C)C1 ZINC000493078443 1040078896 /nfs/dbraw/zinc/07/88/96/1040078896.db2.gz JKVZKSMRGHXWLV-NZJQCLFZSA-N 2 1 318.480 4.172 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]C2CCC(c3ccc(F)cc3)CC2)[C@H](C)C1 ZINC000493078441 1040079262 /nfs/dbraw/zinc/07/92/62/1040079262.db2.gz JKVZKSMRGHXWLV-CRBUXINTSA-N 2 1 318.480 4.172 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000708571425 1040088317 /nfs/dbraw/zinc/08/83/17/1040088317.db2.gz SKUXVAXCAWQVMB-SQAAOVBZSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309920835 1040099748 /nfs/dbraw/zinc/09/97/48/1040099748.db2.gz QQECRDPRORAZAK-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309885439 1040100545 /nfs/dbraw/zinc/10/05/45/1040100545.db2.gz YVJCVHWPTQXCSY-YZGWKJHDSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H](CC1CC1)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000309967466 1040102554 /nfs/dbraw/zinc/10/25/54/1040102554.db2.gz LTDOGYFNQAYQBY-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310080403 1040107181 /nfs/dbraw/zinc/10/71/81/1040107181.db2.gz IUPZTYZXKGEZJJ-FCHUYYIVSA-N 2 1 322.496 4.119 20 0 DIADMP c1oc2ccccc2c1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000310244667 1040115050 /nfs/dbraw/zinc/11/50/50/1040115050.db2.gz CJCSBGMXFBFSNY-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1nccc2ccccc21 ZINC000685647662 1040183038 /nfs/dbraw/zinc/18/30/38/1040183038.db2.gz PMJJLDRCSSHQNP-QAPCUYQASA-N 2 1 313.489 4.252 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000165352693 1040202942 /nfs/dbraw/zinc/20/29/42/1040202942.db2.gz XKMOJVSEIJLKGY-HLLBOEOZSA-N 2 1 306.519 4.320 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000165352693 1040202957 /nfs/dbraw/zinc/20/29/57/1040202957.db2.gz XKMOJVSEIJLKGY-HLLBOEOZSA-N 2 1 306.519 4.320 20 0 DIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000309712036 1040210945 /nfs/dbraw/zinc/21/09/45/1040210945.db2.gz JQVXIZNJXFFEGY-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccc(C[N@@H+](CCCCn2cc[nH+]c2C)C(C)C)s1 ZINC000125482934 1040212461 /nfs/dbraw/zinc/21/24/61/1040212461.db2.gz BPZDXVUMIYRZNT-UHFFFAOYSA-N 2 1 305.491 4.252 20 0 DIADMP Cc1ccc(C[N@H+](CCCCn2cc[nH+]c2C)C(C)C)s1 ZINC000125482934 1040212473 /nfs/dbraw/zinc/21/24/73/1040212473.db2.gz BPZDXVUMIYRZNT-UHFFFAOYSA-N 2 1 305.491 4.252 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(Cc2ccccc2)CCCC1 ZINC000185842938 1040225218 /nfs/dbraw/zinc/22/52/18/1040225218.db2.gz NKFAMSLVGIMSRC-UHFFFAOYSA-N 2 1 311.473 4.117 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CC(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000694031521 1040242604 /nfs/dbraw/zinc/24/26/04/1040242604.db2.gz VILYBHIFGRRMER-WBVHZDCISA-N 2 1 324.459 4.311 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CC(F)F)CC[N@H+]1Cc1ccccc1 ZINC000694031521 1040242613 /nfs/dbraw/zinc/24/26/13/1040242613.db2.gz VILYBHIFGRRMER-WBVHZDCISA-N 2 1 324.459 4.311 20 0 DIADMP C[C@H](CC1CCC1)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309741378 1040244258 /nfs/dbraw/zinc/24/42/58/1040244258.db2.gz RXEKMIUCYAFOIO-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1 ZINC000658280498 1040400628 /nfs/dbraw/zinc/40/06/28/1040400628.db2.gz IYESEMULTXPDHQ-MLGOLLRUSA-N 2 1 319.399 4.123 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319477 1040417628 /nfs/dbraw/zinc/41/76/28/1040417628.db2.gz BZNBMSVMIPPNCZ-MJGOQNOKSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319477 1040417638 /nfs/dbraw/zinc/41/76/38/1040417638.db2.gz BZNBMSVMIPPNCZ-MJGOQNOKSA-N 2 1 324.468 4.233 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(CC(C)C)cc2)[C@H](C)C1 ZINC001167686820 1040457929 /nfs/dbraw/zinc/45/79/29/1040457929.db2.gz ZGRAMIPWWIFFLM-XLIONFOSSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(CC(C)C)cc2)[C@H](C)C1 ZINC001167686820 1040457939 /nfs/dbraw/zinc/45/79/39/1040457939.db2.gz ZGRAMIPWWIFFLM-XLIONFOSSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(CC(C)C)cc2)[C@H](C)C1 ZINC001167686820 1040457947 /nfs/dbraw/zinc/45/79/47/1040457947.db2.gz ZGRAMIPWWIFFLM-XLIONFOSSA-N 2 1 302.506 4.047 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C1 ZINC000323308526 1040520147 /nfs/dbraw/zinc/52/01/47/1040520147.db2.gz FBCADAHGPGBHRP-XEYPJELSSA-N 2 1 312.501 4.033 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753457 1040724929 /nfs/dbraw/zinc/72/49/29/1040724929.db2.gz WMRNPDMSBCLVKI-WMZOPIPTSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309753457 1040724940 /nfs/dbraw/zinc/72/49/40/1040724940.db2.gz WMRNPDMSBCLVKI-WMZOPIPTSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309811291 1040731835 /nfs/dbraw/zinc/73/18/35/1040731835.db2.gz WMQPYNWRFWXRLX-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCc4ccccc43)C2)cc1 ZINC000310074591 1040749256 /nfs/dbraw/zinc/74/92/56/1040749256.db2.gz FUWVUMCAKADQBW-KNQAVFIVSA-N 2 1 320.480 4.176 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310103780 1040753721 /nfs/dbraw/zinc/75/37/21/1040753721.db2.gz ZBTVDWGIVWGXHG-CTNGQTDRSA-N 2 1 322.496 4.292 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000414065914 1040812324 /nfs/dbraw/zinc/81/23/24/1040812324.db2.gz GQVXOVJTKWQEKN-AEFFLSMTSA-N 2 1 317.864 4.161 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC(C)(C)C1 ZINC000708833464 1040917196 /nfs/dbraw/zinc/91/71/96/1040917196.db2.gz CHPCXGWZMZVMAQ-IHPCNDPISA-N 2 1 314.517 4.313 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000414169225 1040949206 /nfs/dbraw/zinc/94/92/06/1040949206.db2.gz AWLDWWNNLFBNOP-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000414175058 1040954422 /nfs/dbraw/zinc/95/44/22/1040954422.db2.gz IAQQKPCDWVPTDC-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000414196787 1040987451 /nfs/dbraw/zinc/98/74/51/1040987451.db2.gz WBUZHPUROOENIV-STQMWFEESA-N 2 1 300.899 4.174 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)oc2c1 ZINC000414202402 1040992523 /nfs/dbraw/zinc/99/25/23/1040992523.db2.gz YNPLIOLZYNBXEE-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000414290075 1041086535 /nfs/dbraw/zinc/08/65/35/1041086535.db2.gz SFLMHSIGVUALPR-INIZCTEOSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000414290075 1041086554 /nfs/dbraw/zinc/08/65/54/1041086554.db2.gz SFLMHSIGVUALPR-INIZCTEOSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000414354425 1041163391 /nfs/dbraw/zinc/16/33/91/1041163391.db2.gz VIFVZMRBPYRTOG-UHFFFAOYSA-N 2 1 312.457 4.254 20 0 DIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000193206589 1041175625 /nfs/dbraw/zinc/17/56/25/1041175625.db2.gz SNOSBJQQHLHXSP-OLZOCXBDSA-N 2 1 312.910 4.144 20 0 DIADMP C[C@@H]([NH2+]Cc1sccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206589 1041175638 /nfs/dbraw/zinc/17/56/38/1041175638.db2.gz SNOSBJQQHLHXSP-OLZOCXBDSA-N 2 1 312.910 4.144 20 0 DIADMP Fc1cccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1F ZINC000057888694 1041193874 /nfs/dbraw/zinc/19/38/74/1041193874.db2.gz ZLHRUEGBMCQKKY-UHFFFAOYSA-N 2 1 322.443 4.053 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)cs2)cc1 ZINC000809739137 1041241598 /nfs/dbraw/zinc/24/15/98/1041241598.db2.gz YNWZDYRWLGTMHV-UHFFFAOYSA-N 2 1 308.878 4.095 20 0 DIADMP CCCCCC[C@H](CC)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001170587388 1041262995 /nfs/dbraw/zinc/26/29/95/1041262995.db2.gz PWWPIOMAAGIPSQ-KRWDZBQOSA-N 3 1 313.574 4.211 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331152 1041272509 /nfs/dbraw/zinc/27/25/09/1041272509.db2.gz RKNBBPCJSVXWNK-QUCCMNQESA-N 2 1 323.484 4.035 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331152 1041272520 /nfs/dbraw/zinc/27/25/20/1041272520.db2.gz RKNBBPCJSVXWNK-QUCCMNQESA-N 2 1 323.484 4.035 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1CCc2[nH+]ccn2C1)c1cc(C)sc1C ZINC000623934893 1041274287 /nfs/dbraw/zinc/27/42/87/1041274287.db2.gz IZWRVNHWMJECOV-GDBMZVCRSA-N 2 1 303.475 4.007 20 0 DIADMP CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1 ZINC001170594666 1041297109 /nfs/dbraw/zinc/29/71/09/1041297109.db2.gz WCJIAXWCTDWZKQ-YLJYHZDGSA-N 2 1 300.490 4.289 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1 ZINC001170594666 1041297123 /nfs/dbraw/zinc/29/71/23/1041297123.db2.gz WCJIAXWCTDWZKQ-YLJYHZDGSA-N 2 1 300.490 4.289 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC001170594666 1041297133 /nfs/dbraw/zinc/29/71/33/1041297133.db2.gz WCJIAXWCTDWZKQ-YLJYHZDGSA-N 2 1 300.490 4.289 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCC3(CCCC3)CC2)cn1 ZINC000810130744 1041315331 /nfs/dbraw/zinc/31/53/31/1041315331.db2.gz BRSBBOLCSNCROH-UHFFFAOYSA-N 2 1 324.472 4.168 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(C(F)F)c(F)c2)CC1 ZINC000892687868 1041334982 /nfs/dbraw/zinc/33/49/82/1041334982.db2.gz UOXVQVDSJLZIEP-UHFFFAOYSA-N 2 1 314.395 4.117 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1 ZINC000624121709 1041352062 /nfs/dbraw/zinc/35/20/62/1041352062.db2.gz BKNSAFLIYJCMSE-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP C[N@H+]1CCC[C@]2(CC[NH+](Cc3ccc(C4CCCC4)cc3)C2)C1 ZINC001170604340 1041375952 /nfs/dbraw/zinc/37/59/52/1041375952.db2.gz KGVJPBLVXFERCL-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ccsc2)cc1 ZINC000177727382 1041484473 /nfs/dbraw/zinc/48/44/73/1041484473.db2.gz GBDLEQKLJXDGJM-AWEZNQCLSA-N 2 1 311.454 4.136 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000660113668 1041620761 /nfs/dbraw/zinc/62/07/61/1041620761.db2.gz CNFUKYKNBIRQHE-WOIUINJBSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000660113668 1041620765 /nfs/dbraw/zinc/62/07/65/1041620765.db2.gz CNFUKYKNBIRQHE-WOIUINJBSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000660113668 1041620768 /nfs/dbraw/zinc/62/07/68/1041620768.db2.gz CNFUKYKNBIRQHE-WOIUINJBSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000660113668 1041620772 /nfs/dbraw/zinc/62/07/72/1041620772.db2.gz CNFUKYKNBIRQHE-WOIUINJBSA-N 2 1 324.512 4.055 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307852 1041708762 /nfs/dbraw/zinc/70/87/62/1041708762.db2.gz WWRYUABKGJLJGJ-BRKWEVRTSA-N 2 1 320.480 4.043 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307852 1041708769 /nfs/dbraw/zinc/70/87/69/1041708769.db2.gz WWRYUABKGJLJGJ-BRKWEVRTSA-N 2 1 320.480 4.043 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000813789822 1041732713 /nfs/dbraw/zinc/73/27/13/1041732713.db2.gz DYPODBZVPYWNGA-HHXCZETCSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001170720547 1041757800 /nfs/dbraw/zinc/75/78/00/1041757800.db2.gz MNPIKHGLBJPDIW-JUSBFGHESA-N 2 1 312.501 4.064 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@H+]1Cc1ccccc1 ZINC001170720547 1041757809 /nfs/dbraw/zinc/75/78/09/1041757809.db2.gz MNPIKHGLBJPDIW-JUSBFGHESA-N 2 1 312.501 4.064 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(-c2ccncc2)c1 ZINC000364452845 1041794441 /nfs/dbraw/zinc/79/44/41/1041794441.db2.gz ZEOZAOLXASTZKB-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(-c2ccncc2)c1 ZINC000364452844 1041795158 /nfs/dbraw/zinc/79/51/58/1041795158.db2.gz ZEOZAOLXASTZKB-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170757969 1041848563 /nfs/dbraw/zinc/84/85/63/1041848563.db2.gz MUJHXHVPMGJVRL-ACDBMABISA-N 2 1 312.501 4.017 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([N@H+]3CC[C@]4(CC[NH+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761503 1041858699 /nfs/dbraw/zinc/85/86/99/1041858699.db2.gz MVLKDJOOQDQVBF-KEZQHZCBSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH+]3CC[C@]4(CC[N@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761503 1041858704 /nfs/dbraw/zinc/85/87/04/1041858704.db2.gz MVLKDJOOQDQVBF-KEZQHZCBSA-N 2 1 324.512 4.019 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH+]3CC[C@]4(CC[N@@H+](Cc5ccccc5)C4)C3)C[C@@H]21 ZINC001170761503 1041858709 /nfs/dbraw/zinc/85/87/09/1041858709.db2.gz MVLKDJOOQDQVBF-KEZQHZCBSA-N 2 1 324.512 4.019 20 0 DIADMP c1cc(C[N@H+]2CCC[C@@H](C3CC3)C2)ccc1C[NH+]1CCCCC1 ZINC001170783179 1041946443 /nfs/dbraw/zinc/94/64/43/1041946443.db2.gz MYHUAZYWVAOFQC-OAQYLSRUSA-N 2 1 312.501 4.295 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccnc1 ZINC000248518625 1042067075 /nfs/dbraw/zinc/06/70/75/1042067075.db2.gz QANDCBCIVXFVQQ-IEBWSBKVSA-N 2 1 303.494 4.025 20 0 DIADMP CCCC[N@H+](Cc1ncc(C[NH+](C)C)s1)[C@@H]1CCC[C@H](C)C1 ZINC000816658433 1042076170 /nfs/dbraw/zinc/07/61/70/1042076170.db2.gz MPOGHJRFFURYOL-JKSUJKDBSA-N 2 1 323.550 4.386 20 0 DIADMP CCCC[N@@H+](Cc1ncc(C[NH+](C)C)s1)[C@@H]1CCC[C@H](C)C1 ZINC000816658433 1042076177 /nfs/dbraw/zinc/07/61/77/1042076177.db2.gz MPOGHJRFFURYOL-JKSUJKDBSA-N 2 1 323.550 4.386 20 0 DIADMP CCCC[N@H+](Cc1ncc(C[NH+](C)C)s1)[C@@H]1CCC[C@@H](C)C1 ZINC000816658432 1042076624 /nfs/dbraw/zinc/07/66/24/1042076624.db2.gz MPOGHJRFFURYOL-HZPDHXFCSA-N 2 1 323.550 4.386 20 0 DIADMP CCCC[N@@H+](Cc1ncc(C[NH+](C)C)s1)[C@@H]1CCC[C@@H](C)C1 ZINC000816658432 1042076633 /nfs/dbraw/zinc/07/66/33/1042076633.db2.gz MPOGHJRFFURYOL-HZPDHXFCSA-N 2 1 323.550 4.386 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1OC ZINC000817898610 1042128569 /nfs/dbraw/zinc/12/85/69/1042128569.db2.gz JWQZYBFQIZXSQX-YZGWKJHDSA-N 2 1 324.468 4.229 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466103 1042176266 /nfs/dbraw/zinc/17/62/66/1042176266.db2.gz OBPHNTCJSMDMLL-WMZOPIPTSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466103 1042176272 /nfs/dbraw/zinc/17/62/72/1042176272.db2.gz OBPHNTCJSMDMLL-WMZOPIPTSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470290 1042181790 /nfs/dbraw/zinc/18/17/90/1042181790.db2.gz UJXUCLOGTWPNEF-NVXWUHKLSA-N 2 1 312.457 4.205 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470290 1042181791 /nfs/dbraw/zinc/18/17/91/1042181791.db2.gz UJXUCLOGTWPNEF-NVXWUHKLSA-N 2 1 312.457 4.205 20 0 DIADMP CCCCC[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000236805593 1042193310 /nfs/dbraw/zinc/19/33/10/1042193310.db2.gz LQYPQMYITZWNEK-GOSISDBHSA-N 2 1 302.506 4.252 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc2ccccc2s1 ZINC000278924070 1042215488 /nfs/dbraw/zinc/21/54/88/1042215488.db2.gz IFHBLWMJRQKXMO-UONOGXRCSA-N 2 1 311.454 4.011 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1cccc(OC)c1 ZINC001167837483 1042249522 /nfs/dbraw/zinc/24/95/22/1042249522.db2.gz LIXACRFNKPSNSG-XLIONFOSSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)Cc1csc(C(C)C)n1 ZINC001167838373 1042249623 /nfs/dbraw/zinc/24/96/23/1042249623.db2.gz UCVLFOVCRKHWGZ-HNNXBMFYSA-N 2 1 311.539 4.209 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1cccc(OC)c1 ZINC001167837484 1042249973 /nfs/dbraw/zinc/24/99/73/1042249973.db2.gz LIXACRFNKPSNSG-YLJYHZDGSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001167840670 1042254160 /nfs/dbraw/zinc/25/41/60/1042254160.db2.gz HGEDGWXGEDJIJX-OKZBNKHCSA-N 2 1 300.490 4.084 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Cl)cc(Cl)c1 ZINC000278969901 1042254891 /nfs/dbraw/zinc/25/48/91/1042254891.db2.gz NKBFMTBCZRJIIH-NEPJUHHUSA-N 2 1 324.255 4.103 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Cl)cc(Cl)c1 ZINC000278969906 1042255010 /nfs/dbraw/zinc/25/50/10/1042255010.db2.gz NKBFMTBCZRJIIH-NWDGAFQWSA-N 2 1 324.255 4.103 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCSc2ccccc2C1 ZINC001167842400 1042258578 /nfs/dbraw/zinc/25/85/78/1042258578.db2.gz WVQJXYBWINCBHQ-MRXNPFEDSA-N 2 1 306.519 4.105 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]CC2(C)CCC2)C[N@H+]1Cc1ccccc1 ZINC000434774547 1042304990 /nfs/dbraw/zinc/30/49/90/1042304990.db2.gz HQOKAONRKBWJFY-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513494121 1042546579 /nfs/dbraw/zinc/54/65/79/1042546579.db2.gz GEBKAWBLIYMRKX-LFGUQSLTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2cccs2)C[N@H+]1Cc1ccccc1 ZINC000513495934 1042547862 /nfs/dbraw/zinc/54/78/62/1042547862.db2.gz XGXGMVKGFKDLDB-FUHWJXTLSA-N 2 1 314.498 4.138 20 0 DIADMP CC[N@@H+](CC[C@H]1CC[NH2+]C1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000420299796 1042598408 /nfs/dbraw/zinc/59/84/08/1042598408.db2.gz JGRUHHJTJFRQHY-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H](CC(F)F)c2ccccc2)CC1 ZINC000421377616 1042634438 /nfs/dbraw/zinc/63/44/38/1042634438.db2.gz UBVRMDKTTPVNNL-MRXNPFEDSA-N 2 1 310.432 4.235 20 0 DIADMP COc1cc(Cl)ccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000421824525 1042653234 /nfs/dbraw/zinc/65/32/34/1042653234.db2.gz JEOJBIJGLULIIO-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP COc1cc(Cl)ccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000421824525 1042653235 /nfs/dbraw/zinc/65/32/35/1042653235.db2.gz JEOJBIJGLULIIO-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(N2CCCC2)c1 ZINC000422876506 1042691696 /nfs/dbraw/zinc/69/16/96/1042691696.db2.gz QFMBJPYWELYTHX-ONGXBYRLSA-N 2 1 321.468 4.082 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccccc1)c1ccc2ccccc2c1)C1C[NH2+]C1 ZINC000422904609 1042692222 /nfs/dbraw/zinc/69/22/22/1042692222.db2.gz HBXKDGRJFHEWRR-KSFYIVLOSA-N 2 1 316.448 4.127 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)c1c[nH+]ccc1N)c1c(Cl)cccc1Cl ZINC000422885980 1042692444 /nfs/dbraw/zinc/69/24/44/1042692444.db2.gz ZTUURHIDCGXSQN-QWRGUYRKSA-N 2 1 324.255 4.255 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1 ZINC000924959937 1042695983 /nfs/dbraw/zinc/69/59/83/1042695983.db2.gz QHBPPVQBWHQUOF-OAQYLSRUSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)c1 ZINC000423059598 1042696279 /nfs/dbraw/zinc/69/62/79/1042696279.db2.gz GBDKQYGEBHHMCQ-XQXKNUKBSA-N 2 1 320.480 4.265 20 0 DIADMP CC(F)(F)c1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000423134487 1042698872 /nfs/dbraw/zinc/69/88/72/1042698872.db2.gz MEKGEGFDTYJKHD-IAGOWNOFSA-N 2 1 302.368 4.033 20 0 DIADMP Cc1ccc([C@H]([NH2+]CCC[NH2+]Cc2cccnc2)C2CCC2)cc1 ZINC000423185156 1042699490 /nfs/dbraw/zinc/69/94/90/1042699490.db2.gz JJICTRGUWYATBU-OAQYLSRUSA-N 2 1 323.484 4.001 20 0 DIADMP c1ccc([C@@H]([NH2+]CCC[NH2+]Cc2cccnc2)C2CCCC2)cc1 ZINC000423193285 1042700691 /nfs/dbraw/zinc/70/06/91/1042700691.db2.gz WWWUEGPTUOKDSJ-OAQYLSRUSA-N 2 1 323.484 4.082 20 0 DIADMP CCC([NH3+])(CC)C[NH2+][C@@H](C)c1sc(-c2ccccc2)nc1C ZINC000423282602 1042703404 /nfs/dbraw/zinc/70/34/04/1042703404.db2.gz CVLMVIVSOMZTHT-ZDUSSCGKSA-N 2 1 317.502 4.287 20 0 DIADMP c1cncc([C@@H]2CCC[C@@H]([NH2+]CC[NH2+]C3CCCCCC3)C2)c1 ZINC000423266772 1042705511 /nfs/dbraw/zinc/70/55/11/1042705511.db2.gz CIOOSMSTGPKKGC-YLJYHZDGSA-N 2 1 315.505 4.010 20 0 DIADMP [NH3+][C@@H](C[NH2+][C@H](Cc1ccccc1Cl)c1cccs1)C1CC1 ZINC000423319733 1042705684 /nfs/dbraw/zinc/70/56/84/1042705684.db2.gz LXJSLOYTJFWEAF-JKSUJKDBSA-N 2 1 320.889 4.012 20 0 DIADMP CC[C@H]([NH3+])C[NH2+][C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000423457503 1042713915 /nfs/dbraw/zinc/71/39/15/1042713915.db2.gz FZARMTGFXPILAF-YGRLFVJLSA-N 2 1 323.893 4.160 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377102 1042738765 /nfs/dbraw/zinc/73/87/65/1042738765.db2.gz QKVRUERLIXLPBA-DAXOMENPSA-N 2 1 315.486 4.039 20 0 DIADMP C[C@H]1CC2(C[N@H+]1Cc1csc(Cl)c1Cl)CC[NH2+]CC2 ZINC000424388028 1042738900 /nfs/dbraw/zinc/73/89/00/1042738900.db2.gz YYORTHYITZVIMI-JTQLQIEISA-N 2 1 319.301 4.019 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000514009855 1042766088 /nfs/dbraw/zinc/76/60/88/1042766088.db2.gz OLQJYJFYBQIGNZ-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP c1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)C2CC2)cc1 ZINC001167958520 1042790072 /nfs/dbraw/zinc/79/00/72/1042790072.db2.gz GQLCLYVHWWGOHR-OTYNDTSQSA-N 2 1 310.485 4.133 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(Cl)cc1 ZINC001167961144 1042842998 /nfs/dbraw/zinc/84/29/98/1042842998.db2.gz FQFXVXLPGPPKIT-NZKYFMOASA-N 2 1 318.892 4.396 20 0 DIADMP C[C@@]1(C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@@H+](Cc2ccccc2)C1 ZINC000712458633 1042851802 /nfs/dbraw/zinc/85/18/02/1042851802.db2.gz VUTASKLGHOINHS-BURNTYAHSA-N 2 1 312.501 4.067 20 0 DIADMP CS[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C(C)(C)C ZINC000517187495 1042871448 /nfs/dbraw/zinc/87/14/48/1042871448.db2.gz KJHLQDYKAVGZGW-RCCFBDPRSA-N 2 1 320.546 4.189 20 0 DIADMP CS[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C(C)(C)C ZINC000517187495 1042871453 /nfs/dbraw/zinc/87/14/53/1042871453.db2.gz KJHLQDYKAVGZGW-RCCFBDPRSA-N 2 1 320.546 4.189 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc3ccc(C)cc3o2)CC1 ZINC000425922474 1042874978 /nfs/dbraw/zinc/87/49/78/1042874978.db2.gz SMVCSXBWDHGVEA-HNNXBMFYSA-N 2 1 300.446 4.266 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934355 1042876281 /nfs/dbraw/zinc/87/62/81/1042876281.db2.gz BJQRKFQFQIOWSG-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934355 1042876288 /nfs/dbraw/zinc/87/62/88/1042876288.db2.gz BJQRKFQFQIOWSG-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1 ZINC000262004480 1042932454 /nfs/dbraw/zinc/93/24/54/1042932454.db2.gz QZJRGLXPGRWOII-DNVCBOLYSA-N 2 1 312.457 4.145 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cc(F)cc(F)c1 ZINC001167967112 1042952737 /nfs/dbraw/zinc/95/27/37/1042952737.db2.gz CCFGEPMWALTOJC-OGMQIKDJSA-N 2 1 320.427 4.021 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cc(F)cc(F)c1 ZINC001167967112 1042952741 /nfs/dbraw/zinc/95/27/41/1042952741.db2.gz CCFGEPMWALTOJC-OGMQIKDJSA-N 2 1 320.427 4.021 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccc1F ZINC001167967632 1042953629 /nfs/dbraw/zinc/95/36/29/1042953629.db2.gz JAVGYIRGQIPWDO-KRXYWNSISA-N 2 1 316.464 4.272 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccc1F ZINC001167967632 1042953633 /nfs/dbraw/zinc/95/36/33/1042953633.db2.gz JAVGYIRGQIPWDO-KRXYWNSISA-N 2 1 316.464 4.272 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc21 ZINC001167967904 1042955126 /nfs/dbraw/zinc/95/51/26/1042955126.db2.gz KONWITHECRGTAB-QCVWNGFQSA-N 2 1 310.485 4.230 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+][C@@H]1CCC[C@@H]3CCCC[C@@H]13)C2 ZINC001167968572 1042956860 /nfs/dbraw/zinc/95/68/60/1042956860.db2.gz RQHBLCBTIJDUTA-XPMJQDLXSA-N 2 1 316.533 4.340 20 0 DIADMP C[C@H](CC1CCCCC1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167970932 1042962082 /nfs/dbraw/zinc/96/20/82/1042962082.db2.gz QHBNMVKWGJZXEP-MIJOPJBOSA-N 2 1 304.522 4.340 20 0 DIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)cc1 ZINC001167974378 1042966932 /nfs/dbraw/zinc/96/69/32/1042966932.db2.gz YKDJNCJEIXGOJR-YQQQUEKLSA-N 2 1 316.464 4.056 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC3(CCCCC3)CC1)C2 ZINC001167984751 1042982240 /nfs/dbraw/zinc/98/22/40/1042982240.db2.gz QPUPUTAEQKRXPJ-YOFSQIOKSA-N 2 1 316.533 4.438 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)c(F)c1 ZINC000467839914 1042995638 /nfs/dbraw/zinc/99/56/38/1042995638.db2.gz FMBSBAWHMGHDPI-LSDHHAIUSA-N 2 1 310.432 4.270 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441395980 1043043884 /nfs/dbraw/zinc/04/38/84/1043043884.db2.gz BDDSLEJOGCMTNN-YYWHXJBOSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441395980 1043043891 /nfs/dbraw/zinc/04/38/91/1043043891.db2.gz BDDSLEJOGCMTNN-YYWHXJBOSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441395980 1043043895 /nfs/dbraw/zinc/04/38/95/1043043895.db2.gz BDDSLEJOGCMTNN-YYWHXJBOSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441395980 1043043903 /nfs/dbraw/zinc/04/39/03/1043043903.db2.gz BDDSLEJOGCMTNN-YYWHXJBOSA-N 2 1 310.485 4.013 20 0 DIADMP CC(C)[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000112561580 1043051737 /nfs/dbraw/zinc/05/17/37/1043051737.db2.gz PFFIRWDSZLQEMF-GDBMZVCRSA-N 2 1 314.395 4.086 20 0 DIADMP CC(C)[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000112561580 1043051747 /nfs/dbraw/zinc/05/17/47/1043051747.db2.gz PFFIRWDSZLQEMF-GDBMZVCRSA-N 2 1 314.395 4.086 20 0 DIADMP CC(C)[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000112561577 1043052400 /nfs/dbraw/zinc/05/24/00/1043052400.db2.gz PFFIRWDSZLQEMF-GOEBONIOSA-N 2 1 314.395 4.086 20 0 DIADMP CC(C)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000112561577 1043052415 /nfs/dbraw/zinc/05/24/15/1043052415.db2.gz PFFIRWDSZLQEMF-GOEBONIOSA-N 2 1 314.395 4.086 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000794827914 1043068190 /nfs/dbraw/zinc/06/81/90/1043068190.db2.gz MBGRMVYOVVQCOX-UGKGYDQZSA-N 2 1 320.480 4.094 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000178750954 1043137085 /nfs/dbraw/zinc/13/70/85/1043137085.db2.gz QJRWLBXFZHPECK-DLBZAZTESA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000178750954 1043137097 /nfs/dbraw/zinc/13/70/97/1043137097.db2.gz QJRWLBXFZHPECK-DLBZAZTESA-N 2 1 311.473 4.006 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2sc(C)nc2C)c1 ZINC000178737157 1043137610 /nfs/dbraw/zinc/13/76/10/1043137610.db2.gz JZQNNRLZASWWHZ-CYBMUJFWSA-N 2 1 317.502 4.062 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000178699395 1043137650 /nfs/dbraw/zinc/13/76/50/1043137650.db2.gz AFPJBXIFWIDWNI-TYNCELHUSA-N 2 1 321.515 4.104 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccnc(Cl)c1 ZINC000120772199 1043141763 /nfs/dbraw/zinc/14/17/63/1043141763.db2.gz VLVJKUKIFZLKHT-AWEZNQCLSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccnc(Cl)c1 ZINC000120772199 1043141770 /nfs/dbraw/zinc/14/17/70/1043141770.db2.gz VLVJKUKIFZLKHT-AWEZNQCLSA-N 2 1 309.885 4.040 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382394 1043184988 /nfs/dbraw/zinc/18/49/88/1043184988.db2.gz JYROJYYUEKRLHW-OPYAIIAOSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382394 1043184995 /nfs/dbraw/zinc/18/49/95/1043184995.db2.gz JYROJYYUEKRLHW-OPYAIIAOSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1cncc([C@H](C)[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382413 1043185326 /nfs/dbraw/zinc/18/53/26/1043185326.db2.gz JYROJYYUEKRLHW-LQWHRVPQSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1cncc([C@H](C)[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382413 1043185330 /nfs/dbraw/zinc/18/53/30/1043185330.db2.gz JYROJYYUEKRLHW-LQWHRVPQSA-N 2 1 323.484 4.094 20 0 DIADMP CCC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1cccnc1 ZINC000185352200 1043200856 /nfs/dbraw/zinc/20/08/56/1043200856.db2.gz XRFHQTMWDHJMIN-FQEVSTJZSA-N 2 1 311.473 4.164 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000427610540 1043243670 /nfs/dbraw/zinc/24/36/70/1043243670.db2.gz VHSPOAGBURPGIW-XLIONFOSSA-N 2 1 300.490 4.158 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCC(F)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168008197 1043269670 /nfs/dbraw/zinc/26/96/70/1043269670.db2.gz WNAQCKQQRQKKOJ-MQMXLAGYSA-N 2 1 318.480 4.298 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792268 1043332106 /nfs/dbraw/zinc/33/21/06/1043332106.db2.gz VFPHZRYORADPQH-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cccc(-c2ccncc2)c1 ZINC000268792268 1043332117 /nfs/dbraw/zinc/33/21/17/1043332117.db2.gz VFPHZRYORADPQH-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(SC(C)C)cc1 ZINC000268817260 1043333077 /nfs/dbraw/zinc/33/30/77/1043333077.db2.gz NZZYPNJVQWDYEO-CQSZACIVSA-N 2 1 303.475 4.043 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(SC(C)C)cc1 ZINC000268817259 1043334340 /nfs/dbraw/zinc/33/43/40/1043334340.db2.gz NZZYPNJVQWDYEO-AWEZNQCLSA-N 2 1 303.475 4.043 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012443 1043338679 /nfs/dbraw/zinc/33/86/79/1043338679.db2.gz AGJMTUUFTDWNAY-FTEYMNFISA-N 2 1 302.506 4.452 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCC(F)(F)F)cc1 ZINC000268983732 1043347526 /nfs/dbraw/zinc/34/75/26/1043347526.db2.gz PJTUUGIOFWORLU-GFCCVEGCSA-N 2 1 311.351 4.174 20 0 DIADMP CC1(C)C[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2S1 ZINC000872020809 1043420511 /nfs/dbraw/zinc/42/05/11/1043420511.db2.gz KPRZNZDKZHAILE-PBHICJAKSA-N 2 1 316.514 4.076 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC(C)(C)Sc3ccccc32)CC[N@@H+]1C ZINC000872040694 1043431169 /nfs/dbraw/zinc/43/11/69/1043431169.db2.gz ZSWYNCLTJVBRQC-FMKPAKJESA-N 2 1 304.503 4.074 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC(C)(C)Sc3ccccc32)CC[N@H+]1C ZINC000872040694 1043431171 /nfs/dbraw/zinc/43/11/71/1043431171.db2.gz ZSWYNCLTJVBRQC-FMKPAKJESA-N 2 1 304.503 4.074 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000442854769 1043442742 /nfs/dbraw/zinc/44/27/42/1043442742.db2.gz JBTKAPHJHOILIH-CVEARBPZSA-N 2 1 306.519 4.324 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000521695255 1043456066 /nfs/dbraw/zinc/45/60/66/1043456066.db2.gz NMBYQIYSGCKCKL-HNAYVOBHSA-N 2 1 304.453 4.080 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000521695255 1043456076 /nfs/dbraw/zinc/45/60/76/1043456076.db2.gz NMBYQIYSGCKCKL-HNAYVOBHSA-N 2 1 304.453 4.080 20 0 DIADMP CCC1([NH3+])CC[NH+]([C@@H]2CCSc3c(Cl)cccc32)CC1 ZINC000925756369 1043465313 /nfs/dbraw/zinc/46/53/13/1043465313.db2.gz LDQIVBJZSYEHAX-CQSZACIVSA-N 2 1 310.894 4.080 20 0 DIADMP FC1(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000558255403 1043473882 /nfs/dbraw/zinc/47/38/82/1043473882.db2.gz DPSLEVZWMRJEDN-REPLKXPHSA-N 2 1 316.464 4.054 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000349364512 1043505050 /nfs/dbraw/zinc/50/50/50/1043505050.db2.gz GSBJZOFLPKIXFU-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000349364512 1043505064 /nfs/dbraw/zinc/50/50/64/1043505064.db2.gz GSBJZOFLPKIXFU-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000558418926 1043506371 /nfs/dbraw/zinc/50/63/71/1043506371.db2.gz YHPNCFVLRTZSET-GQCTYLIASA-N 2 1 315.436 4.010 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C=C/c1ccc(F)cc1 ZINC000558418926 1043506391 /nfs/dbraw/zinc/50/63/91/1043506391.db2.gz YHPNCFVLRTZSET-GQCTYLIASA-N 2 1 315.436 4.010 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000558418926 1043506405 /nfs/dbraw/zinc/50/64/05/1043506405.db2.gz YHPNCFVLRTZSET-GQCTYLIASA-N 2 1 315.436 4.010 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000349403052 1043508476 /nfs/dbraw/zinc/50/84/76/1043508476.db2.gz BHHLKZBQQDEAGJ-VQTJNVASSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000349403052 1043508486 /nfs/dbraw/zinc/50/84/86/1043508486.db2.gz BHHLKZBQQDEAGJ-VQTJNVASSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCc2c(C)ccc(C)c21 ZINC000349826638 1043526981 /nfs/dbraw/zinc/52/69/81/1043526981.db2.gz FBXNSOZEVMXFAR-LJQANCHMSA-N 2 1 311.473 4.256 20 0 DIADMP CCCOc1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c(C)c1 ZINC000474083301 1043585064 /nfs/dbraw/zinc/58/50/64/1043585064.db2.gz OQTWLZGZOIGVDU-UHFFFAOYSA-N 2 1 318.505 4.136 20 0 DIADMP CC(C)[C@@H](C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000474104650 1043610265 /nfs/dbraw/zinc/61/02/65/1043610265.db2.gz ICLJSIXSFPCQBM-HXUWFJFHSA-N 2 1 302.506 4.231 20 0 DIADMP Cc1ccoc1CN1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000353543295 1043616206 /nfs/dbraw/zinc/61/62/06/1043616206.db2.gz NAXANLQKFSOLII-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1ccoc1C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000353543295 1043616214 /nfs/dbraw/zinc/61/62/14/1043616214.db2.gz NAXANLQKFSOLII-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1ccoc1C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000353543295 1043616224 /nfs/dbraw/zinc/61/62/24/1043616224.db2.gz NAXANLQKFSOLII-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1ccoc1C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000353543295 1043616233 /nfs/dbraw/zinc/61/62/33/1043616233.db2.gz NAXANLQKFSOLII-OAQYLSRUSA-N 2 1 324.468 4.076 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(-c2ccncc2)c1 ZINC000353645545 1043627300 /nfs/dbraw/zinc/62/73/00/1043627300.db2.gz HDJZNLNJQMRVEJ-OAQYLSRUSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cccc(-c2ccncc2)c1 ZINC000353645545 1043627308 /nfs/dbraw/zinc/62/73/08/1043627308.db2.gz HDJZNLNJQMRVEJ-OAQYLSRUSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cccc(-c2ccncc2)c1 ZINC000353645545 1043627317 /nfs/dbraw/zinc/62/73/17/1043627317.db2.gz HDJZNLNJQMRVEJ-OAQYLSRUSA-N 2 1 323.484 4.055 20 0 DIADMP FC(F)(F)CCCC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000443629896 1043627394 /nfs/dbraw/zinc/62/73/94/1043627394.db2.gz ITQBFOWHMCHOPP-MRXNPFEDSA-N 2 1 320.443 4.307 20 0 DIADMP FC(F)(F)CCCC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000443629896 1043627401 /nfs/dbraw/zinc/62/74/01/1043627401.db2.gz ITQBFOWHMCHOPP-MRXNPFEDSA-N 2 1 320.443 4.307 20 0 DIADMP C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000926811236 1043637717 /nfs/dbraw/zinc/63/77/17/1043637717.db2.gz YOKNONYYZGRTNW-AUUYWEPGSA-N 2 1 318.411 4.249 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(-c3ccccn3)c2)C[C@@H]1C ZINC000353748370 1043640436 /nfs/dbraw/zinc/64/04/36/1043640436.db2.gz RKCBLQPRPCECCY-PXNSSMCTSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@@H]1C ZINC000353748370 1043640445 /nfs/dbraw/zinc/64/04/45/1043640445.db2.gz RKCBLQPRPCECCY-PXNSSMCTSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@@H]1C ZINC000353748370 1043640455 /nfs/dbraw/zinc/64/04/55/1043640455.db2.gz RKCBLQPRPCECCY-PXNSSMCTSA-N 2 1 323.484 4.053 20 0 DIADMP c1cc2cc(C[NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)ccc2o1 ZINC000665237595 1043642971 /nfs/dbraw/zinc/64/29/71/1043642971.db2.gz FHJJVZNXOGOGEW-MOPGFXCFSA-N 2 1 306.409 4.016 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000191479435 1043645602 /nfs/dbraw/zinc/64/56/02/1043645602.db2.gz XYFIFMHNQOSSGA-AWEZNQCLSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000191479435 1043645608 /nfs/dbraw/zinc/64/56/08/1043645608.db2.gz XYFIFMHNQOSSGA-AWEZNQCLSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000191479435 1043645613 /nfs/dbraw/zinc/64/56/13/1043645613.db2.gz XYFIFMHNQOSSGA-AWEZNQCLSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000191479453 1043646085 /nfs/dbraw/zinc/64/60/85/1043646085.db2.gz XYFIFMHNQOSSGA-CQSZACIVSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000191479453 1043646091 /nfs/dbraw/zinc/64/60/91/1043646091.db2.gz XYFIFMHNQOSSGA-CQSZACIVSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000191479453 1043646095 /nfs/dbraw/zinc/64/60/95/1043646095.db2.gz XYFIFMHNQOSSGA-CQSZACIVSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000191495152 1043647086 /nfs/dbraw/zinc/64/70/86/1043647086.db2.gz OMTROHQKWGBQBK-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)c1ccccc1F ZINC000191495152 1043647095 /nfs/dbraw/zinc/64/70/95/1043647095.db2.gz OMTROHQKWGBQBK-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000191495152 1043647106 /nfs/dbraw/zinc/64/71/06/1043647106.db2.gz OMTROHQKWGBQBK-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000353815264 1043649076 /nfs/dbraw/zinc/64/90/76/1043649076.db2.gz KHPGWZHMKCXPDS-QGZVFWFLSA-N 2 1 312.457 4.192 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2(C(F)(F)F)CC2)cc1 ZINC000353979498 1043669623 /nfs/dbraw/zinc/66/96/23/1043669623.db2.gz RBBCTKLKPPPPFC-LBPRGKRZSA-N 2 1 323.362 4.174 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCS[C@H](C)C2)cc1 ZINC000927032942 1043670121 /nfs/dbraw/zinc/67/01/21/1043670121.db2.gz QVVVGRBXTDRFPO-JKIFEVAISA-N 2 1 315.486 4.115 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]Cc1c(Cl)cccc1SC(C)C ZINC000354215560 1043688931 /nfs/dbraw/zinc/68/89/31/1043688931.db2.gz JHCCZWFNQOPQJU-UHFFFAOYSA-N 2 1 323.893 4.135 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@@H+]1Cc1ccccc1 ZINC000354546272 1043705568 /nfs/dbraw/zinc/70/55/68/1043705568.db2.gz UEWMYFKFMMAWPL-UZLBHIALSA-N 2 1 321.468 4.035 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@H+]1Cc1ccccc1 ZINC000354546272 1043705589 /nfs/dbraw/zinc/70/55/89/1043705589.db2.gz UEWMYFKFMMAWPL-UZLBHIALSA-N 2 1 321.468 4.035 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@@H+]1Cc1ccccc1 ZINC000354546266 1043706010 /nfs/dbraw/zinc/70/60/10/1043706010.db2.gz UEWMYFKFMMAWPL-JXFKEZNVSA-N 2 1 321.468 4.035 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc3c(c[nH+]2)CCC3)CC[N@H+]1Cc1ccccc1 ZINC000354546266 1043706022 /nfs/dbraw/zinc/70/60/22/1043706022.db2.gz UEWMYFKFMMAWPL-JXFKEZNVSA-N 2 1 321.468 4.035 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474270210 1043718352 /nfs/dbraw/zinc/71/83/52/1043718352.db2.gz UGAHXCLZJNFOLS-ICSRJNTNSA-N 2 1 302.506 4.090 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC=C(c2cc(C)cc(C)c2)CC1 ZINC000354826630 1043722280 /nfs/dbraw/zinc/72/22/80/1043722280.db2.gz JBPABQTYICVKHJ-UHFFFAOYSA-N 2 1 323.484 4.378 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC=C(c2cc(C)cc(C)c2)CC1 ZINC000354826630 1043722282 /nfs/dbraw/zinc/72/22/82/1043722282.db2.gz JBPABQTYICVKHJ-UHFFFAOYSA-N 2 1 323.484 4.378 20 0 DIADMP CCCC[N@H+](C)c1ccc(N[C@H](C)C2CC[NH+](C)CC2)cc1 ZINC000777684260 1043739791 /nfs/dbraw/zinc/73/97/91/1043739791.db2.gz LHIMEZPCBHYQON-MRXNPFEDSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@@H+](C)c1ccc(N[C@H](C)C2CC[NH+](C)CC2)cc1 ZINC000777684260 1043739803 /nfs/dbraw/zinc/73/98/03/1043739803.db2.gz LHIMEZPCBHYQON-MRXNPFEDSA-N 2 1 303.494 4.065 20 0 DIADMP CCC1([NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CCC1 ZINC001168033544 1043751210 /nfs/dbraw/zinc/75/12/10/1043751210.db2.gz LSVUQCHZUQCLFD-IZZQQSIFSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470717 1043789408 /nfs/dbraw/zinc/78/94/08/1043789408.db2.gz AXGGNPGMCHYGBH-RMEBNNNOSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470717 1043789412 /nfs/dbraw/zinc/78/94/12/1043789412.db2.gz AXGGNPGMCHYGBH-RMEBNNNOSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470705 1043790016 /nfs/dbraw/zinc/79/00/16/1043790016.db2.gz AXGGNPGMCHYGBH-AHDPXTMNSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470705 1043790027 /nfs/dbraw/zinc/79/00/27/1043790027.db2.gz AXGGNPGMCHYGBH-AHDPXTMNSA-N 2 1 324.921 4.110 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)C2CCCC2)CC1 ZINC000474473096 1043793991 /nfs/dbraw/zinc/79/39/91/1043793991.db2.gz JIVDNIAOKFXBKJ-KRWDZBQOSA-N 2 1 300.490 4.128 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)C2CCCC2)CC1 ZINC000474473097 1043794963 /nfs/dbraw/zinc/79/49/63/1043794963.db2.gz JIVDNIAOKFXBKJ-QGZVFWFLSA-N 2 1 300.490 4.128 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cscc2C(F)(F)F)C[C@H]1C ZINC000356132459 1043813088 /nfs/dbraw/zinc/81/30/88/1043813088.db2.gz HVAUOIXPZFPYHC-DGCLKSJQSA-N 2 1 320.424 4.072 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cscc2C(F)(F)F)C[C@@H]1C ZINC000356132462 1043813467 /nfs/dbraw/zinc/81/34/67/1043813467.db2.gz HVAUOIXPZFPYHC-WCQYABFASA-N 2 1 320.424 4.072 20 0 DIADMP CC[N@H+](CC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C(C)C ZINC000474602421 1043843127 /nfs/dbraw/zinc/84/31/27/1043843127.db2.gz KTJWLHUJZMDVCB-MELADBBJSA-N 2 1 314.926 4.213 20 0 DIADMP CC[N@@H+](CC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C(C)C ZINC000474602421 1043843147 /nfs/dbraw/zinc/84/31/47/1043843147.db2.gz KTJWLHUJZMDVCB-MELADBBJSA-N 2 1 314.926 4.213 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168039247 1043852816 /nfs/dbraw/zinc/85/28/16/1043852816.db2.gz CMUPLSWZGFPHCP-XLSPSMHOSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168039247 1043852829 /nfs/dbraw/zinc/85/28/29/1043852829.db2.gz CMUPLSWZGFPHCP-XLSPSMHOSA-N 2 1 318.480 4.108 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@H](C)c2ccc(Cl)cc2)C1 ZINC000474626389 1043858654 /nfs/dbraw/zinc/85/86/54/1043858654.db2.gz FBUGONHNCLPROP-ARFHVFGLSA-N 2 1 308.897 4.154 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCCC2(F)F)C[C@@H]1c1ccccc1 ZINC000453244869 1043867913 /nfs/dbraw/zinc/86/79/13/1043867913.db2.gz HPXQSPMTKSTPLS-OKZBNKHCSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCCC2(F)F)C[C@@H]1c1ccccc1 ZINC000453244869 1043867929 /nfs/dbraw/zinc/86/79/29/1043867929.db2.gz HPXQSPMTKSTPLS-OKZBNKHCSA-N 2 1 322.443 4.237 20 0 DIADMP C[C@@H]1C[C@@H](N2CCCC[C@H](F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168040044 1043871813 /nfs/dbraw/zinc/87/18/13/1043871813.db2.gz JZSQVEFUWNRDTE-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@H](F)C2)C[C@H](C)N1Cc1ccccc1 ZINC001168040044 1043871824 /nfs/dbraw/zinc/87/18/24/1043871824.db2.gz JZSQVEFUWNRDTE-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@H](F)C2)C[C@H](C)N1Cc1ccccc1 ZINC001168040044 1043871830 /nfs/dbraw/zinc/87/18/30/1043871830.db2.gz JZSQVEFUWNRDTE-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@H](F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168040044 1043871839 /nfs/dbraw/zinc/87/18/39/1043871839.db2.gz JZSQVEFUWNRDTE-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@H](F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168040044 1043871850 /nfs/dbraw/zinc/87/18/50/1043871850.db2.gz JZSQVEFUWNRDTE-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@H](F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040044 1043871866 /nfs/dbraw/zinc/87/18/66/1043871866.db2.gz JZSQVEFUWNRDTE-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@H](F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040044 1043871883 /nfs/dbraw/zinc/87/18/83/1043871883.db2.gz JZSQVEFUWNRDTE-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001649175306 1043874049 /nfs/dbraw/zinc/87/40/49/1043874049.db2.gz AZUPAFKURUCCCO-INIZCTEOSA-N 2 1 308.897 4.167 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC001649175307 1043874571 /nfs/dbraw/zinc/87/45/71/1043874571.db2.gz AZUPAFKURUCCCO-MRXNPFEDSA-N 2 1 308.897 4.167 20 0 DIADMP C[C@@H]1C[C@@H](N(C)C2CC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168040198 1043874921 /nfs/dbraw/zinc/87/49/21/1043874921.db2.gz KSJVHUKIYUUWHV-SCAQPMJSSA-N 2 1 322.443 4.158 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040198 1043874974 /nfs/dbraw/zinc/87/49/74/1043874974.db2.gz KSJVHUKIYUUWHV-SCAQPMJSSA-N 2 1 322.443 4.158 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040198 1043874989 /nfs/dbraw/zinc/87/49/89/1043874989.db2.gz KSJVHUKIYUUWHV-SCAQPMJSSA-N 2 1 322.443 4.158 20 0 DIADMP C[C@@H]1CC([NH+]2CCCCCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040750 1043883694 /nfs/dbraw/zinc/88/36/94/1043883694.db2.gz OWFVBMKIQPEVOC-QZTJIDSGSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H](C)[N@H+](C)CC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709026 1043896115 /nfs/dbraw/zinc/89/61/15/1043896115.db2.gz NFBWAYMJLOTDRA-XDQVBPFNSA-N 2 1 314.926 4.213 20 0 DIADMP CC[C@H](C)[N@@H+](C)CC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709026 1043896134 /nfs/dbraw/zinc/89/61/34/1043896134.db2.gz NFBWAYMJLOTDRA-XDQVBPFNSA-N 2 1 314.926 4.213 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C)(F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168041520 1043909127 /nfs/dbraw/zinc/90/91/27/1043909127.db2.gz SNTDTIPUJJQSLP-IZZQQSIFSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C)(F)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168041520 1043909137 /nfs/dbraw/zinc/90/91/37/1043909137.db2.gz SNTDTIPUJJQSLP-IZZQQSIFSA-N 2 1 318.480 4.252 20 0 DIADMP CC(C)OCC[NH+]1CCC([NH2+][C@@H](C)[C@@H](C)C2CCCCC2)CC1 ZINC000474795850 1043918775 /nfs/dbraw/zinc/91/87/75/1043918775.db2.gz QSRMFURFWDWDCC-MSOLQXFVSA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)OCC[NH+]1CCC([NH2+][C@@H](C)[C@H](C)C2CCCCC2)CC1 ZINC000474795852 1043919251 /nfs/dbraw/zinc/91/92/51/1043919251.db2.gz QSRMFURFWDWDCC-ROUUACIJSA-N 2 1 324.553 4.070 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@](C)(CF)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168042071 1043931784 /nfs/dbraw/zinc/93/17/84/1043931784.db2.gz YODDVXFMAJXEPC-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@](C)(CF)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168042071 1043931791 /nfs/dbraw/zinc/93/17/91/1043931791.db2.gz YODDVXFMAJXEPC-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@](C)(CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168042071 1043931797 /nfs/dbraw/zinc/93/17/97/1043931797.db2.gz YODDVXFMAJXEPC-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@](C)(CF)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168042071 1043931801 /nfs/dbraw/zinc/93/18/01/1043931801.db2.gz YODDVXFMAJXEPC-PIKOESSRSA-N 2 1 318.480 4.110 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1cccc2ccccc21 ZINC000179314163 1043952948 /nfs/dbraw/zinc/95/29/48/1043952948.db2.gz HGJFMANZBHUBRM-UHFFFAOYSA-N 2 1 307.441 4.257 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1cccc2ccccc21 ZINC000179314163 1043952951 /nfs/dbraw/zinc/95/29/51/1043952951.db2.gz HGJFMANZBHUBRM-UHFFFAOYSA-N 2 1 307.441 4.257 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC000522551616 1044047094 /nfs/dbraw/zinc/04/70/94/1044047094.db2.gz RLENIPIQPZEWPN-UHFFFAOYSA-N 2 1 310.485 4.392 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)cc1 ZINC000358287156 1044047960 /nfs/dbraw/zinc/04/79/60/1044047960.db2.gz AKLNLWSLSWLSPO-CZUORRHYSA-N 2 1 319.399 4.409 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000562023596 1044050171 /nfs/dbraw/zinc/05/01/71/1044050171.db2.gz LWMQOTBIKBMUTR-KBAYOESNSA-N 2 1 320.546 4.374 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000562023596 1044050187 /nfs/dbraw/zinc/05/01/87/1044050187.db2.gz LWMQOTBIKBMUTR-KBAYOESNSA-N 2 1 320.546 4.374 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000562058765 1044055408 /nfs/dbraw/zinc/05/54/08/1044055408.db2.gz RRUFRFDWFXLOMI-CEXWTWQISA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000562058765 1044055418 /nfs/dbraw/zinc/05/54/18/1044055418.db2.gz RRUFRFDWFXLOMI-CEXWTWQISA-N 2 1 300.490 4.065 20 0 DIADMP Cc1csc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001137158458 1044059499 /nfs/dbraw/zinc/05/94/99/1044059499.db2.gz TVFNKXAYYSPFMH-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1csc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001137158458 1044059511 /nfs/dbraw/zinc/05/95/11/1044059511.db2.gz TVFNKXAYYSPFMH-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC23CCCC3)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168048175 1044079792 /nfs/dbraw/zinc/07/97/92/1044079792.db2.gz UJELKQUDAMCCDI-OPVJXMOQSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC23CCCC3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168048175 1044079808 /nfs/dbraw/zinc/07/98/08/1044079808.db2.gz UJELKQUDAMCCDI-OPVJXMOQSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC23CCCC3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168048175 1044079821 /nfs/dbraw/zinc/07/98/21/1044079821.db2.gz UJELKQUDAMCCDI-OPVJXMOQSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC23CCCC3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168048175 1044079837 /nfs/dbraw/zinc/07/98/37/1044079837.db2.gz UJELKQUDAMCCDI-OPVJXMOQSA-N 2 1 312.501 4.447 20 0 DIADMP CC[N@H+](CCC1CC[NH+](Cc2csc(C)n2)CC1)CC(C)C ZINC000358744098 1044097861 /nfs/dbraw/zinc/09/78/61/1044097861.db2.gz MBWYNUBSQXHZEU-UHFFFAOYSA-N 2 1 323.550 4.032 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2csc(C)n2)CC1)CC(C)C ZINC000358744098 1044097874 /nfs/dbraw/zinc/09/78/74/1044097874.db2.gz MBWYNUBSQXHZEU-UHFFFAOYSA-N 2 1 323.550 4.032 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3occc32)CC1 ZINC000359101102 1044129837 /nfs/dbraw/zinc/12/98/37/1044129837.db2.gz CQYTYCFLTYKVJS-LZQZEXGQSA-N 2 1 316.489 4.290 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000359427011 1044165757 /nfs/dbraw/zinc/16/57/57/1044165757.db2.gz FSOPHWMYGVMMPT-WMLDXEAASA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000359427011 1044165761 /nfs/dbraw/zinc/16/57/61/1044165761.db2.gz FSOPHWMYGVMMPT-WMLDXEAASA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000359659689 1044187810 /nfs/dbraw/zinc/18/78/10/1044187810.db2.gz ISROZVQDOSGFCT-MRXNPFEDSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCOc3ccccc32)C1 ZINC000359943558 1044218394 /nfs/dbraw/zinc/21/83/94/1044218394.db2.gz QJJYQHOXMZCCNL-IEBWSBKVSA-N 2 1 316.489 4.002 20 0 DIADMP Cc1sccc1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000293680044 1044313085 /nfs/dbraw/zinc/31/30/85/1044313085.db2.gz AJCKRHQRXBKJLN-UHFFFAOYSA-N 2 1 302.487 4.187 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1cc2cc(F)ccc2o1)C1CCCCC1 ZINC000360864517 1044320570 /nfs/dbraw/zinc/32/05/70/1044320570.db2.gz JMWBEJZTRPHMAZ-UHFFFAOYSA-N 2 1 318.436 4.316 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1cc2cc(F)ccc2o1)C1CCCCC1 ZINC000360864517 1044320578 /nfs/dbraw/zinc/32/05/78/1044320578.db2.gz JMWBEJZTRPHMAZ-UHFFFAOYSA-N 2 1 318.436 4.316 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000564084571 1044338621 /nfs/dbraw/zinc/33/86/21/1044338621.db2.gz PJWMYPJYBMLSSD-WRURNZQNSA-N 2 1 300.490 4.031 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475288856 1044346519 /nfs/dbraw/zinc/34/65/19/1044346519.db2.gz UYUPPFQQJZOYRZ-AZUAARDMSA-N 2 1 300.490 4.233 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000361378150 1044399833 /nfs/dbraw/zinc/39/98/33/1044399833.db2.gz QOCGATYISZWIIX-UYAOXDASSA-N 2 1 322.452 4.037 20 0 DIADMP C[C@@H]1C[C@@H](N2CC3CCC2CC3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168065697 1044411259 /nfs/dbraw/zinc/41/12/59/1044411259.db2.gz XROJGNFMWOTCHT-WOKRCIATSA-N 2 1 312.501 4.302 20 0 DIADMP CC[C@@H]1CC[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168066250 1044419061 /nfs/dbraw/zinc/41/90/61/1044419061.db2.gz MEJRXEIBFPHHMY-KZNAEPCWSA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CC[N@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168066250 1044419064 /nfs/dbraw/zinc/41/90/64/1044419064.db2.gz MEJRXEIBFPHHMY-KZNAEPCWSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753567 1044439545 /nfs/dbraw/zinc/43/95/45/1044439545.db2.gz KTVHZOQIENTELC-SKDZVZGDSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753567 1044439552 /nfs/dbraw/zinc/43/95/52/1044439552.db2.gz KTVHZOQIENTELC-SKDZVZGDSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCSc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753903 1044440526 /nfs/dbraw/zinc/44/05/26/1044440526.db2.gz LNUVJEBVTZDPMD-XPKDYRNWSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCSc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753903 1044440537 /nfs/dbraw/zinc/44/05/37/1044440537.db2.gz LNUVJEBVTZDPMD-XPKDYRNWSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCSc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753898 1044440911 /nfs/dbraw/zinc/44/09/11/1044440911.db2.gz LNUVJEBVTZDPMD-INWMFGNUSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCSc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753898 1044440921 /nfs/dbraw/zinc/44/09/21/1044440921.db2.gz LNUVJEBVTZDPMD-INWMFGNUSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1cccnc1 ZINC000112528168 1044442997 /nfs/dbraw/zinc/44/29/97/1044442997.db2.gz AKWPYYRYABEFRY-ROUUACIJSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1cscc1C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000565744578 1044455419 /nfs/dbraw/zinc/45/54/19/1044455419.db2.gz WYHLGICAXSCJCJ-WMZOPIPTSA-N 2 1 314.498 4.057 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccccc2)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000565979178 1044467503 /nfs/dbraw/zinc/46/75/03/1044467503.db2.gz YIVACTAJCDEGLM-CBQGHPETSA-N 2 1 320.480 4.411 20 0 DIADMP C[NH+](Cc1cccc(-c2ccccc2)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000565979178 1044467507 /nfs/dbraw/zinc/46/75/07/1044467507.db2.gz YIVACTAJCDEGLM-CBQGHPETSA-N 2 1 320.480 4.411 20 0 DIADMP C[NH+](Cc1cccc(-c2ccccc2)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000565979178 1044467513 /nfs/dbraw/zinc/46/75/13/1044467513.db2.gz YIVACTAJCDEGLM-CBQGHPETSA-N 2 1 320.480 4.411 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000566884561 1044524986 /nfs/dbraw/zinc/52/49/86/1044524986.db2.gz PDMXCRFBZSXMFA-MRXNPFEDSA-N 2 1 324.255 4.239 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000338010116 1044535735 /nfs/dbraw/zinc/53/57/35/1044535735.db2.gz DRWRCEKGWKWDIM-HNNXBMFYSA-N 2 1 321.877 4.062 20 0 DIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000567296125 1044555912 /nfs/dbraw/zinc/55/59/12/1044555912.db2.gz BFLYZQPFSCKTBK-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000567296125 1044555923 /nfs/dbraw/zinc/55/59/23/1044555923.db2.gz BFLYZQPFSCKTBK-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315278 1044600381 /nfs/dbraw/zinc/60/03/81/1044600381.db2.gz JQJNSEYCOPNHHC-ROUUACIJSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000523315278 1044600389 /nfs/dbraw/zinc/60/03/89/1044600389.db2.gz JQJNSEYCOPNHHC-ROUUACIJSA-N 2 1 318.480 4.331 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)cc1 ZINC000348367701 1044622020 /nfs/dbraw/zinc/62/20/20/1044622020.db2.gz FSENHVBDBXBKIU-ZFWWWQNUSA-N 2 1 319.399 4.267 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)cc1 ZINC000348367697 1044622776 /nfs/dbraw/zinc/62/27/76/1044622776.db2.gz FSENHVBDBXBKIU-UKRRQHHQSA-N 2 1 319.399 4.267 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(-c2ccncc2)c1 ZINC000364452842 1044664606 /nfs/dbraw/zinc/66/46/06/1044664606.db2.gz ZEOZAOLXASTZKB-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CCCSC(C)(C)C)CC2)[nH+]c1C ZINC000886659244 1044676640 /nfs/dbraw/zinc/67/66/40/1044676640.db2.gz HMMYBVRWGYLUGO-UHFFFAOYSA-N 2 1 309.523 4.128 20 0 DIADMP CCCC(C)(C)[N@H+](CCn1cc[nH+]c1C)Cc1cccs1 ZINC000569747997 1044709908 /nfs/dbraw/zinc/70/99/08/1044709908.db2.gz FCEOZDKAALMSTD-UHFFFAOYSA-N 2 1 305.491 4.334 20 0 DIADMP CCCC(C)(C)[N@@H+](CCn1cc[nH+]c1C)Cc1cccs1 ZINC000569747997 1044709921 /nfs/dbraw/zinc/70/99/21/1044709921.db2.gz FCEOZDKAALMSTD-UHFFFAOYSA-N 2 1 305.491 4.334 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000569748351 1044710600 /nfs/dbraw/zinc/71/06/00/1044710600.db2.gz OVVUCCBHDKYHKA-QIJZPMMNSA-N 2 1 314.517 4.280 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000366426632 1044719182 /nfs/dbraw/zinc/71/91/82/1044719182.db2.gz AGHXHKXZPWGBNE-ODIFPOPNSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+]CC[C@@H]3CCC[N@H+](C)C3)c2)cc1 ZINC001202749575 1044783143 /nfs/dbraw/zinc/78/31/43/1044783143.db2.gz JQHKHGCZNLGEGU-IBGZPJMESA-N 2 1 322.496 4.484 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCS2 ZINC000368753953 1044787104 /nfs/dbraw/zinc/78/71/04/1044787104.db2.gz NWKXYHUMTWLKST-SOLBZPMBSA-N 2 1 316.514 4.057 20 0 DIADMP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccnc2Cl)c1 ZINC000123924621 1044787818 /nfs/dbraw/zinc/78/78/18/1044787818.db2.gz HPRSFERGEDZCBT-CQSZACIVSA-N 2 1 317.864 4.038 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccnc2Cl)c1 ZINC000123924621 1044787827 /nfs/dbraw/zinc/78/78/27/1044787827.db2.gz HPRSFERGEDZCBT-CQSZACIVSA-N 2 1 317.864 4.038 20 0 DIADMP CSc1ccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)s1 ZINC000570978277 1044791729 /nfs/dbraw/zinc/79/17/29/1044791729.db2.gz UBOPYPQIBUPODO-UHFFFAOYSA-N 2 1 300.537 4.069 20 0 DIADMP CCc1[nH+]c2ccccc2c(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1C ZINC000571114798 1044797388 /nfs/dbraw/zinc/79/73/88/1044797388.db2.gz UVWHQGJPHPKJGZ-OAHLLOKOSA-N 2 1 320.440 4.213 20 0 DIADMP CCC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1ccccc1 ZINC000126296142 1044810636 /nfs/dbraw/zinc/81/06/36/1044810636.db2.gz HQXCAKQNGSMGHW-IBGZPJMESA-N 2 1 320.440 4.207 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(F)cc1)C(C)C ZINC000337430637 1044900241 /nfs/dbraw/zinc/90/02/41/1044900241.db2.gz UWNACHOHCWKAKG-SFHVURJKSA-N 2 1 303.425 4.098 20 0 DIADMP CSc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC000573845152 1044927229 /nfs/dbraw/zinc/92/72/29/1044927229.db2.gz RLUDJARZTSKJAF-IHBAFOEMSA-N 2 1 316.514 4.001 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC(C)(C)C)cc1 ZINC000372806292 1044928357 /nfs/dbraw/zinc/92/83/57/1044928357.db2.gz UHJPYKIRDVIUAT-SZMVWBNQSA-N 2 1 316.489 4.141 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCCc2ccc(Cl)cc21 ZINC000338020404 1044973909 /nfs/dbraw/zinc/97/39/09/1044973909.db2.gz PIDVAAYBDVDHLT-GOSISDBHSA-N 2 1 317.864 4.292 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)[C@@H](C)c1ccc(Cl)cc1 ZINC000373385866 1044974526 /nfs/dbraw/zinc/97/45/26/1044974526.db2.gz FZNFONCIMIKWKC-NONVJHHQSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCCc2ccc(Cl)cc21 ZINC000338020406 1044974708 /nfs/dbraw/zinc/97/47/08/1044974708.db2.gz PIDVAAYBDVDHLT-SFHVURJKSA-N 2 1 317.864 4.292 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525274302 1045022953 /nfs/dbraw/zinc/02/29/53/1045022953.db2.gz PBMQMTZHEYJWEM-ROUUACIJSA-N 2 1 308.469 4.319 20 0 DIADMP c1ccc2cc(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000525274153 1045023168 /nfs/dbraw/zinc/02/31/68/1045023168.db2.gz TYYLVIMCZADIQC-LJQANCHMSA-N 2 1 308.469 4.148 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1Cl ZINC000575974958 1045023483 /nfs/dbraw/zinc/02/34/83/1045023483.db2.gz IKQLMGAGHPODOI-IJEWVQPXSA-N 2 1 324.896 4.261 20 0 DIADMP C[N@H+](C/C=C\c1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268840 1045026795 /nfs/dbraw/zinc/02/67/95/1045026795.db2.gz BOHVTFCHTUCRAC-NGHDKMLMSA-N 2 1 320.480 4.154 20 0 DIADMP C[N@@H+](C/C=C\c1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268840 1045026800 /nfs/dbraw/zinc/02/68/00/1045026800.db2.gz BOHVTFCHTUCRAC-NGHDKMLMSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C\c1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000525268840 1045026810 /nfs/dbraw/zinc/02/68/10/1045026810.db2.gz BOHVTFCHTUCRAC-NGHDKMLMSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C\c1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000525268840 1045026817 /nfs/dbraw/zinc/02/68/17/1045026817.db2.gz BOHVTFCHTUCRAC-NGHDKMLMSA-N 2 1 320.480 4.154 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3ccccc3s2)C1 ZINC000446745818 1045027911 /nfs/dbraw/zinc/02/79/11/1045027911.db2.gz QODODCCLVLIPED-GJZGRUSLSA-N 2 1 302.487 4.284 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)cc1 ZINC000446748891 1045029106 /nfs/dbraw/zinc/02/91/06/1045029106.db2.gz VBEXYJOQTGGNMO-QHAWAJNXSA-N 2 1 312.501 4.443 20 0 DIADMP Cc1nccn1CCCC[N@H+]1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000411976856 1045040275 /nfs/dbraw/zinc/04/02/75/1045040275.db2.gz FEVXJIPEXQDPIT-FQEVSTJZSA-N 2 1 323.484 4.241 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000411976856 1045040286 /nfs/dbraw/zinc/04/02/86/1045040286.db2.gz FEVXJIPEXQDPIT-FQEVSTJZSA-N 2 1 323.484 4.241 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000411976856 1045040298 /nfs/dbraw/zinc/04/02/98/1045040298.db2.gz FEVXJIPEXQDPIT-FQEVSTJZSA-N 2 1 323.484 4.241 20 0 DIADMP C[N@H+](C[C@H]1CCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000576296540 1045049571 /nfs/dbraw/zinc/04/95/71/1045049571.db2.gz WAYXKCIXOAYLII-KRWDZBQOSA-N 2 1 322.443 4.018 20 0 DIADMP C[N@@H+](C[C@H]1CCC(F)(F)C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000576296540 1045049581 /nfs/dbraw/zinc/04/95/81/1045049581.db2.gz WAYXKCIXOAYLII-KRWDZBQOSA-N 2 1 322.443 4.018 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)C2CCCC2)cc1 ZINC000446838691 1045054865 /nfs/dbraw/zinc/05/48/65/1045054865.db2.gz LBUKNFWWEYJYBB-NSISKUIASA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)C2CCCC2)cc1 ZINC000446838691 1045054879 /nfs/dbraw/zinc/05/48/79/1045054879.db2.gz LBUKNFWWEYJYBB-NSISKUIASA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)C2CCCC2)cc1 ZINC000446838692 1045055504 /nfs/dbraw/zinc/05/55/04/1045055504.db2.gz LBUKNFWWEYJYBB-PWIZWCRZSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)C2CCCC2)cc1 ZINC000446838692 1045055514 /nfs/dbraw/zinc/05/55/14/1045055514.db2.gz LBUKNFWWEYJYBB-PWIZWCRZSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623379473 1045065168 /nfs/dbraw/zinc/06/51/68/1045065168.db2.gz RWSKLCQGSZSPCP-WMZOPIPTSA-N 2 1 302.506 4.205 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@@H]3CC[N@@H+](C)C[C@@H]3C)o2)cc1 ZINC000577026511 1045097321 /nfs/dbraw/zinc/09/73/21/1045097321.db2.gz PWGNWTLROVAVRO-QFBILLFUSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@@H]3CC[N@H+](C)C[C@@H]3C)o2)cc1 ZINC000577026511 1045097334 /nfs/dbraw/zinc/09/73/34/1045097334.db2.gz PWGNWTLROVAVRO-QFBILLFUSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CC[NH+](C)C[C@@H]3C)o2)cc1 ZINC000577026511 1045097343 /nfs/dbraw/zinc/09/73/43/1045097343.db2.gz PWGNWTLROVAVRO-QFBILLFUSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CC[NH+](C)C[C@@H]3C)o2)cc1 ZINC000577026511 1045097355 /nfs/dbraw/zinc/09/73/55/1045097355.db2.gz PWGNWTLROVAVRO-QFBILLFUSA-N 2 1 312.457 4.027 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)c(F)c1 ZINC000467839911 1045133707 /nfs/dbraw/zinc/13/37/07/1045133707.db2.gz FMBSBAWHMGHDPI-CABCVRRESA-N 2 1 310.432 4.270 20 0 DIADMP Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H]1CCN(C)[C@H](C)C1 ZINC000447560355 1045148851 /nfs/dbraw/zinc/14/88/51/1045148851.db2.gz VQPZZNMRXNXQAO-FMKPAKJESA-N 2 1 314.395 4.061 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000525981560 1045149231 /nfs/dbraw/zinc/14/92/31/1045149231.db2.gz BSGMCIVINIWDFM-IYBDPMFKSA-N 2 1 324.459 4.472 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(C(F)F)cc1 ZINC000525980866 1045149482 /nfs/dbraw/zinc/14/94/82/1045149482.db2.gz KGJQEQNLPZRLCY-OAHLLOKOSA-N 2 1 310.432 4.368 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000447587486 1045152527 /nfs/dbraw/zinc/15/25/27/1045152527.db2.gz QLZCVMKXEBSJPH-NQQSBDJJSA-N 2 1 312.501 4.350 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447583798 1045152684 /nfs/dbraw/zinc/15/26/84/1045152684.db2.gz CMTPOQALOMSFBO-HAGHYFMRSA-N 2 1 312.501 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CC24CCCC4)C3)cc1 ZINC000447600706 1045158619 /nfs/dbraw/zinc/15/86/19/1045158619.db2.gz NCNGCJXOVZEXJG-HAGHYFMRSA-N 2 1 310.485 4.104 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CCCc3c(Cl)ccnc32)CC(C)(C)[NH2+]1 ZINC000924570271 1045178205 /nfs/dbraw/zinc/17/82/05/1045178205.db2.gz NXDNYHBNQQQQPS-OAHLLOKOSA-N 2 1 321.896 4.011 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1csc2ccccc12 ZINC000924648573 1045187636 /nfs/dbraw/zinc/18/76/36/1045187636.db2.gz LTJVKZRUEFFTGF-UONOGXRCSA-N 2 1 300.471 4.036 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ncc(C(C)(C)C)s2)C1 ZINC000447935796 1045191973 /nfs/dbraw/zinc/19/19/73/1045191973.db2.gz JUPLMPUBRZICAQ-OAHLLOKOSA-N 2 1 323.550 4.042 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000577984271 1045195095 /nfs/dbraw/zinc/19/50/95/1045195095.db2.gz HVKJHXKRROADQY-CVEARBPZSA-N 2 1 306.519 4.128 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000577984271 1045195101 /nfs/dbraw/zinc/19/51/01/1045195101.db2.gz HVKJHXKRROADQY-CVEARBPZSA-N 2 1 306.519 4.128 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)Cc3ccccc3)C2)s1 ZINC000578401073 1045240708 /nfs/dbraw/zinc/24/07/08/1045240708.db2.gz ZKLLEHACZBXPCF-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)Cc3ccccc3)C2)s1 ZINC000578401073 1045240716 /nfs/dbraw/zinc/24/07/16/1045240716.db2.gz ZKLLEHACZBXPCF-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)Cc3ccccc3)C2)s1 ZINC000578401073 1045240724 /nfs/dbraw/zinc/24/07/24/1045240724.db2.gz ZKLLEHACZBXPCF-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)CC[N@@H+]1C ZINC000527664018 1045245987 /nfs/dbraw/zinc/24/59/87/1045245987.db2.gz CHQDLSAUXBKMEK-BTHPGYMESA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)CC[N@H+]1C ZINC000527664018 1045245994 /nfs/dbraw/zinc/24/59/94/1045245994.db2.gz CHQDLSAUXBKMEK-BTHPGYMESA-N 2 1 300.490 4.175 20 0 DIADMP c1cn2c([nH+]1)CC[C@@H](C[NH2+][C@H]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC000527695194 1045249989 /nfs/dbraw/zinc/24/99/89/1045249989.db2.gz LUPJUPQPPIGSDA-SXLOBPIMSA-N 2 1 323.484 4.152 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000697101672 1045311993 /nfs/dbraw/zinc/31/19/93/1045311993.db2.gz PNYJELRJUWJHNV-RDJZCZTQSA-N 2 1 324.459 4.311 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449061597 1045338822 /nfs/dbraw/zinc/33/88/22/1045338822.db2.gz GSYMVIIFXZNEAR-MAUKXSAKSA-N 2 1 306.881 4.050 20 0 DIADMP Clc1ccc([C@@H]2CC[C@@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)C2)cc1 ZINC000449078397 1045345079 /nfs/dbraw/zinc/34/50/79/1045345079.db2.gz UWQOBFWAKANCPW-QGPMSJSTSA-N 2 1 318.892 4.050 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CCCC34CCC4)C2)c1 ZINC000449106378 1045346715 /nfs/dbraw/zinc/34/67/15/1045346715.db2.gz LQPMWIFFTXINIT-AEFFLSMTSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCCC34CCC4)C2)c1 ZINC000449106378 1045346719 /nfs/dbraw/zinc/34/67/19/1045346719.db2.gz LQPMWIFFTXINIT-AEFFLSMTSA-N 2 1 318.530 4.273 20 0 DIADMP Cc1ncsc1C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449125359 1045349683 /nfs/dbraw/zinc/34/96/83/1045349683.db2.gz JETLTYFTVQGCDB-UHFFFAOYSA-N 2 1 323.550 4.220 20 0 DIADMP Cc1cc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cs1 ZINC000449193102 1045357750 /nfs/dbraw/zinc/35/77/50/1045357750.db2.gz QJCYVWSYAUFGHW-AWEZNQCLSA-N 2 1 311.454 4.401 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cccc(C)c2F)cc1 ZINC000449189770 1045358414 /nfs/dbraw/zinc/35/84/14/1045358414.db2.gz MQQXDEDVZIRTGI-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP CC[N@@H+](CCCCn1ccnc1C)[C@@H](C)c1ccc(F)cc1 ZINC000119420727 1045427011 /nfs/dbraw/zinc/42/70/11/1045427011.db2.gz RVASZJICJHPUJA-HNNXBMFYSA-N 2 1 303.425 4.194 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)[C@@H](C)c1ccc(F)cc1 ZINC000119420727 1045427012 /nfs/dbraw/zinc/42/70/12/1045427012.db2.gz RVASZJICJHPUJA-HNNXBMFYSA-N 2 1 303.425 4.194 20 0 DIADMP CC[N@@H+](CCCCn1cc[nH+]c1C)[C@@H](C)c1ccc(F)cc1 ZINC000119420727 1045427015 /nfs/dbraw/zinc/42/70/15/1045427015.db2.gz RVASZJICJHPUJA-HNNXBMFYSA-N 2 1 303.425 4.194 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)C2CC(F)(F)C2)cc1 ZINC000529540606 1045491452 /nfs/dbraw/zinc/49/14/52/1045491452.db2.gz FJDASEQFBGZWKY-OLZOCXBDSA-N 2 1 319.399 4.265 20 0 DIADMP C(=C\c1ccccc1)\CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000450602762 1045523924 /nfs/dbraw/zinc/52/39/24/1045523924.db2.gz RTRXKWZQUAGLSC-CGGWXRJGSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C\c1ccccc1)\CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000450602762 1045523937 /nfs/dbraw/zinc/52/39/37/1045523937.db2.gz RTRXKWZQUAGLSC-CGGWXRJGSA-N 2 1 310.485 4.039 20 0 DIADMP C(=C\c1ccccc1)\CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000450602762 1045523949 /nfs/dbraw/zinc/52/39/49/1045523949.db2.gz RTRXKWZQUAGLSC-CGGWXRJGSA-N 2 1 310.485 4.039 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728667 1045555363 /nfs/dbraw/zinc/55/53/63/1045555363.db2.gz PKEZILHOBBLSJU-JYJNAYRXSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H]([NH2+]CC/C=C\c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450729065 1045555518 /nfs/dbraw/zinc/55/55/18/1045555518.db2.gz QZVBWZXESBVYED-GCSNRRRASA-N 2 1 312.501 4.333 20 0 DIADMP CC1CCC([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000381023719 1045557917 /nfs/dbraw/zinc/55/79/17/1045557917.db2.gz XEGVYVMEBJVTGD-UUKMXZOPSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)SCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390870309 1045584807 /nfs/dbraw/zinc/58/48/07/1045584807.db2.gz FTUCEJLXWMSSPE-SFHVURJKSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)SCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390870309 1045584816 /nfs/dbraw/zinc/58/48/16/1045584816.db2.gz FTUCEJLXWMSSPE-SFHVURJKSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccccc2)cc1 ZINC000392195649 1045641269 /nfs/dbraw/zinc/64/12/69/1045641269.db2.gz SDSVVPABRMBUTO-KRWDZBQOSA-N 2 1 306.453 4.266 20 0 DIADMP CC[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000392262317 1045649192 /nfs/dbraw/zinc/64/91/92/1045649192.db2.gz RRVAIZJZCXTHEP-MRXNPFEDSA-N 2 1 313.272 4.296 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394400 1045656599 /nfs/dbraw/zinc/65/65/99/1045656599.db2.gz JFFLIDCRWICHKP-DZGCQCFKSA-N 2 1 304.409 4.097 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394400 1045656606 /nfs/dbraw/zinc/65/66/06/1045656606.db2.gz JFFLIDCRWICHKP-DZGCQCFKSA-N 2 1 304.409 4.097 20 0 DIADMP Clc1oc2ccccc2c1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000629522718 1045676236 /nfs/dbraw/zinc/67/62/36/1045676236.db2.gz HCDAOVDJJOMJGO-VNQPRFMTSA-N 2 1 318.848 4.097 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccccc2CC(F)(F)F)c2ccccc21 ZINC000629553609 1045678723 /nfs/dbraw/zinc/67/87/23/1045678723.db2.gz BCTOUDOCBGQDPQ-IRXDYDNUSA-N 2 1 320.358 4.026 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc2cccc(F)c2o1 ZINC000530544647 1045687918 /nfs/dbraw/zinc/68/79/18/1045687918.db2.gz HGCHOYGFUNKHBA-ZDUSSCGKSA-N 2 1 316.420 4.097 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666053 1045707008 /nfs/dbraw/zinc/70/70/08/1045707008.db2.gz SNKRRJUKDULZFX-JSGCOSHPSA-N 2 1 315.288 4.298 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666053 1045707015 /nfs/dbraw/zinc/70/70/15/1045707015.db2.gz SNKRRJUKDULZFX-JSGCOSHPSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666053 1045707024 /nfs/dbraw/zinc/70/70/24/1045707024.db2.gz SNKRRJUKDULZFX-JSGCOSHPSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666053 1045707042 /nfs/dbraw/zinc/70/70/42/1045707042.db2.gz SNKRRJUKDULZFX-JSGCOSHPSA-N 2 1 315.288 4.298 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666044 1045707839 /nfs/dbraw/zinc/70/78/39/1045707839.db2.gz SNKRRJUKDULZFX-GXTWGEPZSA-N 2 1 315.288 4.298 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666044 1045707845 /nfs/dbraw/zinc/70/78/45/1045707845.db2.gz SNKRRJUKDULZFX-GXTWGEPZSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666044 1045707850 /nfs/dbraw/zinc/70/78/50/1045707850.db2.gz SNKRRJUKDULZFX-GXTWGEPZSA-N 2 1 315.288 4.298 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1C ZINC000530666044 1045707857 /nfs/dbraw/zinc/70/78/57/1045707857.db2.gz SNKRRJUKDULZFX-GXTWGEPZSA-N 2 1 315.288 4.298 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1ccc(F)cc1C ZINC000451984131 1045755011 /nfs/dbraw/zinc/75/50/11/1045755011.db2.gz HCICZZFEBFCFSJ-IBGZPJMESA-N 2 1 315.436 4.256 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1ccc(F)cc1C ZINC000451984131 1045755023 /nfs/dbraw/zinc/75/50/23/1045755023.db2.gz HCICZZFEBFCFSJ-IBGZPJMESA-N 2 1 315.436 4.256 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)C2CCCCCC2)cn1 ZINC000753626996 1045781002 /nfs/dbraw/zinc/78/10/02/1045781002.db2.gz UBVXQPUDEJGZGI-OAHLLOKOSA-N 2 1 312.461 4.024 20 0 DIADMP COc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC000753656323 1045784128 /nfs/dbraw/zinc/78/41/28/1045784128.db2.gz ZZCOVEDDJBWJCE-QZTJIDSGSA-N 2 1 318.505 4.083 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CCN1C ZINC000531143661 1045791221 /nfs/dbraw/zinc/79/12/21/1045791221.db2.gz MUDJWLKKWBVGGP-DYESRHJHSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143661 1045791259 /nfs/dbraw/zinc/79/12/59/1045791259.db2.gz MUDJWLKKWBVGGP-DYESRHJHSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143661 1045791268 /nfs/dbraw/zinc/79/12/68/1045791268.db2.gz MUDJWLKKWBVGGP-DYESRHJHSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CCN1C ZINC000531143664 1045791535 /nfs/dbraw/zinc/79/15/35/1045791535.db2.gz MUDJWLKKWBVGGP-UWJYYQICSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143664 1045791566 /nfs/dbraw/zinc/79/15/66/1045791566.db2.gz MUDJWLKKWBVGGP-UWJYYQICSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143664 1045791577 /nfs/dbraw/zinc/79/15/77/1045791577.db2.gz MUDJWLKKWBVGGP-UWJYYQICSA-N 2 1 308.469 4.268 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000531340251 1045828674 /nfs/dbraw/zinc/82/86/74/1045828674.db2.gz DSTYKYSQQLTPPX-SFHVURJKSA-N 2 1 308.469 4.004 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C(C1CCCC1)C1CCCC1 ZINC000754150889 1045855342 /nfs/dbraw/zinc/85/53/42/1045855342.db2.gz UUPPDFYNQWXOIB-UHFFFAOYSA-N 2 1 303.494 4.310 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2ncccc21 ZINC000631568561 1045871405 /nfs/dbraw/zinc/87/14/05/1045871405.db2.gz DXPORVVQXZIETE-NRFANRHFSA-N 2 1 323.484 4.089 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@@H+]1C ZINC000531683326 1045896911 /nfs/dbraw/zinc/89/69/11/1045896911.db2.gz GPBXWGUUHCDUSN-JLSDUUJJSA-N 2 1 306.469 4.375 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@H+]1C ZINC000531683326 1045896917 /nfs/dbraw/zinc/89/69/17/1045896917.db2.gz GPBXWGUUHCDUSN-JLSDUUJJSA-N 2 1 306.469 4.375 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)s1 ZINC000631706565 1045906836 /nfs/dbraw/zinc/90/68/36/1045906836.db2.gz IDXJOJNYYSBTKT-KEYYUXOJSA-N 2 1 321.534 4.145 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CC1 ZINC000531723445 1045912553 /nfs/dbraw/zinc/91/25/53/1045912553.db2.gz AEKDUACSXOSLGG-DBVUQKKJSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CC1 ZINC000531723445 1045912559 /nfs/dbraw/zinc/91/25/59/1045912559.db2.gz AEKDUACSXOSLGG-DBVUQKKJSA-N 2 1 300.490 4.064 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1csc2ccccc12 ZINC000754740780 1045923023 /nfs/dbraw/zinc/92/30/23/1045923023.db2.gz UCNCWZPNDBIXML-KBPBESRZSA-N 2 1 313.470 4.393 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2sccc21 ZINC000453082679 1045929299 /nfs/dbraw/zinc/92/92/99/1045929299.db2.gz MEGMNDCLBTZYOE-GUYCJALGSA-N 2 1 304.503 4.293 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccsc1 ZINC000453118705 1045944271 /nfs/dbraw/zinc/94/42/71/1045944271.db2.gz JXXMSUBHVQYXGZ-KRWDZBQOSA-N 2 1 315.486 4.161 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)[C@@H]1c1cccs1 ZINC000453124160 1045946666 /nfs/dbraw/zinc/94/66/66/1045946666.db2.gz NRFGSAXLZTZTST-BHIYHBOVSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](C2CC2)C2CCC2)[C@@H]1c1cccs1 ZINC000453124160 1045946680 /nfs/dbraw/zinc/94/66/80/1045946680.db2.gz NRFGSAXLZTZTST-BHIYHBOVSA-N 2 1 318.530 4.299 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)c1ccncc1 ZINC000453126532 1045947104 /nfs/dbraw/zinc/94/71/04/1045947104.db2.gz QKUXFPHXUJZPNF-DYESRHJHSA-N 2 1 323.484 4.348 20 0 DIADMP CC(F)(F)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453215792 1045987809 /nfs/dbraw/zinc/98/78/09/1045987809.db2.gz GZXYLVCEDUPDOA-RCCFBDPRSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc2)cc1 ZINC000453336733 1046041965 /nfs/dbraw/zinc/04/19/65/1046041965.db2.gz FLNDHWBVKJWXSD-KBRMVUAJSA-N 2 1 320.480 4.299 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)cc1 ZINC000453336733 1046041976 /nfs/dbraw/zinc/04/19/76/1046041976.db2.gz FLNDHWBVKJWXSD-KBRMVUAJSA-N 2 1 320.480 4.299 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc2)cc1 ZINC000453336733 1046041991 /nfs/dbraw/zinc/04/19/91/1046041991.db2.gz FLNDHWBVKJWXSD-KBRMVUAJSA-N 2 1 320.480 4.299 20 0 DIADMP Cc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc2)cc1 ZINC000453336735 1046042873 /nfs/dbraw/zinc/04/28/73/1046042873.db2.gz FLNDHWBVKJWXSD-LQCXBHPOSA-N 2 1 320.480 4.299 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)cc1 ZINC000453336735 1046042889 /nfs/dbraw/zinc/04/28/89/1046042889.db2.gz FLNDHWBVKJWXSD-LQCXBHPOSA-N 2 1 320.480 4.299 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc2)cc1 ZINC000453336735 1046042898 /nfs/dbraw/zinc/04/28/98/1046042898.db2.gz FLNDHWBVKJWXSD-LQCXBHPOSA-N 2 1 320.480 4.299 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC000453381480 1046057369 /nfs/dbraw/zinc/05/73/69/1046057369.db2.gz BAIUSEWANWJOHZ-HUHSQHJXSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC000453381480 1046057385 /nfs/dbraw/zinc/05/73/85/1046057385.db2.gz BAIUSEWANWJOHZ-HUHSQHJXSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC000453381481 1046058070 /nfs/dbraw/zinc/05/80/70/1046058070.db2.gz BAIUSEWANWJOHZ-LFVTVUPYSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC000453381481 1046058082 /nfs/dbraw/zinc/05/80/82/1046058082.db2.gz BAIUSEWANWJOHZ-LFVTVUPYSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(OC(C)(C)C)cc1 ZINC000453412633 1046079860 /nfs/dbraw/zinc/07/98/60/1046079860.db2.gz WDRVZRRZEICBPG-INIZCTEOSA-N 2 1 318.505 4.389 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(C(F)(F)F)s2)CC1 ZINC000902850364 1046086078 /nfs/dbraw/zinc/08/60/78/1046086078.db2.gz MXRGAIZEUUXSAN-NSHDSACASA-N 2 1 320.424 4.290 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1c(Cl)oc2ccccc21)C1CC1 ZINC000453594984 1046091645 /nfs/dbraw/zinc/09/16/45/1046091645.db2.gz JFKDKJGUKMJAGI-UHFFFAOYSA-N 2 1 306.837 4.050 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCc3c2cccc3Cl)C1 ZINC000532214875 1046116516 /nfs/dbraw/zinc/11/65/16/1046116516.db2.gz YWEQIAUONJLJHY-KDOFPFPSSA-N 2 1 306.881 4.037 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC[N@H+]1C ZINC000532216940 1046116992 /nfs/dbraw/zinc/11/69/92/1046116992.db2.gz MGXLSTKJXPRZKG-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000532235992 1046123892 /nfs/dbraw/zinc/12/38/92/1046123892.db2.gz TYCIDHLEFXOAOJ-CVYDXHPNSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000532235992 1046123895 /nfs/dbraw/zinc/12/38/95/1046123895.db2.gz TYCIDHLEFXOAOJ-CVYDXHPNSA-N 2 1 306.519 4.299 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCCC[C@H]1/C=C\c1ccccc1 ZINC001168146255 1046149035 /nfs/dbraw/zinc/14/90/35/1046149035.db2.gz QYGXBTOYAGEUCW-ODLZTCLXSA-N 2 1 323.484 4.311 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCCC[C@H]1/C=C\c1ccccc1 ZINC001168146255 1046149040 /nfs/dbraw/zinc/14/90/40/1046149040.db2.gz QYGXBTOYAGEUCW-ODLZTCLXSA-N 2 1 323.484 4.311 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccccc1Cl ZINC000903055739 1046150677 /nfs/dbraw/zinc/15/06/77/1046150677.db2.gz KMTQHNDDBGYNRE-WYQXTGKHSA-N 2 1 304.865 4.148 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccccc1Cl ZINC000903055739 1046150684 /nfs/dbraw/zinc/15/06/84/1046150684.db2.gz KMTQHNDDBGYNRE-WYQXTGKHSA-N 2 1 304.865 4.148 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)C2CC2)cc1 ZINC000903066790 1046152182 /nfs/dbraw/zinc/15/21/82/1046152182.db2.gz LOYMYPNLIDVECM-VCYXJBJXSA-N 2 1 310.485 4.194 20 0 DIADMP CC(C)(CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccccc1 ZINC000903076896 1046157275 /nfs/dbraw/zinc/15/72/75/1046157275.db2.gz WHHBGQBZCANFKO-CTXDPNEZSA-N 2 1 312.501 4.102 20 0 DIADMP Clc1cccc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c1 ZINC000903116711 1046168037 /nfs/dbraw/zinc/16/80/37/1046168037.db2.gz NCSXCJUEFLUVGT-JLYLLQBASA-N 2 1 318.892 4.020 20 0 DIADMP Clc1ccc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903116075 1046168331 /nfs/dbraw/zinc/16/83/31/1046168331.db2.gz JTQWLJXLKPZLTC-JLYLLQBASA-N 2 1 318.892 4.020 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1cc2ccccc2o1 ZINC000903158086 1046178439 /nfs/dbraw/zinc/17/84/39/1046178439.db2.gz QMOOIZJQFSUOMR-PNFOFYCQSA-N 2 1 310.441 4.241 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1cc2ccccc2o1 ZINC000903158086 1046178445 /nfs/dbraw/zinc/17/84/45/1046178445.db2.gz QMOOIZJQFSUOMR-PNFOFYCQSA-N 2 1 310.441 4.241 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(OCC)cc2C)CC1 ZINC001138436361 1046180445 /nfs/dbraw/zinc/18/04/45/1046180445.db2.gz FDWIRBYYXNDRMH-UHFFFAOYSA-N 2 1 318.505 4.090 20 0 DIADMP Cc1c2ccccc2sc1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001138458810 1046189832 /nfs/dbraw/zinc/18/98/32/1046189832.db2.gz JJUUHFPEPPFIHH-UHFFFAOYSA-N 2 1 314.498 4.270 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)cc1 ZINC001138543884 1046218567 /nfs/dbraw/zinc/21/85/67/1046218567.db2.gz YOWHCVBFPFLRDX-MRXNPFEDSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCc3ccccc3[C@H]2C)cc1 ZINC001138543884 1046218585 /nfs/dbraw/zinc/21/85/85/1046218585.db2.gz YOWHCVBFPFLRDX-MRXNPFEDSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)cc1 ZINC001138543883 1046219262 /nfs/dbraw/zinc/21/92/62/1046219262.db2.gz YOWHCVBFPFLRDX-INIZCTEOSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCc3ccccc3[C@@H]2C)cc1 ZINC001138543883 1046219273 /nfs/dbraw/zinc/21/92/73/1046219273.db2.gz YOWHCVBFPFLRDX-INIZCTEOSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCCc3ccccc3C2)cc1 ZINC001138547193 1046222090 /nfs/dbraw/zinc/22/20/90/1046222090.db2.gz HKZZBPVQBAIVAK-UHFFFAOYSA-N 2 1 317.436 4.129 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCCc3ccccc3C2)cc1 ZINC001138547193 1046222105 /nfs/dbraw/zinc/22/21/05/1046222105.db2.gz HKZZBPVQBAIVAK-UHFFFAOYSA-N 2 1 317.436 4.129 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](CCc1ccc(F)cc1)C1CCCC1 ZINC001168165491 1046223615 /nfs/dbraw/zinc/22/36/15/1046223615.db2.gz YNOPVHXZLLWNEC-IBGZPJMESA-N 2 1 318.480 4.097 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)Cc2ccc(C)cc2)cc1 ZINC001138547929 1046223597 /nfs/dbraw/zinc/22/35/97/1046223597.db2.gz WZFRBKMGAJLGGV-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)Cc2ccc(C)cc2)cc1 ZINC001138547929 1046223613 /nfs/dbraw/zinc/22/36/13/1046223613.db2.gz WZFRBKMGAJLGGV-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC001168165491 1046223631 /nfs/dbraw/zinc/22/36/31/1046223631.db2.gz YNOPVHXZLLWNEC-IBGZPJMESA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC001168165491 1046223645 /nfs/dbraw/zinc/22/36/45/1046223645.db2.gz YNOPVHXZLLWNEC-IBGZPJMESA-N 2 1 318.480 4.097 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccc(Cl)cc2)C1 ZINC001168167417 1046232006 /nfs/dbraw/zinc/23/20/06/1046232006.db2.gz OTDOCBHYYQHZID-YOEHRIQHSA-N 2 1 308.897 4.124 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccc(Cl)cc2)C1 ZINC001168167417 1046232009 /nfs/dbraw/zinc/23/20/09/1046232009.db2.gz OTDOCBHYYQHZID-YOEHRIQHSA-N 2 1 308.897 4.124 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001168172056 1046249016 /nfs/dbraw/zinc/24/90/16/1046249016.db2.gz ZMHJACDUOBDBGE-NVXWUHKLSA-N 2 1 308.897 4.112 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+][C@@H]1CC[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000903380529 1046261138 /nfs/dbraw/zinc/26/11/38/1046261138.db2.gz NFHBAPOIEWLHHD-NRSPTQNISA-N 2 1 323.484 4.000 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000638319610 1046315808 /nfs/dbraw/zinc/31/58/08/1046315808.db2.gz YVBSGKURIGEBCW-LDQXTDLNSA-N 2 1 321.468 4.100 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000638319610 1046315819 /nfs/dbraw/zinc/31/58/19/1046315819.db2.gz YVBSGKURIGEBCW-LDQXTDLNSA-N 2 1 321.468 4.100 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903896283 1046337464 /nfs/dbraw/zinc/33/74/64/1046337464.db2.gz ADRQYBKGLRNXFO-HNSVSWJLSA-N 2 1 321.534 4.098 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cccc(OC(C)C)c2)CC1 ZINC001138987635 1046348350 /nfs/dbraw/zinc/34/83/50/1046348350.db2.gz WIDDZWJFZKMFIM-UHFFFAOYSA-N 2 1 318.505 4.170 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)CC(F)F ZINC000639284253 1046377694 /nfs/dbraw/zinc/37/76/94/1046377694.db2.gz WHXYPIQHCWHIQO-QILLFSRXSA-N 2 1 322.443 4.235 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)CC(F)F ZINC000639284253 1046377705 /nfs/dbraw/zinc/37/77/05/1046377705.db2.gz WHXYPIQHCWHIQO-QILLFSRXSA-N 2 1 322.443 4.235 20 0 DIADMP CCCCC(CCCC)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001258383440 1046388972 /nfs/dbraw/zinc/38/89/72/1046388972.db2.gz QCHXAGVNMWBEOD-UHFFFAOYSA-N 3 1 313.574 4.211 20 0 DIADMP CC1CCC([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001168206374 1046421228 /nfs/dbraw/zinc/42/12/28/1046421228.db2.gz RJHCRRRHVCBALN-PSYANXERSA-N 2 1 318.480 4.476 20 0 DIADMP CC1CCC([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)CC1 ZINC001168214586 1046423864 /nfs/dbraw/zinc/42/38/64/1046423864.db2.gz BKVQTMILYDHSLU-UHFFFAOYSA-N 2 1 316.489 4.146 20 0 DIADMP c1cn(-c2ccc(C[N@H+]3CCC[C@@H](c4ccccc4)C3)cc2)cn1 ZINC001139360215 1046436855 /nfs/dbraw/zinc/43/68/55/1046436855.db2.gz LRHGLTRZZSDTID-HXUWFJFHSA-N 2 1 317.436 4.252 20 0 DIADMP c1cn(-c2ccc(C[N@H+]3CCC[C@H](c4ccccc4)C3)cc2)cn1 ZINC001139360214 1046437025 /nfs/dbraw/zinc/43/70/25/1046437025.db2.gz LRHGLTRZZSDTID-FQEVSTJZSA-N 2 1 317.436 4.252 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccnc1Cl ZINC000246944548 1046443112 /nfs/dbraw/zinc/44/31/12/1046443112.db2.gz HUJPGXWVINHVOE-OWCLPIDISA-N 2 1 323.912 4.144 20 0 DIADMP CC[N@@H+](CCn1ccnc1)Cc1ccc(-c2ccccc2)s1 ZINC001139416448 1046447152 /nfs/dbraw/zinc/44/71/52/1046447152.db2.gz RVVNQQCSKQDWGQ-UHFFFAOYSA-N 2 1 311.454 4.134 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC000677129741 1046466121 /nfs/dbraw/zinc/46/61/21/1046466121.db2.gz OAEZNMWZBKVYAL-KUHUBIRLSA-N 2 1 322.443 4.196 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC000125522657 1046470641 /nfs/dbraw/zinc/47/06/41/1046470641.db2.gz MCHSPDCGHQLWOH-KRWDZBQOSA-N 2 1 301.434 4.182 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000125522657 1046470645 /nfs/dbraw/zinc/47/06/45/1046470645.db2.gz MCHSPDCGHQLWOH-KRWDZBQOSA-N 2 1 301.434 4.182 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125870893 1046474681 /nfs/dbraw/zinc/47/46/81/1046474681.db2.gz XJIVFCNFEZMOOX-KBXCAEBGSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125870893 1046474691 /nfs/dbraw/zinc/47/46/91/1046474691.db2.gz XJIVFCNFEZMOOX-KBXCAEBGSA-N 2 1 310.432 4.126 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccs1 ZINC000677237879 1046476830 /nfs/dbraw/zinc/47/68/30/1046476830.db2.gz PDSXHBJFSHMUHL-JZXOWHBKSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)C(C)(C)C ZINC000677241257 1046477209 /nfs/dbraw/zinc/47/72/09/1046477209.db2.gz OOVLEOOBXURJPB-AOIWGVFYSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-c2cccnc2)cc1 ZINC000677241691 1046477548 /nfs/dbraw/zinc/47/75/48/1046477548.db2.gz SZNPAZASGGRJSQ-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccccc1C(F)F ZINC001139800234 1046518234 /nfs/dbraw/zinc/51/82/34/1046518234.db2.gz HAGBEZYDDUCVSH-IRXDYDNUSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C(F)F ZINC001139800234 1046518243 /nfs/dbraw/zinc/51/82/43/1046518243.db2.gz HAGBEZYDDUCVSH-IRXDYDNUSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccccc1C(F)F ZINC001139800234 1046518254 /nfs/dbraw/zinc/51/82/54/1046518254.db2.gz HAGBEZYDDUCVSH-IRXDYDNUSA-N 2 1 322.443 4.463 20 0 DIADMP CC[NH+](CC)CCCC1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000782537479 1046533726 /nfs/dbraw/zinc/53/37/26/1046533726.db2.gz YMCDTVGXPMXZCV-QINSGFPZSA-N 2 1 307.309 4.139 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3oc21)CC1CC[NH+](C)CC1 ZINC001139855490 1046534043 /nfs/dbraw/zinc/53/40/43/1046534043.db2.gz HGXXKANJIQHKPG-UHFFFAOYSA-N 2 1 322.452 4.360 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)CC(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000694020660 1046535944 /nfs/dbraw/zinc/53/59/44/1046535944.db2.gz FCISDJPJDRKHQH-RDJZCZTQSA-N 2 1 324.459 4.168 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139232 1046591252 /nfs/dbraw/zinc/59/12/52/1046591252.db2.gz BKKWRVHDXUVEQO-WOJBJXKFSA-N 2 1 323.484 4.035 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139232 1046591267 /nfs/dbraw/zinc/59/12/67/1046591267.db2.gz BKKWRVHDXUVEQO-WOJBJXKFSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000237543481 1046598058 /nfs/dbraw/zinc/59/80/58/1046598058.db2.gz QRTOCTVONVNSNF-APWZRJJASA-N 2 1 312.457 4.190 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)c(C)n1 ZINC000678411058 1046630094 /nfs/dbraw/zinc/63/00/94/1046630094.db2.gz GJWPVDAUELNRFY-MRXNPFEDSA-N 2 1 303.494 4.004 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)c(C)n1 ZINC000678411058 1046630096 /nfs/dbraw/zinc/63/00/96/1046630096.db2.gz GJWPVDAUELNRFY-MRXNPFEDSA-N 2 1 303.494 4.004 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000678499869 1046650437 /nfs/dbraw/zinc/65/04/37/1046650437.db2.gz QJCKHDZAKICPBY-LJQANCHMSA-N 2 1 322.496 4.140 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)c1ccc2ccccc2c1 ZINC000533080646 1046651133 /nfs/dbraw/zinc/65/11/33/1046651133.db2.gz HKXNNSBICWSLPE-MRXNPFEDSA-N 2 1 307.441 4.428 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)c1ccc2ccccc2c1 ZINC000533080646 1046651140 /nfs/dbraw/zinc/65/11/40/1046651140.db2.gz HKXNNSBICWSLPE-MRXNPFEDSA-N 2 1 307.441 4.428 20 0 DIADMP Clc1cccc2c1SCC[C@H]2[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546089 1046670764 /nfs/dbraw/zinc/67/07/64/1046670764.db2.gz IEVSKVOFMYFOPB-IUODEOHRSA-N 2 1 322.905 4.141 20 0 DIADMP Cc1ccc([C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547326 1046671465 /nfs/dbraw/zinc/67/14/65/1046671465.db2.gz CUTOYNKPFBJPGU-RTWAWAEBSA-N 2 1 320.480 4.349 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccccn1 ZINC000245949605 1046676765 /nfs/dbraw/zinc/67/67/65/1046676765.db2.gz SGLKHLSZNUEKDO-QZTJIDSGSA-N 2 1 323.484 4.164 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@@H](C)c2ccncc2)CC1)CC(C)C ZINC000678636085 1046682238 /nfs/dbraw/zinc/68/22/38/1046682238.db2.gz ZCRBLPOSZQADEK-SFHVURJKSA-N 2 1 317.521 4.223 20 0 DIADMP CC[NH+](CC)Cc1ccccc1Nc1cc[nH+]cc1C(F)(F)F ZINC001211986495 1046682368 /nfs/dbraw/zinc/68/23/68/1046682368.db2.gz OLIBMBWVZHOCIH-UHFFFAOYSA-N 2 1 323.362 4.108 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000533307351 1046693875 /nfs/dbraw/zinc/69/38/75/1046693875.db2.gz CMNMXSOKGOSHCZ-SQWSFHKJSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC000533425951 1046719503 /nfs/dbraw/zinc/71/95/03/1046719503.db2.gz ULILGJMEJOZVMI-OALUTQOASA-N 2 1 300.490 4.091 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000678892332 1046728023 /nfs/dbraw/zinc/72/80/23/1046728023.db2.gz FNYIYGORPASLSE-UGSOOPFHSA-N 2 1 321.415 4.093 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cccc(C(F)(F)F)c1 ZINC000678997714 1046751928 /nfs/dbraw/zinc/75/19/28/1046751928.db2.gz ISPPMXBIWXMDEX-CJNGLKHVSA-N 2 1 314.395 4.230 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000645465510 1046793059 /nfs/dbraw/zinc/79/30/59/1046793059.db2.gz IGNMSPUUIYCLOY-RTWAWAEBSA-N 2 1 312.501 4.451 20 0 DIADMP Cc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)s1 ZINC000246828862 1046817491 /nfs/dbraw/zinc/81/74/91/1046817491.db2.gz BPEKUTXKICBKJZ-ZIAGYGMSSA-N 2 1 309.523 4.065 20 0 DIADMP CCC[N@H+]1CC[C@H](CN[C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000247156534 1046823832 /nfs/dbraw/zinc/82/38/32/1046823832.db2.gz TXWDIWQGJJNAES-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000247156534 1046823852 /nfs/dbraw/zinc/82/38/52/1046823852.db2.gz TXWDIWQGJJNAES-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000247156534 1046823871 /nfs/dbraw/zinc/82/38/71/1046823871.db2.gz TXWDIWQGJJNAES-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP c1cc2ccncc2c(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001140645490 1046831040 /nfs/dbraw/zinc/83/10/40/1046831040.db2.gz WRURWGVQCMYERO-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@H](c1ccco1)[NH+](C)C/C=C/C[N@H+](C)[C@H](C)c1ccco1 ZINC000249842991 1046864751 /nfs/dbraw/zinc/86/47/51/1046864751.db2.gz YXWYPCNKAGUWMS-DOOVEFGSSA-N 2 1 302.418 4.115 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)o1 ZINC000067668325 1046892783 /nfs/dbraw/zinc/89/27/83/1046892783.db2.gz MYQJRPVVIWRKKI-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)n1 ZINC000679722959 1046895372 /nfs/dbraw/zinc/89/53/72/1046895372.db2.gz IPHRXUDSQJXMLI-RYQLBKOJSA-N 2 1 315.505 4.002 20 0 DIADMP Cc1cccc(C[N@H+](Cc2c[nH]c3cc[nH+]cc23)C2CC2)c1C ZINC001140806084 1046907093 /nfs/dbraw/zinc/90/70/93/1046907093.db2.gz VKNOIBGJFJCJFL-UHFFFAOYSA-N 2 1 305.425 4.344 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2c[nH]c3cc[nH+]cc23)C2CC2)c1C ZINC001140806084 1046907103 /nfs/dbraw/zinc/90/71/03/1046907103.db2.gz VKNOIBGJFJCJFL-UHFFFAOYSA-N 2 1 305.425 4.344 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@H+]1CCC[C@@H](CCc2ccccc2)C1 ZINC001140806350 1046907758 /nfs/dbraw/zinc/90/77/58/1046907758.db2.gz HCBMMTZBYBAXJL-SFHVURJKSA-N 2 1 319.452 4.408 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@@H+]1CCC[C@@H](CCc2ccccc2)C1 ZINC001140806350 1046907762 /nfs/dbraw/zinc/90/77/62/1046907762.db2.gz HCBMMTZBYBAXJL-SFHVURJKSA-N 2 1 319.452 4.408 20 0 DIADMP CSC(C)(C)C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000798182257 1046933239 /nfs/dbraw/zinc/93/32/39/1046933239.db2.gz GNFMPIZDMGMPGI-UHFFFAOYSA-N 2 1 320.546 4.161 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2cccs2)CC1 ZINC000162142967 1046944946 /nfs/dbraw/zinc/94/49/46/1046944946.db2.gz RBXHAPRGMSSLMU-MRXNPFEDSA-N 2 1 314.498 4.372 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2cccs2)CC1 ZINC000162142843 1046945523 /nfs/dbraw/zinc/94/55/23/1046945523.db2.gz RBXHAPRGMSSLMU-INIZCTEOSA-N 2 1 314.498 4.372 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C[C@@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176191 1046949697 /nfs/dbraw/zinc/94/96/97/1046949697.db2.gz XTTFUOCSTOXDPA-UYAOXDASSA-N 2 1 310.485 4.130 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C[C@@H]3CC=CCC3)CC23CC3)cc1 ZINC000647176191 1046949705 /nfs/dbraw/zinc/94/97/05/1046949705.db2.gz XTTFUOCSTOXDPA-UYAOXDASSA-N 2 1 310.485 4.130 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C2CCC(F)(F)CC2)c1 ZINC000647176302 1046951716 /nfs/dbraw/zinc/95/17/16/1046951716.db2.gz ARAKCBNYZRAYMH-UHFFFAOYSA-N 2 1 310.432 4.194 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274274 1046972794 /nfs/dbraw/zinc/97/27/94/1046972794.db2.gz CAWVGDHBOIXTGO-FCHUYYIVSA-N 2 1 320.480 4.270 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274274 1046972800 /nfs/dbraw/zinc/97/28/00/1046972800.db2.gz CAWVGDHBOIXTGO-FCHUYYIVSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274274 1046972805 /nfs/dbraw/zinc/97/28/05/1046972805.db2.gz CAWVGDHBOIXTGO-FCHUYYIVSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274274 1046972811 /nfs/dbraw/zinc/97/28/11/1046972811.db2.gz CAWVGDHBOIXTGO-FCHUYYIVSA-N 2 1 320.480 4.270 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(F)c1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000680401128 1046979617 /nfs/dbraw/zinc/97/96/17/1046979617.db2.gz DGWJEMGFJAPTGG-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(F)c1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000680401128 1046979624 /nfs/dbraw/zinc/97/96/24/1046979624.db2.gz DGWJEMGFJAPTGG-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000680461826 1046985132 /nfs/dbraw/zinc/98/51/32/1046985132.db2.gz YFZIKMZLRLYJHP-YEWFCNIMSA-N 2 1 318.892 4.193 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)[C@H](C)c1ccccc1 ZINC000647344627 1046985546 /nfs/dbraw/zinc/98/55/46/1046985546.db2.gz VTWBAUWJHWHVMD-KKXYHZGYSA-N 2 1 322.496 4.114 20 0 DIADMP C[C@@H]([NH2+]CC1CCC(F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000647350062 1046990080 /nfs/dbraw/zinc/99/00/80/1046990080.db2.gz UCICEMUVCKNFON-BXXUTWAOSA-N 2 1 318.480 4.015 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+]C2(c3cccc(Cl)c3)CCC2)c2ccccc21 ZINC000647804771 1047015775 /nfs/dbraw/zinc/01/57/75/1047015775.db2.gz YMSMFGFKYSYBAH-QZTJIDSGSA-N 2 1 312.844 4.454 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665503 1047055998 /nfs/dbraw/zinc/05/59/98/1047055998.db2.gz MWHLAXPTIAQHKP-OAHLLOKOSA-N 2 1 308.535 4.209 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665503 1047056012 /nfs/dbraw/zinc/05/60/12/1047056012.db2.gz MWHLAXPTIAQHKP-OAHLLOKOSA-N 2 1 308.535 4.209 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665503 1047056028 /nfs/dbraw/zinc/05/60/28/1047056028.db2.gz MWHLAXPTIAQHKP-OAHLLOKOSA-N 2 1 308.535 4.209 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001141231473 1047055814 /nfs/dbraw/zinc/05/58/14/1047055814.db2.gz RJZLBNPZYMPLHY-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665503 1047056041 /nfs/dbraw/zinc/05/60/41/1047056041.db2.gz MWHLAXPTIAQHKP-OAHLLOKOSA-N 2 1 308.535 4.209 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000536697257 1047076821 /nfs/dbraw/zinc/07/68/21/1047076821.db2.gz NLALXDFSZOPSDE-GOSISDBHSA-N 2 1 324.468 4.254 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000536697257 1047076833 /nfs/dbraw/zinc/07/68/33/1047076833.db2.gz NLALXDFSZOPSDE-GOSISDBHSA-N 2 1 324.468 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651548 1047089994 /nfs/dbraw/zinc/08/99/94/1047089994.db2.gz UVCVCKIRKQPCKV-BPQIPLTHSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379653608 1047095126 /nfs/dbraw/zinc/09/51/26/1047095126.db2.gz GKGQZBVJRNAUNV-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379653608 1047095136 /nfs/dbraw/zinc/09/51/36/1047095136.db2.gz GKGQZBVJRNAUNV-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379657300 1047095808 /nfs/dbraw/zinc/09/58/08/1047095808.db2.gz RZXMJMFELKSXIP-WOIUINJBSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379657300 1047095825 /nfs/dbraw/zinc/09/58/25/1047095825.db2.gz RZXMJMFELKSXIP-WOIUINJBSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000379657464 1047096616 /nfs/dbraw/zinc/09/66/16/1047096616.db2.gz SVFCJXXPPKTYAY-BHIYHBOVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC000379657464 1047096632 /nfs/dbraw/zinc/09/66/32/1047096632.db2.gz SVFCJXXPPKTYAY-BHIYHBOVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379656671 1047097931 /nfs/dbraw/zinc/09/79/31/1047097931.db2.gz QDKBUPCOPZIKEA-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379656671 1047097948 /nfs/dbraw/zinc/09/79/48/1047097948.db2.gz QDKBUPCOPZIKEA-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000536828970 1047102596 /nfs/dbraw/zinc/10/25/96/1047102596.db2.gz UWBPMQWTGGSFDS-ZHALLVOQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000536825776 1047104827 /nfs/dbraw/zinc/10/48/27/1047104827.db2.gz JMEGZNUQXAIPJN-ZIFCJYIRSA-N 2 1 312.457 4.231 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@H+](C)C[C@@H]1C)CCC2 ZINC000536835514 1047106675 /nfs/dbraw/zinc/10/66/75/1047106675.db2.gz UHKPUIPMKYEBCC-YSSFQJQWSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C)CCC2 ZINC000536835514 1047106682 /nfs/dbraw/zinc/10/66/82/1047106682.db2.gz UHKPUIPMKYEBCC-YSSFQJQWSA-N 2 1 300.490 4.117 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841144 1047107826 /nfs/dbraw/zinc/10/78/26/1047107826.db2.gz WCQVJPRFMIJDOL-YJBOKZPZSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841144 1047107830 /nfs/dbraw/zinc/10/78/30/1047107830.db2.gz WCQVJPRFMIJDOL-YJBOKZPZSA-N 2 1 322.443 4.065 20 0 DIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536839255 1047108510 /nfs/dbraw/zinc/10/85/10/1047108510.db2.gz MYEHMNRQPJNSAH-ZWKOTPCHSA-N 2 1 318.505 4.022 20 0 DIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536839255 1047108514 /nfs/dbraw/zinc/10/85/14/1047108514.db2.gz MYEHMNRQPJNSAH-ZWKOTPCHSA-N 2 1 318.505 4.022 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC)C1 ZINC000121822835 1047118184 /nfs/dbraw/zinc/11/81/84/1047118184.db2.gz SUGNKSMQPSFVOY-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H](C)C(F)(F)F)CC1)CC(C)C ZINC000536886037 1047120167 /nfs/dbraw/zinc/12/01/67/1047120167.db2.gz PMMDFPZGTOWYNB-OAHLLOKOSA-N 2 1 322.459 4.265 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)C1 ZINC001116288075 1047127439 /nfs/dbraw/zinc/12/74/39/1047127439.db2.gz BZSAMJHBICTFRA-HIFRSBDPSA-N 2 1 323.550 4.132 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)C2CC2)C1 ZINC000537014110 1047131933 /nfs/dbraw/zinc/13/19/33/1047131933.db2.gz CBHAQBXVFRMXLD-FXAWDEMLSA-N 2 1 300.490 4.095 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000537123339 1047138105 /nfs/dbraw/zinc/13/81/05/1047138105.db2.gz NWKVOXPMFMKICC-QGZVFWFLSA-N 2 1 321.415 4.237 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180922 1047146343 /nfs/dbraw/zinc/14/63/43/1047146343.db2.gz BSANLANLKQVJOL-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180922 1047146349 /nfs/dbraw/zinc/14/63/49/1047146349.db2.gz BSANLANLKQVJOL-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180922 1047146354 /nfs/dbraw/zinc/14/63/54/1047146354.db2.gz BSANLANLKQVJOL-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180922 1047146360 /nfs/dbraw/zinc/14/63/60/1047146360.db2.gz BSANLANLKQVJOL-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)o1 ZINC000537231092 1047153932 /nfs/dbraw/zinc/15/39/32/1047153932.db2.gz MRVHGOXZMIPISM-NUJGCVRESA-N 2 1 304.478 4.005 20 0 DIADMP C[C@H]1C[C@@H]1c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)o1 ZINC000537231096 1047154081 /nfs/dbraw/zinc/15/40/81/1047154081.db2.gz MRVHGOXZMIPISM-RYRKJORJSA-N 2 1 304.478 4.005 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1csc2ccccc12 ZINC000838931339 1047177948 /nfs/dbraw/zinc/17/79/48/1047177948.db2.gz CEMMXYNIJIAKQQ-CYBMUJFWSA-N 2 1 300.471 4.179 20 0 DIADMP Cc1ccc(C)c([C@H](N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc2)c1 ZINC000325404461 1047186752 /nfs/dbraw/zinc/18/67/52/1047186752.db2.gz IBJUKPQKFKDQTC-RCZSKKKRSA-N 2 1 322.496 4.465 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@H]2CCN(C)[C@@H](C)C2)c2ccccc2)c1 ZINC000325404461 1047186763 /nfs/dbraw/zinc/18/67/63/1047186763.db2.gz IBJUKPQKFKDQTC-RCZSKKKRSA-N 2 1 322.496 4.465 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000651211003 1047302120 /nfs/dbraw/zinc/30/21/20/1047302120.db2.gz YOBNALZMCVRDKL-PZJWPPBQSA-N 2 1 323.484 4.035 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000651211004 1047302711 /nfs/dbraw/zinc/30/27/11/1047302711.db2.gz YOBNALZMCVRDKL-TZIWHRDSSA-N 2 1 323.484 4.035 20 0 DIADMP Cc1cccnc1[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)C(C)(C)C ZINC000897995954 1047308923 /nfs/dbraw/zinc/30/89/23/1047308923.db2.gz VQZNUBZTACBJNR-GOSISDBHSA-N 2 1 317.521 4.330 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CC4CCC3CC4)C2)cc1 ZINC000394353077 1047309610 /nfs/dbraw/zinc/30/96/10/1047309610.db2.gz IGAXIVSVYZTNEM-OPWVIFHQSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000651829472 1047329355 /nfs/dbraw/zinc/32/93/55/1047329355.db2.gz DCBAROCFJDRERH-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cccnc2)C2CCCCC2)C1 ZINC000652142776 1047344570 /nfs/dbraw/zinc/34/45/70/1047344570.db2.gz BICWZFMLXGVVLC-FXAWDEMLSA-N 2 1 315.505 4.025 20 0 DIADMP CC[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533392 1047346340 /nfs/dbraw/zinc/34/63/40/1047346340.db2.gz TYKHPPZOPQZFBB-LRDDRELGSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533392 1047346353 /nfs/dbraw/zinc/34/63/53/1047346353.db2.gz TYKHPPZOPQZFBB-LRDDRELGSA-N 2 1 315.288 4.376 20 0 DIADMP C[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1cc(F)c(Cl)cc1Cl ZINC000044532756 1047347203 /nfs/dbraw/zinc/34/72/03/1047347203.db2.gz GRKFDIBUFBSHLL-MNOVXSKESA-N 2 1 319.251 4.125 20 0 DIADMP CC[N@H+](CCC[NH2+][C@@H](C)c1cnn(C(C)C)c1)C1CCCCC1 ZINC000652237115 1047348698 /nfs/dbraw/zinc/34/86/98/1047348698.db2.gz HLJULRQOPGSNNW-KRWDZBQOSA-N 2 1 320.525 4.159 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H](C)c1cnn(C(C)C)c1)C1CCCCC1 ZINC000652237115 1047348701 /nfs/dbraw/zinc/34/87/01/1047348701.db2.gz HLJULRQOPGSNNW-KRWDZBQOSA-N 2 1 320.525 4.159 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(SC)s2)CC1 ZINC001142031952 1047353814 /nfs/dbraw/zinc/35/38/14/1047353814.db2.gz PZTAYXMKUSTIAL-UHFFFAOYSA-N 2 1 312.548 4.166 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(SC)s2)CC1 ZINC001142031952 1047353823 /nfs/dbraw/zinc/35/38/23/1047353823.db2.gz PZTAYXMKUSTIAL-UHFFFAOYSA-N 2 1 312.548 4.166 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CCC([NH+]4CCC4)CC3)cc2)cc1 ZINC001142309778 1047428907 /nfs/dbraw/zinc/42/89/07/1047428907.db2.gz MDDFIYHPUQPRSL-UHFFFAOYSA-N 2 1 320.480 4.332 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001168336972 1047492227 /nfs/dbraw/zinc/49/22/27/1047492227.db2.gz JNHDKSNKWSHKEA-CUYAVPTFSA-N 2 1 320.908 4.440 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000121361329 1047519449 /nfs/dbraw/zinc/51/94/49/1047519449.db2.gz IWSSHLQZHUXLDR-KRWDZBQOSA-N 2 1 317.864 4.115 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000121361329 1047519451 /nfs/dbraw/zinc/51/94/51/1047519451.db2.gz IWSSHLQZHUXLDR-KRWDZBQOSA-N 2 1 317.864 4.115 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2F)s1)C1CCC([NH3+])CC1 ZINC000843055977 1047526185 /nfs/dbraw/zinc/52/61/85/1047526185.db2.gz UFMPVRNPIOOPFZ-UHFFFAOYSA-N 2 1 318.461 4.256 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001143251650 1047544903 /nfs/dbraw/zinc/54/49/03/1047544903.db2.gz UOORUVVKXKIMGT-SFHVURJKSA-N 2 1 322.443 4.465 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)CC(C)(C)c2ccccc2)C1 ZINC000314961577 1047591656 /nfs/dbraw/zinc/59/16/56/1047591656.db2.gz UWAFAHHRZDUCQX-MSOLQXFVSA-N 2 1 302.506 4.063 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](CC)c2cc(C)ccc2OC)CC1 ZINC000537879921 1047641942 /nfs/dbraw/zinc/64/19/42/1047641942.db2.gz JFFJNSJNLMWYPK-IBGZPJMESA-N 2 1 318.505 4.309 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000538057890 1047656632 /nfs/dbraw/zinc/65/66/32/1047656632.db2.gz GTHVFTPZHCFIGJ-OXQOHEQNSA-N 2 1 318.480 4.379 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000538099169 1047657454 /nfs/dbraw/zinc/65/74/54/1047657454.db2.gz RUJVHEQRXXGMBJ-YLJYHZDGSA-N 2 1 300.490 4.156 20 0 DIADMP CCCCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000538717470 1047698784 /nfs/dbraw/zinc/69/87/84/1047698784.db2.gz CKOCEHOKUPELDS-PKOBYXMFSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000538717470 1047698791 /nfs/dbraw/zinc/69/87/91/1047698791.db2.gz CKOCEHOKUPELDS-PKOBYXMFSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000538717470 1047698794 /nfs/dbraw/zinc/69/87/94/1047698794.db2.gz CKOCEHOKUPELDS-PKOBYXMFSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000538717470 1047698798 /nfs/dbraw/zinc/69/87/98/1047698798.db2.gz CKOCEHOKUPELDS-PKOBYXMFSA-N 2 1 318.505 4.170 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OCC(C)C)cc2)C[C@@H]1C ZINC000538738355 1047704133 /nfs/dbraw/zinc/70/41/33/1047704133.db2.gz QAKSICCJYWJIOG-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OCC(C)C)cc2)C[C@@H]1C ZINC000538738355 1047704137 /nfs/dbraw/zinc/70/41/37/1047704137.db2.gz QAKSICCJYWJIOG-HKUYNNGSSA-N 2 1 318.505 4.026 20 0 DIADMP Cc1ccc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)[nH+]c1C ZINC001156315956 1047707732 /nfs/dbraw/zinc/70/77/32/1047707732.db2.gz DJNQVXHEXYDHOH-SLFFLAALSA-N 2 1 321.468 4.021 20 0 DIADMP CC[C@H](C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000538796166 1047711477 /nfs/dbraw/zinc/71/14/77/1047711477.db2.gz STGCCZBGWICQBC-YFVAEKQCSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000538796166 1047711485 /nfs/dbraw/zinc/71/14/85/1047711485.db2.gz STGCCZBGWICQBC-YFVAEKQCSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000538796166 1047711491 /nfs/dbraw/zinc/71/14/91/1047711491.db2.gz STGCCZBGWICQBC-YFVAEKQCSA-N 2 1 312.501 4.129 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000539067457 1047734458 /nfs/dbraw/zinc/73/44/58/1047734458.db2.gz UZURLELNTPXRSJ-IBGZPJMESA-N 2 1 318.480 4.001 20 0 DIADMP CCc1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C(C)C)cc1 ZINC000539162638 1047739064 /nfs/dbraw/zinc/73/90/64/1047739064.db2.gz IHPAZWVTSLSNRG-XLIONFOSSA-N 2 1 300.490 4.020 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)N1CCC2(CCC[N@H+]2C)CC1 ZINC000539196028 1047740075 /nfs/dbraw/zinc/74/00/75/1047740075.db2.gz LHTRAXSUYMGWHJ-KRWDZBQOSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1F ZINC001168360287 1047752688 /nfs/dbraw/zinc/75/26/88/1047752688.db2.gz MSUUGUSFFDQQFL-LJQANCHMSA-N 2 1 304.453 4.131 20 0 DIADMP Cc1cc2ccccc2c(N(C2CCCC2)C2CC[NH+](C)CC2)[nH+]1 ZINC001158487935 1047786490 /nfs/dbraw/zinc/78/64/90/1047786490.db2.gz UOKSTNOVVCMUAJ-UHFFFAOYSA-N 2 1 323.484 4.386 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048381 1047832722 /nfs/dbraw/zinc/83/27/22/1047832722.db2.gz ASNHONLBPYFSIF-BEFAXECRSA-N 2 1 324.459 4.372 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048381 1047832733 /nfs/dbraw/zinc/83/27/33/1047832733.db2.gz ASNHONLBPYFSIF-BEFAXECRSA-N 2 1 324.459 4.372 20 0 DIADMP c1cc([NH+]2CCCCCC2)ccc1Nc1ccc2c(c1)CC[NH2+]C2 ZINC001159542784 1047864156 /nfs/dbraw/zinc/86/41/56/1047864156.db2.gz WUAYVDHJJXAQJS-UHFFFAOYSA-N 2 1 321.468 4.456 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)C2)c1 ZINC001182960164 1047867736 /nfs/dbraw/zinc/86/77/36/1047867736.db2.gz PISGKTFYXZJUAR-AVAKVYKDSA-N 2 1 316.464 4.068 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)C2)c1 ZINC001182960164 1047867744 /nfs/dbraw/zinc/86/77/44/1047867744.db2.gz PISGKTFYXZJUAR-AVAKVYKDSA-N 2 1 316.464 4.068 20 0 DIADMP C[C@]1(C[NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)C[C@@H]1c1ccccc1 ZINC001182959245 1047868653 /nfs/dbraw/zinc/86/86/53/1047868653.db2.gz IMRDLEHGGLPUSA-CEWLAPEOSA-N 2 1 312.501 4.177 20 0 DIADMP C[C@]1(C[NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)C[C@@H]1c1ccccc1 ZINC001182959245 1047868669 /nfs/dbraw/zinc/86/86/69/1047868669.db2.gz IMRDLEHGGLPUSA-CEWLAPEOSA-N 2 1 312.501 4.177 20 0 DIADMP CCCc1cccc(C[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000479388943 1047881015 /nfs/dbraw/zinc/88/10/15/1047881015.db2.gz COQLXMGUSJVRRK-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP CCCc1ccc(C[N@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)s1 ZINC001183065220 1047885912 /nfs/dbraw/zinc/88/59/12/1047885912.db2.gz IHVSMNCIAYHGMM-CRAIPNDOSA-N 2 1 308.535 4.253 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)cc1Cl ZINC001183065745 1047887186 /nfs/dbraw/zinc/88/71/86/1047887186.db2.gz OYRNHGWXCWKVLT-YJBOKZPZSA-N 2 1 308.897 4.201 20 0 DIADMP Cc1ccc(C[N@@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)cc1Cl ZINC001183065745 1047887201 /nfs/dbraw/zinc/88/72/01/1047887201.db2.gz OYRNHGWXCWKVLT-YJBOKZPZSA-N 2 1 308.897 4.201 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2ccc3c(c2)CC[NH2+]C3)c(C)c1 ZINC001159656056 1047896319 /nfs/dbraw/zinc/89/63/19/1047896319.db2.gz OAVQNOLZVODPON-UHFFFAOYSA-N 2 1 309.457 4.231 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC(N2CCCCC2)C1)c1cccs1 ZINC000479529645 1047915095 /nfs/dbraw/zinc/91/50/95/1047915095.db2.gz UREOPQLXFLEBMA-OFLPRAFFSA-N 2 1 306.519 4.442 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccs1 ZINC000479529645 1047915101 /nfs/dbraw/zinc/91/51/01/1047915101.db2.gz UREOPQLXFLEBMA-OFLPRAFFSA-N 2 1 306.519 4.442 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000479537150 1047921192 /nfs/dbraw/zinc/92/11/92/1047921192.db2.gz GMFJSSXBYKLPHX-PPQDBTBKSA-N 2 1 312.501 4.208 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc(C)c1F ZINC000479557414 1047930141 /nfs/dbraw/zinc/93/01/41/1047930141.db2.gz XSVSZARRZXBAPA-FAEJEUNOSA-N 2 1 304.453 4.110 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)CCCc1ccc(F)c(F)c1 ZINC001183511675 1047940428 /nfs/dbraw/zinc/94/04/28/1047940428.db2.gz SACSDAZQUDIWLC-UHFFFAOYSA-N 2 1 324.459 4.095 20 0 DIADMP CCC[C@@H](C)CC[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC001183571140 1047944936 /nfs/dbraw/zinc/94/49/36/1047944936.db2.gz FMESUKBOIAPDJA-HZEGPAAWSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCC1CC[NH2+]CC1 ZINC000479691800 1047954795 /nfs/dbraw/zinc/95/47/95/1047954795.db2.gz LZSBHJMBDJMCNF-ZDUSSCGKSA-N 2 1 314.395 4.088 20 0 DIADMP c1cc2cc(Nc3ccc(O[C@H]4CCC[NH2+]C4)cc3)ccc2c[nH+]1 ZINC001159949459 1047955528 /nfs/dbraw/zinc/95/55/28/1047955528.db2.gz OVBWUFRKXLJDPZ-FQEVSTJZSA-N 2 1 319.408 4.109 20 0 DIADMP c1ccc(C2=CC[NH2+]CC2)c(Nc2cccc3cc[nH+]cc32)c1 ZINC001160023142 1047971072 /nfs/dbraw/zinc/97/10/72/1047971072.db2.gz IJZKMBVEHJMWMK-UHFFFAOYSA-N 2 1 301.393 4.355 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)C[C@@H](c2ccccc2)C(C)C)CC1 ZINC001204714508 1048015538 /nfs/dbraw/zinc/01/55/38/1048015538.db2.gz SHZNLCHIXPVPMZ-HXUWFJFHSA-N 2 1 302.506 4.232 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)cc1 ZINC001184292409 1048026631 /nfs/dbraw/zinc/02/66/31/1048026631.db2.gz YOVISWCIIDSVPK-HBMCJLEFSA-N 2 1 314.517 4.015 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000480033089 1048035504 /nfs/dbraw/zinc/03/55/04/1048035504.db2.gz CJTLALLHHVZZDD-KRWDZBQOSA-N 2 1 314.498 4.353 20 0 DIADMP C1=C(Nc2ccc([NH+]3CCCCC3)c(-c3ccccc3)c2)C[NH2+]C1 ZINC001160386562 1048043650 /nfs/dbraw/zinc/04/36/50/1048043650.db2.gz AEGUWYXCMBYHIW-UHFFFAOYSA-N 2 1 319.452 4.243 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]CC2(C)CCC2)cc1 ZINC001199275157 1048048167 /nfs/dbraw/zinc/04/81/67/1048048167.db2.gz DOJJTEYOOXWRAL-KRWDZBQOSA-N 2 1 300.490 4.341 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC001199336870 1048056527 /nfs/dbraw/zinc/05/65/27/1048056527.db2.gz ZATRMBODYSKGMJ-UXHICEINSA-N 2 1 316.533 4.357 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc(Cl)cc2)C1 ZINC001199320451 1048056931 /nfs/dbraw/zinc/05/69/31/1048056931.db2.gz NKJYDKIPYGKIGY-IYBDPMFKSA-N 2 1 308.897 4.188 20 0 DIADMP CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667626258 1048066395 /nfs/dbraw/zinc/06/63/95/1048066395.db2.gz OEBHRKNTKGZHTF-FQEVSTJZSA-N 2 1 320.440 4.096 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000480153033 1048070786 /nfs/dbraw/zinc/07/07/86/1048070786.db2.gz ZWZYILYXHMREBI-MPGHIAIKSA-N 2 1 323.912 4.286 20 0 DIADMP Cc1ccc2cc[nH+]c(N(Cc3ccccc3)C[C@@H](C)C[NH3+])c2c1 ZINC001160661721 1048075449 /nfs/dbraw/zinc/07/54/49/1048075449.db2.gz IZBRFRMJQBCCAP-KRWDZBQOSA-N 2 1 319.452 4.145 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000554362560 1048079665 /nfs/dbraw/zinc/07/96/65/1048079665.db2.gz VHRZEQVBPWLCTB-RTWAWAEBSA-N 2 1 324.468 4.190 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000554362561 1048080378 /nfs/dbraw/zinc/08/03/78/1048080378.db2.gz VHRZEQVBPWLCTB-SFTDATJTSA-N 2 1 324.468 4.190 20 0 DIADMP CC[N@@H+](CCC(C)(C)C1CC1)Cc1ccc(C[NH+](C)C)cc1 ZINC001175060293 1048088507 /nfs/dbraw/zinc/08/85/07/1048088507.db2.gz ACAIRGADDYOKEO-UHFFFAOYSA-N 2 1 302.506 4.396 20 0 DIADMP CC(C)(C)CCNc1ccc2c(c1)[nH+]cn2[C@H]1CCC[NH2+]CC1 ZINC001161677621 1048153116 /nfs/dbraw/zinc/15/31/16/1048153116.db2.gz ZXMOSPNZNLZCKR-INIZCTEOSA-N 2 1 314.477 4.199 20 0 DIADMP CC(C)(C)CN(c1cc(C2CC2)cc[nH+]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001161680447 1048153277 /nfs/dbraw/zinc/15/32/77/1048153277.db2.gz QILDDGWAAYYLEW-QAQDUYKDSA-N 2 1 301.478 4.081 20 0 DIADMP Cc1ccccc1CC[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001200981447 1048165536 /nfs/dbraw/zinc/16/55/36/1048165536.db2.gz WNOSKGZORRLYOH-UHFFFAOYSA-N 2 1 324.512 4.285 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)s1 ZINC000480600517 1048187695 /nfs/dbraw/zinc/18/76/95/1048187695.db2.gz ISJNOIBWOPGMLM-KKUMJFAQSA-N 2 1 323.550 4.033 20 0 DIADMP CC(C)C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000480606097 1048193759 /nfs/dbraw/zinc/19/37/59/1048193759.db2.gz DKRMPTUXWQOJJD-QUCCMNQESA-N 2 1 317.521 4.413 20 0 DIADMP COc1ccccc1[C@H](C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000480630627 1048194843 /nfs/dbraw/zinc/19/48/43/1048194843.db2.gz MIOLMOZGWRGYLI-IRXDYDNUSA-N 2 1 304.478 4.000 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000480618848 1048196326 /nfs/dbraw/zinc/19/63/26/1048196326.db2.gz PTIKSZRZFFNIKY-UYAOXDASSA-N 2 1 317.521 4.271 20 0 DIADMP COc1ccccc1[C@@H](C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000480630525 1048202866 /nfs/dbraw/zinc/20/28/66/1048202866.db2.gz MIOLMOZGWRGYLI-DLBZAZTESA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H](N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646442 1048207119 /nfs/dbraw/zinc/20/71/19/1048207119.db2.gz VIUNVCDCDIDRIS-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCN2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646442 1048207134 /nfs/dbraw/zinc/20/71/34/1048207134.db2.gz VIUNVCDCDIDRIS-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646442 1048207147 /nfs/dbraw/zinc/20/71/47/1048207147.db2.gz VIUNVCDCDIDRIS-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646442 1048207156 /nfs/dbraw/zinc/20/71/56/1048207156.db2.gz VIUNVCDCDIDRIS-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccsc1Cl ZINC000480663422 1048215832 /nfs/dbraw/zinc/21/58/32/1048215832.db2.gz NQDFYIQOQSJJLU-ZDUSSCGKSA-N 2 1 300.899 4.146 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000480693316 1048217906 /nfs/dbraw/zinc/21/79/06/1048217906.db2.gz BIWBNICZGSMLHA-ILXRZTDVSA-N 2 1 320.443 4.350 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@@H]1CC[NH+](C)C[C@@H]1C)c1ccccc1 ZINC000554890888 1048219503 /nfs/dbraw/zinc/21/95/03/1048219503.db2.gz ZQIOHDZQDJRUOY-DFQSSKMNSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@@H]1CC[NH+](C)C[C@@H]1C)c1ccccc1 ZINC000554890888 1048219510 /nfs/dbraw/zinc/21/95/10/1048219510.db2.gz ZQIOHDZQDJRUOY-DFQSSKMNSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@H+](C)C[C@@H]1C)c1ccccc1 ZINC000554890888 1048219525 /nfs/dbraw/zinc/21/95/25/1048219525.db2.gz ZQIOHDZQDJRUOY-DFQSSKMNSA-N 2 1 302.506 4.088 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@@H+](C)C[C@@H]1C)c1ccccc1 ZINC000554890888 1048219532 /nfs/dbraw/zinc/21/95/32/1048219532.db2.gz ZQIOHDZQDJRUOY-DFQSSKMNSA-N 2 1 302.506 4.088 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(-c2ccccc2)c1 ZINC000480741757 1048234012 /nfs/dbraw/zinc/23/40/12/1048234012.db2.gz ACDFYPNSBXPSPS-ZWKOTPCHSA-N 2 1 320.480 4.489 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2CCSC(C)(C)C)CC1 ZINC001175351992 1048273814 /nfs/dbraw/zinc/27/38/14/1048273814.db2.gz NSBKTVSXBYYSBV-QGZVFWFLSA-N 2 1 312.567 4.105 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450731 1048279046 /nfs/dbraw/zinc/27/90/46/1048279046.db2.gz ZSVGWJLVVLSAMA-VAMGGRTRSA-N 2 1 312.501 4.352 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450731 1048279056 /nfs/dbraw/zinc/27/90/56/1048279056.db2.gz ZSVGWJLVVLSAMA-VAMGGRTRSA-N 2 1 312.501 4.352 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008586 1048288067 /nfs/dbraw/zinc/28/80/67/1048288067.db2.gz ANVSXEYZRKUYAC-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008586 1048288081 /nfs/dbraw/zinc/28/80/81/1048288081.db2.gz ANVSXEYZRKUYAC-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@H](C)C[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001201509504 1048291287 /nfs/dbraw/zinc/29/12/87/1048291287.db2.gz QYCSSDPVCGNHPH-KNTRFNDTSA-N 2 1 300.490 4.143 20 0 DIADMP CC[C@H](C)C[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001201509504 1048291297 /nfs/dbraw/zinc/29/12/97/1048291297.db2.gz QYCSSDPVCGNHPH-KNTRFNDTSA-N 2 1 300.490 4.143 20 0 DIADMP CC[C@H](C)C[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001201509504 1048291303 /nfs/dbraw/zinc/29/13/03/1048291303.db2.gz QYCSSDPVCGNHPH-KNTRFNDTSA-N 2 1 300.490 4.143 20 0 DIADMP CC[C@H](C)C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001201511771 1048292554 /nfs/dbraw/zinc/29/25/54/1048292554.db2.gz XQGTYUPMZOMPBK-SFHVURJKSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030177 1048294416 /nfs/dbraw/zinc/29/44/16/1048294416.db2.gz AIVJOTNWLORECS-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030177 1048294428 /nfs/dbraw/zinc/29/44/28/1048294428.db2.gz AIVJOTNWLORECS-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC000481028226 1048294840 /nfs/dbraw/zinc/29/48/40/1048294840.db2.gz YEAYJPYQMLLNSD-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)C1 ZINC000481035353 1048296621 /nfs/dbraw/zinc/29/66/21/1048296621.db2.gz KTZQABQVVXOHTP-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccccc2SCC)C1 ZINC000481041828 1048297281 /nfs/dbraw/zinc/29/72/81/1048297281.db2.gz AXPLQJLHRCEGFN-HOTGVXAUSA-N 2 1 306.519 4.181 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC000481045786 1048297561 /nfs/dbraw/zinc/29/75/61/1048297561.db2.gz GTDNOOUHBDPBCV-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC000481042448 1048300225 /nfs/dbraw/zinc/30/02/25/1048300225.db2.gz QVXGIZWCXCDEEK-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC000481042448 1048300238 /nfs/dbraw/zinc/30/02/38/1048300238.db2.gz QVXGIZWCXCDEEK-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CC[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1 ZINC001201559502 1048316358 /nfs/dbraw/zinc/31/63/58/1048316358.db2.gz ZCSISKNWKXPTBZ-RBUKOAKNSA-N 2 1 302.506 4.138 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC001201558705 1048317680 /nfs/dbraw/zinc/31/76/80/1048317680.db2.gz UQFNPNMJTZCLNQ-TZIWHRDSSA-N 2 1 316.533 4.213 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC[N@H+]1C ZINC000481178440 1048321687 /nfs/dbraw/zinc/32/16/87/1048321687.db2.gz GJRYOGBMOUEISM-APWZRJJASA-N 2 1 318.480 4.100 20 0 DIADMP CCCCC[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001201744365 1048362871 /nfs/dbraw/zinc/36/28/71/1048362871.db2.gz JRHXAEFPIVZVKC-PMACEKPBSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001201744365 1048362882 /nfs/dbraw/zinc/36/28/82/1048362882.db2.gz JRHXAEFPIVZVKC-PMACEKPBSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001201744365 1048362895 /nfs/dbraw/zinc/36/28/95/1048362895.db2.gz JRHXAEFPIVZVKC-PMACEKPBSA-N 2 1 300.490 4.021 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000481332091 1048369823 /nfs/dbraw/zinc/36/98/23/1048369823.db2.gz JBTBELBHNPAGDJ-HNNXBMFYSA-N 2 1 318.530 4.324 20 0 DIADMP CC(C)C[N@H+](Cc1sccc1Cl)CC1CC[NH+](C)CC1 ZINC001175601537 1048370200 /nfs/dbraw/zinc/37/02/00/1048370200.db2.gz ODBYMMXWTLUNPK-UHFFFAOYSA-N 2 1 314.926 4.201 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555597469 1048401924 /nfs/dbraw/zinc/40/19/24/1048401924.db2.gz IHEIQFMXHKBPQP-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555597469 1048401935 /nfs/dbraw/zinc/40/19/35/1048401935.db2.gz IHEIQFMXHKBPQP-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000555597469 1048401948 /nfs/dbraw/zinc/40/19/48/1048401948.db2.gz IHEIQFMXHKBPQP-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000555597469 1048401954 /nfs/dbraw/zinc/40/19/54/1048401954.db2.gz IHEIQFMXHKBPQP-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC001206680609 1048402343 /nfs/dbraw/zinc/40/23/43/1048402343.db2.gz NZYWOWLYDASBLU-ZWKOTPCHSA-N 2 1 302.506 4.064 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(-c2ccccc2)o1)[NH+]1CCCCC1 ZINC001201962431 1048411769 /nfs/dbraw/zinc/41/17/69/1048411769.db2.gz BVJKPYHPLIIQKD-QGZVFWFLSA-N 2 1 312.457 4.301 20 0 DIADMP C[C@H](CC[NH2+]Cc1csc(C(F)(F)F)c1)[NH+]1CCCCC1 ZINC001201963150 1048413585 /nfs/dbraw/zinc/41/35/85/1048413585.db2.gz NMBAAAVLUFAVME-GFCCVEGCSA-N 2 1 320.424 4.121 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162782 1048462949 /nfs/dbraw/zinc/46/29/49/1048462949.db2.gz NXTPGFGVEXRMHW-SQWLQELKSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162782 1048462954 /nfs/dbraw/zinc/46/29/54/1048462954.db2.gz NXTPGFGVEXRMHW-SQWLQELKSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162782 1048462960 /nfs/dbraw/zinc/46/29/60/1048462960.db2.gz NXTPGFGVEXRMHW-SQWLQELKSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162782 1048462964 /nfs/dbraw/zinc/46/29/64/1048462964.db2.gz NXTPGFGVEXRMHW-SQWLQELKSA-N 2 1 324.559 4.337 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](CC4CCCC4)CC[C@H]3C2)cc1 ZINC001202204802 1048480239 /nfs/dbraw/zinc/48/02/39/1048480239.db2.gz ICZVEBOXXKHSKF-LEWJYISDSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]3C[NH+](CC4CCCC4)CC[C@H]3C2)cc1 ZINC001202204802 1048480247 /nfs/dbraw/zinc/48/02/47/1048480247.db2.gz ICZVEBOXXKHSKF-LEWJYISDSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]3C[NH+](CC4CCCC4)CC[C@H]3C2)cc1 ZINC001202204802 1048480255 /nfs/dbraw/zinc/48/02/55/1048480255.db2.gz ICZVEBOXXKHSKF-LEWJYISDSA-N 2 1 312.501 4.021 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)c2)c1 ZINC000481920656 1048528406 /nfs/dbraw/zinc/52/84/06/1048528406.db2.gz FSBZXTXRUBLLMD-UWJYYQICSA-N 2 1 308.469 4.234 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C ZINC000481988734 1048539302 /nfs/dbraw/zinc/53/93/02/1048539302.db2.gz GIFFFFYSJKGLTO-WMZOPIPTSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C ZINC000481988734 1048539309 /nfs/dbraw/zinc/53/93/09/1048539309.db2.gz GIFFFFYSJKGLTO-WMZOPIPTSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C ZINC000481988734 1048539318 /nfs/dbraw/zinc/53/93/18/1048539318.db2.gz GIFFFFYSJKGLTO-WMZOPIPTSA-N 2 1 313.489 4.089 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+]CCn2cc[nH+]c2C)cc1 ZINC000482135555 1048561059 /nfs/dbraw/zinc/56/10/59/1048561059.db2.gz NJCKETXWBRDVGQ-INIZCTEOSA-N 2 1 315.461 4.111 20 0 DIADMP Cc1c[nH+]c(NCc2cccc(C[NH+](C)C)c2)c2ccccc12 ZINC001163992246 1048566126 /nfs/dbraw/zinc/56/61/26/1048566126.db2.gz CBQFBBWBVPLHOP-UHFFFAOYSA-N 2 1 305.425 4.217 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc(C)c1F ZINC000482326096 1048588824 /nfs/dbraw/zinc/58/88/24/1048588824.db2.gz YEFKGTXTZIAJSR-DLBZAZTESA-N 2 1 306.469 4.214 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)C(C)(C)c2ccccc2)C1 ZINC000482343531 1048591335 /nfs/dbraw/zinc/59/13/35/1048591335.db2.gz HRLJKQGLTQXKLS-ROUUACIJSA-N 2 1 302.506 4.063 20 0 DIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000482357177 1048592400 /nfs/dbraw/zinc/59/24/00/1048592400.db2.gz KHDNYBPHZDXIEB-QZTJIDSGSA-N 2 1 318.505 4.246 20 0 DIADMP Cc1ccc2c(C)cc(N3CCC[C@](C)(C[NH3+])CC3)[nH+]c2c1C ZINC001164247441 1048612107 /nfs/dbraw/zinc/61/21/07/1048612107.db2.gz JMUGOCLAZSSTPI-FQEVSTJZSA-N 2 1 311.473 4.115 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000482454161 1048612238 /nfs/dbraw/zinc/61/22/38/1048612238.db2.gz WQOBJAKRYHJICS-IFMALSPDSA-N 2 1 322.496 4.292 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000850467388 1048667306 /nfs/dbraw/zinc/66/73/06/1048667306.db2.gz VGPLYQRYEWGASS-DNVCBOLYSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000850467390 1048667539 /nfs/dbraw/zinc/66/75/39/1048667539.db2.gz VGPLYQRYEWGASS-KXBFYZLASA-N 2 1 324.459 4.168 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1NCC[C@H]1CCC[N@@H+](C)C1 ZINC001165300272 1048677113 /nfs/dbraw/zinc/67/71/13/1048677113.db2.gz KESXXKMMDNNDBD-GOSISDBHSA-N 2 1 315.505 4.129 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1NCC[C@H]1CCC[N@H+](C)C1 ZINC001165300272 1048677119 /nfs/dbraw/zinc/67/71/19/1048677119.db2.gz KESXXKMMDNNDBD-GOSISDBHSA-N 2 1 315.505 4.129 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC001204175644 1048758654 /nfs/dbraw/zinc/75/86/54/1048758654.db2.gz YJGJOGCOFWEQNO-UHFFFAOYSA-N 2 1 300.490 4.224 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000483234188 1048759366 /nfs/dbraw/zinc/75/93/66/1048759366.db2.gz JMFLQEGAJQPEDC-GOSISDBHSA-N 2 1 308.469 4.066 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483507742 1048809338 /nfs/dbraw/zinc/80/93/38/1048809338.db2.gz ZOSSBJWFARRRGC-CGTJXYLNSA-N 2 1 306.881 4.207 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483507742 1048809354 /nfs/dbraw/zinc/80/93/54/1048809354.db2.gz ZOSSBJWFARRRGC-CGTJXYLNSA-N 2 1 306.881 4.207 20 0 DIADMP Cc1ccc2c(C)cc(N3CCC([C@H]4CCC[NH2+]4)CC3)[nH+]c2c1C ZINC001166900293 1048810194 /nfs/dbraw/zinc/81/01/94/1048810194.db2.gz MUJUQZCQJPIPIN-LJQANCHMSA-N 2 1 323.484 4.128 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+]Cc1cc2cc(Cl)cnc2o1 ZINC001177061563 1048819926 /nfs/dbraw/zinc/81/99/26/1048819926.db2.gz PVNLZCQFUPQNNN-UHFFFAOYSA-N 2 1 323.868 4.083 20 0 DIADMP CC(C)(C)c1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC001191071520 1048837906 /nfs/dbraw/zinc/83/79/06/1048837906.db2.gz WVJIUVYXOPPODS-LJQANCHMSA-N 2 1 314.517 4.292 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC001191071520 1048837917 /nfs/dbraw/zinc/83/79/17/1048837917.db2.gz WVJIUVYXOPPODS-LJQANCHMSA-N 2 1 314.517 4.292 20 0 DIADMP CCCCC[C@@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001177148783 1048838928 /nfs/dbraw/zinc/83/89/28/1048838928.db2.gz MUFMJJAPQFVOMY-QGZVFWFLSA-N 2 1 320.496 4.391 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000483700743 1048843230 /nfs/dbraw/zinc/84/32/30/1048843230.db2.gz KYVABEKGWSCREY-LMMKCTJWSA-N 2 1 318.505 4.245 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000483700743 1048843244 /nfs/dbraw/zinc/84/32/44/1048843244.db2.gz KYVABEKGWSCREY-LMMKCTJWSA-N 2 1 318.505 4.245 20 0 DIADMP CCC(CC)[C@@H](C[NH2+]CC1C2CC3CC(C2)CC1C3)[NH+](C)C ZINC001177209977 1048844047 /nfs/dbraw/zinc/84/40/47/1048844047.db2.gz VHJUGOZVBNFZMR-DQBYHPFJSA-N 2 1 306.538 4.015 20 0 DIADMP CC[C@@H](C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181182 1048843685 /nfs/dbraw/zinc/84/36/85/1048843685.db2.gz PHIGAHXVNVJEHT-HKUYNNGSSA-N 2 1 300.490 4.177 20 0 DIADMP CC[C@@H](C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181182 1048843706 /nfs/dbraw/zinc/84/37/06/1048843706.db2.gz PHIGAHXVNVJEHT-HKUYNNGSSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001177298409 1048860335 /nfs/dbraw/zinc/86/03/35/1048860335.db2.gz BLPIPSOEQFMRCV-AWEZNQCLSA-N 2 1 312.860 4.223 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](Cc1ccccc1)CC2 ZINC001203306027 1048863881 /nfs/dbraw/zinc/86/38/81/1048863881.db2.gz BDIBUYRJRYPWBW-FQEVSTJZSA-N 2 1 324.468 4.156 20 0 DIADMP Cc1cc(-n2ccnc2)ccc1C[N@H+]1CCC2(C1)CCCCC2 ZINC001191202085 1048882613 /nfs/dbraw/zinc/88/26/13/1048882613.db2.gz FDTUQUPBDVMYBI-UHFFFAOYSA-N 2 1 309.457 4.337 20 0 DIADMP Cc1cccc([C@H]2CCCC[N@@H+]2CCCc2cncn2C)c1C ZINC001191213465 1048884715 /nfs/dbraw/zinc/88/47/15/1048884715.db2.gz IEXUIKBMGDYTMN-HXUWFJFHSA-N 2 1 311.473 4.197 20 0 DIADMP Cc1cccc([C@H]2CCCC[N@H+]2CCCc2c[nH+]cn2C)c1C ZINC001191213465 1048884737 /nfs/dbraw/zinc/88/47/37/1048884737.db2.gz IEXUIKBMGDYTMN-HXUWFJFHSA-N 2 1 311.473 4.197 20 0 DIADMP Cc1cccc([C@H]2CCCC[N@@H+]2CCCc2c[nH+]cn2C)c1C ZINC001191213465 1048884755 /nfs/dbraw/zinc/88/47/55/1048884755.db2.gz IEXUIKBMGDYTMN-HXUWFJFHSA-N 2 1 311.473 4.197 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)cc1F ZINC001177453593 1048885950 /nfs/dbraw/zinc/88/59/50/1048885950.db2.gz CBYRQYKLCCNNLO-GRDNDAEWSA-N 2 1 315.436 4.234 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CC[C@@H]2CCC[NH+]2C)o1 ZINC001191260076 1048898792 /nfs/dbraw/zinc/89/87/92/1048898792.db2.gz ZFSWUDGQLRVLJI-BQFCYCMXSA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[NH+]2CC[C@@H]2CCC[N@@H+]2C)o1 ZINC001191260076 1048898799 /nfs/dbraw/zinc/89/87/99/1048898799.db2.gz ZFSWUDGQLRVLJI-BQFCYCMXSA-N 2 1 304.478 4.099 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[NH+]2CC[C@@H]2CCC[N@H+]2C)o1 ZINC001191260076 1048898816 /nfs/dbraw/zinc/89/88/16/1048898816.db2.gz ZFSWUDGQLRVLJI-BQFCYCMXSA-N 2 1 304.478 4.099 20 0 DIADMP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001177565533 1048916050 /nfs/dbraw/zinc/91/60/50/1048916050.db2.gz DRJPFXXXIIGVDA-OAHLLOKOSA-N 2 1 316.876 4.437 20 0 DIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391684 1048933752 /nfs/dbraw/zinc/93/37/52/1048933752.db2.gz YVJGTVKSELYOEU-OAHLLOKOSA-N 2 1 316.876 4.267 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391684 1048933758 /nfs/dbraw/zinc/93/37/58/1048933758.db2.gz YVJGTVKSELYOEU-OAHLLOKOSA-N 2 1 316.876 4.267 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391684 1048933770 /nfs/dbraw/zinc/93/37/70/1048933770.db2.gz YVJGTVKSELYOEU-OAHLLOKOSA-N 2 1 316.876 4.267 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391684 1048933778 /nfs/dbraw/zinc/93/37/78/1048933778.db2.gz YVJGTVKSELYOEU-OAHLLOKOSA-N 2 1 316.876 4.267 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000194884134 1048943332 /nfs/dbraw/zinc/94/33/32/1048943332.db2.gz FAZCYIVPVDRPSC-HOTGVXAUSA-N 2 1 306.519 4.180 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1(C)CCCC1 ZINC001177790847 1048946041 /nfs/dbraw/zinc/94/60/41/1048946041.db2.gz MULYMOBYZKCQAC-UHFFFAOYSA-N 2 1 302.506 4.315 20 0 DIADMP C[C@@H]1CCCC[C@@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001177859910 1048956153 /nfs/dbraw/zinc/95/61/53/1048956153.db2.gz NKMGEOGIDFJZRJ-UYAOXDASSA-N 2 1 314.517 4.457 20 0 DIADMP CC(C)CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191522073 1048957035 /nfs/dbraw/zinc/95/70/35/1048957035.db2.gz ZUOMUALVNQSYEQ-VQTJNVASSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191522073 1048957049 /nfs/dbraw/zinc/95/70/49/1048957049.db2.gz ZUOMUALVNQSYEQ-VQTJNVASSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191522073 1048957064 /nfs/dbraw/zinc/95/70/64/1048957064.db2.gz ZUOMUALVNQSYEQ-VQTJNVASSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191521814 1048958813 /nfs/dbraw/zinc/95/88/13/1048958813.db2.gz WEEGCYAYZVZACK-SXLOBPIMSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191521814 1048958823 /nfs/dbraw/zinc/95/88/23/1048958823.db2.gz WEEGCYAYZVZACK-SXLOBPIMSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191521814 1048958838 /nfs/dbraw/zinc/95/88/38/1048958838.db2.gz WEEGCYAYZVZACK-SXLOBPIMSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)C1 ZINC001177913406 1048959860 /nfs/dbraw/zinc/95/98/60/1048959860.db2.gz ZBQPDYCTOBSPLH-CBZIJGRNSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C1 ZINC001177913406 1048959872 /nfs/dbraw/zinc/95/98/72/1048959872.db2.gz ZBQPDYCTOBSPLH-CBZIJGRNSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)C1 ZINC001177913407 1048961254 /nfs/dbraw/zinc/96/12/54/1048961254.db2.gz ZBQPDYCTOBSPLH-MUQADHOPSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC001177913407 1048961271 /nfs/dbraw/zinc/96/12/71/1048961271.db2.gz ZBQPDYCTOBSPLH-MUQADHOPSA-N 2 1 306.519 4.299 20 0 DIADMP Cc1ccccc1C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001203709877 1048974136 /nfs/dbraw/zinc/97/41/36/1048974136.db2.gz SLNNDLZAIKPLHO-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccccc1C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001203709877 1048974147 /nfs/dbraw/zinc/97/41/47/1048974147.db2.gz SLNNDLZAIKPLHO-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccccc1C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001203709877 1048974158 /nfs/dbraw/zinc/97/41/58/1048974158.db2.gz SLNNDLZAIKPLHO-JOCHJYFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1Cl ZINC001178249113 1049001510 /nfs/dbraw/zinc/00/15/10/1049001510.db2.gz IPDKIKLLJOQWPW-KRWDZBQOSA-N 2 1 308.897 4.106 20 0 DIADMP CC[N@@H+](Cc1cccc(Oc2ccccc2)c1)C1CCN(C)CC1 ZINC001203811225 1049003923 /nfs/dbraw/zinc/00/39/23/1049003923.db2.gz OJDXJDQCZNMELQ-UHFFFAOYSA-N 2 1 324.468 4.395 20 0 DIADMP CC[N@@H+](c1ccc(N[C@H]2CC[NH+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802222 1049024121 /nfs/dbraw/zinc/02/41/21/1049024121.db2.gz JIVMRHUJLROVBD-APWZRJJASA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@H+](c1ccc(N[C@H]2CC[NH+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802222 1049024131 /nfs/dbraw/zinc/02/41/31/1049024131.db2.gz JIVMRHUJLROVBD-APWZRJJASA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@H]2CC[N@H+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802222 1049024142 /nfs/dbraw/zinc/02/41/42/1049024142.db2.gz JIVMRHUJLROVBD-APWZRJJASA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802222 1049024149 /nfs/dbraw/zinc/02/41/49/1049024149.db2.gz JIVMRHUJLROVBD-APWZRJJASA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@@H+](c1ccc(N[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802224 1049024404 /nfs/dbraw/zinc/02/44/04/1049024404.db2.gz JIVMRHUJLROVBD-QFBILLFUSA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@H+](c1ccc(N[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802224 1049024415 /nfs/dbraw/zinc/02/44/15/1049024415.db2.gz JIVMRHUJLROVBD-QFBILLFUSA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802224 1049024428 /nfs/dbraw/zinc/02/44/28/1049024428.db2.gz JIVMRHUJLROVBD-QFBILLFUSA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1)C(C)C ZINC000776802224 1049024438 /nfs/dbraw/zinc/02/44/38/1049024438.db2.gz JIVMRHUJLROVBD-QFBILLFUSA-N 2 1 303.494 4.064 20 0 DIADMP Clc1cccc(-c2ccc(C[NH2+]CCC[NH+]3CCC3)s2)c1 ZINC001178398327 1049026134 /nfs/dbraw/zinc/02/61/34/1049026134.db2.gz NCGASHQYGOSUDJ-UHFFFAOYSA-N 2 1 320.889 4.254 20 0 DIADMP Cc1c2ccccc2sc1[C@@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001178436397 1049031696 /nfs/dbraw/zinc/03/16/96/1049031696.db2.gz HMUJGASCWFEOOG-PMPSAXMXSA-N 2 1 314.498 4.487 20 0 DIADMP Cc1c2ccccc2sc1[C@@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001178436396 1049031838 /nfs/dbraw/zinc/03/18/38/1049031838.db2.gz HMUJGASCWFEOOG-OWCLPIDISA-N 2 1 314.498 4.487 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc(Cl)cc1 ZINC001203923429 1049033487 /nfs/dbraw/zinc/03/34/87/1049033487.db2.gz OAPMLBYZGXGQEA-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc(Cl)cc1 ZINC001203923429 1049033497 /nfs/dbraw/zinc/03/34/97/1049033497.db2.gz OAPMLBYZGXGQEA-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1 ZINC001203923429 1049033507 /nfs/dbraw/zinc/03/35/07/1049033507.db2.gz OAPMLBYZGXGQEA-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1 ZINC001203923429 1049033517 /nfs/dbraw/zinc/03/35/17/1049033517.db2.gz OAPMLBYZGXGQEA-ZWKOTPCHSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@H+]1CC[C@@]2(CCN(Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943634 1049039365 /nfs/dbraw/zinc/03/93/65/1049039365.db2.gz IKQCARIDJNJFQU-OAQYLSRUSA-N 2 1 322.452 4.007 20 0 DIADMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943634 1049039379 /nfs/dbraw/zinc/03/93/79/1049039379.db2.gz IKQCARIDJNJFQU-OAQYLSRUSA-N 2 1 322.452 4.007 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943634 1049039397 /nfs/dbraw/zinc/03/93/97/1049039397.db2.gz IKQCARIDJNJFQU-OAQYLSRUSA-N 2 1 322.452 4.007 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(Oc4ccccc4)cc3)C2)C1 ZINC001203943634 1049039417 /nfs/dbraw/zinc/03/94/17/1049039417.db2.gz IKQCARIDJNJFQU-OAQYLSRUSA-N 2 1 322.452 4.007 20 0 DIADMP Cc1cc2cc(C[NH2+]CC[C@H](C)[NH+]3CCCCC3)oc2cc1C ZINC001178463397 1049042906 /nfs/dbraw/zinc/04/29/06/1049042906.db2.gz OPAGIYPFZOKZKM-KRWDZBQOSA-N 2 1 314.473 4.404 20 0 DIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccccc1Cl ZINC001178528911 1049052057 /nfs/dbraw/zinc/05/20/57/1049052057.db2.gz SNIJVBQCUDGOFC-UHFFFAOYSA-N 2 1 308.897 4.474 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000195133453 1049070556 /nfs/dbraw/zinc/07/05/56/1049070556.db2.gz CYCGYWGHUMUOAG-MSOLQXFVSA-N 2 1 314.498 4.311 20 0 DIADMP CC(C)c1ccc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)cc1 ZINC001204168444 1049102045 /nfs/dbraw/zinc/10/20/45/1049102045.db2.gz NDCZXKIIWUWHFW-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP c1cc(Oc2ccccc2)oc1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001178917077 1049109306 /nfs/dbraw/zinc/10/93/06/1049109306.db2.gz SXJVXQLBCHYGER-UHFFFAOYSA-N 2 1 319.364 4.009 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178922197 1049109974 /nfs/dbraw/zinc/10/99/74/1049109974.db2.gz RFSMRFRBQMXFKT-OJAHFUOMSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001178922197 1049109978 /nfs/dbraw/zinc/10/99/78/1049109978.db2.gz RFSMRFRBQMXFKT-OJAHFUOMSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178922198 1049110020 /nfs/dbraw/zinc/11/00/20/1049110020.db2.gz RFSMRFRBQMXFKT-RSPOEFSDSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001178922198 1049110023 /nfs/dbraw/zinc/11/00/23/1049110023.db2.gz RFSMRFRBQMXFKT-RSPOEFSDSA-N 2 1 300.490 4.064 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238648 1049118616 /nfs/dbraw/zinc/11/86/16/1049118616.db2.gz RCTMXAWVTCGMTA-GFOJFJKKSA-N 2 1 314.517 4.301 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238648 1049118622 /nfs/dbraw/zinc/11/86/22/1049118622.db2.gz RCTMXAWVTCGMTA-GFOJFJKKSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238648 1049118626 /nfs/dbraw/zinc/11/86/26/1049118626.db2.gz RCTMXAWVTCGMTA-GFOJFJKKSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238648 1049118629 /nfs/dbraw/zinc/11/86/29/1049118629.db2.gz RCTMXAWVTCGMTA-GFOJFJKKSA-N 2 1 314.517 4.301 20 0 DIADMP C[N@H+]1C[C@@H](C[NH2+][C@H]2CCCC(C)(C)CC2)[C@H](c2ccccc2)C1 ZINC001179015751 1049122570 /nfs/dbraw/zinc/12/25/70/1049122570.db2.gz LGDPWMKNDTUCJN-AABGKKOBSA-N 2 1 314.517 4.280 20 0 DIADMP CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001192645069 1049126882 /nfs/dbraw/zinc/12/68/82/1049126882.db2.gz GRQWBXOUJAVKDL-FXAWDEMLSA-N 2 1 300.490 4.435 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C1CC1 ZINC000716710923 1049145059 /nfs/dbraw/zinc/14/50/59/1049145059.db2.gz YXUDZBZPOLGKJQ-FYZZASKESA-N 2 1 312.501 4.064 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001192918318 1049148507 /nfs/dbraw/zinc/14/85/07/1049148507.db2.gz LFBYOAPAIOJLKB-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP Cc1cccc(Cl)c1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001192918318 1049148513 /nfs/dbraw/zinc/14/85/13/1049148513.db2.gz LFBYOAPAIOJLKB-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP CCCCC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001192987426 1049158722 /nfs/dbraw/zinc/15/87/22/1049158722.db2.gz AOWKPXAMYWWCBH-UHFFFAOYSA-N 2 1 300.490 4.165 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@@H+]1C ZINC001204608909 1049198694 /nfs/dbraw/zinc/19/86/94/1049198694.db2.gz LIGDXASZJRXRCP-DNVCBOLYSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@H+]1C ZINC001204608909 1049198697 /nfs/dbraw/zinc/19/86/97/1049198697.db2.gz LIGDXASZJRXRCP-DNVCBOLYSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608909 1049198700 /nfs/dbraw/zinc/19/87/00/1049198700.db2.gz LIGDXASZJRXRCP-DNVCBOLYSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608909 1049198702 /nfs/dbraw/zinc/19/87/02/1049198702.db2.gz LIGDXASZJRXRCP-DNVCBOLYSA-N 2 1 312.501 4.356 20 0 DIADMP c1ccc(CCCCCC[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000858223519 1049227295 /nfs/dbraw/zinc/22/72/95/1049227295.db2.gz USDUSPZZGZTHHA-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924892 1049228103 /nfs/dbraw/zinc/22/81/03/1049228103.db2.gz LQRNZMNUKZNUGQ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924892 1049228109 /nfs/dbraw/zinc/22/81/09/1049228109.db2.gz LQRNZMNUKZNUGQ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001179924892 1049228120 /nfs/dbraw/zinc/22/81/20/1049228120.db2.gz LQRNZMNUKZNUGQ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001179924892 1049228124 /nfs/dbraw/zinc/22/81/24/1049228124.db2.gz LQRNZMNUKZNUGQ-LPHOPBHVSA-N 2 1 318.892 4.097 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@@H](C)c2nccc3ccccc32)CC1 ZINC001204713367 1049237394 /nfs/dbraw/zinc/23/73/94/1049237394.db2.gz CTAHLYMFKGIPQD-INIZCTEOSA-N 2 1 311.473 4.102 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@@H](C)c2nccc3ccccc32)CC1 ZINC001204713367 1049237401 /nfs/dbraw/zinc/23/74/01/1049237401.db2.gz CTAHLYMFKGIPQD-INIZCTEOSA-N 2 1 311.473 4.102 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001179919551 1049241846 /nfs/dbraw/zinc/24/18/46/1049241846.db2.gz NEUDPYRYFYIZQX-WMSWFFGVSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919551 1049241857 /nfs/dbraw/zinc/24/18/57/1049241857.db2.gz NEUDPYRYFYIZQX-WMSWFFGVSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919551 1049241869 /nfs/dbraw/zinc/24/18/69/1049241869.db2.gz NEUDPYRYFYIZQX-WMSWFFGVSA-N 2 1 312.501 4.041 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000485439571 1049247458 /nfs/dbraw/zinc/24/74/58/1049247458.db2.gz OLKJVYPTJGJHFK-HZPDHXFCSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000485439571 1049247468 /nfs/dbraw/zinc/24/74/68/1049247468.db2.gz OLKJVYPTJGJHFK-HZPDHXFCSA-N 2 1 306.881 4.209 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204748405 1049251496 /nfs/dbraw/zinc/25/14/96/1049251496.db2.gz KSDOWPZQQKIAFM-UHFFFAOYSA-N 2 1 324.921 4.028 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2Cc2ccccc2Cl)CC1 ZINC001180038896 1049259704 /nfs/dbraw/zinc/25/97/04/1049259704.db2.gz DXAKURRALMCWBN-SFHVURJKSA-N 2 1 320.908 4.079 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2CCCC[C@@H]2C)CC1 ZINC001193872532 1049276797 /nfs/dbraw/zinc/27/67/97/1049276797.db2.gz OJCJITOJDANZDI-RDJZCZTQSA-N 2 1 302.462 4.060 20 0 DIADMP C[C@H]1C[C@H](N(C)CC[C@@H]2CCCC[N@H+]2C)c2ccsc2S1 ZINC001180099257 1049285430 /nfs/dbraw/zinc/28/54/30/1049285430.db2.gz XIKGBECDBUWRAY-DZKIICNBSA-N 2 1 324.559 4.480 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc3occc3c2)CC1 ZINC001180125409 1049290739 /nfs/dbraw/zinc/29/07/39/1049290739.db2.gz YMDHFLHTJNBEIE-UHFFFAOYSA-N 2 1 314.473 4.377 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)c1Cl ZINC001205651788 1049310417 /nfs/dbraw/zinc/31/04/17/1049310417.db2.gz JWQYRVQKYFUQDO-YPMHNXCESA-N 2 1 315.288 4.109 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001204937434 1049315583 /nfs/dbraw/zinc/31/55/83/1049315583.db2.gz JUYVYUIWLZIOFB-VIYGXFRKSA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)(C)CC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001180300787 1049327839 /nfs/dbraw/zinc/32/78/39/1049327839.db2.gz DVKAPIRESFAUMK-VAMGGRTRSA-N 2 1 314.517 4.313 20 0 DIADMP CC(C)(C)CC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001180300788 1049328189 /nfs/dbraw/zinc/32/81/89/1049328189.db2.gz DVKAPIRESFAUMK-XUVXKRRUSA-N 2 1 314.517 4.313 20 0 DIADMP CCC(CC)C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001194152467 1049328081 /nfs/dbraw/zinc/32/80/81/1049328081.db2.gz BNKSVPIBWZBRPX-KRWDZBQOSA-N 2 1 308.535 4.246 20 0 DIADMP CCC(CC)C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC001194152467 1049328094 /nfs/dbraw/zinc/32/80/94/1049328094.db2.gz BNKSVPIBWZBRPX-KRWDZBQOSA-N 2 1 308.535 4.246 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccc(-c3ccccc3)c2C)C1 ZINC001205017250 1049344581 /nfs/dbraw/zinc/34/45/81/1049344581.db2.gz MHTSTNMAEOVUDA-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@@H+]3[C@@H](C)CC[C@H]3C[NH3+])ccc21 ZINC001205075019 1049363790 /nfs/dbraw/zinc/36/37/90/1049363790.db2.gz FHZAQOYOSUIHNY-RDJZCZTQSA-N 2 1 321.468 4.126 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@H+]3[C@@H](C)CC[C@H]3C[NH3+])ccc21 ZINC001205075019 1049363795 /nfs/dbraw/zinc/36/37/95/1049363795.db2.gz FHZAQOYOSUIHNY-RDJZCZTQSA-N 2 1 321.468 4.126 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2Cl)CC1 ZINC001205101463 1049378008 /nfs/dbraw/zinc/37/80/08/1049378008.db2.gz FTKYOJQHELVLRK-INIZCTEOSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc3c4ccccc4sc32)C[C@H]1C[NH3+] ZINC001205141123 1049392245 /nfs/dbraw/zinc/39/22/45/1049392245.db2.gz WVPFNCVPVKARSJ-DZGCQCFKSA-N 2 1 310.466 4.081 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205257244 1049418024 /nfs/dbraw/zinc/41/80/24/1049418024.db2.gz UUPMEPGBOUKYKH-FXAWDEMLSA-N 2 1 302.506 4.192 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](CC(c2ccccc2)c2ccccc2)CC1 ZINC001205256197 1049418185 /nfs/dbraw/zinc/41/81/85/1049418185.db2.gz NVERXCCYTFNNAE-OAQYLSRUSA-N 2 1 308.469 4.022 20 0 DIADMP CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205263890 1049420116 /nfs/dbraw/zinc/42/01/16/1049420116.db2.gz FFAFJEMLRBVHNL-FQEVSTJZSA-N 2 1 313.489 4.169 20 0 DIADMP COc1ccc(-c2cccc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)c2)cc1 ZINC001205266708 1049421455 /nfs/dbraw/zinc/42/14/55/1049421455.db2.gz WKSFUWNYKYBVBQ-OAQYLSRUSA-N 2 1 324.468 4.066 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)CC1 ZINC001205266674 1049421568 /nfs/dbraw/zinc/42/15/68/1049421568.db2.gz VTWOXFGHMFMQBX-HXUWFJFHSA-N 2 1 312.432 4.196 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2cccc3c4ccccc4oc32)CC1 ZINC001205273151 1049423895 /nfs/dbraw/zinc/42/38/95/1049423895.db2.gz GGIWDIWJDSSSSB-HXUWFJFHSA-N 2 1 308.425 4.289 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001205281621 1049426763 /nfs/dbraw/zinc/42/67/63/1049426763.db2.gz VYAVLHHSBJVPHQ-HXUWFJFHSA-N 2 1 312.432 4.196 20 0 DIADMP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205280487 1049426811 /nfs/dbraw/zinc/42/68/11/1049426811.db2.gz AMEQFFMSCCQCKE-AWEZNQCLSA-N 2 1 320.786 4.062 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205280487 1049426820 /nfs/dbraw/zinc/42/68/20/1049426820.db2.gz AMEQFFMSCCQCKE-AWEZNQCLSA-N 2 1 320.786 4.062 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205280650 1049427539 /nfs/dbraw/zinc/42/75/39/1049427539.db2.gz FHTLIEOMKZZWJB-OAQYLSRUSA-N 2 1 308.469 4.365 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccccc2CCc2ccccc2)CC1 ZINC001205288182 1049428591 /nfs/dbraw/zinc/42/85/91/1049428591.db2.gz HUVPCUIAJWLPIH-JOCHJYFZSA-N 2 1 322.496 4.175 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@](C)([NH3+])CC2)ccc1Oc1ccccc1 ZINC001205296410 1049431392 /nfs/dbraw/zinc/43/13/92/1049431392.db2.gz OQFDSZCPCYRBJY-NRFANRHFSA-N 2 1 324.468 4.491 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1C[NH3+] ZINC001205306624 1049432896 /nfs/dbraw/zinc/43/28/96/1049432896.db2.gz YIBCUPCVHNTBSV-ZBFHGGJFSA-N 2 1 308.425 4.003 20 0 DIADMP C[C@@H]1CC[NH2+]CC[N@@H+]1Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001205333201 1049441265 /nfs/dbraw/zinc/44/12/65/1049441265.db2.gz XPRLMHRQJLPRRK-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001181155134 1049447718 /nfs/dbraw/zinc/44/77/18/1049447718.db2.gz ZEJLAXGMZAECPX-XUVXKRRUSA-N 2 1 314.517 4.311 20 0 DIADMP CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001181155134 1049447727 /nfs/dbraw/zinc/44/77/27/1049447727.db2.gz ZEJLAXGMZAECPX-XUVXKRRUSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc2ccccc2[nH]1 ZINC000775622466 1049456963 /nfs/dbraw/zinc/45/69/63/1049456963.db2.gz WCQNHCKDQWBHII-IRXDYDNUSA-N 2 1 313.489 4.473 20 0 DIADMP Cc1ccc(CC[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181314281 1049464792 /nfs/dbraw/zinc/46/47/92/1049464792.db2.gz CTJHIPFIZQECTC-QFIPXVFZSA-N 2 1 322.496 4.039 20 0 DIADMP CC[C@@H]1CCCC[C@H]1C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001181383830 1049470762 /nfs/dbraw/zinc/47/07/62/1049470762.db2.gz ZOMQRASFGTZYGK-MSOLQXFVSA-N 2 1 316.489 4.450 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1C[C@@H]1c1ccccc1 ZINC001181486683 1049486706 /nfs/dbraw/zinc/48/67/06/1049486706.db2.gz LUTLSCBVFJFHCG-FGZHOGPDSA-N 2 1 322.496 4.374 20 0 DIADMP CN(CCC[N@@H+](C)C[C@H]1CCCC(C)(C)C1)Cc1ccco1 ZINC001181590625 1049491931 /nfs/dbraw/zinc/49/19/31/1049491931.db2.gz OVYUHNDWDCUBIY-KRWDZBQOSA-N 2 1 306.494 4.250 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@](F)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001205545533 1049494638 /nfs/dbraw/zinc/49/46/38/1049494638.db2.gz IZBCFDUYMYZFOM-OXQOHEQNSA-N 2 1 314.448 4.096 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC001205560006 1049497677 /nfs/dbraw/zinc/49/76/77/1049497677.db2.gz YBSPXGJDZNTHEP-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccccc2-c2cccs2)CC1 ZINC001205571424 1049501044 /nfs/dbraw/zinc/50/10/44/1049501044.db2.gz ULZQGCGYFXUXAE-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC001205570014 1049501611 /nfs/dbraw/zinc/50/16/11/1049501611.db2.gz CMUSHRPBLUWVTJ-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP CC(C)c1cc(C[N@H+]2CCC[C@](F)(C[NH3+])CC2)ccc1Cl ZINC001205592503 1049504545 /nfs/dbraw/zinc/50/45/45/1049504545.db2.gz VUJMGOJHYABSRA-QGZVFWFLSA-N 2 1 312.860 4.116 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC[C@H]1C[NH3+] ZINC001205603511 1049508680 /nfs/dbraw/zinc/50/86/80/1049508680.db2.gz PPROREPWACDNTN-MJGOQNOKSA-N 2 1 324.468 4.286 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001205601183 1049510264 /nfs/dbraw/zinc/51/02/64/1049510264.db2.gz RLXILICXSNNMCF-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC[C@H]1C[NH3+] ZINC001205626980 1049513367 /nfs/dbraw/zinc/51/33/67/1049513367.db2.gz LDLBRRSRKSNVBA-UWJYYQICSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CC[C@H]1C[NH3+] ZINC001205626253 1049514889 /nfs/dbraw/zinc/51/48/89/1049514889.db2.gz FBGUKWZBIVYPCM-APWZRJJASA-N 2 1 320.480 4.065 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@H](C)C1 ZINC001195350039 1049517493 /nfs/dbraw/zinc/51/74/93/1049517493.db2.gz MYKFZEDPSLIGSR-QZTJIDSGSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CC[C@@H]1C[NH3+] ZINC001205638591 1049518110 /nfs/dbraw/zinc/51/81/10/1049518110.db2.gz POQSBFFLDIMOHN-XMSQKQJNSA-N 2 1 322.496 4.084 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CC[C@H]1C[NH3+] ZINC001205638589 1049518211 /nfs/dbraw/zinc/51/82/11/1049518211.db2.gz POQSBFFLDIMOHN-GCJKJVERSA-N 2 1 322.496 4.084 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1 ZINC001205638638 1049518425 /nfs/dbraw/zinc/51/84/25/1049518425.db2.gz QKAWWISYWWXAIB-MJGOQNOKSA-N 2 1 322.496 4.469 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(Cl)c1Cl ZINC001205639084 1049518673 /nfs/dbraw/zinc/51/86/73/1049518673.db2.gz VOOYMEZQFMJVOT-AAEUAGOBSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c1Cl ZINC001205651786 1049522208 /nfs/dbraw/zinc/52/22/08/1049522208.db2.gz JWQYRVQKYFUQDO-DGCLKSJQSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1cc(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(Cl)cc1Cl ZINC001205652592 1049522924 /nfs/dbraw/zinc/52/29/24/1049522924.db2.gz QAYXVSOVEPXOAW-AAEUAGOBSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)cccc1-c1ccccc1 ZINC001205651944 1049524140 /nfs/dbraw/zinc/52/41/40/1049524140.db2.gz MGFFHIHRWPXACS-YLJYHZDGSA-N 2 1 322.496 4.469 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc(F)cc(Cl)c1 ZINC001168372443 1049528415 /nfs/dbraw/zinc/52/84/15/1049528415.db2.gz XMPPRDUVBBUTQU-GFCCVEGCSA-N 2 1 310.844 4.004 20 0 DIADMP CC[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205677449 1049529709 /nfs/dbraw/zinc/52/97/09/1049529709.db2.gz CPAVCSWIVJZFTL-PMACEKPBSA-N 2 1 302.506 4.396 20 0 DIADMP CC1=CCC[C@@H](C)[C@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205678915 1049531022 /nfs/dbraw/zinc/53/10/22/1049531022.db2.gz WKPGSNCNNJNUIC-XLIONFOSSA-N 2 1 300.490 4.172 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)C[C@H](C)c1cccc(Cl)c1 ZINC001205693240 1049533764 /nfs/dbraw/zinc/53/37/64/1049533764.db2.gz SCWDPXFCSOTKLG-INIZCTEOSA-N 2 1 308.897 4.251 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cccc(OC(C)(C)C)c1 ZINC001205697299 1049534467 /nfs/dbraw/zinc/53/44/67/1049534467.db2.gz XTJCQRIVAHXLRO-UHFFFAOYSA-N 2 1 306.494 4.028 20 0 DIADMP C[C@H]1CCC[C@H](C[N@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702945 1049539322 /nfs/dbraw/zinc/53/93/22/1049539322.db2.gz RYBIFXCSSIBDKO-ICSRJNTNSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]1CCC[C@H](C[N@@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702945 1049539335 /nfs/dbraw/zinc/53/93/35/1049539335.db2.gz RYBIFXCSSIBDKO-ICSRJNTNSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@H]1CC1(C)C ZINC000487278378 1049541984 /nfs/dbraw/zinc/54/19/84/1049541984.db2.gz SYYGMSCEKVLEAY-TXPKVOOTSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814835 1049573288 /nfs/dbraw/zinc/57/32/88/1049573288.db2.gz DOIFYIVORJTYDF-CABCVRRESA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814835 1049573297 /nfs/dbraw/zinc/57/32/97/1049573297.db2.gz DOIFYIVORJTYDF-CABCVRRESA-N 2 1 313.489 4.025 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001205901246 1049594139 /nfs/dbraw/zinc/59/41/39/1049594139.db2.gz BZQKNARNCRBSCU-WMZOPIPTSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001205903629 1049596198 /nfs/dbraw/zinc/59/61/98/1049596198.db2.gz QJKQSECGOOLPPL-ZFWWWQNUSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001205904719 1049596699 /nfs/dbraw/zinc/59/66/99/1049596699.db2.gz WSPZEDGHCWAMJZ-DLBZAZTESA-N 2 1 310.441 4.038 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@@H](C[NH3+])[C@H]1C ZINC001205902838 1049597239 /nfs/dbraw/zinc/59/72/39/1049597239.db2.gz LYBDFVRKINKUJY-MSOLQXFVSA-N 2 1 318.505 4.205 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@H](C[NH3+])[C@H]2C)cc1 ZINC001205902244 1049597684 /nfs/dbraw/zinc/59/76/84/1049597684.db2.gz JDQGJARCZHTMEK-MBOZVWFJSA-N 2 1 302.506 4.048 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001205902198 1049598000 /nfs/dbraw/zinc/59/80/00/1049598000.db2.gz IOSDFYXSEOZCBZ-GOEBONIOSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205902208 1049598346 /nfs/dbraw/zinc/59/83/46/1049598346.db2.gz IQNXDPWALQBCQB-KXBFYZLASA-N 2 1 312.432 4.052 20 0 DIADMP CC(C)C[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1ccccc1 ZINC001205923914 1049602959 /nfs/dbraw/zinc/60/29/59/1049602959.db2.gz QFSPFZUUXRERJW-UHFFFAOYSA-N 2 1 314.498 4.052 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001205923226 1049603064 /nfs/dbraw/zinc/60/30/64/1049603064.db2.gz LGTZDVBXVAQRHG-QAPCUYQASA-N 2 1 312.432 4.052 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]CC[C@@H](C)c1ccccc1 ZINC001205927899 1049604481 /nfs/dbraw/zinc/60/44/81/1049604481.db2.gz ZQFVQIYNRXNKQB-QUCCMNQESA-N 2 1 302.506 4.280 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@@H+]3CCCC[C@@H]([NH3+])C3)ccc21 ZINC001205933050 1049606446 /nfs/dbraw/zinc/60/64/46/1049606446.db2.gz WQGBJQNRNMOWJT-QGZVFWFLSA-N 2 1 321.468 4.128 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@H+]3CCCC[C@@H]([NH3+])C3)ccc21 ZINC001205933050 1049606450 /nfs/dbraw/zinc/60/64/50/1049606450.db2.gz WQGBJQNRNMOWJT-QGZVFWFLSA-N 2 1 321.468 4.128 20 0 DIADMP Cc1ccc(N(C)c2ccc(C[N@@H+]3CCCC[C@@H]([NH3+])C3)cc2)cc1 ZINC001205931488 1049606498 /nfs/dbraw/zinc/60/64/98/1049606498.db2.gz JUGPGTMHJDPFMP-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP Cc1ccc(N(C)c2ccc(C[N@H+]3CCCC[C@@H]([NH3+])C3)cc2)cc1 ZINC001205931488 1049606500 /nfs/dbraw/zinc/60/65/00/1049606500.db2.gz JUGPGTMHJDPFMP-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP C[C@@H](Nc1cccc2cc[nH+]cc21)c1cccc(C[NH+](C)C)c1 ZINC000864004137 1049613719 /nfs/dbraw/zinc/61/37/19/1049613719.db2.gz KVDQFUVWWFXGEQ-OAHLLOKOSA-N 2 1 305.425 4.470 20 0 DIADMP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000774188851 1049618390 /nfs/dbraw/zinc/61/83/90/1049618390.db2.gz JVSDLMAVLULZER-FFGOWVMKSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(-c3ccsc3)c2)CCC[C@H]1C[NH3+] ZINC001206004984 1049626359 /nfs/dbraw/zinc/62/63/59/1049626359.db2.gz WFVAUBQSKDRPKF-QAPCUYQASA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3cccs3)cc2)CCC[C@H]1C[NH3+] ZINC001206012020 1049628982 /nfs/dbraw/zinc/62/89/82/1049628982.db2.gz IBFOVBKGWQWZIL-YJBOKZPZSA-N 2 1 314.498 4.222 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+]C1CCC(c2ccc(O)cc2)CC1 ZINC001206054324 1049641580 /nfs/dbraw/zinc/64/15/80/1049641580.db2.gz DWVSOJUHQUADCT-LRYGQEGESA-N 2 1 318.505 4.128 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+]C1CCC(c2ccc(O)cc2)CC1 ZINC001206054324 1049641587 /nfs/dbraw/zinc/64/15/87/1049641587.db2.gz DWVSOJUHQUADCT-LRYGQEGESA-N 2 1 318.505 4.128 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC001206056129 1049642639 /nfs/dbraw/zinc/64/26/39/1049642639.db2.gz PIACNGRPOBCMED-MISYRCLQSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC001206056129 1049642644 /nfs/dbraw/zinc/64/26/44/1049642644.db2.gz PIACNGRPOBCMED-MISYRCLQSA-N 2 1 302.506 4.108 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC000488368227 1049643009 /nfs/dbraw/zinc/64/30/09/1049643009.db2.gz QBTMEUXZVXMAAA-MDNKFWRPSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)C1 ZINC000488436757 1049653623 /nfs/dbraw/zinc/65/36/23/1049653623.db2.gz VHQFQPBBDUYBSE-BRWVUGGUSA-N 2 1 312.567 4.008 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436090 1049654739 /nfs/dbraw/zinc/65/47/39/1049654739.db2.gz WWTNOJDSMSRGOA-XLIONFOSSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436090 1049654748 /nfs/dbraw/zinc/65/47/48/1049654748.db2.gz WWTNOJDSMSRGOA-XLIONFOSSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488435852 1049654906 /nfs/dbraw/zinc/65/49/06/1049654906.db2.gz SNUJIGCYEZUUEA-BRWVUGGUSA-N 2 1 312.567 4.151 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)CC1 ZINC001206154150 1049670681 /nfs/dbraw/zinc/67/06/81/1049670681.db2.gz GWOHPRDVWJHDKW-FHWLQOOXSA-N 2 1 308.485 4.221 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)CC1 ZINC001206154150 1049670702 /nfs/dbraw/zinc/67/07/02/1049670702.db2.gz GWOHPRDVWJHDKW-FHWLQOOXSA-N 2 1 308.485 4.221 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)CCC2 ZINC000339070333 1049672299 /nfs/dbraw/zinc/67/22/99/1049672299.db2.gz MNGQSUGDHADKPL-PXNSSMCTSA-N 2 1 300.490 4.082 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1C[C@@]2(C)C[NH+](C)C[C@]2(C)C1 ZINC001196632314 1049679676 /nfs/dbraw/zinc/67/96/76/1049679676.db2.gz NMPRNAINHMBBRR-FGZHOGPDSA-N 2 1 322.496 4.176 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)CC1 ZINC001206205305 1049682203 /nfs/dbraw/zinc/68/22/03/1049682203.db2.gz PQAUPYXBJQSGFX-FQEVSTJZSA-N 2 1 312.501 4.336 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)[C@@H]1CC1(C)C ZINC001182542109 1049686368 /nfs/dbraw/zinc/68/63/68/1049686368.db2.gz BENBFFOKQNDEHX-FYQPLNBISA-N 2 1 314.517 4.136 20 0 DIADMP C[C@H]1C[NH2+]CC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001206276045 1049696814 /nfs/dbraw/zinc/69/68/14/1049696814.db2.gz AVTIKKJHAZQKHQ-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@H]1C[NH2+]CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001206276045 1049696818 /nfs/dbraw/zinc/69/68/18/1049696818.db2.gz AVTIKKJHAZQKHQ-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP CCC[NH+](CCC)c1ccc(N[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC001182694649 1049701924 /nfs/dbraw/zinc/70/19/24/1049701924.db2.gz WPESHXPGGPRQEN-GOSISDBHSA-N 2 1 303.494 4.209 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)cc1 ZINC001206296213 1049703622 /nfs/dbraw/zinc/70/36/22/1049703622.db2.gz QHTQXCNAEJYTQE-FQEVSTJZSA-N 2 1 318.505 4.207 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCc3oc(-c4ccccc4)cc3C2)CC1 ZINC001182764291 1049708846 /nfs/dbraw/zinc/70/88/46/1049708846.db2.gz MNNMVIZZJWOIKD-UHFFFAOYSA-N 2 1 324.468 4.037 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@](C)(C[NH3+])CC3)cc2)o1 ZINC001206317261 1049709604 /nfs/dbraw/zinc/70/96/04/1049709604.db2.gz DZTMNVZTGNMARF-FQEVSTJZSA-N 2 1 312.457 4.206 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001206317331 1049710685 /nfs/dbraw/zinc/71/06/85/1049710685.db2.gz FYTYLHJYRGTFEP-OAHLLOKOSA-N 2 1 319.251 4.083 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2cccc(-c3ccsc3)c2)C1 ZINC001206352449 1049719229 /nfs/dbraw/zinc/71/92/29/1049719229.db2.gz XNXCSJXBPWMCMI-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2cccc(-c3ccsc3)c2)C1 ZINC001206352449 1049719241 /nfs/dbraw/zinc/71/92/41/1049719241.db2.gz XNXCSJXBPWMCMI-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](CCc2cccs2)CC1 ZINC001197360000 1049742304 /nfs/dbraw/zinc/74/23/04/1049742304.db2.gz SNOOHYMUEOUABQ-UHFFFAOYSA-N 2 1 306.519 4.021 20 0 DIADMP [NH3+]CCC1CC[NH+](Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC001206506869 1049745458 /nfs/dbraw/zinc/74/54/58/1049745458.db2.gz UOTDPKYUOKFBNP-UHFFFAOYSA-N 2 1 321.679 4.208 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001206541887 1049752520 /nfs/dbraw/zinc/75/25/20/1049752520.db2.gz MOSPMUXKXWKCRK-OAQYLSRUSA-N 2 1 308.469 4.305 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206572608 1049759871 /nfs/dbraw/zinc/75/98/71/1049759871.db2.gz DJIKETCGPSAGRB-FQEVSTJZSA-N 2 1 318.505 4.042 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@@H]1CCC[NH2+]CC1 ZINC001206579938 1049760313 /nfs/dbraw/zinc/76/03/13/1049760313.db2.gz BICPOOSGQQSBJG-MRXNPFEDSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](C[C@@H]1C[C@H]1c1ccc(Cl)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206580121 1049761881 /nfs/dbraw/zinc/76/18/81/1049761881.db2.gz CJKLZRBQRFAZBM-UHOSZYNNSA-N 2 1 320.908 4.296 20 0 DIADMP CC(C)[N@@H+](C[C@@H]1C[C@H]1c1ccc(Cl)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206580123 1049762238 /nfs/dbraw/zinc/76/22/38/1049762238.db2.gz CJKLZRBQRFAZBM-WDSOQIARSA-N 2 1 320.908 4.296 20 0 DIADMP CCOc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1Cl ZINC001206591635 1049763660 /nfs/dbraw/zinc/76/36/60/1049763660.db2.gz UMNLNIKJAYTBRC-INIZCTEOSA-N 2 1 324.896 4.091 20 0 DIADMP CC(C)[N@@H+](Cc1c(Cl)[nH]c2ccccc21)[C@@H]1CCC[NH2+]CC1 ZINC001206590986 1049764092 /nfs/dbraw/zinc/76/40/92/1049764092.db2.gz OQKHYSLCYCPUNI-CQSZACIVSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(C(C)(C)C)c1)[C@H]1CCC[NH2+]CC1 ZINC001206591740 1049764129 /nfs/dbraw/zinc/76/41/29/1049764129.db2.gz VSYCJEWWRAGVAS-IBGZPJMESA-N 2 1 302.506 4.337 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206599092 1049765576 /nfs/dbraw/zinc/76/55/76/1049765576.db2.gz NNILGFNHIYDSQI-KRWDZBQOSA-N 2 1 308.897 4.309 20 0 DIADMP Cc1cc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)ccc1OC(C)C ZINC001206599272 1049766188 /nfs/dbraw/zinc/76/61/88/1049766188.db2.gz PVCLZZFOILKSBW-IBGZPJMESA-N 2 1 318.505 4.135 20 0 DIADMP CCc1cc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)ccc1Cl ZINC001206599735 1049766915 /nfs/dbraw/zinc/76/69/15/1049766915.db2.gz WOOSTCVRSGYYIJ-QGZVFWFLSA-N 2 1 308.897 4.255 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1C ZINC001206599872 1049767458 /nfs/dbraw/zinc/76/74/58/1049767458.db2.gz XYQXQJWBPBRPDN-KRWDZBQOSA-N 2 1 308.897 4.309 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206615069 1049769790 /nfs/dbraw/zinc/76/97/90/1049769790.db2.gz BGIZAPLOZLCQEV-GOSISDBHSA-N 2 1 318.505 4.207 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001206616455 1049771148 /nfs/dbraw/zinc/77/11/48/1049771148.db2.gz OVWHECFQFKOVSB-KRWDZBQOSA-N 2 1 310.441 4.040 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001206769087 1049794687 /nfs/dbraw/zinc/79/46/87/1049794687.db2.gz NJWCXKBOKNTZFK-FUHWJXTLSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001206767802 1049794721 /nfs/dbraw/zinc/79/47/21/1049794721.db2.gz FGZGMEPFJDVVHK-ZBFHGGJFSA-N 2 1 308.425 4.145 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@@H]3C)c2)cc1 ZINC001206768006 1049795298 /nfs/dbraw/zinc/79/52/98/1049795298.db2.gz GRABIHVBMXJUPV-HKUYNNGSSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001206769086 1049795780 /nfs/dbraw/zinc/79/57/80/1049795780.db2.gz NJWCXKBOKNTZFK-AEFFLSMTSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001206771462 1049796344 /nfs/dbraw/zinc/79/63/44/1049796344.db2.gz WYZTYXXUVBTQNT-UONOGXRCSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001206770121 1049796754 /nfs/dbraw/zinc/79/67/54/1049796754.db2.gz REPMFHLDVZDRQH-CABCVRRESA-N 2 1 316.470 4.100 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001206770123 1049796951 /nfs/dbraw/zinc/79/69/51/1049796951.db2.gz REPMFHLDVZDRQH-HUUCEWRRSA-N 2 1 316.470 4.100 20 0 DIADMP Cc1occc1C[N@@H+](C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000490423105 1049828104 /nfs/dbraw/zinc/82/81/04/1049828104.db2.gz NDXWEGYDDKBITA-JXFKEZNVSA-N 2 1 312.457 4.073 20 0 DIADMP Cc1occc1C[N@H+](C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000490423105 1049828118 /nfs/dbraw/zinc/82/81/18/1049828118.db2.gz NDXWEGYDDKBITA-JXFKEZNVSA-N 2 1 312.457 4.073 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c1C ZINC001207093640 1049835380 /nfs/dbraw/zinc/83/53/80/1049835380.db2.gz MUETXFRPKKLWIS-LIRRHRJNSA-N 2 1 320.546 4.498 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001207185614 1049857169 /nfs/dbraw/zinc/85/71/69/1049857169.db2.gz QSTLXLIXIWEPJS-GOEBONIOSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001207185614 1049857188 /nfs/dbraw/zinc/85/71/88/1049857188.db2.gz QSTLXLIXIWEPJS-GOEBONIOSA-N 2 1 320.443 4.494 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001207274474 1049872984 /nfs/dbraw/zinc/87/29/84/1049872984.db2.gz CXRAOOSWICLNNY-UHFFFAOYSA-N 2 1 306.881 4.017 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001207274474 1049872990 /nfs/dbraw/zinc/87/29/90/1049872990.db2.gz CXRAOOSWICLNNY-UHFFFAOYSA-N 2 1 306.881 4.017 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001207280643 1049874464 /nfs/dbraw/zinc/87/44/64/1049874464.db2.gz XLIYJJMWXINNBA-UHFFFAOYSA-N 2 1 303.277 4.013 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC001207280643 1049874470 /nfs/dbraw/zinc/87/44/70/1049874470.db2.gz XLIYJJMWXINNBA-UHFFFAOYSA-N 2 1 303.277 4.013 20 0 DIADMP C[C@@H]1CC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001207291901 1049875462 /nfs/dbraw/zinc/87/54/62/1049875462.db2.gz FWTWRCKWXWKZPK-MSOLQXFVSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@]1(F)CCCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207286681 1049875912 /nfs/dbraw/zinc/87/59/12/1049875912.db2.gz KHDCPNVCNJWTQB-FQEVSTJZSA-N 2 1 318.480 4.113 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CCC4(CCCC4)C3)CC2)cc1 ZINC001207291134 1049876388 /nfs/dbraw/zinc/87/63/88/1049876388.db2.gz KOHXYOVZZBSFAK-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP CCC[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@@H](C)CC ZINC001207287290 1049876403 /nfs/dbraw/zinc/87/64/03/1049876403.db2.gz RUVOPYIUYFODTQ-SFHVURJKSA-N 2 1 302.506 4.409 20 0 DIADMP C[C@@H]1CC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC001207291902 1049876544 /nfs/dbraw/zinc/87/65/44/1049876544.db2.gz FWTWRCKWXWKZPK-QZTJIDSGSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC001207289880 1049876706 /nfs/dbraw/zinc/87/67/06/1049876706.db2.gz YPVDVCZAWOBAKB-SFTDATJTSA-N 2 1 312.501 4.021 20 0 DIADMP CSCc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)cc1 ZINC001207301290 1049878810 /nfs/dbraw/zinc/87/88/10/1049878810.db2.gz DVVWYPSGMMBOLE-UHFFFAOYSA-N 2 1 320.546 4.248 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c(C)s1 ZINC000491056834 1049882672 /nfs/dbraw/zinc/88/26/72/1049882672.db2.gz JWSDNJPDYFFQFX-GOSISDBHSA-N 2 1 320.546 4.453 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c(C)s1 ZINC000491056834 1049882684 /nfs/dbraw/zinc/88/26/84/1049882684.db2.gz JWSDNJPDYFFQFX-GOSISDBHSA-N 2 1 320.546 4.453 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491059034 1049882972 /nfs/dbraw/zinc/88/29/72/1049882972.db2.gz QTFJCUCQWDNUEH-MSOLQXFVSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491059034 1049882975 /nfs/dbraw/zinc/88/29/75/1049882975.db2.gz QTFJCUCQWDNUEH-MSOLQXFVSA-N 2 1 318.480 4.475 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1CCc1cccc(Cl)c1 ZINC001207425831 1049892312 /nfs/dbraw/zinc/89/23/12/1049892312.db2.gz NHSLUNHYSYNFJP-OALUTQOASA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCc1cccc(Cl)c1 ZINC001207425831 1049892317 /nfs/dbraw/zinc/89/23/17/1049892317.db2.gz NHSLUNHYSYNFJP-OALUTQOASA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCc1cccc(Cl)c1 ZINC001207425831 1049892322 /nfs/dbraw/zinc/89/23/22/1049892322.db2.gz NHSLUNHYSYNFJP-OALUTQOASA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001207483064 1049897553 /nfs/dbraw/zinc/89/75/53/1049897553.db2.gz COQBJLSWWSXJIR-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP C[N@@H+](CCc1ccccc1F)C1CC[NH+](C2CCCCC2)CC1 ZINC001207503535 1049901105 /nfs/dbraw/zinc/90/11/05/1049901105.db2.gz YGDGVAPQFVRDJI-UHFFFAOYSA-N 2 1 318.480 4.097 20 0 DIADMP CC(C)=CCC[C@H](C)CC[N@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@H]2C1 ZINC001207783450 1049938634 /nfs/dbraw/zinc/93/86/34/1049938634.db2.gz GUMACBNCSXFWCO-MUGJNUQGSA-N 2 1 306.538 4.421 20 0 DIADMP CC[NH+](CC)CC[C@@H]([NH2+]C1CC(OC(C)C)C1)c1ccccc1 ZINC001207806112 1049942130 /nfs/dbraw/zinc/94/21/30/1049942130.db2.gz RBKAPGPIXAAQEG-SOAGJPPSSA-N 2 1 318.505 4.005 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@@H]([NH2+]CC3CCC4(CCCCC4)CC3)[C@@H]2C1 ZINC001207836659 1049944114 /nfs/dbraw/zinc/94/41/14/1049944114.db2.gz KOFPLPLTOQIAMC-IPMKNSEASA-N 2 1 304.522 4.057 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C)c1ccccc1 ZINC001207912073 1049954192 /nfs/dbraw/zinc/95/41/92/1049954192.db2.gz NDRPOGLQHIKLSE-YZGWKJHDSA-N 2 1 300.490 4.129 20 0 DIADMP C[C@H](C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC001207912073 1049954207 /nfs/dbraw/zinc/95/42/07/1049954207.db2.gz NDRPOGLQHIKLSE-YZGWKJHDSA-N 2 1 300.490 4.129 20 0 DIADMP C[C@H](C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC001207912073 1049954216 /nfs/dbraw/zinc/95/42/16/1049954216.db2.gz NDRPOGLQHIKLSE-YZGWKJHDSA-N 2 1 300.490 4.129 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+](C)C2CC[NH+](C)CC2)CC1 ZINC001207936121 1049957830 /nfs/dbraw/zinc/95/78/30/1049957830.db2.gz AUIJAGOWGVVPQA-LJQANCHMSA-N 2 1 304.522 4.485 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+](C)C2CC[NH+](C)CC2)CC1 ZINC001207936121 1049957832 /nfs/dbraw/zinc/95/78/32/1049957832.db2.gz AUIJAGOWGVVPQA-LJQANCHMSA-N 2 1 304.522 4.485 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)ccc1F ZINC000571901450 1049970418 /nfs/dbraw/zinc/97/04/18/1049970418.db2.gz FQKHPVKYQJGQKK-AZUAARDMSA-N 2 1 312.432 4.059 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)ccc1F ZINC000571901450 1049970424 /nfs/dbraw/zinc/97/04/24/1049970424.db2.gz FQKHPVKYQJGQKK-AZUAARDMSA-N 2 1 312.432 4.059 20 0 DIADMP C(CC1CCCC1)C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001208088908 1049972699 /nfs/dbraw/zinc/97/26/99/1049972699.db2.gz VIMUTXBTWRPVCJ-UHFFFAOYSA-N 2 1 304.522 4.297 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001208107697 1049973846 /nfs/dbraw/zinc/97/38/46/1049973846.db2.gz YXJHQFWVIHQBEB-QGZVFWFLSA-N 2 1 306.881 4.209 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)o1 ZINC001208155755 1049978985 /nfs/dbraw/zinc/97/89/85/1049978985.db2.gz OKMYHZPEKBZLMO-IEBWSBKVSA-N 2 1 318.505 4.422 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)o1 ZINC001208170450 1049981350 /nfs/dbraw/zinc/98/13/50/1049981350.db2.gz XDSOCSHGOSKXRR-YTQUADARSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@@H](C)CC[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)o1 ZINC001208170450 1049981355 /nfs/dbraw/zinc/98/13/55/1049981355.db2.gz XDSOCSHGOSKXRR-YTQUADARSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@@H](C)CC[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)o1 ZINC001208170450 1049981358 /nfs/dbraw/zinc/98/13/58/1049981358.db2.gz XDSOCSHGOSKXRR-YTQUADARSA-N 2 1 318.505 4.420 20 0 DIADMP C[NH+](C)CC1(C[N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CCCC1 ZINC001208188645 1049981965 /nfs/dbraw/zinc/98/19/65/1049981965.db2.gz MBXRPEBSWKLVSM-GOSISDBHSA-N 2 1 322.443 4.224 20 0 DIADMP C[NH+](C)CC1(C[N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CCCC1 ZINC001208188645 1049981968 /nfs/dbraw/zinc/98/19/68/1049981968.db2.gz MBXRPEBSWKLVSM-GOSISDBHSA-N 2 1 322.443 4.224 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@@H+]2CC2(C[NH+](C)C)CCCC2)cc1 ZINC001208191218 1049983668 /nfs/dbraw/zinc/98/36/68/1049983668.db2.gz LVXHVKVIKGXTOG-IBGZPJMESA-N 2 1 300.490 4.254 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001208601908 1049997594 /nfs/dbraw/zinc/99/75/94/1049997594.db2.gz SMECOVCNXYGPHD-SFHVURJKSA-N 2 1 318.530 4.277 20 0 DIADMP C[C@@H](C[N@@H+](C)CC1CC[NH+](C)CC1)c1cccc2ccccc21 ZINC001208720501 1050006077 /nfs/dbraw/zinc/00/60/77/1050006077.db2.gz YDRXULPQOMEWEI-KRWDZBQOSA-N 2 1 310.485 4.217 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1CCc1ccc(Cl)cc1 ZINC001208742378 1050008415 /nfs/dbraw/zinc/00/84/15/1050008415.db2.gz QDJGBFYGQLAAIM-OALUTQOASA-N 2 1 320.908 4.221 20 0 DIADMP CC(C)CCC[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001208736673 1050008574 /nfs/dbraw/zinc/00/85/74/1050008574.db2.gz MGHCMTPZSGZHTK-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP CC(C)CCC[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001208736673 1050008577 /nfs/dbraw/zinc/00/85/77/1050008577.db2.gz MGHCMTPZSGZHTK-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3C[C@@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208932099 1050023832 /nfs/dbraw/zinc/02/38/32/1050023832.db2.gz OESTVQSDXSONIJ-NJYVYQBISA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@H+]3C[C@@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208932099 1050023838 /nfs/dbraw/zinc/02/38/38/1050023838.db2.gz OESTVQSDXSONIJ-NJYVYQBISA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208932099 1050023843 /nfs/dbraw/zinc/02/38/43/1050023843.db2.gz OESTVQSDXSONIJ-NJYVYQBISA-N 2 1 312.501 4.021 20 0 DIADMP C[C@H]1CCCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935114 1050023979 /nfs/dbraw/zinc/02/39/79/1050023979.db2.gz IHOBOLGXQQBLNS-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935114 1050023987 /nfs/dbraw/zinc/02/39/87/1050023987.db2.gz IHOBOLGXQQBLNS-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208935114 1050023990 /nfs/dbraw/zinc/02/39/90/1050023990.db2.gz IHOBOLGXQQBLNS-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208935114 1050023996 /nfs/dbraw/zinc/02/39/96/1050023996.db2.gz IHOBOLGXQQBLNS-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929974 1050024739 /nfs/dbraw/zinc/02/47/39/1050024739.db2.gz XPQJXBBJAWEVEH-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929974 1050024743 /nfs/dbraw/zinc/02/47/43/1050024743.db2.gz XPQJXBBJAWEVEH-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929974 1050024748 /nfs/dbraw/zinc/02/47/48/1050024748.db2.gz XPQJXBBJAWEVEH-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929974 1050024751 /nfs/dbraw/zinc/02/47/51/1050024751.db2.gz XPQJXBBJAWEVEH-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208931271 1050025527 /nfs/dbraw/zinc/02/55/27/1050025527.db2.gz IRZPBSFBPNENOD-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208931271 1050025534 /nfs/dbraw/zinc/02/55/34/1050025534.db2.gz IRZPBSFBPNENOD-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208931271 1050025539 /nfs/dbraw/zinc/02/55/39/1050025539.db2.gz IRZPBSFBPNENOD-UYAOXDASSA-N 2 1 300.490 4.021 20 0 DIADMP CCC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208931786 1050025659 /nfs/dbraw/zinc/02/56/59/1050025659.db2.gz MRTWVYRUTDQZAU-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3C[C@@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208944159 1050026786 /nfs/dbraw/zinc/02/67/86/1050026786.db2.gz OESTVQSDXSONIJ-HKBOAZHASA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCC4(CCCC4)CC3)C2)cc1 ZINC001208945137 1050026803 /nfs/dbraw/zinc/02/68/03/1050026803.db2.gz ZAHOKDSOSYRCMT-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP CCCC1CC[NH+](C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208947726 1050027041 /nfs/dbraw/zinc/02/70/41/1050027041.db2.gz CEEQXZMABRNBRF-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208948893 1050027628 /nfs/dbraw/zinc/02/76/28/1050027628.db2.gz SZCQOVQOUAOFNG-JOCHJYFZSA-N 2 1 322.496 4.419 20 0 DIADMP CC(C)[N@H+](Cc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208948893 1050027633 /nfs/dbraw/zinc/02/76/33/1050027633.db2.gz SZCQOVQOUAOFNG-JOCHJYFZSA-N 2 1 322.496 4.419 20 0 DIADMP CC(C)[NH+](Cc1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208948893 1050027639 /nfs/dbraw/zinc/02/76/39/1050027639.db2.gz SZCQOVQOUAOFNG-JOCHJYFZSA-N 2 1 322.496 4.419 20 0 DIADMP CC(C)[NH+](Cc1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208948893 1050027642 /nfs/dbraw/zinc/02/76/42/1050027642.db2.gz SZCQOVQOUAOFNG-JOCHJYFZSA-N 2 1 322.496 4.419 20 0 DIADMP C[C@@H]1CC[N@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935418 1050028253 /nfs/dbraw/zinc/02/82/53/1050028253.db2.gz JARYDZVTSOWRRX-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935418 1050028259 /nfs/dbraw/zinc/02/82/59/1050028259.db2.gz JARYDZVTSOWRRX-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935418 1050028263 /nfs/dbraw/zinc/02/82/63/1050028263.db2.gz JARYDZVTSOWRRX-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@H](C)C1 ZINC001208935418 1050028268 /nfs/dbraw/zinc/02/82/68/1050028268.db2.gz JARYDZVTSOWRRX-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCCC3)C2)cc1 ZINC001208939755 1050028348 /nfs/dbraw/zinc/02/83/48/1050028348.db2.gz IDWZEUSPCOSXRY-HXUWFJFHSA-N 2 1 300.490 4.165 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940077 1050028366 /nfs/dbraw/zinc/02/83/66/1050028366.db2.gz ONZVBBMPDIRCGQ-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940077 1050028371 /nfs/dbraw/zinc/02/83/71/1050028371.db2.gz ONZVBBMPDIRCGQ-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208940077 1050028376 /nfs/dbraw/zinc/02/83/76/1050028376.db2.gz ONZVBBMPDIRCGQ-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208940077 1050028381 /nfs/dbraw/zinc/02/83/81/1050028381.db2.gz ONZVBBMPDIRCGQ-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](Cc1ccsc1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208939912 1050028616 /nfs/dbraw/zinc/02/86/16/1050028616.db2.gz LGFGRSYABORIDL-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP C[N@H+](Cc1ccsc1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208939912 1050028621 /nfs/dbraw/zinc/02/86/21/1050028621.db2.gz LGFGRSYABORIDL-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1ccsc1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208939912 1050028625 /nfs/dbraw/zinc/02/86/25/1050028625.db2.gz LGFGRSYABORIDL-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1ccsc1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208939912 1050028628 /nfs/dbraw/zinc/02/86/28/1050028628.db2.gz LGFGRSYABORIDL-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP CC(C)[C@H]1CCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947047 1050028787 /nfs/dbraw/zinc/02/87/87/1050028787.db2.gz YBWBMEBSVJGWFI-WOJBJXKFSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947047 1050028793 /nfs/dbraw/zinc/02/87/93/1050028793.db2.gz YBWBMEBSVJGWFI-WOJBJXKFSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208947047 1050028795 /nfs/dbraw/zinc/02/87/95/1050028795.db2.gz YBWBMEBSVJGWFI-WOJBJXKFSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208947047 1050028801 /nfs/dbraw/zinc/02/88/01/1050028801.db2.gz YBWBMEBSVJGWFI-WOJBJXKFSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC001208949275 1050029126 /nfs/dbraw/zinc/02/91/26/1050029126.db2.gz JULHFFWZFVPNBE-IFMALSPDSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@@H+]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC001208949275 1050029132 /nfs/dbraw/zinc/02/91/32/1050029132.db2.gz JULHFFWZFVPNBE-IFMALSPDSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@H+]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC001208949275 1050029139 /nfs/dbraw/zinc/02/91/39/1050029139.db2.gz JULHFFWZFVPNBE-IFMALSPDSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@H]1c2ccccc2CC[N@@H+]1C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949928 1050029355 /nfs/dbraw/zinc/02/93/55/1050029355.db2.gz ZPWAFVWLGNWVMX-ICSRJNTNSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1c2ccccc2CC[NH+]1C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949928 1050029360 /nfs/dbraw/zinc/02/93/60/1050029360.db2.gz ZPWAFVWLGNWVMX-ICSRJNTNSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1c2ccccc2CC[NH+]1C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949928 1050029365 /nfs/dbraw/zinc/02/93/65/1050029365.db2.gz ZPWAFVWLGNWVMX-ICSRJNTNSA-N 2 1 320.480 4.128 20 0 DIADMP CCC[N@H+](Cc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208950532 1050030304 /nfs/dbraw/zinc/03/03/04/1050030304.db2.gz TZDXVYFKBFWEJG-QFIPXVFZSA-N 2 1 322.496 4.421 20 0 DIADMP CCC[NH+](Cc1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208950532 1050030310 /nfs/dbraw/zinc/03/03/10/1050030310.db2.gz TZDXVYFKBFWEJG-QFIPXVFZSA-N 2 1 322.496 4.421 20 0 DIADMP CCC[NH+](Cc1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208950532 1050030316 /nfs/dbraw/zinc/03/03/16/1050030316.db2.gz TZDXVYFKBFWEJG-QFIPXVFZSA-N 2 1 322.496 4.421 20 0 DIADMP Clc1cc2c(s1)CC[C@@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000572891643 1050046111 /nfs/dbraw/zinc/04/61/11/1050046111.db2.gz LKSOCFQSVMTBKT-HNNXBMFYSA-N 2 1 324.921 4.385 20 0 DIADMP C[C@H]1C[C@@H]1C[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001209433879 1050058705 /nfs/dbraw/zinc/05/87/05/1050058705.db2.gz WGJZEEQLHWGJHI-AZUAARDMSA-N 2 1 312.501 4.021 20 0 DIADMP c1[nH]c2ccc(Nc3cccc(C[NH+]4CCCCC4)c3)cc2[nH+]1 ZINC001209847448 1050094819 /nfs/dbraw/zinc/09/48/19/1050094819.db2.gz QHMDXEKRXRQFHK-UHFFFAOYSA-N 2 1 306.413 4.292 20 0 DIADMP c1[nH]c2ccc(Nc3ccc(CC[NH+]4CCCCC4)cc3)cc2[nH+]1 ZINC001209850978 1050096024 /nfs/dbraw/zinc/09/60/24/1050096024.db2.gz PTODQBUFJIVJHG-UHFFFAOYSA-N 2 1 320.440 4.335 20 0 DIADMP C(=C\C[N@H+]1CCC[C@@H]1C1CCC1)\C[NH+]1CCC[C@H]1C1CCC1 ZINC000590598446 1050098501 /nfs/dbraw/zinc/09/85/01/1050098501.db2.gz BTUWNVJLHGUENQ-DZNLNZEASA-N 2 1 302.506 4.072 20 0 DIADMP C(=C\C[N@@H+]1CCC[C@H]1C1CCC1)\C[NH+]1CCC[C@@H]1C1CCC1 ZINC000590598446 1050098504 /nfs/dbraw/zinc/09/85/04/1050098504.db2.gz BTUWNVJLHGUENQ-DZNLNZEASA-N 2 1 302.506 4.072 20 0 DIADMP C(=C\C[N@H+]1CCC[C@H]1C1CCC1)\C[NH+]1CCC[C@@H]1C1CCC1 ZINC000590598446 1050098508 /nfs/dbraw/zinc/09/85/08/1050098508.db2.gz BTUWNVJLHGUENQ-DZNLNZEASA-N 2 1 302.506 4.072 20 0 DIADMP Cc1cc(C)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(C)c1 ZINC000590786916 1050106464 /nfs/dbraw/zinc/10/64/64/1050106464.db2.gz SBPZJYPIVMUOQR-UHFFFAOYSA-N 2 1 302.506 4.164 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000573127394 1050133894 /nfs/dbraw/zinc/13/38/94/1050133894.db2.gz ZZHFGTTZAFUIDF-ZBFHGGJFSA-N 2 1 306.881 4.083 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(Cl)cccc2C1 ZINC001171031036 1050154706 /nfs/dbraw/zinc/15/47/06/1050154706.db2.gz RKSNXFSRXDIOBA-ULQDDVLXSA-N 2 1 320.908 4.178 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1F)CC(C)C ZINC000348049440 1050169378 /nfs/dbraw/zinc/16/93/78/1050169378.db2.gz QVXBGSZZYUKNJE-UHFFFAOYSA-N 2 1 317.452 4.269 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1F)CC(C)C ZINC000348049440 1050169388 /nfs/dbraw/zinc/16/93/88/1050169388.db2.gz QVXBGSZZYUKNJE-UHFFFAOYSA-N 2 1 317.452 4.269 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1ccc(C)c(C)c1 ZINC000348052691 1050172415 /nfs/dbraw/zinc/17/24/15/1050172415.db2.gz UVHRFIWGAXCLPS-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1ccc(C)c(C)c1 ZINC000348052691 1050172427 /nfs/dbraw/zinc/17/24/27/1050172427.db2.gz UVHRFIWGAXCLPS-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1ccc(C)c(C)c1 ZINC000348052693 1050172757 /nfs/dbraw/zinc/17/27/57/1050172757.db2.gz UVHRFIWGAXCLPS-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1ccc(C)c(C)c1 ZINC000348052693 1050172760 /nfs/dbraw/zinc/17/27/60/1050172760.db2.gz UVHRFIWGAXCLPS-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348068182 1050174099 /nfs/dbraw/zinc/17/40/99/1050174099.db2.gz DTEUZMPEIZFLPP-LSDHHAIUSA-N 2 1 317.502 4.363 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000824065931 1050181690 /nfs/dbraw/zinc/18/16/90/1050181690.db2.gz IIMZLVDFXNYANE-MRXNPFEDSA-N 2 1 317.521 4.454 20 0 DIADMP CCC1CC([NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000573986939 1050298779 /nfs/dbraw/zinc/29/87/79/1050298779.db2.gz JBGLSLYZQSSKCL-AILXTGBUSA-N 2 1 300.490 4.065 20 0 DIADMP [NH3+]Cc1ccc(C[N@@H+](Cc2ccccc2)C2CCCCC2)cc1 ZINC001210581252 1050305218 /nfs/dbraw/zinc/30/52/18/1050305218.db2.gz QHZDYNZJFJSMAG-UHFFFAOYSA-N 2 1 308.469 4.480 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(Cl)ccc2C1 ZINC001171111543 1050378871 /nfs/dbraw/zinc/37/88/71/1050378871.db2.gz SVEURAMGOGIETM-FHWLQOOXSA-N 2 1 320.908 4.178 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001143996154 1050435343 /nfs/dbraw/zinc/43/53/43/1050435343.db2.gz HXSFHPUNLWOUCQ-UHFFFAOYSA-N 2 1 322.802 4.132 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC001143996154 1050435345 /nfs/dbraw/zinc/43/53/45/1050435345.db2.gz HXSFHPUNLWOUCQ-UHFFFAOYSA-N 2 1 322.802 4.132 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccnc(Cl)c1 ZINC000157879330 1050457734 /nfs/dbraw/zinc/45/77/34/1050457734.db2.gz MEFAACSEEVTOEC-GJZGRUSLSA-N 2 1 309.885 4.040 20 0 DIADMP CC(C)CCC[C@@H](C)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170071454 1050581503 /nfs/dbraw/zinc/58/15/03/1050581503.db2.gz OODMBGXYPLZPEE-MISYRCLQSA-N 2 1 317.521 4.368 20 0 DIADMP CC(C)CCC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001170072195 1050588754 /nfs/dbraw/zinc/58/87/54/1050588754.db2.gz YMVHEIFFDUBUOS-INIZCTEOSA-N 2 1 306.469 4.290 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2cccc3ccccc32)CC1 ZINC000788479663 1050687940 /nfs/dbraw/zinc/68/79/40/1050687940.db2.gz ZJVGEAIRMHJSGJ-OAQYLSRUSA-N 2 1 308.469 4.319 20 0 DIADMP Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000180011754 1050717201 /nfs/dbraw/zinc/71/72/01/1050717201.db2.gz LNOKQYWPXXVYIL-RCCFBDPRSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC000180011754 1050717216 /nfs/dbraw/zinc/71/72/16/1050717216.db2.gz LNOKQYWPXXVYIL-RCCFBDPRSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000180011754 1050717238 /nfs/dbraw/zinc/71/72/38/1050717238.db2.gz LNOKQYWPXXVYIL-RCCFBDPRSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000180011754 1050717241 /nfs/dbraw/zinc/71/72/41/1050717241.db2.gz LNOKQYWPXXVYIL-RCCFBDPRSA-N 2 1 315.505 4.268 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccccc1SC(C)(C)C ZINC000788693336 1050726537 /nfs/dbraw/zinc/72/65/37/1050726537.db2.gz SFPCECMJSJHCOZ-OAHLLOKOSA-N 2 1 318.530 4.490 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170117316 1050876499 /nfs/dbraw/zinc/87/64/99/1050876499.db2.gz JXAQKQVZSXRWDJ-UTRMSSBJSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170121082 1050887262 /nfs/dbraw/zinc/88/72/62/1050887262.db2.gz KZVKYUOQXOVFSP-UTRMSSBJSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4cccs4)C3)CC2)C1 ZINC001170137058 1050963758 /nfs/dbraw/zinc/96/37/58/1050963758.db2.gz MRXIYWBBPHTDHJ-IRXDYDNUSA-N 2 1 318.530 4.225 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[C@H]3[N@@H+](C)Cc3ccco3)CC2)C1 ZINC001170139431 1050969277 /nfs/dbraw/zinc/96/92/77/1050969277.db2.gz UXLIAXUPLUIQQD-ZIFCJYIRSA-N 2 1 316.489 4.145 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1cccc(C)c1C ZINC000348190200 1051003317 /nfs/dbraw/zinc/00/33/17/1051003317.db2.gz QYURZIHBOICPSP-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1cccc(C)c1C ZINC000348190200 1051003324 /nfs/dbraw/zinc/00/33/24/1051003324.db2.gz QYURZIHBOICPSP-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716714650 1051134747 /nfs/dbraw/zinc/13/47/47/1051134747.db2.gz VEFIJSQYBIOHGH-BZSNNMDCSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170260504 1051165376 /nfs/dbraw/zinc/16/53/76/1051165376.db2.gz KHQNBGKNOQBDAW-QGPMSJSTSA-N 2 1 320.908 4.395 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccccc2Cl)C1 ZINC001170260298 1051166061 /nfs/dbraw/zinc/16/60/61/1051166061.db2.gz HQIGEGQWPGNZSO-HOCLYGCPSA-N 2 1 308.897 4.124 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@@H](C)Cc2ccccc2Cl)C1 ZINC001170260298 1051166068 /nfs/dbraw/zinc/16/60/68/1051166068.db2.gz HQIGEGQWPGNZSO-HOCLYGCPSA-N 2 1 308.897 4.124 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001170265785 1051167350 /nfs/dbraw/zinc/16/73/50/1051167350.db2.gz JPNGNDOMBMIJIG-JKSUJKDBSA-N 2 1 308.897 4.112 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001170265782 1051167277 /nfs/dbraw/zinc/16/72/77/1051167277.db2.gz JPNGNDOMBMIJIG-CVEARBPZSA-N 2 1 308.897 4.112 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)C2CC2)nc1 ZINC001171630073 1051172255 /nfs/dbraw/zinc/17/22/55/1051172255.db2.gz HMJYNINQAWZCKA-GOSISDBHSA-N 2 1 315.505 4.082 20 0 DIADMP C(=C\C[N@H+]1CCC2(CCCC2)C1)\C[NH+]1CCC2(CCCC2)C1 ZINC000744420318 1051172564 /nfs/dbraw/zinc/17/25/64/1051172564.db2.gz JBNJXNIATREJMF-WAYWQWQTSA-N 2 1 302.506 4.075 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3c(C)cccc3C2)CC1 ZINC001171577405 1051172606 /nfs/dbraw/zinc/17/26/06/1051172606.db2.gz DTRZLQMRJHIGFP-FQEVSTJZSA-N 2 1 314.517 4.049 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2cc3ccccc3o2)CC1(C)C ZINC001171623060 1051179753 /nfs/dbraw/zinc/17/97/53/1051179753.db2.gz JAOZKKAUZSWRMN-UHFFFAOYSA-N 2 1 300.446 4.174 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ccc(F)c(F)c1 ZINC001171624766 1051180545 /nfs/dbraw/zinc/18/05/45/1051180545.db2.gz WQSFCMALENFINZ-GFCCVEGCSA-N 2 1 310.432 4.267 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171665463 1051187745 /nfs/dbraw/zinc/18/77/45/1051187745.db2.gz GUPXJOUGNKVMLJ-MISYRCLQSA-N 2 1 302.506 4.296 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171665462 1051188100 /nfs/dbraw/zinc/18/81/00/1051188100.db2.gz GUPXJOUGNKVMLJ-IHPCNDPISA-N 2 1 302.506 4.296 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001171676127 1051192057 /nfs/dbraw/zinc/19/20/57/1051192057.db2.gz WURQIGUNDARDRQ-IBGZPJMESA-N 2 1 316.533 4.368 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C1CC1 ZINC001171967246 1051248406 /nfs/dbraw/zinc/24/84/06/1051248406.db2.gz YNRQWEINDBXFPV-GOSISDBHSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171963702 1051248435 /nfs/dbraw/zinc/24/84/35/1051248435.db2.gz ISQKDUUCTBSSSD-FXAWDEMLSA-N 2 1 323.484 4.175 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C(C2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001171972308 1051261655 /nfs/dbraw/zinc/26/16/55/1051261655.db2.gz PQJCMBKIUOUMQF-IBGZPJMESA-N 2 1 312.501 4.208 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976050 1051263119 /nfs/dbraw/zinc/26/31/19/1051263119.db2.gz HURXBSTZPMCCIN-UYAOXDASSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976050 1051263133 /nfs/dbraw/zinc/26/31/33/1051263133.db2.gz HURXBSTZPMCCIN-UYAOXDASSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976050 1051263139 /nfs/dbraw/zinc/26/31/39/1051263139.db2.gz HURXBSTZPMCCIN-UYAOXDASSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976050 1051263149 /nfs/dbraw/zinc/26/31/49/1051263149.db2.gz HURXBSTZPMCCIN-UYAOXDASSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975421 1051266086 /nfs/dbraw/zinc/26/60/86/1051266086.db2.gz CTTYJRDRLRHVBS-PKOBYXMFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975421 1051266096 /nfs/dbraw/zinc/26/60/96/1051266096.db2.gz CTTYJRDRLRHVBS-PKOBYXMFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975421 1051266110 /nfs/dbraw/zinc/26/61/10/1051266110.db2.gz CTTYJRDRLRHVBS-PKOBYXMFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975421 1051266113 /nfs/dbraw/zinc/26/61/13/1051266113.db2.gz CTTYJRDRLRHVBS-PKOBYXMFSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(F)CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171978072 1051268776 /nfs/dbraw/zinc/26/87/76/1051268776.db2.gz WLKFGDKWOMYFRP-SFHVURJKSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977916 1051269879 /nfs/dbraw/zinc/26/98/79/1051269879.db2.gz HUUKGTZUWARXIG-LJQANCHMSA-N 2 1 314.517 4.455 20 0 DIADMP C[N@H+](C1CC(F)(F)C1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171978244 1051270254 /nfs/dbraw/zinc/27/02/54/1051270254.db2.gz XITPMSYYWHKPRN-MRXNPFEDSA-N 2 1 322.443 4.159 20 0 DIADMP C[N@@H+](C1CC(F)(F)C1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171978244 1051270268 /nfs/dbraw/zinc/27/02/68/1051270268.db2.gz XITPMSYYWHKPRN-MRXNPFEDSA-N 2 1 322.443 4.159 20 0 DIADMP C[NH+](C1CC(F)(F)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171978244 1051270277 /nfs/dbraw/zinc/27/02/77/1051270277.db2.gz XITPMSYYWHKPRN-MRXNPFEDSA-N 2 1 322.443 4.159 20 0 DIADMP C[NH+](C1CC(F)(F)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171978244 1051270288 /nfs/dbraw/zinc/27/02/88/1051270288.db2.gz XITPMSYYWHKPRN-MRXNPFEDSA-N 2 1 322.443 4.159 20 0 DIADMP CCC[C@H](C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070587 1051274438 /nfs/dbraw/zinc/27/44/38/1051274438.db2.gz PKZKOFNFFDLKEW-FRYIKTPZSA-N 2 1 300.490 4.350 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001172076261 1051276395 /nfs/dbraw/zinc/27/63/95/1051276395.db2.gz XJYGNBXSPUVLQM-NGCWXFERSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001172076261 1051276404 /nfs/dbraw/zinc/27/64/04/1051276404.db2.gz XJYGNBXSPUVLQM-NGCWXFERSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2CC4CCC2CC4)C3)cc1 ZINC001172076261 1051276418 /nfs/dbraw/zinc/27/64/18/1051276418.db2.gz XJYGNBXSPUVLQM-NGCWXFERSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2CC4CCC2CC4)C3)cc1 ZINC001172076261 1051276428 /nfs/dbraw/zinc/27/64/28/1051276428.db2.gz XJYGNBXSPUVLQM-NGCWXFERSA-N 2 1 324.512 4.447 20 0 DIADMP CC1(C)[C@@H]2C[N@@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)N4Cc3ccccc3)C[C@@H]21 ZINC001172075814 1051277906 /nfs/dbraw/zinc/27/79/06/1051277906.db2.gz SXSAOKPLPVFKBH-UZFIKNKDSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[N@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172075814 1051277918 /nfs/dbraw/zinc/27/79/18/1051277918.db2.gz SXSAOKPLPVFKBH-UZFIKNKDSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[N@@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172075814 1051277929 /nfs/dbraw/zinc/27/79/29/1051277929.db2.gz SXSAOKPLPVFKBH-UZFIKNKDSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172075814 1051277939 /nfs/dbraw/zinc/27/79/39/1051277939.db2.gz SXSAOKPLPVFKBH-UZFIKNKDSA-N 2 1 324.512 4.160 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001172075814 1051277951 /nfs/dbraw/zinc/27/79/51/1051277951.db2.gz SXSAOKPLPVFKBH-UZFIKNKDSA-N 2 1 324.512 4.160 20 0 DIADMP CCCC[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080688 1051279498 /nfs/dbraw/zinc/27/94/98/1051279498.db2.gz WCDZMRRPOMBJAA-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172080688 1051279514 /nfs/dbraw/zinc/27/95/14/1051279514.db2.gz WCDZMRRPOMBJAA-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172080688 1051279525 /nfs/dbraw/zinc/27/95/25/1051279525.db2.gz WCDZMRRPOMBJAA-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172079993 1051280494 /nfs/dbraw/zinc/28/04/94/1051280494.db2.gz RUGIQADYWJRQPZ-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP CC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172079993 1051280505 /nfs/dbraw/zinc/28/05/05/1051280505.db2.gz RUGIQADYWJRQPZ-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+](CC2CC2)C2CC2)C3)cc1 ZINC001172087827 1051281163 /nfs/dbraw/zinc/28/11/63/1051281163.db2.gz MIFOSSBLQGUHFY-ZBYYUNFXSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+](CC2CC2)C2CC2)C3)cc1 ZINC001172087827 1051281175 /nfs/dbraw/zinc/28/11/75/1051281175.db2.gz MIFOSSBLQGUHFY-ZBYYUNFXSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001172087827 1051281188 /nfs/dbraw/zinc/28/11/88/1051281188.db2.gz MIFOSSBLQGUHFY-ZBYYUNFXSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001172087827 1051281202 /nfs/dbraw/zinc/28/12/02/1051281202.db2.gz MIFOSSBLQGUHFY-ZBYYUNFXSA-N 2 1 324.512 4.447 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccccc1-c1ccccc1)C2 ZINC001172100845 1051284296 /nfs/dbraw/zinc/28/42/96/1051284296.db2.gz SUJLGNHVSDLKJK-WKCHPHFGSA-N 2 1 320.480 4.459 20 0 DIADMP CC(C)(C)C(=[NH2+])N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172063688 1051284344 /nfs/dbraw/zinc/28/43/44/1051284344.db2.gz BJSYHKWMVJURDG-NNZMDNLPSA-N 2 1 313.489 4.185 20 0 DIADMP CC(C)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CC1 ZINC001172063749 1051285407 /nfs/dbraw/zinc/28/54/07/1051285407.db2.gz CGHYWRQHVMHPIU-OWZKRDHZSA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC001172063749 1051285418 /nfs/dbraw/zinc/28/54/18/1051285418.db2.gz CGHYWRQHVMHPIU-OWZKRDHZSA-N 2 1 312.501 4.350 20 0 DIADMP c1ccc(-c2ccccc2C[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000793337552 1051285907 /nfs/dbraw/zinc/28/59/07/1051285907.db2.gz RFDOUKVAIZTFEC-UHFFFAOYSA-N 2 1 320.480 4.460 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2C=CCCC2)C3)cc1 ZINC001172067582 1051286109 /nfs/dbraw/zinc/28/61/09/1051286109.db2.gz HDNGEYXAYZXGNQ-MXEMCNAFSA-N 2 1 310.485 4.270 20 0 DIADMP F[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172064076 1051286780 /nfs/dbraw/zinc/28/67/80/1051286780.db2.gz FJAJGYMDJPZGPF-LTFPLMDUSA-N 2 1 316.464 4.052 20 0 DIADMP CC[C@@H](C)[N@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069074 1051287799 /nfs/dbraw/zinc/28/77/99/1051287799.db2.gz NSVZKDXNPHQWBI-LMCOJAPRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H](C)[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069074 1051287808 /nfs/dbraw/zinc/28/78/08/1051287808.db2.gz NSVZKDXNPHQWBI-LMCOJAPRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H](C)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069074 1051287823 /nfs/dbraw/zinc/28/78/23/1051287823.db2.gz NSVZKDXNPHQWBI-LMCOJAPRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H](C)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069074 1051287834 /nfs/dbraw/zinc/28/78/34/1051287834.db2.gz NSVZKDXNPHQWBI-LMCOJAPRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H](C)[N@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069075 1051288045 /nfs/dbraw/zinc/28/80/45/1051288045.db2.gz NSVZKDXNPHQWBI-RSPOEFSDSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H](C)[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069075 1051288056 /nfs/dbraw/zinc/28/80/56/1051288056.db2.gz NSVZKDXNPHQWBI-RSPOEFSDSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H](C)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069075 1051288064 /nfs/dbraw/zinc/28/80/64/1051288064.db2.gz NSVZKDXNPHQWBI-RSPOEFSDSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H](C)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069075 1051288078 /nfs/dbraw/zinc/28/80/78/1051288078.db2.gz NSVZKDXNPHQWBI-RSPOEFSDSA-N 2 1 300.490 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2CCCCC2)C3)cc1 ZINC001172069191 1051288950 /nfs/dbraw/zinc/28/89/50/1051288950.db2.gz RWIAYUMGTRJBRW-WKCHPHFGSA-N 2 1 312.501 4.494 20 0 DIADMP CCCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172068371 1051289040 /nfs/dbraw/zinc/28/90/40/1051289040.db2.gz QKIUXWHZYVYMPY-OWZKRDHZSA-N 2 1 300.490 4.352 20 0 DIADMP CC(C)[C@H](C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067809 1051290212 /nfs/dbraw/zinc/29/02/12/1051290212.db2.gz OAIKSJJDHIUAKS-FRYIKTPZSA-N 2 1 300.490 4.206 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CC4(C2)CCCC4)C3)cc1 ZINC001172070123 1051290646 /nfs/dbraw/zinc/29/06/46/1051290646.db2.gz XBPJFDGRORFJHY-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccc(F)cc1F)C2 ZINC001172131235 1051293044 /nfs/dbraw/zinc/29/30/44/1051293044.db2.gz VIFMMRLWOZGZKJ-YYAJDYIMSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccc(F)cc1F)C2 ZINC001172131235 1051293053 /nfs/dbraw/zinc/29/30/53/1051293053.db2.gz VIFMMRLWOZGZKJ-YYAJDYIMSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccc(F)cc1F)C2 ZINC001172131235 1051293062 /nfs/dbraw/zinc/29/30/62/1051293062.db2.gz VIFMMRLWOZGZKJ-YYAJDYIMSA-N 2 1 320.427 4.117 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131099 1051293913 /nfs/dbraw/zinc/29/39/13/1051293913.db2.gz UWTBAPNXPYXKQV-WCVJEAGWSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131099 1051293927 /nfs/dbraw/zinc/29/39/27/1051293927.db2.gz UWTBAPNXPYXKQV-WCVJEAGWSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131099 1051293938 /nfs/dbraw/zinc/29/39/38/1051293938.db2.gz UWTBAPNXPYXKQV-WCVJEAGWSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131099 1051293950 /nfs/dbraw/zinc/29/39/50/1051293950.db2.gz UWTBAPNXPYXKQV-WCVJEAGWSA-N 2 1 306.881 4.348 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C2 ZINC001172106992 1051295094 /nfs/dbraw/zinc/29/50/94/1051295094.db2.gz RLLZMHADIGWSAE-JRSUCEMESA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C2 ZINC001172106992 1051295103 /nfs/dbraw/zinc/29/51/03/1051295103.db2.gz RLLZMHADIGWSAE-JRSUCEMESA-N 2 1 312.501 4.318 20 0 DIADMP CCCCc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172102612 1051296068 /nfs/dbraw/zinc/29/60/68/1051296068.db2.gz NKQRXDBUCMCYQV-ACDBMABISA-N 2 1 300.490 4.134 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(Cl)c1 ZINC001172108045 1051296174 /nfs/dbraw/zinc/29/61/74/1051296174.db2.gz OJQBFEIMGVULMU-NGFQHRJXSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(Cl)c1 ZINC001172108045 1051296186 /nfs/dbraw/zinc/29/61/86/1051296186.db2.gz OJQBFEIMGVULMU-NGFQHRJXSA-N 2 1 310.844 4.145 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105924 1051297385 /nfs/dbraw/zinc/29/73/85/1051297385.db2.gz LEYJMTPAZQVDFN-RDGPPVDQSA-N 2 1 318.892 4.396 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105924 1051297396 /nfs/dbraw/zinc/29/73/96/1051297396.db2.gz LEYJMTPAZQVDFN-RDGPPVDQSA-N 2 1 318.892 4.396 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105027 1051298183 /nfs/dbraw/zinc/29/81/83/1051298183.db2.gz HOLYEDMGYJRYSY-OKYOBFRVSA-N 2 1 300.490 4.379 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105027 1051298203 /nfs/dbraw/zinc/29/82/03/1051298203.db2.gz HOLYEDMGYJRYSY-OKYOBFRVSA-N 2 1 300.490 4.379 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110083 1051300612 /nfs/dbraw/zinc/30/06/12/1051300612.db2.gz JSSHOBOMICYOJV-YGTYGHESSA-N 2 1 318.892 4.322 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3c(Cl)cccc31)C2 ZINC001172110083 1051300618 /nfs/dbraw/zinc/30/06/18/1051300618.db2.gz JSSHOBOMICYOJV-YGTYGHESSA-N 2 1 318.892 4.322 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172109100 1051301132 /nfs/dbraw/zinc/30/11/32/1051301132.db2.gz AXSQBOFKUXUCPN-SSSFQFABSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172109100 1051301143 /nfs/dbraw/zinc/30/11/43/1051301143.db2.gz AXSQBOFKUXUCPN-SSSFQFABSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110193 1051301163 /nfs/dbraw/zinc/30/11/63/1051301163.db2.gz IUDFMLPMZZCHMU-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110193 1051301172 /nfs/dbraw/zinc/30/11/72/1051301172.db2.gz IUDFMLPMZZCHMU-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110195 1051302371 /nfs/dbraw/zinc/30/23/71/1051302371.db2.gz IUDFMLPMZZCHMU-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CC1)c1ccc(F)cc1)C2 ZINC001172110195 1051302376 /nfs/dbraw/zinc/30/23/76/1051302376.db2.gz IUDFMLPMZZCHMU-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(C)(C)c1ccccc1Cl)C2 ZINC001172119023 1051303765 /nfs/dbraw/zinc/30/37/65/1051303765.db2.gz VFAAFQQRLQDJHJ-QKDCVEJESA-N 2 1 306.881 4.180 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCCCCCCCCCC[NH3+])C2 ZINC001172118502 1051306800 /nfs/dbraw/zinc/30/68/00/1051306800.db2.gz RBCQPXJBZJBLCZ-OWZKRDHZSA-N 3 1 323.569 4.061 20 0 DIADMP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCCCCCCCCCC[NH3+])C2 ZINC001172118502 1051306809 /nfs/dbraw/zinc/30/68/09/1051306809.db2.gz RBCQPXJBZJBLCZ-OWZKRDHZSA-N 2 1 323.569 4.061 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1c1ccccc1)C2 ZINC001172119013 1051307282 /nfs/dbraw/zinc/30/72/82/1051307282.db2.gz UXJNYZVXIFZMQN-ZFELAIKPSA-N 2 1 324.512 4.174 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1[C@@H]3CC[C@@H](C3)[C@H]1c1ccccc1)C2 ZINC001172119013 1051307285 /nfs/dbraw/zinc/30/72/85/1051307285.db2.gz UXJNYZVXIFZMQN-ZFELAIKPSA-N 2 1 324.512 4.174 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCCCCCCCCCC[NH3+])C2 ZINC001172118500 1051307385 /nfs/dbraw/zinc/30/73/85/1051307385.db2.gz RBCQPXJBZJBLCZ-ACDBMABISA-N 3 1 323.569 4.061 20 0 DIADMP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCCCCCCCCCC[NH3+])C2 ZINC001172118500 1051307393 /nfs/dbraw/zinc/30/73/93/1051307393.db2.gz RBCQPXJBZJBLCZ-ACDBMABISA-N 2 1 323.569 4.061 20 0 DIADMP CC[NH+](CC)Cc1ccc(F)c(Nc2c[nH+]c3ccccn23)c1 ZINC001215723953 1051324907 /nfs/dbraw/zinc/32/49/07/1051324907.db2.gz GEEAWNJIBBOAME-UHFFFAOYSA-N 2 1 312.392 4.059 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C[C@@H]1C ZINC001172372807 1051352444 /nfs/dbraw/zinc/35/24/44/1051352444.db2.gz JFTXRHNQOXMVSX-AOIWGVFYSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC001172379409 1051355813 /nfs/dbraw/zinc/35/58/13/1051355813.db2.gz ODWCIHDMZBLXRQ-ZFMNYDKASA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC001172379409 1051355822 /nfs/dbraw/zinc/35/58/22/1051355822.db2.gz ODWCIHDMZBLXRQ-ZFMNYDKASA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC001172379409 1051355833 /nfs/dbraw/zinc/35/58/33/1051355833.db2.gz ODWCIHDMZBLXRQ-ZFMNYDKASA-N 2 1 314.517 4.265 20 0 DIADMP CCC(CC)[N@H+]([C@H](C)CCO[C@@H](C)CC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172332228 1051356501 /nfs/dbraw/zinc/35/65/01/1051356501.db2.gz HLFRXJWDYMJIJV-SFNKJDCFSA-N 2 1 312.542 4.341 20 0 DIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338541 1051360610 /nfs/dbraw/zinc/36/06/10/1051360610.db2.gz ZADRAMOMJLNGBD-SFNKJDCFSA-N 2 1 310.526 4.095 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000380907863 1051366351 /nfs/dbraw/zinc/36/63/51/1051366351.db2.gz IJWOTXLIDKEBCM-IEBWSBKVSA-N 2 1 312.457 4.151 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000380907863 1051366356 /nfs/dbraw/zinc/36/63/56/1051366356.db2.gz IJWOTXLIDKEBCM-IEBWSBKVSA-N 2 1 312.457 4.151 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001170450701 1051402274 /nfs/dbraw/zinc/40/22/74/1051402274.db2.gz FFYVJBUXTQEZPW-QFIPXVFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001170450701 1051402283 /nfs/dbraw/zinc/40/22/83/1051402283.db2.gz FFYVJBUXTQEZPW-QFIPXVFZSA-N 2 1 322.496 4.320 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001170450701 1051402290 /nfs/dbraw/zinc/40/22/90/1051402290.db2.gz FFYVJBUXTQEZPW-QFIPXVFZSA-N 2 1 322.496 4.320 20 0 DIADMP CC(C)COCC[C@H](C)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172474087 1051402467 /nfs/dbraw/zinc/40/24/67/1051402467.db2.gz XQFHYPNQVZJTMJ-IHPCNDPISA-N 2 1 324.553 4.200 20 0 DIADMP CCCCCC[C@H](CCCC)[NH2+]C1CC[NH+](CCOC)CC1 ZINC001172515918 1051430215 /nfs/dbraw/zinc/43/02/15/1051430215.db2.gz FCGGDZIGJAYSFG-SFHVURJKSA-N 2 1 312.542 4.216 20 0 DIADMP CCCCCC[C@@H](CCCC)[NH2+]C1CC[NH+](CCOC)CC1 ZINC001172515916 1051431059 /nfs/dbraw/zinc/43/10/59/1051431059.db2.gz FCGGDZIGJAYSFG-GOSISDBHSA-N 2 1 312.542 4.216 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001172538087 1051451859 /nfs/dbraw/zinc/45/18/59/1051451859.db2.gz LUEKXFJCVWUAQA-MISYRCLQSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169099671 1051508277 /nfs/dbraw/zinc/50/82/77/1051508277.db2.gz DNEIPIBBZSVGQS-RDGPPVDQSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169099669 1051509369 /nfs/dbraw/zinc/50/93/69/1051509369.db2.gz DNEIPIBBZSVGQS-FCGDIQPGSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cccc(-c3cccs3)c1)C2 ZINC001169100491 1051509797 /nfs/dbraw/zinc/50/97/97/1051509797.db2.gz JXSOQZVLLSZSEH-BCDXTJNWSA-N 2 1 312.482 4.130 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001169084253 1051514464 /nfs/dbraw/zinc/51/44/64/1051514464.db2.gz IKGVTLYYOCPBTH-HXUWFJFHSA-N 2 1 314.517 4.062 20 0 DIADMP c1[nH+]cn(C2CCC(Cc3ccccc3)CC2)c1C1CC[NH2+]CC1 ZINC001172824968 1051515806 /nfs/dbraw/zinc/51/58/06/1051515806.db2.gz MPASAUDQKVFGDE-UHFFFAOYSA-N 2 1 323.484 4.324 20 0 DIADMP Cc1ccc2c(c1)C[C@H]([N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828017 1051518003 /nfs/dbraw/zinc/51/80/03/1051518003.db2.gz HWEAYXRBOUJBAB-NJDAHSKKSA-N 2 1 314.517 4.080 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC1c3ccccc3-c3ccccc31)C2 ZINC001169118584 1051523540 /nfs/dbraw/zinc/52/35/40/1051523540.db2.gz KVXFWUYJKNBZAL-OSYLJGHBSA-N 2 1 318.464 4.014 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC1c3ccccc3-c3ccccc31)C2 ZINC001169118583 1051523766 /nfs/dbraw/zinc/52/37/66/1051523766.db2.gz KVXFWUYJKNBZAL-BJWYYQGGSA-N 2 1 318.464 4.014 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001169140127 1051526580 /nfs/dbraw/zinc/52/65/80/1051526580.db2.gz HNACMMNRAXQYQL-VSZNYVQBSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001169140127 1051526596 /nfs/dbraw/zinc/52/65/96/1051526596.db2.gz HNACMMNRAXQYQL-VSZNYVQBSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001169140127 1051526608 /nfs/dbraw/zinc/52/66/08/1051526608.db2.gz HNACMMNRAXQYQL-VSZNYVQBSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1cccc(-c3ccc(F)cc3)c1)C2 ZINC001169115124 1051530643 /nfs/dbraw/zinc/53/06/43/1051530643.db2.gz HQLPHUQLNIULIN-WKCHPHFGSA-N 2 1 324.443 4.208 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cccc(-c3ccc(F)cc3)c1)C2 ZINC001169115120 1051531599 /nfs/dbraw/zinc/53/15/99/1051531599.db2.gz HQLPHUQLNIULIN-MZADTFQBSA-N 2 1 324.443 4.208 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+](Cc1ccccc1)Cc1ccccc1)C2 ZINC001169147011 1051535334 /nfs/dbraw/zinc/53/53/34/1051535334.db2.gz RDMDOHXFODDOGO-ZBYYUNFXSA-N 2 1 320.480 4.314 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC001172859024 1051545947 /nfs/dbraw/zinc/54/59/47/1051545947.db2.gz QPLYBHOPWDJXMK-CZUORRHYSA-N 2 1 324.871 4.017 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@@H]1CC[N@H+](C2CCCC2)C1 ZINC001172859024 1051545953 /nfs/dbraw/zinc/54/59/53/1051545953.db2.gz QPLYBHOPWDJXMK-CZUORRHYSA-N 2 1 324.871 4.017 20 0 DIADMP CC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001169261651 1051558833 /nfs/dbraw/zinc/55/88/33/1051558833.db2.gz KEXJFXCJXOKCND-QGZVFWFLSA-N 2 1 304.503 4.030 20 0 DIADMP CC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001169261651 1051558839 /nfs/dbraw/zinc/55/88/39/1051558839.db2.gz KEXJFXCJXOKCND-QGZVFWFLSA-N 2 1 304.503 4.030 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccsc1 ZINC000178335743 1051569456 /nfs/dbraw/zinc/56/94/56/1051569456.db2.gz NHQSHZHBRNWUIL-JTDSTZFVSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccsc1 ZINC000178335743 1051569466 /nfs/dbraw/zinc/56/94/66/1051569466.db2.gz NHQSHZHBRNWUIL-JTDSTZFVSA-N 2 1 314.498 4.452 20 0 DIADMP Cn1c[nH+]c2cccc(Nc3ccc(C4CC[NH+](C)CC4)cc3)c21 ZINC001212691467 1051577978 /nfs/dbraw/zinc/57/79/78/1051577978.db2.gz SHCKCIZOXWRFOJ-UHFFFAOYSA-N 2 1 320.440 4.126 20 0 DIADMP C[C@H]1CCCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001169395932 1051607751 /nfs/dbraw/zinc/60/77/51/1051607751.db2.gz NUSZHEVDTBVZEN-SFHVURJKSA-N 2 1 300.490 4.295 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000493279683 1051608892 /nfs/dbraw/zinc/60/88/92/1051608892.db2.gz ZMIGKCVDXBVKHG-WOJBJXKFSA-N 2 1 308.469 4.238 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000493279681 1051609673 /nfs/dbraw/zinc/60/96/73/1051609673.db2.gz ZMIGKCVDXBVKHG-UXHICEINSA-N 2 1 308.469 4.238 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H]2c2ccccc2)CC1 ZINC001173111705 1051610447 /nfs/dbraw/zinc/61/04/47/1051610447.db2.gz KBPDZTCYYHNYDW-SOAGJPPSSA-N 2 1 300.490 4.477 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2ccc(OC)cc2)CC1 ZINC001173113151 1051611959 /nfs/dbraw/zinc/61/19/59/1051611959.db2.gz JHZJPUXHZAVPSX-UHFFFAOYSA-N 2 1 318.505 4.170 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3cc(C)ccc3C2)CC1 ZINC001173114137 1051612190 /nfs/dbraw/zinc/61/21/90/1051612190.db2.gz XSBNFYLRMUZYJH-UHFFFAOYSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@H]([NH3+])C1 ZINC001173204038 1051626377 /nfs/dbraw/zinc/62/63/77/1051626377.db2.gz BZGSZXKEQRJMQJ-XLIONFOSSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]([NH3+])C1 ZINC001173204038 1051626386 /nfs/dbraw/zinc/62/63/86/1051626386.db2.gz BZGSZXKEQRJMQJ-XLIONFOSSA-N 2 1 308.469 4.020 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2cccc(C[NH2+]C)c2F)cc1 ZINC001216223768 1051632976 /nfs/dbraw/zinc/63/29/76/1051632976.db2.gz YNZAEPRQVZBANC-UHFFFAOYSA-N 2 1 301.409 4.135 20 0 DIADMP C[C@H](C[NH3+])C[N@@H+](C)[C@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173211530 1051649670 /nfs/dbraw/zinc/64/96/70/1051649670.db2.gz QZZKAPDCGXJQMO-QZTJIDSGSA-N 2 1 310.485 4.124 20 0 DIADMP CCCC[C@@H](CC(C)C)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001173254067 1051656582 /nfs/dbraw/zinc/65/65/82/1051656582.db2.gz BGDXXWCNTVGTIV-VQTJNVASSA-N 2 1 324.553 4.167 20 0 DIADMP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000493884565 1051664422 /nfs/dbraw/zinc/66/44/22/1051664422.db2.gz YSBKKHQLDGKDAF-GGPKGHCWSA-N 2 1 318.505 4.007 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173270611 1051669264 /nfs/dbraw/zinc/66/92/64/1051669264.db2.gz NZDBHXRSCKHULA-MVJPYGJCSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293176 1051674901 /nfs/dbraw/zinc/67/49/01/1051674901.db2.gz JZCRHGJIFWHCQY-UTKZUKDTSA-N 2 1 312.501 4.088 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293176 1051674913 /nfs/dbraw/zinc/67/49/13/1051674913.db2.gz JZCRHGJIFWHCQY-UTKZUKDTSA-N 2 1 312.501 4.088 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001173292504 1051675187 /nfs/dbraw/zinc/67/51/87/1051675187.db2.gz GZINFETXHHBEMD-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173292504 1051675204 /nfs/dbraw/zinc/67/52/04/1051675204.db2.gz GZINFETXHHBEMD-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173292504 1051675209 /nfs/dbraw/zinc/67/52/09/1051675209.db2.gz GZINFETXHHBEMD-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001173292503 1051676032 /nfs/dbraw/zinc/67/60/32/1051676032.db2.gz GZINFETXHHBEMD-HOJAQTOUSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173292503 1051676039 /nfs/dbraw/zinc/67/60/39/1051676039.db2.gz GZINFETXHHBEMD-HOJAQTOUSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173292503 1051676049 /nfs/dbraw/zinc/67/60/49/1051676049.db2.gz GZINFETXHHBEMD-HOJAQTOUSA-N 2 1 300.490 4.019 20 0 DIADMP CCSC[C@@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173296095 1051677771 /nfs/dbraw/zinc/67/77/71/1051677771.db2.gz QNZGFASUXLJPPV-DJIMGWMZSA-N 2 1 324.509 4.039 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001173280691 1051686255 /nfs/dbraw/zinc/68/62/55/1051686255.db2.gz PMNPSKCCMGGLFM-PKOBYXMFSA-N 2 1 316.489 4.146 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)o1 ZINC000183184749 1051709580 /nfs/dbraw/zinc/70/95/80/1051709580.db2.gz DBAFEGDFLDAWQY-OWCLPIDISA-N 2 1 304.478 4.146 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000183184749 1051709597 /nfs/dbraw/zinc/70/95/97/1051709597.db2.gz DBAFEGDFLDAWQY-OWCLPIDISA-N 2 1 304.478 4.146 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000183700199 1051719033 /nfs/dbraw/zinc/71/90/33/1051719033.db2.gz FATXNJXERXPUPA-HWOWSKLDSA-N 2 1 320.443 4.065 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000185518515 1051770336 /nfs/dbraw/zinc/77/03/36/1051770336.db2.gz GEZCNUWEERLILB-HWOWSKLDSA-N 2 1 320.443 4.019 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000185518515 1051770351 /nfs/dbraw/zinc/77/03/51/1051770351.db2.gz GEZCNUWEERLILB-HWOWSKLDSA-N 2 1 320.443 4.019 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000185518515 1051770363 /nfs/dbraw/zinc/77/03/63/1051770363.db2.gz GEZCNUWEERLILB-HWOWSKLDSA-N 2 1 320.443 4.019 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000185517301 1051771872 /nfs/dbraw/zinc/77/18/72/1051771872.db2.gz UTVWYLRNAFKCNM-PRLABOORSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000185517301 1051771886 /nfs/dbraw/zinc/77/18/86/1051771886.db2.gz UTVWYLRNAFKCNM-PRLABOORSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000185517301 1051771893 /nfs/dbraw/zinc/77/18/93/1051771893.db2.gz UTVWYLRNAFKCNM-PRLABOORSA-N 2 1 320.443 4.017 20 0 DIADMP CCSc1cccc(C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000185518086 1051772191 /nfs/dbraw/zinc/77/21/91/1051772191.db2.gz YBGJDMTVAZEHTL-QGZVFWFLSA-N 2 1 306.519 4.009 20 0 DIADMP C[N@@H+](C1CCC([NH3+])CC1)C1CCC2(CCc3ccccc32)CC1 ZINC001173688921 1051780492 /nfs/dbraw/zinc/78/04/92/1051780492.db2.gz NUKXWBXJYOHRER-UHFFFAOYSA-N 2 1 312.501 4.015 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c1 ZINC001206211680 1051786036 /nfs/dbraw/zinc/78/60/36/1051786036.db2.gz OQOCJOPXISNIHC-IRXDYDNUSA-N 2 1 312.498 4.132 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)s1 ZINC001206214179 1051790593 /nfs/dbraw/zinc/79/05/93/1051790593.db2.gz XNRMJWQUZRTZLK-IAGOWNOFSA-N 2 1 312.498 4.132 20 0 DIADMP CC[C@@H](NC[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330008 1051874692 /nfs/dbraw/zinc/87/46/92/1051874692.db2.gz GJHSRJXEOOENLT-QFBILLFUSA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccccc1F ZINC000494330008 1051874706 /nfs/dbraw/zinc/87/47/06/1051874706.db2.gz GJHSRJXEOOENLT-QFBILLFUSA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330008 1051874713 /nfs/dbraw/zinc/87/47/13/1051874713.db2.gz GJHSRJXEOOENLT-QFBILLFUSA-N 2 1 306.469 4.234 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)s2)cc1 ZINC000768193357 1051899835 /nfs/dbraw/zinc/89/98/35/1051899835.db2.gz MNLLBVKKKVYOGV-UHFFFAOYSA-N 2 1 308.878 4.095 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000494482464 1051902887 /nfs/dbraw/zinc/90/28/87/1051902887.db2.gz FLAMDMBONKAALO-RDTXWAMCSA-N 2 1 306.519 4.189 20 0 DIADMP C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768228852 1051906137 /nfs/dbraw/zinc/90/61/37/1051906137.db2.gz KPOUQYCTMAHWMJ-AWEZNQCLSA-N 2 1 318.411 4.219 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)[NH+](C)C ZINC000222422686 1051915607 /nfs/dbraw/zinc/91/56/07/1051915607.db2.gz LPUORHMELGBLAM-ILXRZTDVSA-N 2 1 308.432 4.064 20 0 DIADMP Cc1c([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)cnn1C(C)C ZINC000191141349 1051964358 /nfs/dbraw/zinc/96/43/58/1051964358.db2.gz JOHWDFZVHSKKCJ-INIZCTEOSA-N 2 1 320.525 4.078 20 0 DIADMP Cc1c([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cnn1C(C)C ZINC000191141349 1051964371 /nfs/dbraw/zinc/96/43/71/1051964371.db2.gz JOHWDFZVHSKKCJ-INIZCTEOSA-N 2 1 320.525 4.078 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(F)cc2Cl)cc1 ZINC000769380288 1052037781 /nfs/dbraw/zinc/03/77/81/1052037781.db2.gz FWMNBSFYJPAEPM-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(F)cc2Cl)cc1 ZINC000769380288 1052037796 /nfs/dbraw/zinc/03/77/96/1052037796.db2.gz FWMNBSFYJPAEPM-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2C)C2CCCC2)C1 ZINC000494890688 1052158121 /nfs/dbraw/zinc/15/81/21/1052158121.db2.gz OAJFQHGPMOOBGJ-PXNSSMCTSA-N 2 1 300.490 4.158 20 0 DIADMP Cc1ccccc1[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000494919996 1052171682 /nfs/dbraw/zinc/17/16/82/1052171682.db2.gz FZKNFUPIUYJEAG-UWJYYQICSA-N 2 1 312.501 4.300 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)C1CCCC1 ZINC000495052958 1052203827 /nfs/dbraw/zinc/20/38/27/1052203827.db2.gz ZYSBBHYJRQFEHO-XKGZKEIXSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)C1CCCC1 ZINC000495052958 1052203838 /nfs/dbraw/zinc/20/38/38/1052203838.db2.gz ZYSBBHYJRQFEHO-XKGZKEIXSA-N 2 1 300.490 4.299 20 0 DIADMP CCCCCC[C@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218213659 1052208928 /nfs/dbraw/zinc/20/89/28/1052208928.db2.gz GIIYIMZCUHWACZ-KRWDZBQOSA-N 2 1 318.505 4.347 20 0 DIADMP CCC[C@@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)[C@@H](C)CC ZINC001218292781 1052218126 /nfs/dbraw/zinc/21/81/26/1052218126.db2.gz TVMMZRXCOLICAF-QFBILLFUSA-N 2 1 318.505 4.203 20 0 DIADMP CCC(CC)[C@@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218294613 1052218546 /nfs/dbraw/zinc/21/85/46/1052218546.db2.gz BGQXDTGJSXTYGX-LJQANCHMSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@H](C[C@@H](C)CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218294185 1052219059 /nfs/dbraw/zinc/21/90/59/1052219059.db2.gz ISMVKRQIKPYYAM-QFBILLFUSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccccc1[C@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218295354 1052219097 /nfs/dbraw/zinc/21/90/97/1052219097.db2.gz MTDIBIWSWIFHSY-KRWDZBQOSA-N 2 1 324.468 4.058 20 0 DIADMP CC(C)CCC[C@@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218312746 1052223046 /nfs/dbraw/zinc/22/30/46/1052223046.db2.gz YNYRMMCTAVGICI-QGZVFWFLSA-N 2 1 318.505 4.203 20 0 DIADMP C[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000230407407 1052267312 /nfs/dbraw/zinc/26/73/12/1052267312.db2.gz WUMSNLMFPAEURA-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000230407407 1052267319 /nfs/dbraw/zinc/26/73/19/1052267319.db2.gz WUMSNLMFPAEURA-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000230407407 1052267327 /nfs/dbraw/zinc/26/73/27/1052267327.db2.gz WUMSNLMFPAEURA-STQMWFEESA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1)CC1CC[NH2+]CC1 ZINC000410084132 1052293637 /nfs/dbraw/zinc/29/36/37/1052293637.db2.gz YYQHQXINYBHITJ-SFHVURJKSA-N 2 1 308.469 4.249 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000495415046 1052340914 /nfs/dbraw/zinc/34/09/14/1052340914.db2.gz MENVEIZRWVZREY-IPZZXCBHSA-N 2 1 316.464 4.080 20 0 DIADMP CC[N@@H+](CC1CC[NH2+]CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000237008665 1052434750 /nfs/dbraw/zinc/43/47/50/1052434750.db2.gz KUNWCEQZMAPUCE-ZDUSSCGKSA-N 2 1 314.395 4.088 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+]CCC3CCCCC3)CC2)cc1 ZINC000319919859 1052437028 /nfs/dbraw/zinc/43/70/28/1052437028.db2.gz DUNQTMQCSPVLEU-UHFFFAOYSA-N 2 1 314.517 4.254 20 0 DIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000237335161 1052438560 /nfs/dbraw/zinc/43/85/60/1052438560.db2.gz VJJWCPUEAJAQPU-IBGZPJMESA-N 2 1 322.496 4.087 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)([NH+](C)C)C1 ZINC000237368702 1052439594 /nfs/dbraw/zinc/43/95/94/1052439594.db2.gz VSXUTMNZRIZJKE-FPCVCCKLSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)o1 ZINC001222155298 1052452394 /nfs/dbraw/zinc/45/23/94/1052452394.db2.gz ZNJLPPPSSPPUTO-YLJYHZDGSA-N 2 1 318.505 4.327 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)o1 ZINC001222155297 1052453021 /nfs/dbraw/zinc/45/30/21/1052453021.db2.gz ZNJLPPPSSPPUTO-XLIONFOSSA-N 2 1 318.505 4.327 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222160833 1052453565 /nfs/dbraw/zinc/45/35/65/1052453565.db2.gz JBFRFUOUGCUBSU-LJQANCHMSA-N 2 1 322.443 4.370 20 0 DIADMP c1ccc(-c2cccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]C4)c2)cc1 ZINC001222247456 1052469427 /nfs/dbraw/zinc/46/94/27/1052469427.db2.gz FTUWVPXJECPJHT-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@@]34CCC[NH2+]C4)c2)cc1 ZINC001222247456 1052469430 /nfs/dbraw/zinc/46/94/30/1052469430.db2.gz FTUWVPXJECPJHT-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP C1C[C@@H]2C[C@H]([NH2+][C@H]3CCCC[C@H]3C3CCCCC3)CC[N@H+]2C1 ZINC000316720169 1052471167 /nfs/dbraw/zinc/47/11/67/1052471167.db2.gz FISYUDXQHLSSMH-ZRNYENFQSA-N 2 1 304.522 4.342 20 0 DIADMP CCCCc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000316667337 1052471620 /nfs/dbraw/zinc/47/16/20/1052471620.db2.gz UTYKKBZLKLOJQE-VDGAXYAQSA-N 2 1 300.490 4.307 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000316789448 1052472760 /nfs/dbraw/zinc/47/27/60/1052472760.db2.gz NPCSNVZUARPIFW-CFVMTHIKSA-N 2 1 321.534 4.026 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000316789448 1052472766 /nfs/dbraw/zinc/47/27/66/1052472766.db2.gz NPCSNVZUARPIFW-CFVMTHIKSA-N 2 1 321.534 4.026 20 0 DIADMP CC(C)(C)C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000316903647 1052475575 /nfs/dbraw/zinc/47/55/75/1052475575.db2.gz ZOKBDVPKPMOWCV-QYZOEREBSA-N 2 1 300.490 4.380 20 0 DIADMP Clc1cc(Cl)cc(C[N@@H+]2CCC[C@@]23CCC[NH2+]CC3)c1 ZINC001222308257 1052478671 /nfs/dbraw/zinc/47/86/71/1052478671.db2.gz IGCIFAIEFOABSN-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1cc(Cl)cc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c1 ZINC001222308257 1052478674 /nfs/dbraw/zinc/47/86/74/1052478674.db2.gz IGCIFAIEFOABSN-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1ccc(Cl)c(C[N@@H+]2CCC[C@]23CCC[NH2+]CC3)c1 ZINC001222309220 1052478861 /nfs/dbraw/zinc/47/88/61/1052478861.db2.gz OILMFVQHFUVVRW-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1ccc(Cl)c(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c1 ZINC001222309220 1052478863 /nfs/dbraw/zinc/47/88/63/1052478863.db2.gz OILMFVQHFUVVRW-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001222309752 1052478991 /nfs/dbraw/zinc/47/89/91/1052478991.db2.gz RCGHLDHNBLBYMC-HXUWFJFHSA-N 2 1 300.490 4.092 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)c2)cc1 ZINC001222315267 1052479912 /nfs/dbraw/zinc/47/99/12/1052479912.db2.gz LZMGWGPVXXWSHJ-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222314096 1052479971 /nfs/dbraw/zinc/47/99/71/1052479971.db2.gz CIPVQJPLUBRFMJ-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222316408 1052480828 /nfs/dbraw/zinc/48/08/28/1052480828.db2.gz VUDXIEADMBFKHK-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222315530 1052480871 /nfs/dbraw/zinc/48/08/71/1052480871.db2.gz OHLKXIGHPNQDEM-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222315834 1052480938 /nfs/dbraw/zinc/48/09/38/1052480938.db2.gz PJWUVLUBXIDNSZ-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP Fc1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000393391058 1052481664 /nfs/dbraw/zinc/48/16/64/1052481664.db2.gz CFAVITVRYUMNNI-NJDAHSKKSA-N 2 1 324.443 4.132 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320733 1052481916 /nfs/dbraw/zinc/48/19/16/1052481916.db2.gz LZBOFLMJQCBQBD-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP c1ccc(C2(C[N@@H+]3CCC[C@]4(CCCC[NH2+]4)C3)CCCC2)cc1 ZINC001222385063 1052493989 /nfs/dbraw/zinc/49/39/89/1052493989.db2.gz DVARVZDHIPCUET-OAQYLSRUSA-N 2 1 312.501 4.107 20 0 DIADMP c1ccc(C2(C[N@H+]3CCC[C@]4(CCCC[NH2+]4)C3)CCCC2)cc1 ZINC001222385063 1052493993 /nfs/dbraw/zinc/49/39/93/1052493993.db2.gz DVARVZDHIPCUET-OAQYLSRUSA-N 2 1 312.501 4.107 20 0 DIADMP c1ccc(CCCCC[N@@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385650 1052494324 /nfs/dbraw/zinc/49/43/24/1052494324.db2.gz SNSWGERYFMLLTE-FQEVSTJZSA-N 2 1 300.490 4.008 20 0 DIADMP c1ccc(CCCCC[N@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385650 1052494325 /nfs/dbraw/zinc/49/43/25/1052494325.db2.gz SNSWGERYFMLLTE-FQEVSTJZSA-N 2 1 300.490 4.008 20 0 DIADMP c1ccc(C2(C[N@@H+]3CCC[C@@]4(CCCC[NH2+]4)C3)CCCC2)cc1 ZINC001222385062 1052494328 /nfs/dbraw/zinc/49/43/28/1052494328.db2.gz DVARVZDHIPCUET-NRFANRHFSA-N 2 1 312.501 4.107 20 0 DIADMP c1ccc(C2(C[N@H+]3CCC[C@@]4(CCCC[NH2+]4)C3)CCCC2)cc1 ZINC001222385062 1052494329 /nfs/dbraw/zinc/49/43/29/1052494329.db2.gz DVARVZDHIPCUET-NRFANRHFSA-N 2 1 312.501 4.107 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C1 ZINC000322814581 1052497144 /nfs/dbraw/zinc/49/71/44/1052497144.db2.gz ALNJNFXUNUZBQL-BLAJRMAGSA-N 2 1 312.501 4.174 20 0 DIADMP C[C@@H](C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421151 1052498118 /nfs/dbraw/zinc/49/81/18/1052498118.db2.gz JFTOWHWIHYOWSR-UWJYYQICSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421151 1052498122 /nfs/dbraw/zinc/49/81/22/1052498122.db2.gz JFTOWHWIHYOWSR-UWJYYQICSA-N 2 1 308.469 4.161 20 0 DIADMP C[N@@H+](C/C=C/c1ccccc1)C1CCN(Cc2ccccc2)CC1 ZINC000026992405 1052499427 /nfs/dbraw/zinc/49/94/27/1052499427.db2.gz YRTVIZSNPPJZLP-MDWZMJQESA-N 2 1 320.480 4.296 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)cc12 ZINC001222624070 1052519352 /nfs/dbraw/zinc/51/93/52/1052519352.db2.gz UCWOHOWAQRIKEJ-CALCHBBNSA-N 2 1 320.436 4.017 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)c(C)c12 ZINC001222630015 1052520251 /nfs/dbraw/zinc/52/02/51/1052520251.db2.gz WKPIHWZZHBJHFE-OKILXGFUSA-N 2 1 320.527 4.011 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC000320557743 1052531574 /nfs/dbraw/zinc/53/15/74/1052531574.db2.gz JQKZJNOVGIWZOH-AEFFLSMTSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H](C[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C(C)(C)C ZINC000670267134 1052543239 /nfs/dbraw/zinc/54/32/39/1052543239.db2.gz RTRCPZQOAPEKJH-IRXDYDNUSA-N 2 1 302.506 4.484 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCC1 ZINC000398045957 1052563673 /nfs/dbraw/zinc/56/36/73/1052563673.db2.gz VSXISAMDUQXTHA-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC000154098044 1052621516 /nfs/dbraw/zinc/62/15/16/1052621516.db2.gz GAQVSLQCYYGCGN-BELGNNRLSA-N 2 1 317.864 4.017 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000037649030 1052627800 /nfs/dbraw/zinc/62/78/00/1052627800.db2.gz DDAQXDZMMXAYPU-NEPJUHHUSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649134 1052627968 /nfs/dbraw/zinc/62/79/68/1052627968.db2.gz PWNZGQAVMARMGW-VXGBXAGGSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649134 1052627970 /nfs/dbraw/zinc/62/79/70/1052627970.db2.gz PWNZGQAVMARMGW-VXGBXAGGSA-N 2 1 313.272 4.128 20 0 DIADMP c1csc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCC2)c1 ZINC000037649472 1052628156 /nfs/dbraw/zinc/62/81/56/1052628156.db2.gz FOYAGXRYGRKXNG-KBXCAEBGSA-N 2 1 304.503 4.053 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000037786373 1052629043 /nfs/dbraw/zinc/62/90/43/1052629043.db2.gz RBWCXYSEGOKDOO-UHFFFAOYSA-N 2 1 315.288 4.346 20 0 DIADMP CC[C@@H]1c2ccsc2CC[N@H+]1CCCCn1cc[nH+]c1C ZINC000125468330 1052649785 /nfs/dbraw/zinc/64/97/85/1052649785.db2.gz GKJHVQWYZYSHIT-MRXNPFEDSA-N 2 1 303.475 4.043 20 0 DIADMP CC[C@@H]1c2ccsc2CC[N@@H+]1CCCCn1cc[nH+]c1C ZINC000125468330 1052649787 /nfs/dbraw/zinc/64/97/87/1052649787.db2.gz GKJHVQWYZYSHIT-MRXNPFEDSA-N 2 1 303.475 4.043 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](C)Cc1ccc(Cl)cc1 ZINC000125522132 1052649859 /nfs/dbraw/zinc/64/98/59/1052649859.db2.gz DHYSMBHKYKGRNM-OAHLLOKOSA-N 2 1 319.880 4.188 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](C)Cc1ccc(Cl)cc1 ZINC000125522132 1052649863 /nfs/dbraw/zinc/64/98/63/1052649863.db2.gz DHYSMBHKYKGRNM-OAHLLOKOSA-N 2 1 319.880 4.188 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccco1 ZINC000126470651 1052670621 /nfs/dbraw/zinc/67/06/21/1052670621.db2.gz GLSUBIGRWZRJOA-QGZVFWFLSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1)c1cccc(O)c1 ZINC000126638399 1052672713 /nfs/dbraw/zinc/67/27/13/1052672713.db2.gz DCVHOVNAYTVMAP-GQIGUUNPSA-N 2 1 316.489 4.086 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1)c1cccc(O)c1 ZINC000126638654 1052673084 /nfs/dbraw/zinc/67/30/84/1052673084.db2.gz DCVHOVNAYTVMAP-TWOQFEAHSA-N 2 1 316.489 4.086 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126888062 1052683569 /nfs/dbraw/zinc/68/35/69/1052683569.db2.gz GVOGDTWVSBVWCE-CVEARBPZSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126888062 1052683572 /nfs/dbraw/zinc/68/35/72/1052683572.db2.gz GVOGDTWVSBVWCE-CVEARBPZSA-N 2 1 306.519 4.128 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c(C)c1 ZINC000128191145 1052711883 /nfs/dbraw/zinc/71/18/83/1052711883.db2.gz GAZOACOXGMJAIZ-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccccc1-c1ccccc1 ZINC000917395176 1052723232 /nfs/dbraw/zinc/72/32/32/1052723232.db2.gz CKFOAUKNHFLELZ-UHFFFAOYSA-N 2 1 305.425 4.038 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)C[C@H]1c1ccccc1 ZINC000556063008 1052795327 /nfs/dbraw/zinc/79/53/27/1052795327.db2.gz YTYVYKZDFQWFHY-TYPHKJRUSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)C[C@H]1c1ccccc1 ZINC000556063008 1052795336 /nfs/dbraw/zinc/79/53/36/1052795336.db2.gz YTYVYKZDFQWFHY-TYPHKJRUSA-N 2 1 324.443 4.238 20 0 DIADMP CCc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556093987 1052797157 /nfs/dbraw/zinc/79/71/57/1052797157.db2.gz NXIUUKJEKACCDQ-VXKWHMMOSA-N 2 1 322.496 4.217 20 0 DIADMP CCc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556093987 1052797165 /nfs/dbraw/zinc/79/71/65/1052797165.db2.gz NXIUUKJEKACCDQ-VXKWHMMOSA-N 2 1 322.496 4.217 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@@H]1C ZINC000322011435 1052800884 /nfs/dbraw/zinc/80/08/84/1052800884.db2.gz PEZJHDLBBUKSOD-LQWHRVPQSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C[C@@H]1C ZINC000556172737 1052816231 /nfs/dbraw/zinc/81/62/31/1052816231.db2.gz VXCQDYHPGGLEHZ-QVHQYWGISA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C[C@@H]1C ZINC000556172737 1052816238 /nfs/dbraw/zinc/81/62/38/1052816238.db2.gz VXCQDYHPGGLEHZ-QVHQYWGISA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000556177554 1052816295 /nfs/dbraw/zinc/81/62/95/1052816295.db2.gz BHYHFKCMRUMCRO-NHCUHLMSSA-N 2 1 320.480 4.187 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000556177554 1052816299 /nfs/dbraw/zinc/81/62/99/1052816299.db2.gz BHYHFKCMRUMCRO-NHCUHLMSSA-N 2 1 320.480 4.187 20 0 DIADMP C[C@H]([NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1)C1CCCC1 ZINC000179841131 1053031029 /nfs/dbraw/zinc/03/10/29/1053031029.db2.gz YHMHWOVXODGTCM-INIZCTEOSA-N 2 1 315.505 4.208 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)C1 ZINC000323396918 1053053255 /nfs/dbraw/zinc/05/32/55/1053053255.db2.gz MEZCGHKUTLJRNO-OSTWSGHESA-N 2 1 312.501 4.175 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)C1 ZINC000323396918 1053053259 /nfs/dbraw/zinc/05/32/59/1053053259.db2.gz MEZCGHKUTLJRNO-OSTWSGHESA-N 2 1 312.501 4.175 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](Cc1ccc(OC)cc1)C(C)(C)C ZINC001559884363 1053139839 /nfs/dbraw/zinc/13/98/39/1053139839.db2.gz SKDGQVAVZRKXAV-UHFFFAOYSA-N 2 1 306.494 4.028 20 0 DIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC)C1 ZINC001319754872 1053269727 /nfs/dbraw/zinc/26/97/27/1053269727.db2.gz MHQUVRYSBUOFOP-LSDHHAIUSA-N 2 1 324.896 4.121 20 0 DIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC)C1 ZINC001319754872 1053269732 /nfs/dbraw/zinc/26/97/32/1053269732.db2.gz MHQUVRYSBUOFOP-LSDHHAIUSA-N 2 1 324.896 4.121 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867432 1053368082 /nfs/dbraw/zinc/36/80/82/1053368082.db2.gz VWFRUJPPQMXVJM-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867432 1053368093 /nfs/dbraw/zinc/36/80/93/1053368093.db2.gz VWFRUJPPQMXVJM-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP CC(C)C(C[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)C(C)C ZINC001200106636 1053386313 /nfs/dbraw/zinc/38/63/13/1053386313.db2.gz ZZKLCOCCBOJQGY-FQEVSTJZSA-N 2 1 316.533 4.069 20 0 DIADMP CC(C)C(C[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)C(C)C ZINC001200106639 1053386980 /nfs/dbraw/zinc/38/69/80/1053386980.db2.gz ZZKLCOCCBOJQGY-HXUWFJFHSA-N 2 1 316.533 4.069 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631681 1053529505 /nfs/dbraw/zinc/52/95/05/1053529505.db2.gz BVGZMJTUJSTVKV-IRXDYDNUSA-N 2 1 312.457 4.329 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631681 1053529516 /nfs/dbraw/zinc/52/95/16/1053529516.db2.gz BVGZMJTUJSTVKV-IRXDYDNUSA-N 2 1 312.457 4.329 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000261918036 1053543447 /nfs/dbraw/zinc/54/34/47/1053543447.db2.gz RDPAFPMRYNBPCW-KPOBHBOGSA-N 2 1 310.441 4.269 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472771 1053581618 /nfs/dbraw/zinc/58/16/18/1053581618.db2.gz PIUKASJHJYUCAU-UONOGXRCSA-N 2 1 320.864 4.469 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472771 1053581632 /nfs/dbraw/zinc/58/16/32/1053581632.db2.gz PIUKASJHJYUCAU-UONOGXRCSA-N 2 1 320.864 4.469 20 0 DIADMP CCCc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000620434668 1053661444 /nfs/dbraw/zinc/66/14/44/1053661444.db2.gz HIHHFDGLUYSAHY-UHFFFAOYSA-N 2 1 322.496 4.393 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2ccc(F)c(F)c2)CC1 ZINC000620645856 1053692236 /nfs/dbraw/zinc/69/22/36/1053692236.db2.gz JLLMBKQJVDOONM-OAHLLOKOSA-N 2 1 324.459 4.470 20 0 DIADMP c1ccc(-c2ccc(C[NH2+]C3CC[NH+](C4CCC4)CC3)cc2)cc1 ZINC000620759688 1053733616 /nfs/dbraw/zinc/73/36/16/1053733616.db2.gz HUNPFVXJBBOILL-UHFFFAOYSA-N 2 1 320.480 4.460 20 0 DIADMP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000163232876 1053743410 /nfs/dbraw/zinc/74/34/10/1053743410.db2.gz UWVOPQVYSRBOKP-JKSUJKDBSA-N 2 1 300.446 4.042 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000163232876 1053743422 /nfs/dbraw/zinc/74/34/22/1053743422.db2.gz UWVOPQVYSRBOKP-JKSUJKDBSA-N 2 1 300.446 4.042 20 0 DIADMP CCc1ccc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)s1 ZINC001231498283 1053770918 /nfs/dbraw/zinc/77/09/18/1053770918.db2.gz DMCSIEAJGNWLMC-UHFFFAOYSA-N 2 1 318.530 4.151 20 0 DIADMP CCc1ccc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)s1 ZINC001231498283 1053770930 /nfs/dbraw/zinc/77/09/30/1053770930.db2.gz DMCSIEAJGNWLMC-UHFFFAOYSA-N 2 1 318.530 4.151 20 0 DIADMP CC[N@@H+](CCn1ccnc1)Cc1cccc(-c2ccccc2)c1 ZINC001231511644 1053774556 /nfs/dbraw/zinc/77/45/56/1053774556.db2.gz STAJKLHLHUTMSH-UHFFFAOYSA-N 2 1 305.425 4.072 20 0 DIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1csc(C)n1 ZINC000269419497 1053779855 /nfs/dbraw/zinc/77/98/55/1053779855.db2.gz LJIQMULGKSDSSL-AWEZNQCLSA-N 2 1 317.502 4.144 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000157230057 1053845564 /nfs/dbraw/zinc/84/55/64/1053845564.db2.gz WPCNGYSBTSEYCB-OQUMVOOASA-N 2 1 300.490 4.033 20 0 DIADMP CSc1ccccc1C[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001231785855 1053858256 /nfs/dbraw/zinc/85/82/56/1053858256.db2.gz JYDJCRIZFOUJQU-ROUUACIJSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccccc1C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001231785855 1053858260 /nfs/dbraw/zinc/85/82/60/1053858260.db2.gz JYDJCRIZFOUJQU-ROUUACIJSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccccc1C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001231785855 1053858273 /nfs/dbraw/zinc/85/82/73/1053858273.db2.gz JYDJCRIZFOUJQU-ROUUACIJSA-N 2 1 318.530 4.247 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CCC([NH+]2CCC2)CC1 ZINC001231809298 1053868426 /nfs/dbraw/zinc/86/84/26/1053868426.db2.gz MMHIYLOUMDUUAC-UHFFFAOYSA-N 2 1 320.480 4.332 20 0 DIADMP CC(C[NH+]1CCC2(CCCC2)C1)C[N@H+]1CCC2(CCCC2)C1 ZINC001327642427 1053870616 /nfs/dbraw/zinc/87/06/16/1053870616.db2.gz IOSKKLHYEXOPMR-UHFFFAOYSA-N 2 1 304.522 4.155 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)C1 ZINC001200672149 1053872651 /nfs/dbraw/zinc/87/26/51/1053872651.db2.gz LWDHNADNGCOPSJ-RBUKOAKNSA-N 2 1 320.546 4.291 20 0 DIADMP CS[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)C1 ZINC001200672150 1053873888 /nfs/dbraw/zinc/87/38/88/1053873888.db2.gz LWDHNADNGCOPSJ-RTBURBONSA-N 2 1 320.546 4.291 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@H+](C)C3)oc2cc1C ZINC000158125832 1053889759 /nfs/dbraw/zinc/88/97/59/1053889759.db2.gz HOOADDUIVDWCKV-CVEARBPZSA-N 2 1 300.446 4.042 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@@H+](C)C3)oc2cc1C ZINC000158125832 1053889774 /nfs/dbraw/zinc/88/97/74/1053889774.db2.gz HOOADDUIVDWCKV-CVEARBPZSA-N 2 1 300.446 4.042 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@H+](C)C3)oc2cc1C ZINC000158126095 1053891185 /nfs/dbraw/zinc/89/11/85/1053891185.db2.gz HOOADDUIVDWCKV-HZPDHXFCSA-N 2 1 300.446 4.042 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@@H+](C)C3)oc2cc1C ZINC000158126095 1053891192 /nfs/dbraw/zinc/89/11/92/1053891192.db2.gz HOOADDUIVDWCKV-HZPDHXFCSA-N 2 1 300.446 4.042 20 0 DIADMP CCC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccccn1 ZINC000159010054 1053931924 /nfs/dbraw/zinc/93/19/24/1053931924.db2.gz UQBSJXWTNZVJQW-IBGZPJMESA-N 2 1 311.473 4.164 20 0 DIADMP c1c2c[nH+]ccc2[nH]c1C[N@@H+](Cc1ccccn1)C1CCCCC1 ZINC001232016413 1053944743 /nfs/dbraw/zinc/94/47/43/1053944743.db2.gz XMPKXBCOXCCYIK-UHFFFAOYSA-N 2 1 320.440 4.293 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)cc1 ZINC001232080181 1053954417 /nfs/dbraw/zinc/95/44/17/1053954417.db2.gz FAYSZFQNGCTNFV-UHFFFAOYSA-N 2 1 314.517 4.292 20 0 DIADMP CCC(C)(C)c1ccc(C[N@@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC001232081546 1053960087 /nfs/dbraw/zinc/96/00/87/1053960087.db2.gz ZXDVZFWTLXCCHR-UHFFFAOYSA-N 2 1 302.506 4.148 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC001232145857 1053972075 /nfs/dbraw/zinc/97/20/75/1053972075.db2.gz CHEJQFUFRMPIEH-QGZVFWFLSA-N 2 1 318.461 4.286 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+](C)Cc2ccc(Cl)cc2)c1 ZINC001232146791 1053972934 /nfs/dbraw/zinc/97/29/34/1053972934.db2.gz HLDIWQWMRKZIJZ-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001232150542 1053973718 /nfs/dbraw/zinc/97/37/18/1053973718.db2.gz YLPRQRHGEVYVGK-UHFFFAOYSA-N 2 1 324.443 4.177 20 0 DIADMP c1ccc2c(c1)ccnc2C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001232252966 1054006721 /nfs/dbraw/zinc/00/67/21/1054006721.db2.gz CICFGAQRVNVHEE-LJQANCHMSA-N 2 1 323.484 4.075 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1nccc2ccccc21 ZINC001232252713 1054007635 /nfs/dbraw/zinc/00/76/35/1054007635.db2.gz YCFPXBISOCYBBW-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1nccc2ccccc21 ZINC001232252713 1054007646 /nfs/dbraw/zinc/00/76/46/1054007646.db2.gz YCFPXBISOCYBBW-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1nccc2ccccc21 ZINC001232252713 1054007653 /nfs/dbraw/zinc/00/76/53/1054007653.db2.gz YCFPXBISOCYBBW-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP Cc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)o1 ZINC000165010356 1054066555 /nfs/dbraw/zinc/06/65/55/1054066555.db2.gz NCFHAHKTISBUFU-MPGHIAIKSA-N 2 1 318.486 4.383 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN(C)[C@@H]2c2cccs2)o1 ZINC000165010356 1054066563 /nfs/dbraw/zinc/06/65/63/1054066563.db2.gz NCFHAHKTISBUFU-MPGHIAIKSA-N 2 1 318.486 4.383 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(F)c1 ZINC001331386442 1054074341 /nfs/dbraw/zinc/07/43/41/1054074341.db2.gz JVTSPKROBYPVHC-OKZBNKHCSA-N 2 1 304.453 4.129 20 0 DIADMP Cc1cccc(-c2ccc(C[NH+]3CCC([NH+](C)C)CC3)cc2)c1 ZINC001233223552 1054206173 /nfs/dbraw/zinc/20/61/73/1054206173.db2.gz NEIKDYFNJALDEB-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP Cc1cccc(-c2ccc(C[NH+]3C[C@H]4CC[N@H+](C)C[C@H]4C3)cc2)c1 ZINC001233221777 1054206689 /nfs/dbraw/zinc/20/66/89/1054206689.db2.gz CNGMVHGLCABVNL-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3C[C@H]4CC[NH+](C)C[C@H]4C3)cc2)c1 ZINC001233221777 1054206693 /nfs/dbraw/zinc/20/66/93/1054206693.db2.gz CNGMVHGLCABVNL-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3C[C@H]4CC[NH+](C)C[C@H]4C3)cc2)c1 ZINC001233221777 1054206701 /nfs/dbraw/zinc/20/67/01/1054206701.db2.gz CNGMVHGLCABVNL-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccc(Cl)cc1C[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001233249804 1054217258 /nfs/dbraw/zinc/21/72/58/1054217258.db2.gz JLIWYCUBAUAOEC-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(Cl)c(F)c1 ZINC001356064764 1054272319 /nfs/dbraw/zinc/27/23/19/1054272319.db2.gz ZKGGBFRSGRSEIL-DITUJHHDSA-N 2 1 322.855 4.288 20 0 DIADMP CC[C@H](C)c1ccc(NC(=[NH2+])NCCCC[N@@H+](C)C2CC2)cc1 ZINC000849039842 1054353201 /nfs/dbraw/zinc/35/32/01/1054353201.db2.gz UJFKLCGRISMJJY-HNNXBMFYSA-N 2 1 316.493 4.011 20 0 DIADMP CC[C@]1(C)CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001473279464 1054487034 /nfs/dbraw/zinc/48/70/34/1054487034.db2.gz ZVCSLJYFCMISPT-HXUWFJFHSA-N 2 1 300.490 4.295 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCCCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC000671309299 1054553488 /nfs/dbraw/zinc/55/34/88/1054553488.db2.gz SBMRLSJVTBEGPG-OALUTQOASA-N 2 1 320.908 4.440 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623363043 1054570714 /nfs/dbraw/zinc/57/07/14/1054570714.db2.gz VOMUTNRACNFHTQ-LSDHHAIUSA-N 2 1 300.446 4.265 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623363043 1054570730 /nfs/dbraw/zinc/57/07/30/1054570730.db2.gz VOMUTNRACNFHTQ-LSDHHAIUSA-N 2 1 300.446 4.265 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(-c2cccnc2)cc1 ZINC000623439079 1054594961 /nfs/dbraw/zinc/59/49/61/1054594961.db2.gz VAIHHAORRBRFFE-OXJNMPFZSA-N 2 1 323.484 4.272 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485194 1054603588 /nfs/dbraw/zinc/60/35/88/1054603588.db2.gz RCRBPKPFEBAQCO-HOCLYGCPSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485194 1054603594 /nfs/dbraw/zinc/60/35/94/1054603594.db2.gz RCRBPKPFEBAQCO-HOCLYGCPSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)CC1(C)C ZINC000623512595 1054610010 /nfs/dbraw/zinc/61/00/10/1054610010.db2.gz NVVWTDUUECVTFQ-HJOIGYKYSA-N 2 1 324.871 4.130 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3ccccc32)c1 ZINC000177977308 1054638297 /nfs/dbraw/zinc/63/82/97/1054638297.db2.gz AATQHNASCBYWJB-NRFANRHFSA-N 2 1 308.469 4.304 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000177977297 1054639251 /nfs/dbraw/zinc/63/92/51/1054639251.db2.gz AATQHNASCBYWJB-OAQYLSRUSA-N 2 1 308.469 4.304 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@@]2(CC[NH2+]C2)C1 ZINC001235030634 1054644483 /nfs/dbraw/zinc/64/44/83/1054644483.db2.gz BHUGTTNGQROHNY-HXUWFJFHSA-N 2 1 322.477 4.240 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235043746 1054645809 /nfs/dbraw/zinc/64/58/09/1054645809.db2.gz GWMJOJNWGCNOOI-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001235041211 1054646316 /nfs/dbraw/zinc/64/63/16/1054646316.db2.gz OGLMMXOYJPYFRS-FQEVSTJZSA-N 2 1 300.490 4.092 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235046565 1054646388 /nfs/dbraw/zinc/64/63/88/1054646388.db2.gz RFAIJLDELGPWLG-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)cc2)o1 ZINC001235048696 1054647080 /nfs/dbraw/zinc/64/70/80/1054647080.db2.gz ZQQJJNWZTCBWOY-NRFANRHFSA-N 2 1 324.468 4.363 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001235040494 1054647524 /nfs/dbraw/zinc/64/75/24/1054647524.db2.gz KZSAIDDECNCIIY-WDSOQIARSA-N 2 1 318.892 4.052 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235043745 1054647682 /nfs/dbraw/zinc/64/76/82/1054647682.db2.gz GWMJOJNWGCNOOI-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP c1ccc(C2(C[N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)CCCC2)cc1 ZINC001235040724 1054647761 /nfs/dbraw/zinc/64/77/61/1054647761.db2.gz NJFSXVWQKSVWPB-OAQYLSRUSA-N 2 1 312.501 4.107 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[NH+]2CCC3(CC[NH2+]3)CC2)CC1 ZINC001235106386 1054658762 /nfs/dbraw/zinc/65/87/62/1054658762.db2.gz MICFKSHCIQENMC-LJQANCHMSA-N 2 1 302.506 4.287 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCCc2c(C)ccc(C)c21 ZINC000349408217 1054662113 /nfs/dbraw/zinc/66/21/13/1054662113.db2.gz JJKMPYURHALPGD-KUHUBIRLSA-N 2 1 311.473 4.112 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCCc2c(C)ccc(C)c21 ZINC000349408218 1054662855 /nfs/dbraw/zinc/66/28/55/1054662855.db2.gz JJKMPYURHALPGD-LIRRHRJNSA-N 2 1 311.473 4.112 20 0 DIADMP C[C@@H](C[N@H+]1CCCC12CC[NH2+]CC2)c1cccc2ccccc21 ZINC001235140338 1054665316 /nfs/dbraw/zinc/66/53/16/1054665316.db2.gz JMLKNNSTGUDBPO-KRWDZBQOSA-N 2 1 308.469 4.161 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CCCC34CC[NH2+]CC4)s2)c1 ZINC001235140777 1054665437 /nfs/dbraw/zinc/66/54/37/1054665437.db2.gz NKUKJJYYZHNLGI-UHFFFAOYSA-N 2 1 318.511 4.195 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)ccc1Cl ZINC001235157698 1054666893 /nfs/dbraw/zinc/66/68/93/1054666893.db2.gz KFKYRIDMYZGCOM-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCCC34CC[NH2+]CC4)c(C)c12 ZINC001235145303 1054667105 /nfs/dbraw/zinc/66/71/05/1054667105.db2.gz SYGGRNCSRSPJBP-UHFFFAOYSA-N 2 1 320.527 4.298 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235156195 1054667664 /nfs/dbraw/zinc/66/76/64/1054667664.db2.gz FMMDTTFVNVCIOR-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c(C)c1Cl ZINC001235157061 1054667974 /nfs/dbraw/zinc/66/79/74/1054667974.db2.gz QOCJIYSDAYUDBZ-GOSISDBHSA-N 2 1 320.908 4.311 20 0 DIADMP Cc1cc(F)cc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1Cl ZINC001235160176 1054670071 /nfs/dbraw/zinc/67/00/71/1054670071.db2.gz ZJNRDPFFRAOPSJ-QGZVFWFLSA-N 2 1 324.871 4.142 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235174776 1054672144 /nfs/dbraw/zinc/67/21/44/1054672144.db2.gz VIVSLHPODDICBH-ICSRJNTNSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235174777 1054673632 /nfs/dbraw/zinc/67/36/32/1054673632.db2.gz VIVSLHPODDICBH-QUCCMNQESA-N 2 1 324.553 4.216 20 0 DIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1cc(-c2ccsc2)cs1 ZINC001235185069 1054678630 /nfs/dbraw/zinc/67/86/30/1054678630.db2.gz FTFXOGXXHQYLNL-UHFFFAOYSA-N 2 1 320.527 4.394 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1cc(-c2ccsc2)cs1 ZINC001235185069 1054678633 /nfs/dbraw/zinc/67/86/33/1054678633.db2.gz FTFXOGXXHQYLNL-UHFFFAOYSA-N 2 1 320.527 4.394 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001235193435 1054681621 /nfs/dbraw/zinc/68/16/21/1054681621.db2.gz LKKVPFTZHMJDLX-GDBMZVCRSA-N 2 1 322.477 4.096 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1)c1ccccc1 ZINC001235247237 1054692497 /nfs/dbraw/zinc/69/24/97/1054692497.db2.gz BKHIWUWPADVUDH-VLCRHTCISA-N 2 1 320.480 4.012 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)CC1 ZINC001235255475 1054694464 /nfs/dbraw/zinc/69/44/64/1054694464.db2.gz NEHSZYQXIWTHGN-UFYCRDLUSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)CC1 ZINC001235255475 1054694468 /nfs/dbraw/zinc/69/44/68/1054694468.db2.gz NEHSZYQXIWTHGN-UFYCRDLUSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@@H](C3C[NH2+]C3)C2)c1 ZINC001235338452 1054703601 /nfs/dbraw/zinc/70/36/01/1054703601.db2.gz AMUZDOUYHDCUTI-HXUWFJFHSA-N 2 1 320.480 4.012 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235348100 1054707888 /nfs/dbraw/zinc/70/78/88/1054707888.db2.gz AAUQAUXURIWSEM-VXSCBNMQSA-N 2 1 324.512 4.058 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CC[N@H+](CCCC2CCCC2)C3)cc1 ZINC001235380917 1054711863 /nfs/dbraw/zinc/71/18/63/1054711863.db2.gz XKYDKMIVEIEGAN-RTWAWAEBSA-N 2 1 312.501 4.036 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CC[N@H+](CCC2CCCCC2)C3)cc1 ZINC001235379876 1054712061 /nfs/dbraw/zinc/71/20/61/1054712061.db2.gz SIGXHKQSHAXJCF-RTWAWAEBSA-N 2 1 312.501 4.036 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235377117 1054712112 /nfs/dbraw/zinc/71/21/12/1054712112.db2.gz AAUQAUXURIWSEM-UVUJQTEASA-N 2 1 324.512 4.058 20 0 DIADMP c1cc(C2CCC2)ccc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235427755 1054716369 /nfs/dbraw/zinc/71/63/69/1054716369.db2.gz ODOPRYREGUUDJV-NHCUHLMSSA-N 2 1 312.501 4.166 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235425383 1054716774 /nfs/dbraw/zinc/71/67/74/1054716774.db2.gz IXWSMVUQTRSKBO-JKSUJKDBSA-N 2 1 314.498 4.113 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc1 ZINC001235429739 1054718835 /nfs/dbraw/zinc/71/88/35/1054718835.db2.gz ZHRLJJILMAKJHC-VQTJNVASSA-N 2 1 300.490 4.022 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccc(Cl)c2)o1)CC1CC[NH2+]CC1 ZINC001235433573 1054720100 /nfs/dbraw/zinc/72/01/00/1054720100.db2.gz MWMBTVKEJCIOBC-UHFFFAOYSA-N 2 1 318.848 4.031 20 0 DIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)C(C)(C)c1ccccc1 ZINC000180013098 1054726992 /nfs/dbraw/zinc/72/69/92/1054726992.db2.gz LGWYSMHLCBDROX-IBGZPJMESA-N 2 1 313.489 4.318 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@](C)(Cc1ccccc1)c1ccccc1 ZINC001473551263 1054743689 /nfs/dbraw/zinc/74/36/89/1054743689.db2.gz VUDHLCBSPMKESO-FCHUYYIVSA-N 2 1 322.496 4.218 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000180402046 1054756599 /nfs/dbraw/zinc/75/65/99/1054756599.db2.gz BKWOYYPYVDLAJB-HNNXBMFYSA-N 2 1 306.519 4.322 20 0 DIADMP C[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1cccc2ccccc21 ZINC001235663167 1054763037 /nfs/dbraw/zinc/76/30/37/1054763037.db2.gz RRRDBOPVEGGUSM-UHFFFAOYSA-N 2 1 322.477 4.179 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001235672904 1054767189 /nfs/dbraw/zinc/76/71/89/1054767189.db2.gz JANSVFGFDTXYJP-CQSZACIVSA-N 2 1 310.466 4.225 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001235673514 1054768200 /nfs/dbraw/zinc/76/82/00/1054768200.db2.gz BITFKPOTZQZOBG-OAHLLOKOSA-N 2 1 314.860 4.178 20 0 DIADMP COc1ccc([C@@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001235676629 1054769125 /nfs/dbraw/zinc/76/91/25/1054769125.db2.gz CGYOTCZHFBYGHE-FQEVSTJZSA-N 2 1 316.489 4.145 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1CC1CC2(C1)CC[NH2+]CC2 ZINC001235693484 1054781788 /nfs/dbraw/zinc/78/17/88/1054781788.db2.gz BIGDWVVFLANSAU-GOSISDBHSA-N 2 1 318.892 4.257 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCCC3(C[NH2+]C3)C2)c1 ZINC001235712356 1054784985 /nfs/dbraw/zinc/78/49/85/1054784985.db2.gz AOFMYLJAMRXUPS-UHFFFAOYSA-N 2 1 320.480 4.156 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCCC3(C[NH2+]C3)C2)c1 ZINC001235712356 1054784998 /nfs/dbraw/zinc/78/49/98/1054784998.db2.gz AOFMYLJAMRXUPS-UHFFFAOYSA-N 2 1 320.480 4.156 20 0 DIADMP Cc1cc(Cl)c(C[N@@H+](C)CCC2CC[NH2+]CC2)c(Cl)c1 ZINC001235717726 1054788540 /nfs/dbraw/zinc/78/85/40/1054788540.db2.gz LAXXDCARCIHTSN-UHFFFAOYSA-N 2 1 315.288 4.123 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(Cc2ccccc2)cc1 ZINC001235718341 1054788660 /nfs/dbraw/zinc/78/86/60/1054788660.db2.gz YYNYUSJPZQJYNW-UHFFFAOYSA-N 2 1 322.496 4.099 20 0 DIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2nc(C)cs2)c1 ZINC000623866836 1054791093 /nfs/dbraw/zinc/79/10/93/1054791093.db2.gz HVZZEVBEKORRDA-OAHLLOKOSA-N 2 1 317.502 4.144 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccccc2CCc2ccccc2)CC1 ZINC001235726410 1054792601 /nfs/dbraw/zinc/79/26/01/1054792601.db2.gz PGBJMKOBSMWJFB-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2cccc(C)c2)cc1)C1CC[NH2+]CC1 ZINC001235762374 1054802316 /nfs/dbraw/zinc/80/23/16/1054802316.db2.gz SSEQILPFLJHJAV-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3[C@@H]4CC[C@H]3C[C@@H]([NH3+])C4)c2)cc1 ZINC001235810908 1054812404 /nfs/dbraw/zinc/81/24/04/1054812404.db2.gz PNMHTZIOVXQVIM-WKCHPHFGSA-N 2 1 306.453 4.116 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3[C@@H]4CC[C@H]3C[C@@H]([NH3+])C4)cc2)cc1 ZINC001235811445 1054813415 /nfs/dbraw/zinc/81/34/15/1054813415.db2.gz QKJGWLZVLKXCCQ-WKCHPHFGSA-N 2 1 306.453 4.116 20 0 DIADMP C[NH2+]CCC[N@H+]1CCCC[C@H]1C(c1ccccc1)c1ccccc1 ZINC001235826518 1054815600 /nfs/dbraw/zinc/81/56/00/1054815600.db2.gz YOEVJOLGFLGKDF-NRFANRHFSA-N 2 1 322.496 4.283 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@H+](CCC[NH2+]C2CCCCC2)C1 ZINC001235825880 1054816669 /nfs/dbraw/zinc/81/66/69/1054816669.db2.gz QWRAIZAMFJLWSA-INIZCTEOSA-N 2 1 320.908 4.442 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@@H+](CCC[NH2+]C2CCCCC2)C1 ZINC001235825880 1054816681 /nfs/dbraw/zinc/81/66/81/1054816681.db2.gz QWRAIZAMFJLWSA-INIZCTEOSA-N 2 1 320.908 4.442 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)c1 ZINC001235839804 1054818623 /nfs/dbraw/zinc/81/86/23/1054818623.db2.gz YURAERZTUJCENK-AWEZNQCLSA-N 2 1 306.862 4.197 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+](C)C[C@H]2CC[NH2+]C2)c1 ZINC001235842956 1054822296 /nfs/dbraw/zinc/82/22/96/1054822296.db2.gz UOOYTTUKQFFZJF-IBGZPJMESA-N 2 1 308.469 4.012 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891667 1054833769 /nfs/dbraw/zinc/83/37/69/1054833769.db2.gz HIZQEHWDVVBRDJ-JSGCOSHPSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891667 1054833780 /nfs/dbraw/zinc/83/37/80/1054833780.db2.gz HIZQEHWDVVBRDJ-JSGCOSHPSA-N 2 1 312.910 4.022 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001474595449 1054837487 /nfs/dbraw/zinc/83/74/87/1054837487.db2.gz LJHBBUCJECKALF-MMKMLUHNSA-N 2 1 316.533 4.382 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902391 1054840235 /nfs/dbraw/zinc/84/02/35/1054840235.db2.gz FKWKJCBQICNOOW-KDOFPFPSSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902391 1054840252 /nfs/dbraw/zinc/84/02/52/1054840252.db2.gz FKWKJCBQICNOOW-KDOFPFPSSA-N 2 1 314.860 4.319 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001235925323 1054849589 /nfs/dbraw/zinc/84/95/89/1054849589.db2.gz HTMCUHFTDPNAPH-IBGZPJMESA-N 2 1 314.860 4.320 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@H]2CC[NH3+])c1 ZINC001235925951 1054850606 /nfs/dbraw/zinc/85/06/06/1054850606.db2.gz SZTCAZKHNADMEM-FQEVSTJZSA-N 2 1 308.469 4.284 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC[C@H]1CC[NH3+] ZINC001235926283 1054851661 /nfs/dbraw/zinc/85/16/61/1054851661.db2.gz WJJVUPFDBOSMJK-SFHVURJKSA-N 2 1 310.441 4.101 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1 ZINC001235943869 1054862328 /nfs/dbraw/zinc/86/23/28/1054862328.db2.gz ZONFUKXHMXWKDH-LEWJYISDSA-N 2 1 320.480 4.012 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)C[C@@H]1CCC[NH2+]C1 ZINC001235950425 1054865954 /nfs/dbraw/zinc/86/59/54/1054865954.db2.gz FSHCPFVVUBDPRS-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)C[C@@H]1CCC[NH2+]C1 ZINC001235950425 1054865959 /nfs/dbraw/zinc/86/59/59/1054865959.db2.gz FSHCPFVVUBDPRS-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP Cc1c(C[N@@H+](C)C[C@H]2CCC[NH2+]C2)cccc1-c1ccccc1 ZINC001235956780 1054869718 /nfs/dbraw/zinc/86/97/18/1054869718.db2.gz HZPAEKGMDVKORX-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1ccc(Cl)cc1 ZINC001235960324 1054871802 /nfs/dbraw/zinc/87/18/02/1054871802.db2.gz SFNYPEHECZAARL-UHFFFAOYSA-N 2 1 320.889 4.069 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@H]3CC[C@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989020 1054882774 /nfs/dbraw/zinc/88/27/74/1054882774.db2.gz BOAPPUYQQFHZBC-NQIIRXRSSA-N 2 1 324.443 4.033 20 0 DIADMP Cc1cc(C[N@H+]2C[C@H]3CC[C@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989020 1054882782 /nfs/dbraw/zinc/88/27/82/1054882782.db2.gz BOAPPUYQQFHZBC-NQIIRXRSSA-N 2 1 324.443 4.033 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001236067236 1054923758 /nfs/dbraw/zinc/92/37/58/1054923758.db2.gz OLODWSWJVBUBGW-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000181634769 1054926396 /nfs/dbraw/zinc/92/63/96/1054926396.db2.gz FEYADYNLFFOTTJ-SFHVURJKSA-N 2 1 321.415 4.237 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236141999 1054968956 /nfs/dbraw/zinc/96/89/56/1054968956.db2.gz QQONOZDEILLMMB-UHFFFAOYSA-N 2 1 302.849 4.178 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]C2(c3cccc(Cl)c3)CC2)CC1 ZINC000182261337 1054974419 /nfs/dbraw/zinc/97/44/19/1054974419.db2.gz ZWFRDSGEWZGWQN-UHFFFAOYSA-N 2 1 306.881 4.182 20 0 DIADMP CCC[N@@H+](Cc1ccc(C)c(Cl)c1Cl)C1CC[NH2+]CC1 ZINC001236182300 1054980930 /nfs/dbraw/zinc/98/09/30/1054980930.db2.gz JPLYWFAFQUBLBV-UHFFFAOYSA-N 2 1 315.288 4.266 20 0 DIADMP CCC[N@H+](Cc1ccc(C)c(Cl)c1Cl)C1CC[NH2+]CC1 ZINC001236182300 1054980917 /nfs/dbraw/zinc/98/09/17/1054980917.db2.gz JPLYWFAFQUBLBV-UHFFFAOYSA-N 2 1 315.288 4.266 20 0 DIADMP CCC[N@@H+](Cc1ccc2c(c1)Cc1ccccc1-2)C1CC[NH2+]CC1 ZINC001236181773 1054982582 /nfs/dbraw/zinc/98/25/82/1054982582.db2.gz FFLAFONBCMDODS-UHFFFAOYSA-N 2 1 320.480 4.222 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@@H+]1CCC[NH+]1CCCCC1 ZINC001236195244 1054994623 /nfs/dbraw/zinc/99/46/23/1054994623.db2.gz YXKMCAYWMMMCAF-FQEVSTJZSA-N 2 1 311.473 4.181 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCc2occc21 ZINC000360035435 1054995408 /nfs/dbraw/zinc/99/54/08/1054995408.db2.gz BBVXJTYSVYCADV-LSTHTHJFSA-N 2 1 324.468 4.157 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCc2occc21 ZINC000360035435 1054995418 /nfs/dbraw/zinc/99/54/18/1054995418.db2.gz BBVXJTYSVYCADV-LSTHTHJFSA-N 2 1 324.468 4.157 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCc2occc21 ZINC000360035437 1054996485 /nfs/dbraw/zinc/99/64/85/1054996485.db2.gz BBVXJTYSVYCADV-UXPWSPDFSA-N 2 1 324.468 4.157 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCc2occc21 ZINC000360035437 1054996495 /nfs/dbraw/zinc/99/64/95/1054996495.db2.gz BBVXJTYSVYCADV-UXPWSPDFSA-N 2 1 324.468 4.157 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccc(F)cc1)[C@@]1(C)CCC[NH2+]C1 ZINC001236208189 1055000140 /nfs/dbraw/zinc/00/01/40/1055000140.db2.gz STRCMPUGDFSUTO-FQEVSTJZSA-N 2 1 312.432 4.067 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@@]1(C)CCC[NH2+]C1 ZINC001236208189 1055000150 /nfs/dbraw/zinc/00/01/50/1055000150.db2.gz STRCMPUGDFSUTO-FQEVSTJZSA-N 2 1 312.432 4.067 20 0 DIADMP C[NH2+]C1CCC([N@H+](C)Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001236212574 1055001605 /nfs/dbraw/zinc/00/16/05/1055001605.db2.gz HPVKQJDJZBAOSN-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(Cl)ccc(F)c2Cl)CC1 ZINC001236212574 1055001616 /nfs/dbraw/zinc/00/16/16/1055001616.db2.gz HPVKQJDJZBAOSN-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(Cl)c(F)c(Cl)c2)CC1 ZINC001236214308 1055003127 /nfs/dbraw/zinc/00/31/27/1055003127.db2.gz ATNXHFRVYFVANY-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccsc2)c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236217584 1055004207 /nfs/dbraw/zinc/00/42/07/1055004207.db2.gz PFYXVDUEKROUID-QZTJIDSGSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccsc2)c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236217584 1055004220 /nfs/dbraw/zinc/00/42/20/1055004220.db2.gz PFYXVDUEKROUID-QZTJIDSGSA-N 2 1 300.471 4.117 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@H+](C)[C@@H]2CCCC[C@H]2[NH3+])c1 ZINC001236215401 1055004900 /nfs/dbraw/zinc/00/49/00/1055004900.db2.gz HVBJAPFINJRSPR-NHCUHLMSSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@@H+](C)[C@@H]2CCCC[C@H]2[NH3+])c1 ZINC001236215401 1055004916 /nfs/dbraw/zinc/00/49/16/1055004916.db2.gz HVBJAPFINJRSPR-NHCUHLMSSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236216582 1055005259 /nfs/dbraw/zinc/00/52/59/1055005259.db2.gz KLOKHJGJWXTOSC-WOJBJXKFSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236216582 1055005270 /nfs/dbraw/zinc/00/52/70/1055005270.db2.gz KLOKHJGJWXTOSC-WOJBJXKFSA-N 2 1 312.432 4.194 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cnc(-c3ccccc3)c(C)c2)CC1 ZINC001236216310 1055006304 /nfs/dbraw/zinc/00/63/04/1055006304.db2.gz YAKXDGAQFOMVQR-UHFFFAOYSA-N 2 1 323.484 4.019 20 0 DIADMP C[N@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236219108 1055011352 /nfs/dbraw/zinc/01/13/52/1055011352.db2.gz ULTHBRUYULGZTL-FUHWJXTLSA-N 2 1 313.489 4.167 20 0 DIADMP C[N@@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236219108 1055011367 /nfs/dbraw/zinc/01/13/67/1055011367.db2.gz ULTHBRUYULGZTL-FUHWJXTLSA-N 2 1 313.489 4.167 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223248 1055011737 /nfs/dbraw/zinc/01/17/37/1055011737.db2.gz MFTMWLIXIDLDRA-WGSAOQKQSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222951 1055012402 /nfs/dbraw/zinc/01/24/02/1055012402.db2.gz KJBIFCJKLYJQGJ-WGSAOQKQSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](CC(c1ccccc1)c1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224598 1055014154 /nfs/dbraw/zinc/01/41/54/1055014154.db2.gz VFLWOOMYNHLZKL-MXVIHJGJSA-N 2 1 308.469 4.020 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccs2)s1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223325 1055014452 /nfs/dbraw/zinc/01/44/52/1055014452.db2.gz OVOQRSOTZRUOSE-JOCQHMNTSA-N 2 1 306.500 4.178 20 0 DIADMP Cc1csc2sc(C[N@H+](C)C3(C)CC[NH2+]CC3)c(C)c12 ZINC001236225683 1055016419 /nfs/dbraw/zinc/01/64/19/1055016419.db2.gz BMBJUAUVGYRPID-UHFFFAOYSA-N 2 1 308.516 4.154 20 0 DIADMP C[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C1(C)CC[NH2+]CC1 ZINC001236226723 1055017111 /nfs/dbraw/zinc/01/71/11/1055017111.db2.gz RYJPANWAYAORSU-UHFFFAOYSA-N 2 1 321.679 4.221 20 0 DIADMP [NH3+]C1CCC([N@H+](Cc2ccccc2)CC2CCCCC2)CC1 ZINC001236227614 1055016981 /nfs/dbraw/zinc/01/69/81/1055016981.db2.gz INZXUWYFDHVWCM-UHFFFAOYSA-N 2 1 300.490 4.339 20 0 DIADMP C[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C1(C)CC[NH2+]CC1 ZINC001236226723 1055017094 /nfs/dbraw/zinc/01/70/94/1055017094.db2.gz RYJPANWAYAORSU-UHFFFAOYSA-N 2 1 321.679 4.221 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+](C)C3(C)CC[NH2+]CC3)c2)cc1 ZINC001236225660 1055017205 /nfs/dbraw/zinc/01/72/05/1055017205.db2.gz AMCYCRMABVEDHN-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP Cc1csc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)c1 ZINC001236228345 1055018953 /nfs/dbraw/zinc/01/89/53/1055018953.db2.gz UJXQSUQSONGRQW-UHFFFAOYSA-N 2 1 314.498 4.329 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccccc2)Cc2cccc(F)c2)CC1 ZINC001236228138 1055019942 /nfs/dbraw/zinc/01/99/42/1055019942.db2.gz QLKDPNCPUABXQG-UHFFFAOYSA-N 2 1 312.432 4.098 20 0 DIADMP CC[N@@H+](CCCCCC[NH3+])Cc1ccc(C(F)(F)F)cc1 ZINC001236238782 1055025867 /nfs/dbraw/zinc/02/58/67/1055025867.db2.gz BRHWGIZJRXTXMK-UHFFFAOYSA-N 2 1 302.384 4.046 20 0 DIADMP CC[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccc(C)c(C)c1 ZINC001236239463 1055026084 /nfs/dbraw/zinc/02/60/84/1055026084.db2.gz FUCAIBBHXFHKBY-UHFFFAOYSA-N 2 1 314.498 4.033 20 0 DIADMP C[N@@H+](CCCCCC[NH3+])Cc1cccc(Oc2ccccc2)c1 ZINC001236238872 1055026265 /nfs/dbraw/zinc/02/62/65/1055026265.db2.gz CTAHFRMJDVHCLK-UHFFFAOYSA-N 2 1 312.457 4.430 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(s1)C[NH2+]CC2 ZINC001236244503 1055028532 /nfs/dbraw/zinc/02/85/32/1055028532.db2.gz LIKGDYPLDHLMQM-GFCCVEGCSA-N 2 1 320.889 4.240 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(s1)C[NH2+]CC2 ZINC001236244503 1055028549 /nfs/dbraw/zinc/02/85/49/1055028549.db2.gz LIKGDYPLDHLMQM-GFCCVEGCSA-N 2 1 320.889 4.240 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)CC1CC2(C1)CC[NH2+]CC2 ZINC001236245023 1055028639 /nfs/dbraw/zinc/02/86/39/1055028639.db2.gz PGJSEGZIEBAJAR-AWEZNQCLSA-N 2 1 306.881 4.113 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2CC2(C)CC[NH2+]CC2)cc1C ZINC001236246216 1055029024 /nfs/dbraw/zinc/02/90/24/1055029024.db2.gz ZOCJKDUPAFJLAM-IBGZPJMESA-N 2 1 300.490 4.220 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)CC1CC2(C1)CC[NH2+]CC2 ZINC001236245029 1055029546 /nfs/dbraw/zinc/02/95/46/1055029546.db2.gz PGJSEGZIEBAJAR-CQSZACIVSA-N 2 1 306.881 4.113 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCC[NH2+]C1)Cc1ccc(Cl)cc1Cl ZINC001236266461 1055043920 /nfs/dbraw/zinc/04/39/20/1055043920.db2.gz SKYDKCBUKOXGEY-ZDUSSCGKSA-N 2 1 315.288 4.205 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1Cl)CC1(C)CC[NH2+]CC1 ZINC001236267084 1055045380 /nfs/dbraw/zinc/04/53/80/1055045380.db2.gz YORNTKOHYURYDV-UHFFFAOYSA-N 2 1 315.288 4.205 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1C ZINC001236286531 1055049202 /nfs/dbraw/zinc/04/92/02/1055049202.db2.gz LYJRXPBHNHHVIA-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP CCc1cccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1 ZINC001236300849 1055049649 /nfs/dbraw/zinc/04/96/49/1055049649.db2.gz NMPCBZLCRAEMAV-UHFFFAOYSA-N 2 1 308.469 4.003 20 0 DIADMP Cc1cc(C)c(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1C ZINC001236300412 1055049687 /nfs/dbraw/zinc/04/96/87/1055049687.db2.gz ALYRXCNTPHARNS-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP FC1(F)CCC(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CC1 ZINC001236288193 1055050474 /nfs/dbraw/zinc/05/04/74/1055050474.db2.gz XJWLSYHXOIMUIF-UHFFFAOYSA-N 2 1 322.443 4.066 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)cc2)cc1 ZINC001236321246 1055055603 /nfs/dbraw/zinc/05/56/03/1055055603.db2.gz YWRHMVXYQIELME-SZPZYZBQSA-N 2 1 320.480 4.093 20 0 DIADMP CC/C=C\CCCCCC[N@@H+]1CC[C@H]([NH3+])[C@H](C(F)(F)F)C1 ZINC001236361741 1055073023 /nfs/dbraw/zinc/07/30/23/1055073023.db2.gz SJIJRBTUVRXRMA-OVNWPICBSA-N 2 1 306.416 4.115 20 0 DIADMP CC/C=C\CCCCCC[N@H+]1CC[C@H]([NH3+])[C@H](C(F)(F)F)C1 ZINC001236361741 1055073034 /nfs/dbraw/zinc/07/30/34/1055073034.db2.gz SJIJRBTUVRXRMA-OVNWPICBSA-N 2 1 306.416 4.115 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000184377712 1055075899 /nfs/dbraw/zinc/07/58/99/1055075899.db2.gz CGWDISPFSQQZTF-UONOGXRCSA-N 2 1 313.470 4.393 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000184377726 1055076189 /nfs/dbraw/zinc/07/61/89/1055076189.db2.gz CGWDISPFSQQZTF-ZIAGYGMSSA-N 2 1 313.470 4.393 20 0 DIADMP Fc1cccc(CCC[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236370449 1055077343 /nfs/dbraw/zinc/07/73/43/1055077343.db2.gz FXZIWLUQZJLJJH-SFHVURJKSA-N 2 1 318.480 4.003 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)c1cnc2ccsc2c1)[NH+]1CCCCC1 ZINC000184513037 1055077737 /nfs/dbraw/zinc/07/77/37/1055077737.db2.gz PSOFOOBKTGYASK-HUUCEWRRSA-N 2 1 317.502 4.211 20 0 DIADMP CC(C)C[C@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccccn1 ZINC000184500742 1055078363 /nfs/dbraw/zinc/07/83/63/1055078363.db2.gz VZXAOHBUYXSLQX-HKUYNNGSSA-N 2 1 303.494 4.023 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)CC1 ZINC001236372593 1055079280 /nfs/dbraw/zinc/07/92/80/1055079280.db2.gz QPURLUCQEAZENY-OTWHNJEPSA-N 2 1 304.522 4.223 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(F)c1F ZINC001236372719 1055080118 /nfs/dbraw/zinc/08/01/18/1055080118.db2.gz CVUXWZLLJOFTSG-HNNXBMFYSA-N 2 1 322.443 4.017 20 0 DIADMP Clc1cccc(CC[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373480 1055080823 /nfs/dbraw/zinc/08/08/23/1055080823.db2.gz XJRYYWSPJATHBA-KRWDZBQOSA-N 2 1 320.908 4.127 20 0 DIADMP Clc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cs1 ZINC001236375268 1055081403 /nfs/dbraw/zinc/08/14/03/1055081403.db2.gz IQHZKVNPTXOMLY-CYBMUJFWSA-N 2 1 312.910 4.146 20 0 DIADMP FC(F)c1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236375027 1055082281 /nfs/dbraw/zinc/08/22/81/1055082281.db2.gz HJYWSLRUQWPDPM-MRXNPFEDSA-N 2 1 322.443 4.368 20 0 DIADMP c1oc2ccccc2c1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376859 1055082323 /nfs/dbraw/zinc/08/23/23/1055082323.db2.gz UYKLSJAZKKETPB-MRXNPFEDSA-N 2 1 312.457 4.177 20 0 DIADMP CSc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236374776 1055082594 /nfs/dbraw/zinc/08/25/94/1055082594.db2.gz TZRFIMBVQJYPCD-QGZVFWFLSA-N 2 1 318.530 4.153 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1Cl ZINC001236375851 1055083019 /nfs/dbraw/zinc/08/30/19/1055083019.db2.gz MTOGSWJAXGJWTA-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP CCc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236374573 1055083157 /nfs/dbraw/zinc/08/31/57/1055083157.db2.gz FEDLKKRQMQQFFZ-HNNXBMFYSA-N 2 1 306.519 4.055 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001236402190 1055093689 /nfs/dbraw/zinc/09/36/89/1055093689.db2.gz WZPRNXUFUDEWJR-ARJAWSKDSA-N 2 1 304.453 4.126 20 0 DIADMP C[C@@H]([NH2+]CCCc1cccc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185755492 1055096816 /nfs/dbraw/zinc/09/68/16/1055096816.db2.gz PXVHMGZPXPNHIT-AEFFLSMTSA-N 2 1 318.480 4.001 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](CC)C[C@@H]2CC[NH2+]C2)cc1 ZINC001236407793 1055098355 /nfs/dbraw/zinc/09/83/55/1055098355.db2.gz HKIPXJAYWUVIQK-LJQANCHMSA-N 2 1 318.505 4.077 20 0 DIADMP CC[N@H+](Cc1cccc(-c2ccc(C)cc2)c1)C[C@@H]1CC[NH2+]C1 ZINC001236408131 1055099329 /nfs/dbraw/zinc/09/93/29/1055099329.db2.gz LGIRKRUYIBTLJK-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@H+](Cc1ccc(Oc2ccccc2)cc1C)C[C@@H]1CC[NH2+]C1 ZINC001236409569 1055100721 /nfs/dbraw/zinc/10/07/21/1055100721.db2.gz BWTFMWAHVFUPFO-GOSISDBHSA-N 2 1 324.468 4.219 20 0 DIADMP CC[N@H+](Cc1ccc(Oc2ccccc2)cc1C)C[C@H]1CC[NH2+]C1 ZINC001236409570 1055100882 /nfs/dbraw/zinc/10/08/82/1055100882.db2.gz BWTFMWAHVFUPFO-SFHVURJKSA-N 2 1 324.468 4.219 20 0 DIADMP CC[N@H+](Cc1ccc(C2CCCCC2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236412106 1055101873 /nfs/dbraw/zinc/10/18/73/1055101873.db2.gz QVKLFHZNWFOZDZ-GOSISDBHSA-N 2 1 300.490 4.166 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415474 1055104268 /nfs/dbraw/zinc/10/42/68/1055104268.db2.gz OKIDJDCEAGTZOA-IUODEOHRSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415474 1055104270 /nfs/dbraw/zinc/10/42/70/1055104270.db2.gz OKIDJDCEAGTZOA-IUODEOHRSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419167 1055104931 /nfs/dbraw/zinc/10/49/31/1055104931.db2.gz HBXFWYBPMLLPMA-DNVCBOLYSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419167 1055104938 /nfs/dbraw/zinc/10/49/38/1055104938.db2.gz HBXFWYBPMLLPMA-DNVCBOLYSA-N 2 1 319.452 4.147 20 0 DIADMP C[NH+](C)Cc1cccc(-c2ccc3c(c2)[nH]c2cc[nH+]cc23)c1 ZINC001236426479 1055109521 /nfs/dbraw/zinc/10/95/21/1055109521.db2.gz WFCJACSAACKCRY-UHFFFAOYSA-N 2 1 301.393 4.445 20 0 DIADMP Clc1ccccc1C[N@@H+](CC1CCCCC1)C1CC[NH2+]CC1 ZINC001236450358 1055119627 /nfs/dbraw/zinc/11/96/27/1055119627.db2.gz HBHQOQFKNFLEEP-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP CCC[C@H](C)C[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450872 1055120371 /nfs/dbraw/zinc/12/03/71/1055120371.db2.gz KZUCDPAQUPGCDO-HNNXBMFYSA-N 2 1 308.897 4.330 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450872 1055120377 /nfs/dbraw/zinc/12/03/77/1055120377.db2.gz KZUCDPAQUPGCDO-HNNXBMFYSA-N 2 1 308.897 4.330 20 0 DIADMP CC/C=C\CC[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450851 1055120677 /nfs/dbraw/zinc/12/06/77/1055120677.db2.gz KDVHJFQFAMVTEW-ARJAWSKDSA-N 2 1 306.881 4.250 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450851 1055120681 /nfs/dbraw/zinc/12/06/81/1055120681.db2.gz KDVHJFQFAMVTEW-ARJAWSKDSA-N 2 1 306.881 4.250 20 0 DIADMP CCC[C@@H](C)C[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450873 1055121170 /nfs/dbraw/zinc/12/11/70/1055121170.db2.gz KZUCDPAQUPGCDO-OAHLLOKOSA-N 2 1 308.897 4.330 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450873 1055121173 /nfs/dbraw/zinc/12/11/73/1055121173.db2.gz KZUCDPAQUPGCDO-OAHLLOKOSA-N 2 1 308.897 4.330 20 0 DIADMP Clc1ccc(C[N@@H+](CCC2CCCC2)C2CC[NH2+]CC2)cc1 ZINC001236453573 1055122695 /nfs/dbraw/zinc/12/26/95/1055122695.db2.gz SNEBYLPADNKGKP-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236453263 1055122723 /nfs/dbraw/zinc/12/27/23/1055122723.db2.gz ORMLPHLXESPFKB-ARJAWSKDSA-N 2 1 306.881 4.250 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc2ccccc2c1)C1CC[NH2+]CC1 ZINC001236458751 1055127048 /nfs/dbraw/zinc/12/70/48/1055127048.db2.gz XTPLTLQQGSFTJF-UHFFFAOYSA-N 2 1 310.485 4.440 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380908913 1055137219 /nfs/dbraw/zinc/13/72/19/1055137219.db2.gz JOJVBLZFPFALGC-HOJAQTOUSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](CCC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236481331 1055138553 /nfs/dbraw/zinc/13/85/53/1055138553.db2.gz REUXYLPQOPVADR-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236489916 1055143971 /nfs/dbraw/zinc/14/39/71/1055143971.db2.gz ZOCXZCQFNCWPNE-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP CC/C=C\CCC[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001236502100 1055150325 /nfs/dbraw/zinc/15/03/25/1055150325.db2.gz PBDFMMFUWPLFGQ-ARJAWSKDSA-N 2 1 322.443 4.265 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001236502100 1055150333 /nfs/dbraw/zinc/15/03/33/1055150333.db2.gz PBDFMMFUWPLFGQ-ARJAWSKDSA-N 2 1 322.443 4.265 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001236500130 1055150612 /nfs/dbraw/zinc/15/06/12/1055150612.db2.gz WBDVUEKJBNTBNE-ARJAWSKDSA-N 2 1 322.443 4.265 20 0 DIADMP Cc1ccc(F)cc1C[N@H+](CCCC(C)C)C1CC[NH2+]CC1 ZINC001236508857 1055152815 /nfs/dbraw/zinc/15/28/15/1055152815.db2.gz DVTKAASIXLDXNZ-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2F)C[C@@H]2CC=CCC2)CC1 ZINC001236534222 1055164927 /nfs/dbraw/zinc/16/49/27/1055164927.db2.gz SLBHJDYDWJIYAD-BHIYHBOVSA-N 2 1 316.464 4.254 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236534184 1055164943 /nfs/dbraw/zinc/16/49/43/1055164943.db2.gz QXMBULSLIRYRHX-SZMVWBNQSA-N 2 1 306.469 4.334 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236541969 1055170200 /nfs/dbraw/zinc/17/02/00/1055170200.db2.gz RKJIEEVCMVHVPZ-MXVIHJGJSA-N 2 1 300.490 4.175 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236540752 1055170590 /nfs/dbraw/zinc/17/05/90/1055170590.db2.gz ARHJSCWHGFSUHH-WKILWMFISA-N 2 1 322.443 4.145 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2cccc(F)c2)CC2CCC2)CC1 ZINC001236540605 1055170625 /nfs/dbraw/zinc/17/06/25/1055170625.db2.gz HGFHGYCPNSKCHB-MXVIHJGJSA-N 2 1 318.480 4.130 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236540500 1055171183 /nfs/dbraw/zinc/17/11/83/1055171183.db2.gz FHIXLEIEFJNSIR-RNQOJCNYSA-N 2 1 304.522 4.351 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236542083 1055171215 /nfs/dbraw/zinc/17/12/15/1055171215.db2.gz WTLJGYQLNGJEGV-WGSAOQKQSA-N 2 1 304.453 4.006 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236543391 1055172635 /nfs/dbraw/zinc/17/26/35/1055172635.db2.gz QUNRKEOXQWGXJL-WGSAOQKQSA-N 2 1 318.505 4.203 20 0 DIADMP COc1cc(C)c(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236550897 1055178184 /nfs/dbraw/zinc/17/81/84/1055178184.db2.gz OKGZSGBATRQBAP-WGSAOQKQSA-N 2 1 318.505 4.040 20 0 DIADMP CC(C)C[N@@H+](Cc1cccc(Cl)c1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550292 1055178383 /nfs/dbraw/zinc/17/83/83/1055178383.db2.gz KSIUNSOKNZIDDR-SHTZXODSSA-N 2 1 312.860 4.207 20 0 DIADMP CC(C)C[N@@H+](Cc1cc(Cl)cs1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550283 1055178390 /nfs/dbraw/zinc/17/83/90/1055178390.db2.gz BOOBXMCTWOVXIY-HDJSIYSDSA-N 2 1 300.899 4.129 20 0 DIADMP Cc1ccc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1F ZINC001236549755 1055178516 /nfs/dbraw/zinc/17/85/16/1055178516.db2.gz AVGOXBMSNKEUKO-WKILWMFISA-N 2 1 310.432 4.001 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551038 1055179871 /nfs/dbraw/zinc/17/98/71/1055179871.db2.gz JYFLKQFCILHYSP-QAQDUYKDSA-N 2 1 310.432 4.001 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3cccccc2-3)CC2CC2)CC1 ZINC001236552114 1055180127 /nfs/dbraw/zinc/18/01/27/1055180127.db2.gz RQQIVYOHSSTNTJ-MXVIHJGJSA-N 2 1 308.469 4.273 20 0 DIADMP Cc1ccc(F)c(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236551648 1055180327 /nfs/dbraw/zinc/18/03/27/1055180327.db2.gz SQHBOUKDOZXXDK-SHTZXODSSA-N 2 1 310.432 4.001 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC(C)(C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381791633 1055181997 /nfs/dbraw/zinc/18/19/97/1055181997.db2.gz LMDBSEMUXSPTMF-WDSOQIARSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C[N@@H+](Cc1cccc2occc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554164 1055182026 /nfs/dbraw/zinc/18/20/26/1055182026.db2.gz CZFQLSBENHKAJI-QAQDUYKDSA-N 2 1 300.446 4.161 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccccc2Cl)CC2CC2)CC1 ZINC001236553338 1055182201 /nfs/dbraw/zinc/18/22/01/1055182201.db2.gz XFLPYVHXBNMXCC-IYARVYRRSA-N 2 1 320.908 4.255 20 0 DIADMP CC(C)c1ccccc1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554342 1055182302 /nfs/dbraw/zinc/18/23/02/1055182302.db2.gz ZGCBOTGOKGWPKE-WGSAOQKQSA-N 2 1 300.490 4.292 20 0 DIADMP CC(C)c1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236553248 1055182446 /nfs/dbraw/zinc/18/24/46/1055182446.db2.gz VJUCTITWDSFIFR-MXVIHJGJSA-N 2 1 300.490 4.292 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCC2CCCC2)Cc2ccncc2)CC1 ZINC001236560157 1055183638 /nfs/dbraw/zinc/18/36/38/1055183638.db2.gz IZJUNIKYJJZLAZ-MXVIHJGJSA-N 2 1 315.505 4.124 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCC2CCCCC2)Cc2cccnc2)CC1 ZINC001236562340 1055184631 /nfs/dbraw/zinc/18/46/31/1055184631.db2.gz PVXPSOXWXPUXSR-MXVIHJGJSA-N 2 1 315.505 4.124 20 0 DIADMP Cc1ccsc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236565452 1055185840 /nfs/dbraw/zinc/18/58/40/1055185840.db2.gz GVHZYWPBLLAZCD-JCNLHEQBSA-N 2 1 306.519 4.461 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccccc2F)C2CCCCC2)CC1 ZINC001236565264 1055185989 /nfs/dbraw/zinc/18/59/89/1055185989.db2.gz BSBNOWOLZVLIAV-UAPYVXQJSA-N 2 1 318.480 4.273 20 0 DIADMP CCc1csc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)n1 ZINC001236565787 1055186468 /nfs/dbraw/zinc/18/64/68/1055186468.db2.gz MYYFBYMLFCXOEB-CZIWCDLHSA-N 2 1 321.534 4.110 20 0 DIADMP Cc1cc(O)cc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236565778 1055186482 /nfs/dbraw/zinc/18/64/82/1055186482.db2.gz MLSITSSCKBXCBF-UAPYVXQJSA-N 2 1 316.489 4.105 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(F)cc(F)c2)C2CCCCC2)CC1 ZINC001236565340 1055186551 /nfs/dbraw/zinc/18/65/51/1055186551.db2.gz FHAGMVOUACYYNM-UAPYVXQJSA-N 2 1 322.443 4.369 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccccc2)C2CCCCC2)CC1 ZINC001236566346 1055186583 /nfs/dbraw/zinc/18/65/83/1055186583.db2.gz XOPNUWYLDIAFQM-KESTWPANSA-N 2 1 300.490 4.134 20 0 DIADMP CNc1ccccc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236565769 1055186664 /nfs/dbraw/zinc/18/66/64/1055186664.db2.gz LVFWLNWUXLWRSC-UAPYVXQJSA-N 2 1 315.505 4.133 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2Cl)C2CCCC2)CC1 ZINC001236566169 1055186725 /nfs/dbraw/zinc/18/67/25/1055186725.db2.gz DLRBIAITDQSTIF-JCNLHEQBSA-N 2 1 324.871 4.494 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1O ZINC001236565827 1055186867 /nfs/dbraw/zinc/18/68/67/1055186867.db2.gz OVWOBVOOSKNLRB-UAPYVXQJSA-N 2 1 316.489 4.105 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CCCCC2)CC1 ZINC001236565985 1055186914 /nfs/dbraw/zinc/18/69/14/1055186914.db2.gz SXONYUPNEROYEA-JCNLHEQBSA-N 2 1 322.443 4.369 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(F)ccc2Cl)C2CCCC2)CC1 ZINC001236566544 1055187891 /nfs/dbraw/zinc/18/78/91/1055187891.db2.gz KHTKUZBZDSCNAO-JCNLHEQBSA-N 2 1 324.871 4.494 20 0 DIADMP COc1ccc(C)cc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236566804 1055187904 /nfs/dbraw/zinc/18/79/04/1055187904.db2.gz MFIUFISPUHKGKF-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2c(F)cccc2F)C2CCCC2)CC1 ZINC001236567088 1055187916 /nfs/dbraw/zinc/18/79/16/1055187916.db2.gz SQOQIGSOOYFQDO-KOMQPUFPSA-N 2 1 322.443 4.022 20 0 DIADMP CSc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236567544 1055187937 /nfs/dbraw/zinc/18/79/37/1055187937.db2.gz YJMHBOXPRRHOOO-SAABIXHNSA-N 2 1 318.530 4.423 20 0 DIADMP COc1ccsc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236567998 1055187973 /nfs/dbraw/zinc/18/79/73/1055187973.db2.gz UCDWGGRMYDHDTK-KOMQPUFPSA-N 2 1 322.518 4.161 20 0 DIADMP Cc1c(O)cccc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236567960 1055187984 /nfs/dbraw/zinc/18/79/84/1055187984.db2.gz RRFCXAVDDOYEEC-UAPYVXQJSA-N 2 1 316.489 4.105 20 0 DIADMP Cc1cccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236566808 1055188072 /nfs/dbraw/zinc/18/80/72/1055188072.db2.gz MJZUZZDKDJEJTN-SAABIXHNSA-N 2 1 304.453 4.149 20 0 DIADMP Cc1cccc(CC[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236567546 1055188142 /nfs/dbraw/zinc/18/81/42/1055188142.db2.gz YKCDYFFJYRPDAZ-KESTWPANSA-N 2 1 300.490 4.052 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2F)C2CCCC2)CC1 ZINC001236566859 1055188312 /nfs/dbraw/zinc/18/83/12/1055188312.db2.gz NOTSQULKAIBLRU-JCNLHEQBSA-N 2 1 324.871 4.494 20 0 DIADMP Cc1cnc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236566673 1055188325 /nfs/dbraw/zinc/18/83/25/1055188325.db2.gz ZZDGZCFPQBBTBS-UAPYVXQJSA-N 2 1 315.505 4.103 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236566872 1055188511 /nfs/dbraw/zinc/18/85/11/1055188511.db2.gz NVJSFQKMRMUYJS-KOMQPUFPSA-N 2 1 322.443 4.288 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc(C)n1 ZINC001236568415 1055190418 /nfs/dbraw/zinc/19/04/18/1055190418.db2.gz ZSPXWZVDPYSLEK-KESTWPANSA-N 2 1 315.505 4.103 20 0 DIADMP CC(C)Oc1cccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236572280 1055193088 /nfs/dbraw/zinc/19/30/88/1055193088.db2.gz OOTJFYNEQFAZRW-UAPYVXQJSA-N 2 1 316.489 4.098 20 0 DIADMP Cc1cc(C)c(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236572115 1055193225 /nfs/dbraw/zinc/19/32/25/1055193225.db2.gz IAUOWCINEIMIKP-KESTWPANSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc(F)c1F ZINC001236571377 1055193266 /nfs/dbraw/zinc/19/32/66/1055193266.db2.gz GTMJRJOFNYKEOJ-JCNLHEQBSA-N 2 1 322.443 4.288 20 0 DIADMP CC(C)c1ccc(CC[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236571421 1055193759 /nfs/dbraw/zinc/19/37/59/1055193759.db2.gz CNSNXXIMZYTOOM-XUTJKUGGSA-N 2 1 314.517 4.477 20 0 DIADMP Cc1nc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1Cl ZINC001236573833 1055195374 /nfs/dbraw/zinc/19/53/74/1055195374.db2.gz GMSHDDRJJZJMFZ-CZIWCDLHSA-N 2 1 321.896 4.058 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)c1 ZINC001236573429 1055195689 /nfs/dbraw/zinc/19/56/89/1055195689.db2.gz XNXDDEPAWZCVQC-JCNLHEQBSA-N 2 1 306.881 4.273 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236577099 1055197318 /nfs/dbraw/zinc/19/73/18/1055197318.db2.gz SLZGBBDQUIGNLM-UAPYVXQJSA-N 2 1 300.490 4.182 20 0 DIADMP c1ccc(-c2cccc(C[N@@H+](C3CCC3)C3CC[NH2+]CC3)c2)cc1 ZINC001236636265 1055208723 /nfs/dbraw/zinc/20/87/23/1055208723.db2.gz CAOCQOXYBWDTIG-UHFFFAOYSA-N 2 1 320.480 4.460 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)C[C@@H]1CCC[NH2+]C1 ZINC001236661304 1055217910 /nfs/dbraw/zinc/21/79/10/1055217910.db2.gz BVQPSAYSCDWCNE-UXHICEINSA-N 2 1 302.506 4.109 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236714944 1055241459 /nfs/dbraw/zinc/24/14/59/1055241459.db2.gz QGZJMODFPFECRY-MXVIHJGJSA-N 2 1 300.490 4.257 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc2ccoc21 ZINC001236734894 1055242942 /nfs/dbraw/zinc/24/29/42/1055242942.db2.gz GCPFCXGNYUOGHG-RBUKOAKNSA-N 2 1 312.457 4.272 20 0 DIADMP Cc1ccncc1C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236759342 1055251339 /nfs/dbraw/zinc/25/13/39/1055251339.db2.gz ULRPPNACCWLHHT-MXVIHJGJSA-N 2 1 315.505 4.042 20 0 DIADMP CCc1ccc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236754793 1055252967 /nfs/dbraw/zinc/25/29/67/1055252967.db2.gz JSJLLRMXTXBQBW-IYARVYRRSA-N 2 1 318.505 4.494 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccccc1N(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781732 1055255745 /nfs/dbraw/zinc/25/57/45/1055255745.db2.gz IDQFXIVNZHWXSN-UAPYVXQJSA-N 2 1 317.521 4.013 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1c[nH]c2ccccc12)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767953 1055255855 /nfs/dbraw/zinc/25/58/55/1055255855.db2.gz LHEAXDUAEBJTBC-QAQDUYKDSA-N 2 1 313.489 4.286 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(O)cc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782161 1055257279 /nfs/dbraw/zinc/25/72/79/1055257279.db2.gz PKAQXVQMDBENFN-JCNLHEQBSA-N 2 1 324.896 4.306 20 0 DIADMP CCC(CC)[N@@H+](CCc1cc(F)cc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782429 1055257570 /nfs/dbraw/zinc/25/75/70/1055257570.db2.gz KFZNABUTHSRYQY-UAPYVXQJSA-N 2 1 324.459 4.268 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)s1 ZINC001236828993 1055278670 /nfs/dbraw/zinc/27/86/70/1055278670.db2.gz JTWNWSUQFPLHLA-WBAXXEDZSA-N 2 1 306.519 4.040 20 0 DIADMP CCC[N@H+](Cc1ccccc1-c1ccccc1)C[C@H]1CC[NH2+]C1 ZINC001236836529 1055283219 /nfs/dbraw/zinc/28/32/19/1055283219.db2.gz WUNYGNUIQXFRAY-SFHVURJKSA-N 2 1 308.469 4.175 20 0 DIADMP CCC[N@H+](Cc1cccc(Oc2ccccc2)c1)C[C@@H]1CC[NH2+]C1 ZINC001236835654 1055285041 /nfs/dbraw/zinc/28/50/41/1055285041.db2.gz OOJQSPMSMJGTMG-LJQANCHMSA-N 2 1 324.468 4.300 20 0 DIADMP CCC[N@H+](Cc1sc2scc(C)c2c1C)C[C@@H]1CC[NH2+]C1 ZINC001236843090 1055290251 /nfs/dbraw/zinc/29/02/51/1055290251.db2.gz KWYQUTVPEICSCS-CQSZACIVSA-N 2 1 322.543 4.401 20 0 DIADMP CC(C)[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)[C@@H](C)c1ccccc1 ZINC001236860646 1055297160 /nfs/dbraw/zinc/29/71/60/1055297160.db2.gz SBGDOOFDWHFKTH-HNNXBMFYSA-N 2 1 314.498 4.365 20 0 DIADMP C[C@@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000764963384 1055307669 /nfs/dbraw/zinc/30/76/69/1055307669.db2.gz NXIIFSMXJFGZNY-HOTGVXAUSA-N 2 1 300.556 4.151 20 0 DIADMP C[C@H]1CCCCC[N@H+]1Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236907002 1055309786 /nfs/dbraw/zinc/30/97/86/1055309786.db2.gz YWRFJZSPEDOWNW-AWEZNQCLSA-N 2 1 303.837 4.290 20 0 DIADMP Clc1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)ccc1-n1ccnc1 ZINC001236915209 1055317356 /nfs/dbraw/zinc/31/73/56/1055317356.db2.gz ZUORYNANALYXMU-RDJZCZTQSA-N 2 1 315.848 4.290 20 0 DIADMP [NH3+]CCCCC[N@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC001236976299 1055320029 /nfs/dbraw/zinc/32/00/29/1055320029.db2.gz PDKPQBYVZOSMTG-INIZCTEOSA-N 2 1 314.395 4.361 20 0 DIADMP [NH3+]CCCCC[N@H+]1CCSC[C@@H]1c1cccc2ccccc21 ZINC001237001652 1055331601 /nfs/dbraw/zinc/33/16/01/1055331601.db2.gz ZXDCQOPXPZGHRP-LJQANCHMSA-N 2 1 314.498 4.059 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2CCc2ccccc2)C1 ZINC001237080227 1055363282 /nfs/dbraw/zinc/36/32/82/1055363282.db2.gz FWHFIQIIEPYBKK-QFIPXVFZSA-N 2 1 322.496 4.033 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001237082042 1055363555 /nfs/dbraw/zinc/36/35/55/1055363555.db2.gz NMGIWVONGZZDNX-QKUVIELKSA-N 2 1 324.443 4.194 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(F)c(-c3ccccc3)c2)C1 ZINC001237079702 1055364186 /nfs/dbraw/zinc/36/41/86/1055364186.db2.gz ABKIUOGOJMSIHY-FQEVSTJZSA-N 2 1 312.432 4.054 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc3cccccc2-3)CC1 ZINC001237186407 1055395130 /nfs/dbraw/zinc/39/51/30/1055395130.db2.gz ZONBGDKXDGYNQT-UHFFFAOYSA-N 2 1 310.485 4.488 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)C1CCCCC1 ZINC000386015959 1055403445 /nfs/dbraw/zinc/40/34/45/1055403445.db2.gz GSLRCAAMJXXRDJ-LSDHHAIUSA-N 2 1 320.443 4.352 20 0 DIADMP CC1=CC[C@H](CC[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)C1(C)C ZINC001237300968 1055420261 /nfs/dbraw/zinc/42/02/61/1055420261.db2.gz RWGKIESPAYYHQB-LJQANCHMSA-N 2 1 324.512 4.463 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@@H+]2Cc3ccccc3C23CC[NH2+]CC3)o1 ZINC001237300793 1055420822 /nfs/dbraw/zinc/42/08/22/1055420822.db2.gz OZHXQTTWEVCHTD-INIZCTEOSA-N 2 1 324.468 4.176 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)o1 ZINC001237300793 1055420838 /nfs/dbraw/zinc/42/08/38/1055420838.db2.gz OZHXQTTWEVCHTD-INIZCTEOSA-N 2 1 324.468 4.176 20 0 DIADMP Cc1ccc([C@H](C)CC[N@@H+]2Cc3ccccc3C23CC[NH2+]CC3)o1 ZINC001237300796 1055421625 /nfs/dbraw/zinc/42/16/25/1055421625.db2.gz OZHXQTTWEVCHTD-MRXNPFEDSA-N 2 1 324.468 4.176 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)o1 ZINC001237300796 1055421634 /nfs/dbraw/zinc/42/16/34/1055421634.db2.gz OZHXQTTWEVCHTD-MRXNPFEDSA-N 2 1 324.468 4.176 20 0 DIADMP CC(C)=CCC[C@@H](C)C[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001237299290 1055421685 /nfs/dbraw/zinc/42/16/85/1055421685.db2.gz CUVSEQNJULOTIN-GOSISDBHSA-N 2 1 312.501 4.463 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001620910971 1055535161 /nfs/dbraw/zinc/53/51/61/1055535161.db2.gz PCEMCDQOBVPXKF-FUHWJXTLSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001620910971 1055535166 /nfs/dbraw/zinc/53/51/66/1055535166.db2.gz PCEMCDQOBVPXKF-FUHWJXTLSA-N 2 1 314.517 4.311 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CCC[C@@](C)(F)C3)cc21 ZINC001237881189 1055548721 /nfs/dbraw/zinc/54/87/21/1055548721.db2.gz NKKGSMJAOKRJPS-LJQANCHMSA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@@](C)(F)C3)cc21 ZINC001237881189 1055548736 /nfs/dbraw/zinc/54/87/36/1055548736.db2.gz NKKGSMJAOKRJPS-LJQANCHMSA-N 2 1 302.437 4.012 20 0 DIADMP CC[N@@H+](Cc1cccnc1)Cc1ccc2c(c1)C(C(C)C)=[NH+]CC2 ZINC001237880834 1055548950 /nfs/dbraw/zinc/54/89/50/1055548950.db2.gz IOJFVRYTCRLPCI-UHFFFAOYSA-N 2 1 321.468 4.105 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@@H](C(F)F)C3)cc21 ZINC001237886632 1055550195 /nfs/dbraw/zinc/55/01/95/1055550195.db2.gz PIEYMYAEKLHJOH-MRXNPFEDSA-N 2 1 320.427 4.165 20 0 DIADMP CC(C)Cc1ccc(C[NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)cc1 ZINC001620946127 1055561369 /nfs/dbraw/zinc/56/13/69/1055561369.db2.gz GWGIZDOUNZYPIM-NRFANRHFSA-N 2 1 316.533 4.485 20 0 DIADMP Cc1sccc1C[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001237971227 1055566837 /nfs/dbraw/zinc/56/68/37/1055566837.db2.gz BVCCDNQRHQFHAO-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP Cc1sccc1C[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001237971227 1055566849 /nfs/dbraw/zinc/56/68/49/1055566849.db2.gz BVCCDNQRHQFHAO-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP CC(C)[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000387442297 1055585421 /nfs/dbraw/zinc/58/54/21/1055585421.db2.gz PFFIRWDSZLQEMF-ZBFHGGJFSA-N 2 1 314.395 4.086 20 0 DIADMP CC(C)[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000387442297 1055585433 /nfs/dbraw/zinc/58/54/33/1055585433.db2.gz PFFIRWDSZLQEMF-ZBFHGGJFSA-N 2 1 314.395 4.086 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cccc2c[nH+]cn21 ZINC001238111937 1055609702 /nfs/dbraw/zinc/60/97/02/1055609702.db2.gz ZDIJTUWKQOKNDE-SFHVURJKSA-N 2 1 323.465 4.393 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1cccc2c[nH+]cn21 ZINC001238111937 1055609712 /nfs/dbraw/zinc/60/97/12/1055609712.db2.gz ZDIJTUWKQOKNDE-SFHVURJKSA-N 2 1 323.465 4.393 20 0 DIADMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547976 1055683168 /nfs/dbraw/zinc/68/31/68/1055683168.db2.gz GJDRKLRFTCPTMD-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547976 1055683173 /nfs/dbraw/zinc/68/31/73/1055683173.db2.gz GJDRKLRFTCPTMD-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547976 1055683176 /nfs/dbraw/zinc/68/31/76/1055683176.db2.gz GJDRKLRFTCPTMD-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(F)c(-c4ccccc4)c3)C2)C1 ZINC001238547976 1055683178 /nfs/dbraw/zinc/68/31/78/1055683178.db2.gz GJDRKLRFTCPTMD-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP Cc1ccc(Cl)c(CN2CC[C@@H](Oc3ccncc3C)C2)c1 ZINC001238566357 1055689521 /nfs/dbraw/zinc/68/95/21/1055689521.db2.gz LIXFEAKFSVTORF-MRXNPFEDSA-N 2 1 316.832 4.005 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2c(C)cc(OC(C)C)cc2C)CC1 ZINC001238673817 1055717811 /nfs/dbraw/zinc/71/78/11/1055717811.db2.gz OTXZTGBQNQTIBU-UHFFFAOYSA-N 2 1 318.505 4.007 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2c(C)cc(OC(C)C)cc2C)CC1 ZINC001238673817 1055717820 /nfs/dbraw/zinc/71/78/20/1055717820.db2.gz OTXZTGBQNQTIBU-UHFFFAOYSA-N 2 1 318.505 4.007 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(C)cc(SC)c2)CC1 ZINC001238689679 1055722919 /nfs/dbraw/zinc/72/29/19/1055722919.db2.gz LUCXPIZOJRUIQC-UHFFFAOYSA-N 2 1 320.546 4.413 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000126656730 1055841449 /nfs/dbraw/zinc/84/14/49/1055841449.db2.gz SWXQSGZUCOJHST-RBUKOAKNSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)cc2)cc1 ZINC000126656730 1055841458 /nfs/dbraw/zinc/84/14/58/1055841458.db2.gz SWXQSGZUCOJHST-RBUKOAKNSA-N 2 1 322.452 4.195 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CCC2)CC1(C)C ZINC001620764473 1055934819 /nfs/dbraw/zinc/93/48/19/1055934819.db2.gz SUKBCBKHDGZSQT-QGZVFWFLSA-N 2 1 320.908 4.224 20 0 DIADMP CC[N@@H+](CCCNCc1cnc(C2CC2)s1)C1CCCCC1 ZINC001620996553 1055965901 /nfs/dbraw/zinc/96/59/01/1055965901.db2.gz ZRKQXFRCIHAEHL-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1cnc(C2CC2)s1)C1CCCCC1 ZINC001620996553 1055965910 /nfs/dbraw/zinc/96/59/10/1055965910.db2.gz ZRKQXFRCIHAEHL-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cnc(C2CC2)s1)C1CCCCC1 ZINC001620996553 1055965922 /nfs/dbraw/zinc/96/59/22/1055965922.db2.gz ZRKQXFRCIHAEHL-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H]1CCC[C@H](SC)C1)C1CCCCC1 ZINC001620997129 1055966408 /nfs/dbraw/zinc/96/64/08/1055966408.db2.gz XTDDAXJZKVSDOA-AEFFLSMTSA-N 2 1 312.567 4.295 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)c1 ZINC001620720673 1055984159 /nfs/dbraw/zinc/98/41/59/1055984159.db2.gz RPGKVMDIUCNAHZ-KRWDZBQOSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)c1 ZINC001620720673 1055984171 /nfs/dbraw/zinc/98/41/71/1055984171.db2.gz RPGKVMDIUCNAHZ-KRWDZBQOSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCCC[C@H]3C)[nH]c2c1 ZINC001620725131 1055986471 /nfs/dbraw/zinc/98/64/71/1055986471.db2.gz XCEUFWAVZPILRU-QGZVFWFLSA-N 2 1 313.489 4.221 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]C[C@H](C1CCCCC1)[NH+](C)C ZINC001620724575 1055987530 /nfs/dbraw/zinc/98/75/30/1055987530.db2.gz DFBDMAYAJSXDPX-GHTZIAJQSA-N 2 1 316.533 4.355 20 0 DIADMP CC(C)c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001620724550 1055987586 /nfs/dbraw/zinc/98/75/86/1055987586.db2.gz CDDDUWKSRFMUKW-GOSISDBHSA-N 2 1 302.506 4.412 20 0 DIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000671770035 1056012896 /nfs/dbraw/zinc/01/28/96/1056012896.db2.gz QFCTYLMHRQQYSL-QYZOEREBSA-N 2 1 320.908 4.296 20 0 DIADMP C[NH+](Cc1cccc(CC2CCC2)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001621327946 1056035027 /nfs/dbraw/zinc/03/50/27/1056035027.db2.gz HMLLNGHALQGLRN-WCRBZPEASA-N 2 1 312.501 4.086 20 0 DIADMP C[NH+](Cc1cccc(CC2CCC2)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001621327946 1056035040 /nfs/dbraw/zinc/03/50/40/1056035040.db2.gz HMLLNGHALQGLRN-WCRBZPEASA-N 2 1 312.501 4.086 20 0 DIADMP Cc1ccc(-c2ccccc2C[NH+]2CCC([NH3+])CC2)c(Cl)c1 ZINC001239863241 1056115674 /nfs/dbraw/zinc/11/56/74/1056115674.db2.gz FKAGJPWDSRRAOF-UHFFFAOYSA-N 2 1 314.860 4.239 20 0 DIADMP C[N@H+]1CCc2c(F)cc(-c3ccc(C[NH+]4CCCC4)cc3)cc2C1 ZINC001240061995 1056297637 /nfs/dbraw/zinc/29/76/37/1056297637.db2.gz PPIXNTWOFPAGSF-UHFFFAOYSA-N 2 1 324.443 4.076 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474463234 1056313137 /nfs/dbraw/zinc/31/31/37/1056313137.db2.gz BONGSCURARTRQG-WLYUNCDWSA-N 2 1 308.432 4.064 20 0 DIADMP C[NH+](C)Cc1ccc(C2=CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001240388259 1056470417 /nfs/dbraw/zinc/47/04/17/1056470417.db2.gz FYNQOAGBQAXWBD-UHFFFAOYSA-N 2 1 306.453 4.038 20 0 DIADMP c1ccc(C[N@H+]2CCC=C(c3ccc([C@@H]4CC[NH2+]C4)cc3)C2)cc1 ZINC001240388394 1056470820 /nfs/dbraw/zinc/47/08/20/1056470820.db2.gz BTLJLMNBMNEQQK-OAQYLSRUSA-N 2 1 318.464 4.053 20 0 DIADMP [NH3+]C1(c2cccc(C3=CCC[N@@H+](Cc4ccccc4)C3)c2)CCC1 ZINC001240388380 1056471721 /nfs/dbraw/zinc/47/17/21/1056471721.db2.gz AZXSCWFOEMIOSW-UHFFFAOYSA-N 2 1 318.464 4.314 20 0 DIADMP c1ccc(C[N@H+]2CCC=C(c3ccc([C@@H]4CCC[NH2+]4)cc3)C2)cc1 ZINC001240388152 1056472165 /nfs/dbraw/zinc/47/21/65/1056472165.db2.gz CSXWXMYZRPCSNZ-QFIPXVFZSA-N 2 1 318.464 4.400 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H]1c1cccc2ccccc21 ZINC001615252273 1056485112 /nfs/dbraw/zinc/48/51/12/1056485112.db2.gz XRTPIEZEUMIMCG-WIYYLYMNSA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC001615252273 1056485116 /nfs/dbraw/zinc/48/51/16/1056485116.db2.gz XRTPIEZEUMIMCG-WIYYLYMNSA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC001615252273 1056485117 /nfs/dbraw/zinc/48/51/17/1056485117.db2.gz XRTPIEZEUMIMCG-WIYYLYMNSA-N 2 1 308.469 4.461 20 0 DIADMP C[C@@H]1SCC[N@H+](CCC[NH+]2CCCCC2)[C@H]1c1ccccc1 ZINC001615522890 1056527240 /nfs/dbraw/zinc/52/72/40/1056527240.db2.gz BORZGJHYRLYUKK-PKOBYXMFSA-N 2 1 318.530 4.041 20 0 DIADMP C[C@@H]1SCC[N@@H+](CCC[NH+]2CCCCC2)[C@H]1c1ccccc1 ZINC001615522890 1056527257 /nfs/dbraw/zinc/52/72/57/1056527257.db2.gz BORZGJHYRLYUKK-PKOBYXMFSA-N 2 1 318.530 4.041 20 0 DIADMP C[C@H]1CC(CC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)C[C@H](C)C1 ZINC001615577638 1056540453 /nfs/dbraw/zinc/54/04/53/1056540453.db2.gz JMRAUKQJYIBVEL-GGPKGHCWSA-N 2 1 306.538 4.399 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C1CC1)C1CC(c2ccccc2C)C1 ZINC001615726058 1056569486 /nfs/dbraw/zinc/56/94/86/1056569486.db2.gz PDZVVJCJZITLAA-UHFFFAOYSA-N 2 1 314.517 4.437 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615845998 1056585087 /nfs/dbraw/zinc/58/50/87/1056585087.db2.gz FJIZRWZKYBJNSI-SESVDKBCSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615845998 1056585101 /nfs/dbraw/zinc/58/51/01/1056585101.db2.gz FJIZRWZKYBJNSI-SESVDKBCSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615845998 1056585113 /nfs/dbraw/zinc/58/51/13/1056585113.db2.gz FJIZRWZKYBJNSI-SESVDKBCSA-N 2 1 314.517 4.408 20 0 DIADMP C[NH+](C)CC1(C[NH2+][C@H]2CCSc3c(F)cccc32)CCCC1 ZINC000355052826 1056610771 /nfs/dbraw/zinc/61/07/71/1056610771.db2.gz ABCITJGSZOXFHO-INIZCTEOSA-N 2 1 322.493 4.074 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccccc2F)CC1)CC1CC1 ZINC001616570338 1056679678 /nfs/dbraw/zinc/67/96/78/1056679678.db2.gz RGSFYMCAFVYJGC-UHFFFAOYSA-N 2 1 318.480 4.160 20 0 DIADMP CCc1ccc(C2=CC[N@H+](CCC[NH+](CC)CC)CC2)cc1 ZINC001616832543 1056726293 /nfs/dbraw/zinc/72/62/93/1056726293.db2.gz RIMHIRXPCDEOPY-UHFFFAOYSA-N 2 1 300.490 4.070 20 0 DIADMP CCc1ccc(C2=CC[N@@H+](CCC[NH+](CC)CC)CC2)cc1 ZINC001616832543 1056726303 /nfs/dbraw/zinc/72/63/03/1056726303.db2.gz RIMHIRXPCDEOPY-UHFFFAOYSA-N 2 1 300.490 4.070 20 0 DIADMP C[C@@H]1CCC[C@@H](CC[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001616879865 1056730169 /nfs/dbraw/zinc/73/01/69/1056730169.db2.gz GZTHYCOLEHZRRZ-MSOLQXFVSA-N 2 1 302.506 4.396 20 0 DIADMP Fc1ccc(C2CC[NH+](CCC[NH+]3CCCCC3)CC2)cc1F ZINC000682027917 1056881768 /nfs/dbraw/zinc/88/17/68/1056881768.db2.gz NEXLWIGGKCSDHN-UHFFFAOYSA-N 2 1 322.443 4.020 20 0 DIADMP CC[NH+](CC)Cc1cc(C)ccc1-c1c[nH+]c(N(C)C)cc1C ZINC001241252352 1056981567 /nfs/dbraw/zinc/98/15/67/1056981567.db2.gz SJIYBZNCHZBOTL-UHFFFAOYSA-N 2 1 311.473 4.273 20 0 DIADMP C[NH+](C)CC(C)(C)C[NH2+][C@@H]1CCSc2c(Cl)cccc21 ZINC000359367736 1057007212 /nfs/dbraw/zinc/00/72/12/1057007212.db2.gz DUVZLIJYRCBTRH-CQSZACIVSA-N 2 1 312.910 4.054 20 0 DIADMP C[N@@H+]1CC=C(c2ccc(C(F)(F)F)cc2C[NH+]2CCCC2)CC1 ZINC001241332984 1057017769 /nfs/dbraw/zinc/01/77/69/1057017769.db2.gz OAHGSHCAJJTRIG-UHFFFAOYSA-N 2 1 324.390 4.020 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000360028641 1057018369 /nfs/dbraw/zinc/01/83/69/1057018369.db2.gz GSTQAXMKGGWZJO-XEZPLFJOSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000360028641 1057018372 /nfs/dbraw/zinc/01/83/72/1057018372.db2.gz GSTQAXMKGGWZJO-XEZPLFJOSA-N 2 1 322.905 4.093 20 0 DIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C(C)(C)C ZINC000766003522 1057070630 /nfs/dbraw/zinc/07/06/30/1057070630.db2.gz ARMPHNGGVOXXHN-MRXNPFEDSA-N 2 1 320.496 4.104 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000361964806 1057103412 /nfs/dbraw/zinc/10/34/12/1057103412.db2.gz CKZCFALXBYDORT-WOSRLPQWSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000483708616 1057137828 /nfs/dbraw/zinc/13/78/28/1057137828.db2.gz DDYCCZIEQCDPAF-UIFIKXQLSA-N 2 1 314.517 4.250 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000483708616 1057137830 /nfs/dbraw/zinc/13/78/30/1057137830.db2.gz DDYCCZIEQCDPAF-UIFIKXQLSA-N 2 1 314.517 4.250 20 0 DIADMP C[N@H+]1CC[C@H](c2ccc(-c3cccc(C[NH+]4CCCC4)c3)cc2)C1 ZINC001242119746 1057268959 /nfs/dbraw/zinc/26/89/59/1057268959.db2.gz CQQIBVGMRPFHMG-QFIPXVFZSA-N 2 1 320.480 4.369 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCc2ccco2)cc1 ZINC000658326973 1057373021 /nfs/dbraw/zinc/37/30/21/1057373021.db2.gz LRBSMKXPHPLARC-OAHLLOKOSA-N 2 1 309.413 4.057 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccn1 ZINC000675815951 1057418529 /nfs/dbraw/zinc/41/85/29/1057418529.db2.gz HTOXVVUAJJKXAG-HXUWFJFHSA-N 2 1 315.505 4.310 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCNc2ccccc21 ZINC000347914635 1057534027 /nfs/dbraw/zinc/53/40/27/1057534027.db2.gz HKOUUWIHLZSEGZ-YLJYHZDGSA-N 2 1 315.505 4.178 20 0 DIADMP CC[N@@H+](CCCCC(F)(F)F)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062975 1057555156 /nfs/dbraw/zinc/55/51/56/1057555156.db2.gz NGNQBBIWSWOXNI-UHFFFAOYSA-N 2 1 316.411 4.303 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166484600 1057583468 /nfs/dbraw/zinc/58/34/68/1057583468.db2.gz TYTNYROZMSMPLQ-BHYGNILZSA-N 2 1 304.503 4.076 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-c2ccncc2)cc1 ZINC000161601548 1057597309 /nfs/dbraw/zinc/59/73/09/1057597309.db2.gz XSHRWYVADUXWBM-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP CC[C@H](C)C[N@@H+]1C[C@@H]2CC[NH+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278393490 1058082834 /nfs/dbraw/zinc/08/28/34/1058082834.db2.gz XAFBPMHZPXWJDW-HRCADAONSA-N 2 1 320.443 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1C[C@@H]2CC[N@@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278393490 1058082837 /nfs/dbraw/zinc/08/28/37/1058082837.db2.gz XAFBPMHZPXWJDW-HRCADAONSA-N 2 1 320.443 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1C[C@@H]2CC[N@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278393490 1058082840 /nfs/dbraw/zinc/08/28/40/1058082840.db2.gz XAFBPMHZPXWJDW-HRCADAONSA-N 2 1 320.443 4.019 20 0 DIADMP C[N@H+]1CCCC[C@H]1c1ccc(-c2ccc([C@H]3CCC[NH2+]3)cc2)nc1 ZINC001245349452 1058149764 /nfs/dbraw/zinc/14/97/64/1058149764.db2.gz MNZULLFNIHIBAP-CTNGQTDRSA-N 2 1 321.468 4.330 20 0 DIADMP Cc1cccc2c1cc[nH+]c2NC1CCN(c2cc[nH+]cc2)CC1 ZINC001516473114 1058177984 /nfs/dbraw/zinc/17/79/84/1058177984.db2.gz SWIZGTBDRUGTBI-UHFFFAOYSA-N 2 1 318.424 4.019 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H](c3ccncc3)C3CCC3)CC[NH2+]2)cc1 ZINC001550351849 1058339996 /nfs/dbraw/zinc/33/99/96/1058339996.db2.gz SLDUAVMSHINFEF-QHAWAJNXSA-N 2 1 321.468 4.006 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+][C@H](C2CCC2)C2CCCC2)C1 ZINC001550511507 1058342198 /nfs/dbraw/zinc/34/21/98/1058342198.db2.gz FIJDIZREENZWBG-SQNIBIBYSA-N 2 1 301.478 4.005 20 0 DIADMP Cc1cccc(C2([NH2+][C@H]3CC[C@H](c4[nH+]ccn4C)C3)CCC2)c1 ZINC001550512052 1058342299 /nfs/dbraw/zinc/34/22/99/1058342299.db2.gz QCDOCKFRVZAXSU-WMZOPIPTSA-N 2 1 309.457 4.034 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+][C@H]2CCCC23CCCCC3)C1 ZINC001550515575 1058343342 /nfs/dbraw/zinc/34/33/42/1058343342.db2.gz QKMYOFVCCYTRKE-IKGGRYGDSA-N 2 1 301.478 4.149 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[C@H](c2[nH+]ccn2C)C1)c1cccc(C2CC2)c1 ZINC001550505030 1058343770 /nfs/dbraw/zinc/34/37/70/1058343770.db2.gz GUYVSUQDWSOPIF-JVPBZIDWSA-N 2 1 309.457 4.284 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC001552080698 1058428708 /nfs/dbraw/zinc/42/87/08/1058428708.db2.gz IULZQYVYEHEUDG-YXIVMFJDSA-N 2 1 324.443 4.155 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC001552080696 1058429057 /nfs/dbraw/zinc/42/90/57/1058429057.db2.gz IULZQYVYEHEUDG-OPWVIFHQSA-N 2 1 324.443 4.155 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC001552080695 1058429307 /nfs/dbraw/zinc/42/93/07/1058429307.db2.gz IULZQYVYEHEUDG-BCKAPOECSA-N 2 1 324.443 4.155 20 0 DIADMP FC1CC([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)(c2ccccc2)C1 ZINC001552312469 1058433700 /nfs/dbraw/zinc/43/37/00/1058433700.db2.gz PWABGAUPIBYHBV-RKDVLTNBSA-N 2 1 324.443 4.097 20 0 DIADMP CCCCC[C@H](O)C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246063667 1058659230 /nfs/dbraw/zinc/65/92/30/1058659230.db2.gz BQWFMXDCJQKEFU-UFYCRDLUSA-N 2 1 324.553 4.080 20 0 DIADMP c1ccc(C([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)c2ccccc2)cc1 ZINC001246071205 1058662194 /nfs/dbraw/zinc/66/21/94/1058662194.db2.gz IVZFGVOWPSCLTF-ACDBMABISA-N 2 1 306.453 4.039 20 0 DIADMP Clc1ccc(C2([NH2+][C@@H]3CC[NH2+]C4(CCCCC4)C3)CC2)cc1 ZINC001246075765 1058666188 /nfs/dbraw/zinc/66/61/88/1058666188.db2.gz KFFICYMLVFLZBS-QGZVFWFLSA-N 2 1 318.892 4.374 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076788 1058666838 /nfs/dbraw/zinc/66/68/38/1058666838.db2.gz PNGJRPJSAWGDAT-SJORKVTESA-N 2 1 306.881 4.230 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076573 1058667749 /nfs/dbraw/zinc/66/77/49/1058667749.db2.gz PBXVPVGHLQFXGB-JKSUJKDBSA-N 2 1 306.881 4.085 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246084123 1058669609 /nfs/dbraw/zinc/66/96/09/1058669609.db2.gz WBOVVCUOBPCGBM-WMZOPIPTSA-N 2 1 304.453 4.240 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)s1 ZINC001246085124 1058671091 /nfs/dbraw/zinc/67/10/91/1058671091.db2.gz NHZHEDDKTXQIBS-QAPCUYQASA-N 2 1 318.461 4.087 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)s1 ZINC001246085120 1058671280 /nfs/dbraw/zinc/67/12/80/1058671280.db2.gz NHZHEDDKTXQIBS-CRAIPNDOSA-N 2 1 318.461 4.087 20 0 DIADMP Fc1cc(Cl)cc(C[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246081185 1058672183 /nfs/dbraw/zinc/67/21/83/1058672183.db2.gz QVMSGAOSCIAUEU-INIZCTEOSA-N 2 1 310.844 4.024 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1C[NH2+]CC[C@H]1C ZINC001246119932 1058683487 /nfs/dbraw/zinc/68/34/87/1058683487.db2.gz XYBUIWYEHOGWSK-JBYIUTFZSA-N 2 1 322.496 4.185 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccs2)CC[NH2+]1 ZINC001246114546 1058684076 /nfs/dbraw/zinc/68/40/76/1058684076.db2.gz NNRWIRNLTUAKSM-KMFMINBZSA-N 2 1 318.461 4.340 20 0 DIADMP FC(F)c1cccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246124263 1058687467 /nfs/dbraw/zinc/68/74/67/1058687467.db2.gz DSUXAKGYZHAHBX-QZTJIDSGSA-N 2 1 316.395 4.207 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1Cl ZINC001246162852 1058705119 /nfs/dbraw/zinc/70/51/19/1058705119.db2.gz GRJZWFJYDREPSY-LSDHHAIUSA-N 2 1 306.881 4.446 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CC34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246174498 1058719428 /nfs/dbraw/zinc/71/94/28/1058719428.db2.gz XDOOJQIGMTYEDF-IXHQKZKNSA-N 2 1 324.512 4.286 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CCC2CCCCC2)CC[NH2+]1 ZINC001246177283 1058722988 /nfs/dbraw/zinc/72/29/88/1058722988.db2.gz IKPCGCRWMAFYAC-AZUAARDMSA-N 2 1 318.480 4.487 20 0 DIADMP CC[C@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246190280 1058731066 /nfs/dbraw/zinc/73/10/66/1058731066.db2.gz GINANHNIWUXFFF-ZWKOTPCHSA-N 2 1 310.441 4.099 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(C)c1 ZINC001246185950 1058731309 /nfs/dbraw/zinc/73/13/09/1058731309.db2.gz XLAAMPLIAAQCRW-TZIWHRDSSA-N 2 1 308.469 4.195 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@]1(C)CCC[NH2+]C1 ZINC001246191668 1058733520 /nfs/dbraw/zinc/73/35/20/1058733520.db2.gz WXJFMIIJJPRJFE-BLLLJJGKSA-N 2 1 315.288 4.046 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246197519 1058738188 /nfs/dbraw/zinc/73/81/88/1058738188.db2.gz KXRSVGNGDFLRFQ-ZDUSSCGKSA-N 2 1 313.272 4.066 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]C2c3ccccc3-c3ccccc32)CC[NH2+]1 ZINC001246201444 1058740413 /nfs/dbraw/zinc/74/04/13/1058740413.db2.gz UZUYRNJDBFESKV-FOIQADDNSA-N 2 1 306.453 4.123 20 0 DIADMP Cc1cc(F)cc(C)c1C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246201071 1058742305 /nfs/dbraw/zinc/74/23/05/1058742305.db2.gz UKLOTLWBZMTELK-QUCCMNQESA-N 2 1 312.432 4.025 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(Cl)c(F)c2)C[C@H](CC)[NH2+]1 ZINC001246211463 1058744740 /nfs/dbraw/zinc/74/47/40/1058744740.db2.gz JXVXOCUFAOMRAE-RZFFKMDDSA-N 2 1 312.860 4.439 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]CCC3CCCCCC3)CC[NH2+]2)cc1 ZINC001246230468 1058753721 /nfs/dbraw/zinc/75/37/21/1058753721.db2.gz BLBQCVZBGVOGGL-WOJBJXKFSA-N 2 1 300.490 4.430 20 0 DIADMP COc1ccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246230513 1058754961 /nfs/dbraw/zinc/75/49/61/1058754961.db2.gz BUCKFALNRAHUKJ-ICSRJNTNSA-N 2 1 324.468 4.013 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246235097 1058755970 /nfs/dbraw/zinc/75/59/70/1058755970.db2.gz XTTBGAYMSMXGMM-CJCBUOBESA-N 2 1 306.469 4.342 20 0 DIADMP C=Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)cc1 ZINC001246233816 1058758255 /nfs/dbraw/zinc/75/82/55/1058758255.db2.gz FFSKCOSSVKZZET-FPOVZHCZSA-N 2 1 324.443 4.360 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246240294 1058759934 /nfs/dbraw/zinc/75/99/34/1058759934.db2.gz UHMZWXLYDRMCID-CVEARBPZSA-N 2 1 306.881 4.085 20 0 DIADMP Fc1cc(Cl)ccc1C[NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246236914 1058760471 /nfs/dbraw/zinc/76/04/71/1058760471.db2.gz UMPRNANMSARIIC-OAHLLOKOSA-N 2 1 310.844 4.024 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC001246237900 1058760862 /nfs/dbraw/zinc/76/08/62/1058760862.db2.gz JTOCCTFXORDORW-NJDAHSKKSA-N 2 1 308.469 4.467 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246262007 1058780845 /nfs/dbraw/zinc/78/08/45/1058780845.db2.gz GQEBVPHVIGGHPE-OALUTQOASA-N 2 1 312.432 4.144 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccccc1F ZINC001246271588 1058784879 /nfs/dbraw/zinc/78/48/79/1058784879.db2.gz JXUABMRLDHSJOP-YYAJDYIMSA-N 2 1 304.453 4.176 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccccc1F ZINC001246271584 1058785830 /nfs/dbraw/zinc/78/58/30/1058785830.db2.gz JXUABMRLDHSJOP-MKSNKDDYSA-N 2 1 304.453 4.176 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CC2CCCCCC2)CC[NH2+]1 ZINC001246273971 1058787071 /nfs/dbraw/zinc/78/70/71/1058787071.db2.gz TVUBRCPSENFMQI-QUCCMNQESA-N 2 1 318.480 4.487 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CC2CCCCCC2)CC[NH2+]1 ZINC001246273973 1058787218 /nfs/dbraw/zinc/78/72/18/1058787218.db2.gz TVUBRCPSENFMQI-UYAOXDASSA-N 2 1 318.480 4.487 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246274684 1058789982 /nfs/dbraw/zinc/78/99/82/1058789982.db2.gz ZTQYMYOGAHDYKS-GFOJFJKKSA-N 2 1 324.443 4.073 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccccc1F ZINC001246277267 1058796505 /nfs/dbraw/zinc/79/65/05/1058796505.db2.gz QKWRLNFQMVWPSE-JLSDUUJJSA-N 2 1 306.469 4.423 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccc(F)c(F)c1 ZINC001246282338 1058797809 /nfs/dbraw/zinc/79/78/09/1058797809.db2.gz BKLLQXYYFYMKFC-UKRRQHHQSA-N 2 1 308.416 4.070 20 0 DIADMP [NH3+][C@H](C[NH2+][C@@H]1CCCC2(CCCCC2)C1)Cc1ccccc1 ZINC001246300701 1058813272 /nfs/dbraw/zinc/81/32/72/1058813272.db2.gz UHABAKNFBQWCMK-RBUKOAKNSA-N 2 1 300.490 4.039 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246310040 1058819974 /nfs/dbraw/zinc/81/99/74/1058819974.db2.gz LYSQRTDHTISBDS-CZUORRHYSA-N 2 1 308.897 4.331 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@H](CC)c2ccc(F)cc2F)CC[NH2+]1 ZINC001246316507 1058823727 /nfs/dbraw/zinc/82/37/27/1058823727.db2.gz GXNIKYLUZNHJJS-RLFYNMQTSA-N 2 1 310.432 4.316 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CCC[NH2+][C@@H]1C ZINC001246325280 1058832725 /nfs/dbraw/zinc/83/27/25/1058832725.db2.gz ITWFCPKBJQSBDW-XHBSWPGZSA-N 2 1 315.288 4.045 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1CCC[NH2+][C@@H]1C ZINC001246324902 1058833385 /nfs/dbraw/zinc/83/33/85/1058833385.db2.gz HMVHYIVWHSVUGD-HMFYCAOWSA-N 2 1 322.496 4.327 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+][C@@H]1C[NH2+]CCC1(C)C ZINC001246324791 1058833914 /nfs/dbraw/zinc/83/39/14/1058833914.db2.gz GKLKUECVLRALBR-GOEBONIOSA-N 2 1 324.534 4.048 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](CC(C)C)c2ccccn2)CC[NH2+]1 ZINC001246328098 1058837395 /nfs/dbraw/zinc/83/73/95/1058837395.db2.gz VXEBCNUEIQLBAZ-ZHALLVOQSA-N 2 1 303.494 4.069 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccn1 ZINC001246328516 1058839384 /nfs/dbraw/zinc/83/93/84/1058839384.db2.gz YORRYTGRDCTTRQ-IEBWSBKVSA-N 2 1 315.505 4.213 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[C@H](C)[NH2+]C1 ZINC001246328644 1058839564 /nfs/dbraw/zinc/83/95/64/1058839564.db2.gz YBALOINAFCGXKD-GLQYFDAESA-N 2 1 315.288 4.045 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](CC(C)C)c2ccccn2)CC[NH2+]1 ZINC001246328099 1058839854 /nfs/dbraw/zinc/83/98/54/1058839854.db2.gz VXEBCNUEIQLBAZ-ZIFCJYIRSA-N 2 1 303.494 4.069 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CC23CCCCC3)CC[NH2+]1 ZINC001246333548 1058841250 /nfs/dbraw/zinc/84/12/50/1058841250.db2.gz JVTFJCVZQSENFL-YTQUADARSA-N 2 1 316.464 4.240 20 0 DIADMP C[NH2+]CC[C@@H](C)[NH2+]Cc1ccccc1Oc1ccc(Cl)cc1 ZINC001246332551 1058841327 /nfs/dbraw/zinc/84/13/27/1058841327.db2.gz HITDLGDIBSWFHB-CQSZACIVSA-N 2 1 318.848 4.220 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246330997 1058841845 /nfs/dbraw/zinc/84/18/45/1058841845.db2.gz AVEQQSJIVRYDMA-ZQNRLITLSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CC23CCCCC3)CC[NH2+]1 ZINC001246333547 1058843107 /nfs/dbraw/zinc/84/31/07/1058843107.db2.gz JVTFJCVZQSENFL-WDSOQIARSA-N 2 1 316.464 4.240 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+][C@@H](C[NH3+])C(C)(C)C ZINC001246345373 1058857273 /nfs/dbraw/zinc/85/72/73/1058857273.db2.gz MDBRBOFGXJKKSG-HIFRSBDPSA-N 2 1 312.523 4.033 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC001246346023 1058857534 /nfs/dbraw/zinc/85/75/34/1058857534.db2.gz LOLNBIIIFKBOQP-DGEVVOEJSA-N 2 1 320.480 4.080 20 0 DIADMP Cc1ccc(Cl)c(C[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246345186 1058858574 /nfs/dbraw/zinc/85/85/74/1058858574.db2.gz VGMGPRQBOBKRCX-MRXNPFEDSA-N 2 1 306.881 4.193 20 0 DIADMP CC[C@H]1CC([NH2+][C@@H](C)c2ccc(C)c(F)c2F)C[C@H](CC)[NH2+]1 ZINC001246348303 1058859599 /nfs/dbraw/zinc/85/95/99/1058859599.db2.gz IZMVVQISPGHAIH-IHRRRGAJSA-N 2 1 310.432 4.233 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](C)CC2)CC[NH2+]1 ZINC001246363641 1058870594 /nfs/dbraw/zinc/87/05/94/1058870594.db2.gz QYOLWRVKKXHAFU-TWILYEHCSA-N 2 1 304.453 4.096 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246370678 1058875142 /nfs/dbraw/zinc/87/51/42/1058875142.db2.gz FXISSSARWNASDW-CZAAIQMYSA-N 2 1 308.469 4.393 20 0 DIADMP CC1CCC([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)CC1 ZINC001246373373 1058878692 /nfs/dbraw/zinc/87/86/92/1058878692.db2.gz HIEABJZFZLWKDM-UHFFFAOYSA-N 2 1 306.881 4.087 20 0 DIADMP CCCCCC[C@@H](C)[NH2+]C1(c2ccccc2OC)CC[NH2+]CC1 ZINC001246375707 1058881498 /nfs/dbraw/zinc/88/14/98/1058881498.db2.gz JISDKPDMUWGKOV-QGZVFWFLSA-N 2 1 318.505 4.222 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C[C@@H]1C ZINC001246378889 1058884067 /nfs/dbraw/zinc/88/40/67/1058884067.db2.gz VEWZDUMVMZRVMI-PMPSAXMXSA-N 2 1 320.908 4.333 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246390614 1058895986 /nfs/dbraw/zinc/89/59/86/1058895986.db2.gz FASJHVOIOAKNOZ-MNEFBYGVSA-N 2 1 318.480 4.423 20 0 DIADMP Fc1ccccc1[C@H](CC1CCC1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246405221 1058906738 /nfs/dbraw/zinc/90/67/38/1058906738.db2.gz OPZFPBBCKBRPIL-XLSPSMHOSA-N 2 1 316.464 4.320 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246404077 1058906999 /nfs/dbraw/zinc/90/69/99/1058906999.db2.gz LYTRUEUXMJWGLN-YJBOKZPZSA-N 2 1 304.453 4.177 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246404074 1058907315 /nfs/dbraw/zinc/90/73/15/1058907315.db2.gz LYTRUEUXMJWGLN-CRAIPNDOSA-N 2 1 304.453 4.177 20 0 DIADMP Cc1cccc(C2([NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)CCC2)c1 ZINC001246415018 1058919486 /nfs/dbraw/zinc/91/94/86/1058919486.db2.gz WZEPSVIKDJIOSY-SFTDATJTSA-N 2 1 320.480 4.457 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+][C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246453233 1058939586 /nfs/dbraw/zinc/93/95/86/1058939586.db2.gz AYONPBZRAQNVMJ-MWDXBVQZSA-N 2 1 304.478 4.045 20 0 DIADMP Cc1ccc(C2([NH2+][C@H]3CC[C@H](C)[NH2+]C3)CCC(F)(F)CC2)cc1 ZINC001246454140 1058940994 /nfs/dbraw/zinc/94/09/94/1058940994.db2.gz DBOWZOHIYXHBRG-RDJZCZTQSA-N 2 1 322.443 4.130 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](c2cccnc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246455782 1058941331 /nfs/dbraw/zinc/94/13/31/1058941331.db2.gz HOYRKTMHURPUPX-IVSAIRAKSA-N 2 1 321.896 4.085 20 0 DIADMP Cc1ccc(C2([NH2+][C@@H]3CC[C@@H](C)[NH2+]C3)CCC(F)(F)CC2)cc1 ZINC001246454139 1058941983 /nfs/dbraw/zinc/94/19/83/1058941983.db2.gz DBOWZOHIYXHBRG-NVXWUHKLSA-N 2 1 322.443 4.130 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C[NH2+]1 ZINC001246459549 1058943034 /nfs/dbraw/zinc/94/30/34/1058943034.db2.gz BAJPCOBQPNQACB-GJZGRUSLSA-N 3 1 300.471 4.186 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C[NH2+]1 ZINC001246459547 1058945007 /nfs/dbraw/zinc/94/50/07/1058945007.db2.gz BAJPCOBQPNQACB-CABCVRRESA-N 3 1 300.471 4.186 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cn2)C2CC2)CC[NH2+]1 ZINC001246457554 1058946433 /nfs/dbraw/zinc/94/64/33/1058946433.db2.gz NEMVXBHDDOVKOQ-RYRKJORJSA-N 2 1 321.896 4.087 20 0 DIADMP CC(C)(C)[PH+](CCC[NH2+][C@@H]1CCCCNC1)C(C)(C)C ZINC001246461510 1058947963 /nfs/dbraw/zinc/94/79/63/1058947963.db2.gz KYPCZNTXONXCMA-OAHLLOKOSA-N 2 1 300.471 4.187 20 0 DIADMP CC(C)(C)[PH+](CCCN[C@@H]1CCCC[NH2+]C1)C(C)(C)C ZINC001246461510 1058947979 /nfs/dbraw/zinc/94/79/79/1058947979.db2.gz KYPCZNTXONXCMA-OAHLLOKOSA-N 2 1 300.471 4.187 20 0 DIADMP CC(C)(C)[PH+](CCC[NH2+][C@H]1CCCCNC1)C(C)(C)C ZINC001246461509 1058949324 /nfs/dbraw/zinc/94/93/24/1058949324.db2.gz KYPCZNTXONXCMA-HNNXBMFYSA-N 2 1 300.471 4.187 20 0 DIADMP CC(C)(C)[PH+](CCCN[C@H]1CCCC[NH2+]C1)C(C)(C)C ZINC001246461509 1058949338 /nfs/dbraw/zinc/94/93/38/1058949338.db2.gz KYPCZNTXONXCMA-HNNXBMFYSA-N 2 1 300.471 4.187 20 0 DIADMP CC(C)[NH2+]CC[NH2+][C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001246460834 1058951121 /nfs/dbraw/zinc/95/11/21/1058951121.db2.gz OABLXTPESSQAJN-SFHVURJKSA-N 2 1 310.485 4.185 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2OC)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246466854 1058951746 /nfs/dbraw/zinc/95/17/46/1058951746.db2.gz BKXLJRAUBUNSLO-CLWJZODNSA-N 2 1 316.489 4.045 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]CC[C@H]2CC[NH2+]CC2(F)F)CC1 ZINC001246484681 1058961875 /nfs/dbraw/zinc/96/18/75/1058961875.db2.gz YPGBCEUNXCWQPM-HWOWSKLDSA-N 2 1 316.480 4.206 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246491006 1058965608 /nfs/dbraw/zinc/96/56/08/1058965608.db2.gz RLYWEBNSIMGIQY-GIVPXCGWSA-N 2 1 306.453 4.065 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)cc(Cl)c2)CC[NH2+]1 ZINC001246491977 1058966109 /nfs/dbraw/zinc/96/61/09/1058966109.db2.gz UYYPFFPGIDNBGN-JLZZUVOBSA-N 2 1 312.860 4.441 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]C(c2cccs2)c2cccs2)CC[NH2+]1 ZINC001246507464 1058976937 /nfs/dbraw/zinc/97/69/37/1058976937.db2.gz BOWIWXCRALEOIT-ZIAGYGMSSA-N 2 1 320.527 4.265 20 0 DIADMP c1ccc(C2CCC([N@H+]3CCCC4(CC[NH2+]CC4)C3)CC2)cc1 ZINC001246520951 1058983533 /nfs/dbraw/zinc/98/35/33/1058983533.db2.gz BKNLGAUFLFIBTK-UHFFFAOYSA-N 2 1 312.501 4.178 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246521953 1058984230 /nfs/dbraw/zinc/98/42/30/1058984230.db2.gz DAUKLRWWNJPZEX-HXUWFJFHSA-N 2 1 320.480 4.383 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(C)c2)C[C@H](CC)[NH2+]1 ZINC001246536438 1058985808 /nfs/dbraw/zinc/98/58/08/1058985808.db2.gz FLMCZNFNDLESLV-YRPNKDGESA-N 2 1 300.490 4.441 20 0 DIADMP CCC[N@H+]([C@H](C)CC)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532120 1058987216 /nfs/dbraw/zinc/98/72/16/1058987216.db2.gz XRENZFGLFJYJID-HHXXYDBFSA-N 2 1 306.469 4.438 20 0 DIADMP CCC[N@@H+]([C@H](C)CC)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532120 1058987231 /nfs/dbraw/zinc/98/72/31/1058987231.db2.gz XRENZFGLFJYJID-HHXXYDBFSA-N 2 1 306.469 4.438 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(C)c2)CC[NH2+]1 ZINC001246542658 1058992179 /nfs/dbraw/zinc/99/21/79/1058992179.db2.gz WRIFSFWBDJCMJC-VAMGGRTRSA-N 2 1 300.490 4.443 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CCN[C@H](c2ccccc2)C1 ZINC001246551536 1058996726 /nfs/dbraw/zinc/99/67/26/1058996726.db2.gz ZOLGGBYPYHCFBW-BSIFCXSSSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246551536 1058996748 /nfs/dbraw/zinc/99/67/48/1058996748.db2.gz ZOLGGBYPYHCFBW-BSIFCXSSSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246551536 1058996770 /nfs/dbraw/zinc/99/67/70/1058996770.db2.gz ZOLGGBYPYHCFBW-BSIFCXSSSA-N 2 1 306.453 4.099 20 0 DIADMP C[NH2+]CC[C@H](C)[N@H+]1CC=C(c2cc(Cl)cc(Cl)c2)CC1 ZINC001246547810 1058997859 /nfs/dbraw/zinc/99/78/59/1058997859.db2.gz GHWNJFURKLQGBO-LBPRGKRZSA-N 2 1 313.272 4.081 20 0 DIADMP C[NH2+]CC[C@H](C)[N@@H+]1CC=C(c2cc(Cl)cc(Cl)c2)CC1 ZINC001246547810 1058997876 /nfs/dbraw/zinc/99/78/76/1058997876.db2.gz GHWNJFURKLQGBO-LBPRGKRZSA-N 2 1 313.272 4.081 20 0 DIADMP C[C@@]1([NH3+])CCC[N@H+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001246549162 1058999290 /nfs/dbraw/zinc/99/92/90/1058999290.db2.gz HNHXECNVMGVZLD-VEDCXYSMSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CCC[C@H](c3ccccc3)C2)CCC[C@@H]1C[NH3+] ZINC001246566963 1059002643 /nfs/dbraw/zinc/00/26/43/1059002643.db2.gz KFWMZLXNSOOJHZ-GSEOLPGOSA-N 2 1 300.490 4.020 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@H](C[NH3+])[C@H]1C ZINC001246565167 1059004103 /nfs/dbraw/zinc/00/41/03/1059004103.db2.gz OUCUGYXWZIXEDT-BZUAXINKSA-N 2 1 324.534 4.129 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246561226 1059004339 /nfs/dbraw/zinc/00/43/39/1059004339.db2.gz JMAPEFPRSRMLRT-KURKYZTESA-N 2 1 304.453 4.129 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2C[C@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246573530 1059007353 /nfs/dbraw/zinc/00/73/53/1059007353.db2.gz RSYWSAIAWIDVRJ-CIWUYKSXSA-N 2 1 316.464 4.049 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001246584998 1059010266 /nfs/dbraw/zinc/01/02/66/1059010266.db2.gz NQDUFWSLGKYUIP-UXHICEINSA-N 2 1 302.506 4.239 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001246575551 1059011529 /nfs/dbraw/zinc/01/15/29/1059011529.db2.gz JRRNTHRGELMOEM-HSALFYBXSA-N 2 1 300.490 4.164 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[NH2+]1 ZINC001246573533 1059011851 /nfs/dbraw/zinc/01/18/51/1059011851.db2.gz RSYWSAIAWIDVRJ-YTXYEVPYSA-N 2 1 316.464 4.049 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001246584996 1059012487 /nfs/dbraw/zinc/01/24/87/1059012487.db2.gz NQDUFWSLGKYUIP-PMACEKPBSA-N 2 1 302.506 4.239 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001246581769 1059013807 /nfs/dbraw/zinc/01/38/07/1059013807.db2.gz AMEAVHPKDGXVOO-FXAWDEMLSA-N 2 1 302.506 4.033 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001246589249 1059014776 /nfs/dbraw/zinc/01/47/76/1059014776.db2.gz DQPGACQIQSFIGA-MSOLQXFVSA-N 2 1 320.546 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCCCC2)C[C@H](C)[NH2+]1 ZINC001246595803 1059016454 /nfs/dbraw/zinc/01/64/54/1059016454.db2.gz IRIOQANTKNMFRZ-XEMDLRDOSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001246595160 1059018804 /nfs/dbraw/zinc/01/88/04/1059018804.db2.gz RNUWTWZPCWQCPF-AQNXPRMDSA-N 2 1 300.490 4.164 20 0 DIADMP c1ccc(C[N@@H+](C2CCCCC2)[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246596941 1059022329 /nfs/dbraw/zinc/02/23/29/1059022329.db2.gz KQIANUVEEINWRI-KXTWHKPSSA-N 2 1 312.501 4.494 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246605467 1059022521 /nfs/dbraw/zinc/02/25/21/1059022521.db2.gz JWBMRATZCLOYRN-LEWJYISDSA-N 2 1 314.517 4.252 20 0 DIADMP c1ccc(C2CCC([N@@H+]3CCC[C@]34CCC[NH2+]CC4)CC2)cc1 ZINC001246604076 1059023506 /nfs/dbraw/zinc/02/35/06/1059023506.db2.gz GTMGFCDPBHKFIT-CBNMVNINSA-N 2 1 312.501 4.321 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001246597034 1059024416 /nfs/dbraw/zinc/02/44/16/1059024416.db2.gz WFCUOSFHZJNJOV-LEWJYISDSA-N 2 1 316.533 4.496 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246602908 1059024597 /nfs/dbraw/zinc/02/45/97/1059024597.db2.gz DTYYJDRUDWCRSO-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246609165 1059027356 /nfs/dbraw/zinc/02/73/56/1059027356.db2.gz XQRMKXGLQROVGF-KDOFPFPSSA-N 2 1 324.871 4.018 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CCC[C@@]4(CC[NH2+]4)C3)CC2)cc1 ZINC001246610256 1059028838 /nfs/dbraw/zinc/02/88/38/1059028838.db2.gz MBMIELMLCJUXDV-NKELODKYSA-N 2 1 318.892 4.194 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CCC[C@@]4(CC[NH2+]4)C3)CC2)cc1 ZINC001246610256 1059028866 /nfs/dbraw/zinc/02/88/66/1059028866.db2.gz MBMIELMLCJUXDV-NKELODKYSA-N 2 1 318.892 4.194 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@H+]3CCC[C@@]4(CCC[NH2+]C4)C3)C2)cc1 ZINC001246610641 1059029409 /nfs/dbraw/zinc/02/94/09/1059029409.db2.gz QSMTZDDAIMYWJT-NJDAHSKKSA-N 2 1 312.501 4.178 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246608642 1059029727 /nfs/dbraw/zinc/02/97/27/1059029727.db2.gz USPQPGRSATYXNM-RDTXWAMCSA-N 2 1 324.871 4.018 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246608934 1059029995 /nfs/dbraw/zinc/02/99/95/1059029995.db2.gz WBYAQCZQDZKYRM-LEWJYISDSA-N 2 1 314.517 4.396 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001246615206 1059033115 /nfs/dbraw/zinc/03/31/15/1059033115.db2.gz QUCJPPDCNUBMSW-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001246619363 1059034009 /nfs/dbraw/zinc/03/40/09/1059034009.db2.gz LWLCUPAERRXSPC-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CCC[C@]4(CCC[NH2+]4)C3)CC2)cc1 ZINC001246619811 1059034931 /nfs/dbraw/zinc/03/49/31/1059034931.db2.gz MMEKGOMZBRQQAF-XVAXZDLZSA-N 2 1 312.501 4.006 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2CCC3(CCC3)CC2)CC[NH2+]1 ZINC001246623504 1059035018 /nfs/dbraw/zinc/03/50/18/1059035018.db2.gz UEGQAOBYIVSBEM-IEBWSBKVSA-N 2 1 316.464 4.193 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246633873 1059036307 /nfs/dbraw/zinc/03/63/07/1059036307.db2.gz MZQJXOKEEGHACU-KDOFPFPSSA-N 2 1 324.871 4.018 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246633873 1059036326 /nfs/dbraw/zinc/03/63/26/1059036326.db2.gz MZQJXOKEEGHACU-KDOFPFPSSA-N 2 1 324.871 4.018 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001246625779 1059036889 /nfs/dbraw/zinc/03/68/89/1059036889.db2.gz UNJZHPVCMJRUAS-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP CC(C)CC(CC(C)C)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246624418 1059039490 /nfs/dbraw/zinc/03/94/90/1059039490.db2.gz PKXDYQRUDHTCTO-FQEVSTJZSA-N 2 1 314.517 4.136 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@H+]2CC[C@]3(C2)CCCC[NH2+]3)CC1 ZINC001246628972 1059039984 /nfs/dbraw/zinc/03/99/84/1059039984.db2.gz ZGCWHYUVSKQFRV-VTLFHKLASA-N 2 1 324.512 4.031 20 0 DIADMP CCCCC[C@H](CC)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625694 1059040945 /nfs/dbraw/zinc/04/09/45/1059040945.db2.gz RZJUREOZOOKECD-OALUTQOASA-N 2 1 300.490 4.034 20 0 DIADMP CCCCC(CCCC)[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001246639301 1059043693 /nfs/dbraw/zinc/04/36/93/1059043693.db2.gz PNBZLHOXLPZXEG-INIZCTEOSA-N 2 1 302.453 4.056 20 0 DIADMP C1C[NH2+][C@@]2(C1)CCC[N@@H+](C1CCC3(CCCCC3)CC1)CC2 ZINC001246635372 1059043781 /nfs/dbraw/zinc/04/37/81/1059043781.db2.gz QVUOPWPHDWLUPW-FQEVSTJZSA-N 2 1 304.522 4.488 20 0 DIADMP C1C[NH2+][C@@]2(C1)CCC[N@H+](C1CCC3(CCCCC3)CC1)CC2 ZINC001246635372 1059043804 /nfs/dbraw/zinc/04/38/04/1059043804.db2.gz QVUOPWPHDWLUPW-FQEVSTJZSA-N 2 1 304.522 4.488 20 0 DIADMP CCCCCC[C@H](CCC)[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001246637005 1059044692 /nfs/dbraw/zinc/04/46/92/1059044692.db2.gz IJSFZTYPITYBKG-DLBZAZTESA-N 2 1 316.480 4.446 20 0 DIADMP CCCCCC[C@@H](CCC)[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001246637011 1059044890 /nfs/dbraw/zinc/04/48/90/1059044890.db2.gz IJSFZTYPITYBKG-IAGOWNOFSA-N 2 1 316.480 4.446 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001246649119 1059048299 /nfs/dbraw/zinc/04/82/99/1059048299.db2.gz VIYBJOWXTBEOIF-CQSZACIVSA-N 2 1 324.871 4.018 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001246649119 1059048315 /nfs/dbraw/zinc/04/83/15/1059048315.db2.gz VIYBJOWXTBEOIF-CQSZACIVSA-N 2 1 324.871 4.018 20 0 DIADMP Clc1ccc(C2CCC([NH+]3CCC4(CC[NH2+]4)CC3)CC2)cc1 ZINC001246646467 1059049776 /nfs/dbraw/zinc/04/97/76/1059049776.db2.gz FFDVMUZNFRRQAC-UHFFFAOYSA-N 2 1 318.892 4.194 20 0 DIADMP c1ccc(C[C@H]2C[C@@H]([NH+]3CCC4(CCCC4)CC3)CC[NH2+]2)cc1 ZINC001246654275 1059051941 /nfs/dbraw/zinc/05/19/41/1059051941.db2.gz JNXABMNHGVMNMH-PMACEKPBSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@@H+]3CCCC[C@@]34CCC[NH2+]C4)C2)cc1 ZINC001246651516 1059052604 /nfs/dbraw/zinc/05/26/04/1059052604.db2.gz LXRGHEIKRGFHFP-NJYVYQBISA-N 2 1 312.501 4.321 20 0 DIADMP CCCC[C@@H](CC)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246675922 1059057155 /nfs/dbraw/zinc/05/71/55/1059057155.db2.gz BKXHYHIOZIZUJR-VAMGGRTRSA-N 2 1 300.490 4.034 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001246662961 1059058394 /nfs/dbraw/zinc/05/83/94/1059058394.db2.gz WLQNFQLFOBCTHD-GHTZIAJQSA-N 2 1 314.517 4.170 20 0 DIADMP CCCCC1CC[NH+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246681733 1059060923 /nfs/dbraw/zinc/06/09/23/1059060923.db2.gz PUYWCPWNHWGDHT-WOJBJXKFSA-N 2 1 300.490 4.382 20 0 DIADMP CCCCC1CC[NH+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246681727 1059061907 /nfs/dbraw/zinc/06/19/07/1059061907.db2.gz PUYWCPWNHWGDHT-PMACEKPBSA-N 2 1 300.490 4.382 20 0 DIADMP CC1(C)CCC[C@H]([N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)C1 ZINC001246682468 1059062057 /nfs/dbraw/zinc/06/20/57/1059062057.db2.gz CXMCQUBTFPVEIF-ZVDOUQERSA-N 2 1 312.501 4.034 20 0 DIADMP CC[C@H](CC(C)C)[N@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246683289 1059062500 /nfs/dbraw/zinc/06/25/00/1059062500.db2.gz IFUIJJUNWREXMD-NJDAHSKKSA-N 2 1 314.517 4.064 20 0 DIADMP CC1(C)CCC([N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001246677361 1059065789 /nfs/dbraw/zinc/06/57/89/1059065789.db2.gz DFJDVIKZECMJQU-TZIWHRDSSA-N 2 1 312.501 4.034 20 0 DIADMP C[N@@H+](C1CC[NH2+]CC1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246695689 1059066948 /nfs/dbraw/zinc/06/69/48/1059066948.db2.gz QBKJWSIHTMRIGY-UHFFFAOYSA-N 2 1 306.881 4.050 20 0 DIADMP CCCC[N@H+](CCC)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246774800 1059071795 /nfs/dbraw/zinc/07/17/95/1059071795.db2.gz GUHHHUKLSHLCQK-IEBWSBKVSA-N 2 1 306.469 4.439 20 0 DIADMP CCCC[N@@H+](CCC)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246774800 1059071819 /nfs/dbraw/zinc/07/18/19/1059071819.db2.gz GUHHHUKLSHLCQK-IEBWSBKVSA-N 2 1 306.469 4.439 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](c3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246774592 1059072893 /nfs/dbraw/zinc/07/28/93/1059072893.db2.gz FXWKBBBQMFSXAZ-YSTOQKLRSA-N 2 1 300.490 4.175 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCCCC[C@@H]2C)CC[NH2+]1 ZINC001246767247 1059074137 /nfs/dbraw/zinc/07/41/37/1059074137.db2.gz AWHBVMDHQDQYRK-WDYCEAGBSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCCCC[C@@H]2C)CC[NH2+]1 ZINC001246767247 1059074161 /nfs/dbraw/zinc/07/41/61/1059074161.db2.gz AWHBVMDHQDQYRK-WDYCEAGBSA-N 2 1 304.453 4.192 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246769403 1059075698 /nfs/dbraw/zinc/07/56/98/1059075698.db2.gz JTVBWKYGEJCKNA-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H](c3ccccc3)C2)C[C@@H](CC)[NH2+]1 ZINC001246774585 1059075813 /nfs/dbraw/zinc/07/58/13/1059075813.db2.gz FXWKBBBQMFSXAZ-GUDVDZBRSA-N 2 1 300.490 4.175 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246771202 1059076095 /nfs/dbraw/zinc/07/60/95/1059076095.db2.gz WKBWSLJKOSGWRN-QGZVFWFLSA-N 2 1 306.881 4.227 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H](Cc3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246776769 1059081346 /nfs/dbraw/zinc/08/13/46/1059081346.db2.gz PBJXJCCXALZFOF-CGXNFDGLSA-N 2 1 314.517 4.250 20 0 DIADMP c1ccc([C@@H]2CCC[N@@H+](C3CCC4(CCC[NH2+]C4)CC3)C2)cc1 ZINC001246781991 1059082166 /nfs/dbraw/zinc/08/21/66/1059082166.db2.gz ZNFULJHOCCYANO-QNGMFEMESA-N 2 1 312.501 4.178 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783854 1059084663 /nfs/dbraw/zinc/08/46/63/1059084663.db2.gz QILIASOQZSTOOE-CRAIPNDOSA-N 2 1 318.461 4.121 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+](C)Cc2cccs2)CC[NH2+]1 ZINC001246783854 1059084685 /nfs/dbraw/zinc/08/46/85/1059084685.db2.gz QILIASOQZSTOOE-CRAIPNDOSA-N 2 1 318.461 4.121 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001246784143 1059084849 /nfs/dbraw/zinc/08/48/49/1059084849.db2.gz FEHYXBZOVGJUGK-ROUUACIJSA-N 2 1 318.892 4.399 20 0 DIADMP c1csc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246786609 1059086796 /nfs/dbraw/zinc/08/67/96/1059086796.db2.gz MDLYHASMVKBCFM-JKSUJKDBSA-N 2 1 304.503 4.340 20 0 DIADMP c1ccc(C[C@@H]2CC[N@@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246791643 1059089389 /nfs/dbraw/zinc/08/93/89/1059089389.db2.gz LKTAXNZUADDJRK-BVSLBCMMSA-N 2 1 320.480 4.044 20 0 DIADMP c1ccc(C[C@@H]2CC[N@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246791643 1059089411 /nfs/dbraw/zinc/08/94/11/1059089411.db2.gz LKTAXNZUADDJRK-BVSLBCMMSA-N 2 1 320.480 4.044 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246791935 1059090220 /nfs/dbraw/zinc/09/02/20/1059090220.db2.gz ZIEHGHYHVZFLDM-MHORFTMASA-N 2 1 304.865 4.150 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2F)C[C@H](CC)[NH2+]1 ZINC001246794598 1059094332 /nfs/dbraw/zinc/09/43/32/1059094332.db2.gz GDIXYIVSTIBNNL-RCJHGTSTSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793661 1059094973 /nfs/dbraw/zinc/09/49/73/1059094973.db2.gz WAILJPZQLDHZQL-OLMNPRSZSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793661 1059094991 /nfs/dbraw/zinc/09/49/91/1059094991.db2.gz WAILJPZQLDHZQL-OLMNPRSZSA-N 2 1 322.443 4.268 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246794213 1059095491 /nfs/dbraw/zinc/09/54/91/1059095491.db2.gz XKGPKYQAAREALB-BORJPKMPSA-N 2 1 304.865 4.150 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2F)CC[NH2+]1 ZINC001246793059 1059098251 /nfs/dbraw/zinc/09/82/51/1059098251.db2.gz ALJGYBQAIHUFFT-JLSDUUJJSA-N 2 1 304.453 4.129 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001246795256 1059099088 /nfs/dbraw/zinc/09/90/88/1059099088.db2.gz IQKZPQRYEGPBCC-HXUWFJFHSA-N 2 1 302.506 4.109 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246801064 1059099958 /nfs/dbraw/zinc/09/99/58/1059099958.db2.gz YLRZPJXTZFRXFA-UIFIKXQLSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246801064 1059099978 /nfs/dbraw/zinc/09/99/78/1059099978.db2.gz YLRZPJXTZFRXFA-UIFIKXQLSA-N 2 1 324.443 4.456 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246796062 1059101082 /nfs/dbraw/zinc/10/10/82/1059101082.db2.gz KUOFTFOXXRCWSX-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246796062 1059101090 /nfs/dbraw/zinc/10/10/90/1059101090.db2.gz KUOFTFOXXRCWSX-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246801187 1059101284 /nfs/dbraw/zinc/10/12/84/1059101284.db2.gz RYWNWEGPHVZHCC-HKBOAZHASA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246801187 1059101286 /nfs/dbraw/zinc/10/12/86/1059101286.db2.gz RYWNWEGPHVZHCC-HKBOAZHASA-N 2 1 324.443 4.456 20 0 DIADMP CC[N@@H+]([C@H](C)CC(C)(C)SCc1ccco1)C1CC[NH2+]CC1 ZINC001246799047 1059101453 /nfs/dbraw/zinc/10/14/53/1059101453.db2.gz WBTOQBUXKRGCJQ-OAHLLOKOSA-N 2 1 324.534 4.144 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246803506 1059102440 /nfs/dbraw/zinc/10/24/40/1059102440.db2.gz YRXSZDQTDMQAHA-SQNIBIBYSA-N 2 1 304.453 4.129 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@@H](C)C[C@@H]2C)CC[NH2+]1 ZINC001246812399 1059105132 /nfs/dbraw/zinc/10/51/32/1059105132.db2.gz ZTZPXEDEIHDVHX-PBYMTVQHSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@@H](C)C[C@@H]2C)CC[NH2+]1 ZINC001246812399 1059105142 /nfs/dbraw/zinc/10/51/42/1059105142.db2.gz ZTZPXEDEIHDVHX-PBYMTVQHSA-N 2 1 304.453 4.048 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@H+]([C@H]2CCC3(C2)CC[NH2+]CC3)C1 ZINC001246809331 1059105247 /nfs/dbraw/zinc/10/52/47/1059105247.db2.gz IDTAGIXHEBTXOB-HOTGVXAUSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+]([C@H]2CCC3(C2)CC[NH2+]CC3)C1 ZINC001246809330 1059106182 /nfs/dbraw/zinc/10/61/82/1059106182.db2.gz IDTAGIXHEBTXOB-CVEARBPZSA-N 2 1 318.892 4.052 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H]3CCC[C@@H]32)CCN1 ZINC001246818217 1059109472 /nfs/dbraw/zinc/10/94/72/1059109472.db2.gz AOSNHAPNNDLTNZ-BEKAIBRUSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246818217 1059109489 /nfs/dbraw/zinc/10/94/89/1059109489.db2.gz AOSNHAPNNDLTNZ-BEKAIBRUSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246818217 1059109509 /nfs/dbraw/zinc/10/95/09/1059109509.db2.gz AOSNHAPNNDLTNZ-BEKAIBRUSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H]3CCC[C@@H]32)CCN1 ZINC001246818222 1059110482 /nfs/dbraw/zinc/11/04/82/1059110482.db2.gz AOSNHAPNNDLTNZ-RKOGWWSCSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246818222 1059110486 /nfs/dbraw/zinc/11/04/86/1059110486.db2.gz AOSNHAPNNDLTNZ-RKOGWWSCSA-N 2 1 316.464 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H]3CCC[C@@H]32)CC[NH2+]1 ZINC001246818222 1059110493 /nfs/dbraw/zinc/11/04/93/1059110493.db2.gz AOSNHAPNNDLTNZ-RKOGWWSCSA-N 2 1 316.464 4.192 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826348 1059111739 /nfs/dbraw/zinc/11/17/39/1059111739.db2.gz WVOKABUWORYFSU-MELADBBJSA-N 2 1 312.910 4.315 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826348 1059111746 /nfs/dbraw/zinc/11/17/46/1059111746.db2.gz WVOKABUWORYFSU-MELADBBJSA-N 2 1 312.910 4.315 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826344 1059112416 /nfs/dbraw/zinc/11/24/16/1059112416.db2.gz WVOKABUWORYFSU-HZSPNIEDSA-N 2 1 312.910 4.315 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826344 1059112427 /nfs/dbraw/zinc/11/24/27/1059112427.db2.gz WVOKABUWORYFSU-HZSPNIEDSA-N 2 1 312.910 4.315 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCc3cc(Cl)ccc3C2)C[C@H](CC)[NH2+]1 ZINC001246835648 1059113774 /nfs/dbraw/zinc/11/37/74/1059113774.db2.gz KYTGXORPQMUOLC-BCDXTJNWSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCc3cc(Cl)ccc3C2)C[C@H](CC)[NH2+]1 ZINC001246835648 1059113783 /nfs/dbraw/zinc/11/37/83/1059113783.db2.gz KYTGXORPQMUOLC-BCDXTJNWSA-N 2 1 306.881 4.007 20 0 DIADMP CCC(CC)[N@H+](CC)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246839493 1059118222 /nfs/dbraw/zinc/11/82/22/1059118222.db2.gz IVBBEBFNTLBYOH-PKOBYXMFSA-N 2 1 306.469 4.438 20 0 DIADMP CCC(CC)[N@@H+](CC)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246839493 1059118229 /nfs/dbraw/zinc/11/82/29/1059118229.db2.gz IVBBEBFNTLBYOH-PKOBYXMFSA-N 2 1 306.469 4.438 20 0 DIADMP [NH3+][C@@H]1[C@@H]2CC[C@H]1C[N@@H+](C1CCC(c3ccc(Cl)cc3)CC1)C2 ZINC001246841646 1059118488 /nfs/dbraw/zinc/11/84/88/1059118488.db2.gz NUURBOLLFIEFHY-MFYDLUHHSA-N 2 1 318.892 4.035 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841214 1059118945 /nfs/dbraw/zinc/11/89/45/1059118945.db2.gz NAHGFPYKURNEJU-PKOBYXMFSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841214 1059118953 /nfs/dbraw/zinc/11/89/53/1059118953.db2.gz NAHGFPYKURNEJU-PKOBYXMFSA-N 2 1 304.453 4.049 20 0 DIADMP CC[N@H+](Cc1cccc(OC)c1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838713 1059119830 /nfs/dbraw/zinc/11/98/30/1059119830.db2.gz FEPATKHOFDXSJJ-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1cccc(OC)c1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838713 1059119841 /nfs/dbraw/zinc/11/98/41/1059119841.db2.gz FEPATKHOFDXSJJ-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP COc1ccccc1[C@H](C)[N@H+](C)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841581 1059119880 /nfs/dbraw/zinc/11/98/80/1059119880.db2.gz UVCSCBMLSLNPRW-IRXDYDNUSA-N 2 1 316.489 4.143 20 0 DIADMP COc1ccccc1[C@H](C)[N@@H+](C)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246841581 1059119888 /nfs/dbraw/zinc/11/98/88/1059119888.db2.gz UVCSCBMLSLNPRW-IRXDYDNUSA-N 2 1 316.489 4.143 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845526 1059121485 /nfs/dbraw/zinc/12/14/85/1059121485.db2.gz OOUVPVULLSOYSJ-MOPGFXCFSA-N 2 1 324.468 4.441 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845526 1059121502 /nfs/dbraw/zinc/12/15/02/1059121502.db2.gz OOUVPVULLSOYSJ-MOPGFXCFSA-N 2 1 324.468 4.441 20 0 DIADMP CCc1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246845206 1059121806 /nfs/dbraw/zinc/12/18/06/1059121806.db2.gz LNGQNXAYUCBGBT-RTWAWAEBSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246845206 1059121819 /nfs/dbraw/zinc/12/18/19/1059121819.db2.gz LNGQNXAYUCBGBT-RTWAWAEBSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246844434 1059123280 /nfs/dbraw/zinc/12/32/80/1059123280.db2.gz YWYGWPYLNBHKEQ-HATOLVCRSA-N 2 1 322.496 4.260 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246848838 1059126366 /nfs/dbraw/zinc/12/63/66/1059126366.db2.gz YFZIQVDQJKBCLX-ROUUACIJSA-N 2 1 306.881 4.084 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846703 1059126452 /nfs/dbraw/zinc/12/64/52/1059126452.db2.gz PZVRTOGCHPNVPB-ICSRJNTNSA-N 2 1 318.480 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846703 1059126459 /nfs/dbraw/zinc/12/64/59/1059126459.db2.gz PZVRTOGCHPNVPB-ICSRJNTNSA-N 2 1 318.480 4.439 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246846477 1059126527 /nfs/dbraw/zinc/12/65/27/1059126527.db2.gz ALPNFBJCVCUJOK-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2CC[C@]2([NH3+])C1 ZINC001246849763 1059126563 /nfs/dbraw/zinc/12/65/63/1059126563.db2.gz AYKCAYNDOYBYIO-ZNLUXHQJSA-N 2 1 320.480 4.020 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246847208 1059127552 /nfs/dbraw/zinc/12/75/52/1059127552.db2.gz JWVCKYOUAXMANF-HLAWJBBLSA-N 2 1 324.443 4.374 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246847208 1059127560 /nfs/dbraw/zinc/12/75/60/1059127560.db2.gz JWVCKYOUAXMANF-HLAWJBBLSA-N 2 1 324.443 4.374 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246848826 1059127617 /nfs/dbraw/zinc/12/76/17/1059127617.db2.gz WSFOYDWFANPUOA-NXYGQSRBSA-N 2 1 306.881 4.179 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846702 1059127669 /nfs/dbraw/zinc/12/76/69/1059127669.db2.gz PZVRTOGCHPNVPB-AZUAARDMSA-N 2 1 318.480 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+](C)CC2CCCCC2)CC[NH2+]1 ZINC001246846702 1059127675 /nfs/dbraw/zinc/12/76/75/1059127675.db2.gz PZVRTOGCHPNVPB-AZUAARDMSA-N 2 1 318.480 4.439 20 0 DIADMP C1C[N@H+](C2CCC3(CCC[NH2+]C3)CC2)C[C@@H]1C1CCCCC1 ZINC001246847073 1059127730 /nfs/dbraw/zinc/12/77/30/1059127730.db2.gz ICELZKSBVUCXDH-XEVCZEQESA-N 2 1 304.522 4.201 20 0 DIADMP CC[C@@H]1CC([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)C[C@@H](CC)[NH2+]1 ZINC001246848777 1059128025 /nfs/dbraw/zinc/12/80/25/1059128025.db2.gz DZTDJYQBXHXWNL-CGTJXYLNSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]1CC[NH3+] ZINC001246848396 1059128131 /nfs/dbraw/zinc/12/81/31/1059128131.db2.gz UZYKTVRRWZBUSX-RXVVDRJESA-N 2 1 322.496 4.410 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)C[C@H](CC)[NH2+]1 ZINC001246848781 1059128552 /nfs/dbraw/zinc/12/85/52/1059128552.db2.gz DZTDJYQBXHXWNL-OQIJWPOYSA-N 2 1 320.908 4.439 20 0 DIADMP Clc1cccc2c1CC[N@H+](C1CCC3(CC[NH2+]CC3)CC1)C2 ZINC001246847672 1059129774 /nfs/dbraw/zinc/12/97/74/1059129774.db2.gz KTUYONYKRKVBGS-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)C1CCC2(CC[NH2+]C2)CC1 ZINC001246849060 1059129948 /nfs/dbraw/zinc/12/99/48/1059129948.db2.gz PVJVFASGHNBSIO-NNGSBXSVSA-N 2 1 306.881 4.255 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+]([C@H]3CCC4(C3)CC[NH2+]CC4)C2)cc1 ZINC001246855183 1059132579 /nfs/dbraw/zinc/13/25/79/1059132579.db2.gz VXVBADJADFKYNV-AEFFLSMTSA-N 2 1 318.892 4.052 20 0 DIADMP F[C@H]1CCC2(C1)CC[NH+]([C@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246850641 1059133328 /nfs/dbraw/zinc/13/33/28/1059133328.db2.gz CGCTUQVVGDMDTL-IRXDYDNUSA-N 2 1 308.485 4.046 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+](C3CCC4(CC[NH2+]C4)CC3)C2)cc1 ZINC001246853036 1059133356 /nfs/dbraw/zinc/13/33/56/1059133356.db2.gz QXFXJUWMXPUZCV-IPJUCJBFSA-N 2 1 318.892 4.052 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@@H+]3CC[C@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851055 1059133628 /nfs/dbraw/zinc/13/36/28/1059133628.db2.gz YDDPYZRMBWKFKT-ACRUOGEOSA-N 2 1 312.501 4.382 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@H+]3CC[C@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851055 1059133639 /nfs/dbraw/zinc/13/36/39/1059133639.db2.gz YDDPYZRMBWKFKT-ACRUOGEOSA-N 2 1 312.501 4.382 20 0 DIADMP CCCC[C@H](CC)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246859181 1059136328 /nfs/dbraw/zinc/13/63/28/1059136328.db2.gz IVUZDOXMVFGKOO-SFHVURJKSA-N 2 1 300.490 4.092 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1C1CCC2(CCC[NH2+]C2)CC1 ZINC001246866309 1059136927 /nfs/dbraw/zinc/13/69/27/1059136927.db2.gz JEVTWFFJUDAKGK-VEDCXYSMSA-N 2 1 312.501 4.308 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@H+]([C@@H](C)CC(c2ccccc2)c2ccccc2)C1 ZINC001246861667 1059137712 /nfs/dbraw/zinc/13/77/12/1059137712.db2.gz CUUNZTXTCXKBFW-OALUTQOASA-N 2 1 322.496 4.138 20 0 DIADMP c1ccc(C2=CC[N@@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)CC2)cc1 ZINC001246858597 1059138324 /nfs/dbraw/zinc/13/83/24/1059138324.db2.gz LKEACAJYIUGZMM-FQEVSTJZSA-N 2 1 310.485 4.231 20 0 DIADMP c1ccc(C[C@H]2C[C@H]([N@H+]3CCC[C@@H]3c3ccccc3)CC[NH2+]2)cc1 ZINC001246866795 1059138368 /nfs/dbraw/zinc/13/83/68/1059138368.db2.gz FBOGUIHOMKJARI-BHDDXSALSA-N 2 1 320.480 4.187 20 0 DIADMP c1ccc2c(c1)C[N@@H+](C1CCCCCCC1)CC21CC[NH2+]CC1 ZINC001246865193 1059138429 /nfs/dbraw/zinc/13/84/29/1059138429.db2.gz YNTNOYUGDHOIJO-UHFFFAOYSA-N 2 1 312.501 4.236 20 0 DIADMP CC[N@H+](Cc1cccc(F)c1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246858885 1059138484 /nfs/dbraw/zinc/13/84/84/1059138484.db2.gz CULZRHPBVUDLHC-VQTJNVASSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246858885 1059138492 /nfs/dbraw/zinc/13/84/92/1059138492.db2.gz CULZRHPBVUDLHC-VQTJNVASSA-N 2 1 312.432 4.141 20 0 DIADMP CCCCC[C@H](C)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246857524 1059138782 /nfs/dbraw/zinc/13/87/82/1059138782.db2.gz ALAYHISXXMJKCC-KRWDZBQOSA-N 2 1 300.490 4.092 20 0 DIADMP c1ccc(C[C@H]2C[C@H]([N@@H+](Cc3ccccc3)C3CC3)CC[NH2+]2)cc1 ZINC001246861086 1059138816 /nfs/dbraw/zinc/13/88/16/1059138816.db2.gz QIDQLRQAIUJOLD-RBBKRZOGSA-N 2 1 320.480 4.014 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246870063 1059140279 /nfs/dbraw/zinc/14/02/79/1059140279.db2.gz YIHZGVZJNTUYEJ-BAGYTPMASA-N 2 1 320.480 4.489 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246870063 1059140299 /nfs/dbraw/zinc/14/02/99/1059140299.db2.gz YIHZGVZJNTUYEJ-BAGYTPMASA-N 2 1 320.480 4.489 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246870581 1059140778 /nfs/dbraw/zinc/14/07/78/1059140778.db2.gz YMLKQOMQWFKXGE-QXAKKESOSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3[C@H]2CC)CC[NH2+]1 ZINC001246867651 1059141964 /nfs/dbraw/zinc/14/19/64/1059141964.db2.gz PTRFSBNXZRUWSA-WSTZPKSXSA-N 2 1 300.490 4.307 20 0 DIADMP CC[N@H+](Cc1ccc(OC)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246876079 1059145471 /nfs/dbraw/zinc/14/54/71/1059145471.db2.gz AQZOWKLBRXPDNM-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246876079 1059145482 /nfs/dbraw/zinc/14/54/82/1059145482.db2.gz AQZOWKLBRXPDNM-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@H+](Cc1cccs1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246880441 1059145562 /nfs/dbraw/zinc/14/55/62/1059145562.db2.gz DZAPMYPAZLBBSK-WMZOPIPTSA-N 2 1 300.471 4.063 20 0 DIADMP CC[N@@H+](Cc1cccs1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246880441 1059145568 /nfs/dbraw/zinc/14/55/68/1059145568.db2.gz DZAPMYPAZLBBSK-WMZOPIPTSA-N 2 1 300.471 4.063 20 0 DIADMP CC[N@H+](Cc1cccs1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246880440 1059146394 /nfs/dbraw/zinc/14/63/94/1059146394.db2.gz DZAPMYPAZLBBSK-SJLPKXTDSA-N 2 1 300.471 4.063 20 0 DIADMP CC[N@@H+](Cc1cccs1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246880440 1059146409 /nfs/dbraw/zinc/14/64/09/1059146409.db2.gz DZAPMYPAZLBBSK-SJLPKXTDSA-N 2 1 300.471 4.063 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)C1CCC2(CC[NH2+]C2)CC1 ZINC001246880218 1059147135 /nfs/dbraw/zinc/14/71/35/1059147135.db2.gz RSKHQZFSHNGDER-UHFFFAOYSA-N 2 1 324.871 4.223 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCC(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246884076 1059148543 /nfs/dbraw/zinc/14/85/43/1059148543.db2.gz SLJHJWPJQCGICY-RXVVDRJESA-N 2 1 322.496 4.281 20 0 DIADMP C[N@@H+](CCC(c1ccccc1)c1ccccc1)[C@H]1CCC[NH2+]CC1 ZINC001246884744 1059149038 /nfs/dbraw/zinc/14/90/38/1059149038.db2.gz VDJNFQZOCACFMR-NRFANRHFSA-N 2 1 322.496 4.283 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899749 1059158810 /nfs/dbraw/zinc/15/88/10/1059158810.db2.gz FYWITXUYHOGEEH-LDDOYCOJSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2c(F)cccc2F)C[C@H](CC)[NH2+]1 ZINC001246899749 1059158818 /nfs/dbraw/zinc/15/88/18/1059158818.db2.gz FYWITXUYHOGEEH-LDDOYCOJSA-N 2 1 322.443 4.411 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)CCCC[NH3+] ZINC001246894125 1059159287 /nfs/dbraw/zinc/15/92/87/1059159287.db2.gz RTMMYMKNINVYGS-SFHVURJKSA-N 2 1 310.485 4.268 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](CCC)C1CC[NH2+]CC1 ZINC001246897450 1059159764 /nfs/dbraw/zinc/15/97/64/1059159764.db2.gz KIRJIJWRKLFEAL-IBGZPJMESA-N 2 1 302.506 4.252 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001246899026 1059159933 /nfs/dbraw/zinc/15/99/33/1059159933.db2.gz CCYKYFJXZWKBQD-OAQYLSRUSA-N 2 1 323.484 4.179 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246893404 1059160023 /nfs/dbraw/zinc/16/00/23/1059160023.db2.gz JMAPEFPRSRMLRT-KZNAEPCWSA-N 2 1 304.453 4.129 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246896717 1059160834 /nfs/dbraw/zinc/16/08/34/1059160834.db2.gz ZSZVJMZWFKDXPQ-SFTDATJTSA-N 2 1 308.469 4.194 20 0 DIADMP Fc1cccc(F)c1[C@@H]1CCC[N@H+]1[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246902759 1059164554 /nfs/dbraw/zinc/16/45/54/1059164554.db2.gz UIDIRYKGOATXOK-UCLAIMLFSA-N 2 1 320.427 4.024 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@H+]3CCSc4ccccc4C3)CCN2)cc1 ZINC001246904842 1059164672 /nfs/dbraw/zinc/16/46/72/1059164672.db2.gz JHZQJIVWAYOSLK-MOPGFXCFSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@@H]2C[C@H](N3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904842 1059164676 /nfs/dbraw/zinc/16/46/76/1059164676.db2.gz JHZQJIVWAYOSLK-MOPGFXCFSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904842 1059164681 /nfs/dbraw/zinc/16/46/81/1059164681.db2.gz JHZQJIVWAYOSLK-MOPGFXCFSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904842 1059164685 /nfs/dbraw/zinc/16/46/85/1059164685.db2.gz JHZQJIVWAYOSLK-MOPGFXCFSA-N 2 1 324.493 4.088 20 0 DIADMP Fc1cccc(F)c1[C@@H]1CCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246901338 1059164785 /nfs/dbraw/zinc/16/47/85/1059164785.db2.gz MCQQWPCDWLMAST-YOEHRIQHSA-N 2 1 320.427 4.024 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1Cl)[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246905792 1059166134 /nfs/dbraw/zinc/16/61/34/1059166134.db2.gz GUYVQIMJZCYDIB-KCPJHIHWSA-N 2 1 315.288 4.126 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](CC)Cc2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC001246906985 1059166306 /nfs/dbraw/zinc/16/63/06/1059166306.db2.gz SZLFAFVZKBAVBP-HZPDHXFCSA-N 2 1 314.395 4.058 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905958 1059167009 /nfs/dbraw/zinc/16/70/09/1059167009.db2.gz PCMOJTXDMHVNGQ-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905958 1059167024 /nfs/dbraw/zinc/16/70/24/1059167024.db2.gz PCMOJTXDMHVNGQ-SJLPKXTDSA-N 2 1 310.441 4.051 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC001246907831 1059167084 /nfs/dbraw/zinc/16/70/84/1059167084.db2.gz JVBDWSMBKMGIBX-SFTDATJTSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC001246907831 1059167103 /nfs/dbraw/zinc/16/71/03/1059167103.db2.gz JVBDWSMBKMGIBX-SFTDATJTSA-N 2 1 308.469 4.229 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246905721 1059167595 /nfs/dbraw/zinc/16/75/95/1059167595.db2.gz AZAZIVRUAIHFCM-RBUKOAKNSA-N 2 1 302.506 4.292 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1C ZINC001246907085 1059168612 /nfs/dbraw/zinc/16/86/12/1059168612.db2.gz HZFSLVHFTWTIAI-YADHBBJMSA-N 2 1 322.496 4.099 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246910466 1059170196 /nfs/dbraw/zinc/17/01/96/1059170196.db2.gz UBSONXRETLPHIS-LSDHHAIUSA-N 2 1 306.881 4.255 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246908790 1059171188 /nfs/dbraw/zinc/17/11/88/1059171188.db2.gz NBEHVKFQSSDWOA-UXHICEINSA-N 2 1 300.490 4.048 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([N@@H+](Cc3ccccc3)C3CCC([NH3+])CC3)C[C@@H]21 ZINC001246912047 1059172264 /nfs/dbraw/zinc/17/22/64/1059172264.db2.gz QKPVLGDVRCKJBM-ZYUSWAADSA-N 2 1 312.501 4.193 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246908793 1059172534 /nfs/dbraw/zinc/17/25/34/1059172534.db2.gz NBEHVKFQSSDWOA-VQTJNVASSA-N 2 1 300.490 4.048 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1(C)CC[NH2+]CC1 ZINC001246914225 1059174222 /nfs/dbraw/zinc/17/42/22/1059174222.db2.gz ZYWFANBCXNUVOH-OAHLLOKOSA-N 2 1 324.534 4.144 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932438 1059179323 /nfs/dbraw/zinc/17/93/23/1059179323.db2.gz AKKYKMWFULBBIK-PKOBYXMFSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932438 1059179330 /nfs/dbraw/zinc/17/93/30/1059179330.db2.gz AKKYKMWFULBBIK-PKOBYXMFSA-N 2 1 316.464 4.193 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932146 1059180889 /nfs/dbraw/zinc/18/08/89/1059180889.db2.gz FIKCSNOFFDOURJ-IAGOWNOFSA-N 2 1 318.480 4.001 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246934936 1059182928 /nfs/dbraw/zinc/18/29/28/1059182928.db2.gz DCXXALPSLYGNLR-CVEARBPZSA-N 2 1 312.567 4.151 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246938316 1059184130 /nfs/dbraw/zinc/18/41/30/1059184130.db2.gz OZUQMIQQNNSEHT-UXHICEINSA-N 2 1 314.517 4.252 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246938320 1059184721 /nfs/dbraw/zinc/18/47/21/1059184721.db2.gz OZUQMIQQNNSEHT-VQTJNVASSA-N 2 1 314.517 4.252 20 0 DIADMP CC[N@@H+](C[C@@H]1CC[NH2+]C1)[C@H](C)CC(C)(C)SCc1ccco1 ZINC001246934362 1059184986 /nfs/dbraw/zinc/18/49/86/1059184986.db2.gz CPSBWNRPZGVDKD-HZPDHXFCSA-N 2 1 324.534 4.001 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@@H](C(C)C)C2)c1 ZINC001246943549 1059191314 /nfs/dbraw/zinc/19/13/14/1059191314.db2.gz LSKFRQZDTOAXEP-AQNXPRMDSA-N 2 1 300.490 4.217 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246945308 1059191518 /nfs/dbraw/zinc/19/15/18/1059191518.db2.gz GMYBOVUDXONSBI-OAHLLOKOSA-N 2 1 322.924 4.371 20 0 DIADMP CC1CCC([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)CC1 ZINC001246949637 1059192915 /nfs/dbraw/zinc/19/29/15/1059192915.db2.gz BICLZWIWJLWILZ-UHFFFAOYSA-N 2 1 320.908 4.473 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CC[NH2+]CC2)[C@@H]2CCC[C@H](C)C2)c1 ZINC001246950702 1059194219 /nfs/dbraw/zinc/19/42/19/1059194219.db2.gz DWBGBKGQTMSJNH-MGPUTAFESA-N 2 1 318.480 4.267 20 0 DIADMP Clc1ccc(C[N@@H+](C2CCCCC2)C2CC[NH2+]CC2)cc1 ZINC001246947025 1059194398 /nfs/dbraw/zinc/19/43/98/1059194398.db2.gz RWVXKNVCUYCJJC-UHFFFAOYSA-N 2 1 306.881 4.227 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CC[NH2+]CC2)[C@@H]2CCC[C@@H](C)C2)c1 ZINC001246950701 1059195605 /nfs/dbraw/zinc/19/56/05/1059195605.db2.gz DWBGBKGQTMSJNH-FOIQADDNSA-N 2 1 318.480 4.267 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246953444 1059198518 /nfs/dbraw/zinc/19/85/18/1059198518.db2.gz CCFUHBKHASHZRX-INIZCTEOSA-N 2 1 310.432 4.098 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956178 1059199442 /nfs/dbraw/zinc/19/94/42/1059199442.db2.gz QPRPPPSAFGGNPB-RDTXWAMCSA-N 2 1 322.443 4.098 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956178 1059199455 /nfs/dbraw/zinc/19/94/55/1059199455.db2.gz QPRPPPSAFGGNPB-RDTXWAMCSA-N 2 1 322.443 4.098 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246953445 1059200167 /nfs/dbraw/zinc/20/01/67/1059200167.db2.gz CCFUHBKHASHZRX-MRXNPFEDSA-N 2 1 310.432 4.098 20 0 DIADMP CC1CCC([N@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)CC1 ZINC001246953457 1059200664 /nfs/dbraw/zinc/20/06/64/1059200664.db2.gz CIYVCXGMWGAGLH-UHFFFAOYSA-N 2 1 322.443 4.098 20 0 DIADMP CC1CCC([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)CC1 ZINC001246953457 1059200685 /nfs/dbraw/zinc/20/06/85/1059200685.db2.gz CIYVCXGMWGAGLH-UHFFFAOYSA-N 2 1 322.443 4.098 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001246952843 1059201717 /nfs/dbraw/zinc/20/17/17/1059201717.db2.gz XWTQTFOSIPTLQY-MRXNPFEDSA-N 2 1 306.469 4.267 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956187 1059202302 /nfs/dbraw/zinc/20/23/02/1059202302.db2.gz QRIPJFXTTDHCJL-PBHICJAKSA-N 2 1 322.443 4.098 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246956829 1059205807 /nfs/dbraw/zinc/20/58/07/1059205807.db2.gz WAYMSGBJTBBSAX-RHSMWYFYSA-N 2 1 322.443 4.098 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246966491 1059213917 /nfs/dbraw/zinc/21/39/17/1059213917.db2.gz UQNFRYJQOXRNLD-GUDVDZBRSA-N 2 1 318.505 4.346 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@@](C)(C[NH3+])C1 ZINC001246965629 1059214300 /nfs/dbraw/zinc/21/43/00/1059214300.db2.gz HLNUOCVKLPYUGO-AVRDEDQJSA-N 2 1 322.496 4.268 20 0 DIADMP C([C@H]1CCC[NH2+]C1)[N@@H+](C1CC1)[C@H]1CCCC2(CCCCC2)C1 ZINC001246971886 1059218229 /nfs/dbraw/zinc/21/82/29/1059218229.db2.gz ISVVNHHDBLVTLV-HKUYNNGSSA-N 2 1 304.522 4.344 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CCC[NH2+]CC1 ZINC001246975378 1059218300 /nfs/dbraw/zinc/21/83/00/1059218300.db2.gz CVUXFSCMFAZGCA-VQTJNVASSA-N 2 1 302.506 4.252 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CC[NH2+][C@H](C)C1 ZINC001246975274 1059218977 /nfs/dbraw/zinc/21/89/77/1059218977.db2.gz BNSDPRXJMGOJIA-RLLQIKCJSA-N 2 1 302.506 4.250 20 0 DIADMP c1ccc(CC[C@@H]2CCC[N@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)[NH2+]4)C2)cc1 ZINC001246981449 1059222154 /nfs/dbraw/zinc/22/21/54/1059222154.db2.gz WMEQOJVOLLOKPE-BURNTYAHSA-N 2 1 312.501 4.004 20 0 DIADMP c1ccc(CC[C@H]2CCC[N@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)[NH2+]4)C2)cc1 ZINC001246981452 1059222751 /nfs/dbraw/zinc/22/27/51/1059222751.db2.gz WMEQOJVOLLOKPE-MXEMCNAFSA-N 2 1 312.501 4.004 20 0 DIADMP CSCC[C@@H](C)[N@@H+](Cc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246977145 1059224178 /nfs/dbraw/zinc/22/41/78/1059224178.db2.gz ZSAJEZUCQPTWPR-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246998174 1059227104 /nfs/dbraw/zinc/22/71/04/1059227104.db2.gz BALAGPVWKNZMPJ-IYWMVGAKSA-N 2 1 318.480 4.142 20 0 DIADMP C[NH2+]CC[C@H](C)[N@@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC001246993545 1059227844 /nfs/dbraw/zinc/22/78/44/1059227844.db2.gz TZMTUFUOZHUNNA-XJKSGUPXSA-N 2 1 314.395 4.230 20 0 DIADMP C[NH2+]CC[C@H](C)[N@H+]1CCCC[C@@H]1c1ccccc1C(F)(F)F ZINC001246993545 1059227862 /nfs/dbraw/zinc/22/78/62/1059227862.db2.gz TZMTUFUOZHUNNA-XJKSGUPXSA-N 2 1 314.395 4.230 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2Cc2ccc(F)cc2)CC[NH2+]1 ZINC001247006235 1059232842 /nfs/dbraw/zinc/23/28/42/1059232842.db2.gz UTIDLTSYUKHMNV-AABGKKOBSA-N 2 1 318.480 4.143 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)CC[NH2+]1 ZINC001247006236 1059235184 /nfs/dbraw/zinc/23/51/84/1059235184.db2.gz UTIDLTSYUKHMNV-AQNXPRMDSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@@H]([NH3+])C[C@H]1C ZINC001247000694 1059235772 /nfs/dbraw/zinc/23/57/72/1059235772.db2.gz WPKAVRSTUNBUAJ-HLIPFELVSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]([NH3+])C[C@H]1C ZINC001247000694 1059235794 /nfs/dbraw/zinc/23/57/94/1059235794.db2.gz WPKAVRSTUNBUAJ-HLIPFELVSA-N 2 1 308.469 4.019 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc3ccccc3o2)CC1 ZINC001559489007 1059264419 /nfs/dbraw/zinc/26/44/19/1059264419.db2.gz BDJDVMVDFLHVFQ-UHFFFAOYSA-N 2 1 314.473 4.377 20 0 DIADMP C[C@@H](CCSc1ccccc1)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001559568555 1059396232 /nfs/dbraw/zinc/39/62/32/1059396232.db2.gz ZQECWUJTIONOKJ-ZWKOTPCHSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@@H](CCSc1ccccc1)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC001559568555 1059396244 /nfs/dbraw/zinc/39/62/44/1059396244.db2.gz ZQECWUJTIONOKJ-ZWKOTPCHSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@@H](CCSc1ccccc1)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC001559568555 1059396267 /nfs/dbraw/zinc/39/62/67/1059396267.db2.gz ZQECWUJTIONOKJ-ZWKOTPCHSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@H](CCSc1ccccc1)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001559568552 1059397555 /nfs/dbraw/zinc/39/75/55/1059397555.db2.gz ZQECWUJTIONOKJ-MSOLQXFVSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@H](CCSc1ccccc1)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC001559568552 1059397576 /nfs/dbraw/zinc/39/75/76/1059397576.db2.gz ZQECWUJTIONOKJ-MSOLQXFVSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@H](CCSc1ccccc1)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC001559568552 1059397599 /nfs/dbraw/zinc/39/75/99/1059397599.db2.gz ZQECWUJTIONOKJ-MSOLQXFVSA-N 2 1 320.546 4.364 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@H]1CCN(C)[C@@H](C)C1 ZINC001559584263 1059415796 /nfs/dbraw/zinc/41/57/96/1059415796.db2.gz GTZHKZWJPCZCEG-NJAFHUGGSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1 ZINC001559584263 1059415808 /nfs/dbraw/zinc/41/58/08/1059415808.db2.gz GTZHKZWJPCZCEG-NJAFHUGGSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1 ZINC001559584263 1059415818 /nfs/dbraw/zinc/41/58/18/1059415818.db2.gz GTZHKZWJPCZCEG-NJAFHUGGSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001559584263 1059415829 /nfs/dbraw/zinc/41/58/29/1059415829.db2.gz GTZHKZWJPCZCEG-NJAFHUGGSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001559584263 1059415845 /nfs/dbraw/zinc/41/58/45/1059415845.db2.gz GTZHKZWJPCZCEG-NJAFHUGGSA-N 2 1 320.546 4.138 20 0 DIADMP CC(C)(C)CC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594634 1059427140 /nfs/dbraw/zinc/42/71/40/1059427140.db2.gz RXQOYLCICASASE-UXHICEINSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594634 1059427153 /nfs/dbraw/zinc/42/71/53/1059427153.db2.gz RXQOYLCICASASE-UXHICEINSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594634 1059427166 /nfs/dbraw/zinc/42/71/66/1059427166.db2.gz RXQOYLCICASASE-UXHICEINSA-N 2 1 314.517 4.409 20 0 DIADMP CC[C@@H]1C[C@H]1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001559594327 1059427288 /nfs/dbraw/zinc/42/72/88/1059427288.db2.gz MZVBUROPSTWRHI-CGXNFDGLSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001559594327 1059427298 /nfs/dbraw/zinc/42/72/98/1059427298.db2.gz MZVBUROPSTWRHI-CGXNFDGLSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@H]1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001559594327 1059427308 /nfs/dbraw/zinc/42/73/08/1059427308.db2.gz MZVBUROPSTWRHI-CGXNFDGLSA-N 2 1 312.501 4.019 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CC4CCCC4)CC[C@H]32)cc1 ZINC001559594755 1059428917 /nfs/dbraw/zinc/42/89/17/1059428917.db2.gz TVRDHPIFMPZJNT-NHCUHLMSSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CC4CCCC4)CC[C@H]32)cc1 ZINC001559594755 1059428922 /nfs/dbraw/zinc/42/89/22/1059428922.db2.gz TVRDHPIFMPZJNT-NHCUHLMSSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CC4CCCC4)CC[C@H]32)cc1 ZINC001559594755 1059428928 /nfs/dbraw/zinc/42/89/28/1059428928.db2.gz TVRDHPIFMPZJNT-NHCUHLMSSA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)[NH2+][C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559634398 1059461952 /nfs/dbraw/zinc/46/19/52/1059461952.db2.gz NQYZRMJAEGUMSF-MISYRCLQSA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)[NH2+][C@@H]1CCC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559634398 1059461956 /nfs/dbraw/zinc/46/19/56/1059461956.db2.gz NQYZRMJAEGUMSF-MISYRCLQSA-N 2 1 300.490 4.033 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](CC1CCCC1)c1ccccc1 ZINC001559703139 1059529327 /nfs/dbraw/zinc/52/93/27/1059529327.db2.gz NWALICFANBHEID-FQEVSTJZSA-N 2 1 311.473 4.264 20 0 DIADMP CCC(C)(C)CC[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001559711689 1059537644 /nfs/dbraw/zinc/53/76/44/1059537644.db2.gz QNTFTSYWBLPORL-UHFFFAOYSA-N 2 1 317.521 4.446 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCCC1(C)C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737881 1059570872 /nfs/dbraw/zinc/57/08/72/1059570872.db2.gz PSVHPVQTJNQIBI-BZSNNMDCSA-N 2 1 306.538 4.445 20 0 DIADMP CC[NH+](CC)CCC[NH+]1CCC(c2cccc(Cl)c2)CC1 ZINC001559783510 1059618290 /nfs/dbraw/zinc/61/82/90/1059618290.db2.gz RBVLZWFTHLFYBL-UHFFFAOYSA-N 2 1 308.897 4.251 20 0 DIADMP Cc1c(C)c(C)c(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c(C)c1C ZINC001559864278 1059685531 /nfs/dbraw/zinc/68/55/31/1059685531.db2.gz ZNRZQFHWQJBSJI-NRFANRHFSA-N 2 1 314.517 4.146 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c(C)c1C ZINC001559864278 1059685537 /nfs/dbraw/zinc/68/55/37/1059685537.db2.gz ZNRZQFHWQJBSJI-NRFANRHFSA-N 2 1 314.517 4.146 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c(C)c1C ZINC001559864278 1059685546 /nfs/dbraw/zinc/68/55/46/1059685546.db2.gz ZNRZQFHWQJBSJI-NRFANRHFSA-N 2 1 314.517 4.146 20 0 DIADMP c1cc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc(C[NH+]2CCCCC2)c1 ZINC001559942647 1059757543 /nfs/dbraw/zinc/75/75/43/1059757543.db2.gz IKYIVFJFLIXTDH-SFTDATJTSA-N 2 1 312.501 4.437 20 0 DIADMP FC1(F)CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC001560004131 1059811969 /nfs/dbraw/zinc/81/19/69/1059811969.db2.gz VPSXWYJZIPHWCU-UHFFFAOYSA-N 2 1 322.443 4.294 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1cccc(Cl)c1)CC(C)C ZINC001560025954 1059841459 /nfs/dbraw/zinc/84/14/59/1059841459.db2.gz LQXHFLBUFPFKIB-UHFFFAOYSA-N 2 1 319.880 4.393 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1cccc(Cl)c1)CC(C)C ZINC001560025954 1059841484 /nfs/dbraw/zinc/84/14/84/1059841484.db2.gz LQXHFLBUFPFKIB-UHFFFAOYSA-N 2 1 319.880 4.393 20 0 DIADMP CCCC[N@@H+](Cc1ccnc(F)c1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001560035889 1059850404 /nfs/dbraw/zinc/85/04/04/1059850404.db2.gz KHNZPAFXUJZGPT-UHFFFAOYSA-N 2 1 321.484 4.132 20 0 DIADMP CC[N@@H+](CC[C@@H]1C[C@H]1C1CC1)Cc1ccc(C[NH+](C)C)cc1 ZINC001560043157 1059856674 /nfs/dbraw/zinc/85/66/74/1059856674.db2.gz PGGFUSYDGJSZCA-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP CC1(C[N@H+]2C[C@]3(C)C[NH+](Cc4ccccc4)C[C@]3(C)C2)CCC1 ZINC001560071712 1059887697 /nfs/dbraw/zinc/88/76/97/1059887697.db2.gz FGTLPIQYQTYAJY-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP CC1(C[N@@H+]2C[C@]3(C)C[NH+](Cc4ccccc4)C[C@]3(C)C2)CCC1 ZINC001560071712 1059887723 /nfs/dbraw/zinc/88/77/23/1059887723.db2.gz FGTLPIQYQTYAJY-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP CC1(C[NH+]2C[C@]3(C)C[N@@H+](Cc4ccccc4)C[C@]3(C)C2)CCC1 ZINC001560071712 1059887752 /nfs/dbraw/zinc/88/77/52/1059887752.db2.gz FGTLPIQYQTYAJY-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP CC1(C[NH+]2C[C@]3(C)C[N@H+](Cc4ccccc4)C[C@]3(C)C2)CCC1 ZINC001560071712 1059887775 /nfs/dbraw/zinc/88/77/75/1059887775.db2.gz FGTLPIQYQTYAJY-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP CSc1ccccc1C[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001560100869 1059910104 /nfs/dbraw/zinc/91/01/04/1059910104.db2.gz XBARSYSUZZHHTL-UHFFFAOYSA-N 2 1 306.519 4.106 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CCN(c3cc[nH+]cc3)[C@@H](C)C2)C[C@@H](C)C1 ZINC001560109185 1059915850 /nfs/dbraw/zinc/91/58/50/1059915850.db2.gz VQZBYKQQUQNVBT-ZSYWTGECSA-N 2 1 315.505 4.055 20 0 DIADMP C[C@H]1CC(CC[N@H+]2CCN(c3cc[nH+]cc3)[C@H](C)C2)C[C@H](C)C1 ZINC001560109184 1059916883 /nfs/dbraw/zinc/91/68/83/1059916883.db2.gz VQZBYKQQUQNVBT-KZNAEPCWSA-N 2 1 315.505 4.055 20 0 DIADMP CCc1ccc(C[NH+]2CCC(C)([NH+]3CCCCC3)CC2)cc1 ZINC001560126798 1059930072 /nfs/dbraw/zinc/93/00/72/1059930072.db2.gz QRYGBGGDKYDXHD-UHFFFAOYSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cccc2[nH]c(C[NH2+]CCC[N@H+](C)C3CCCCC3)cc21 ZINC001560246062 1060008093 /nfs/dbraw/zinc/00/80/93/1060008093.db2.gz DZSXZFCLNZXSDM-UHFFFAOYSA-N 2 1 313.489 4.221 20 0 DIADMP CCc1cccc(F)c1C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560269587 1060042288 /nfs/dbraw/zinc/04/22/88/1060042288.db2.gz JBXDGFIKTPVUBY-CALCHBBNSA-N 2 1 320.496 4.236 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001560272232 1060047832 /nfs/dbraw/zinc/04/78/32/1060047832.db2.gz ZTMXDIYPIBCSTI-GOEBONIOSA-N 2 1 304.478 4.064 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC001560272232 1060047850 /nfs/dbraw/zinc/04/78/50/1060047850.db2.gz ZTMXDIYPIBCSTI-GOEBONIOSA-N 2 1 304.478 4.064 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)c1Cl ZINC001560274092 1060048872 /nfs/dbraw/zinc/04/88/72/1060048872.db2.gz CKBMWJJOJJERJX-LBPRGKRZSA-N 2 1 315.288 4.123 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+][C@H]2CCCc3ccccc3C2)([NH+](C)C)C1 ZINC001560285828 1060063026 /nfs/dbraw/zinc/06/30/26/1060063026.db2.gz JTWJUQGRRWADJO-QMMLZNLJSA-N 2 1 314.517 4.034 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+]CC1(CCOC)CCCCC1 ZINC001560320649 1060106794 /nfs/dbraw/zinc/10/67/94/1060106794.db2.gz IFLOJWOYPVRDON-LJQANCHMSA-N 2 1 324.553 4.218 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+]CC1(CCOC)CCCCC1 ZINC001560320649 1060106802 /nfs/dbraw/zinc/10/68/02/1060106802.db2.gz IFLOJWOYPVRDON-LJQANCHMSA-N 2 1 324.553 4.218 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C2CCC3(CC3)CC2)c1 ZINC001560347798 1060132831 /nfs/dbraw/zinc/13/28/31/1060132831.db2.gz YQEJNBUINCLPQZ-UHFFFAOYSA-N 2 1 300.490 4.339 20 0 DIADMP CCC[N@H+](CC)CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560362406 1060147461 /nfs/dbraw/zinc/14/74/61/1060147461.db2.gz IHTKKRAEWPXMFN-GOSISDBHSA-N 2 1 318.549 4.484 20 0 DIADMP CCC[N@@H+](CC)CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560362406 1060147471 /nfs/dbraw/zinc/14/74/71/1060147471.db2.gz IHTKKRAEWPXMFN-GOSISDBHSA-N 2 1 318.549 4.484 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560482750 1060272679 /nfs/dbraw/zinc/27/26/79/1060272679.db2.gz ADCLJYSZLLRKCB-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560482750 1060272697 /nfs/dbraw/zinc/27/26/97/1060272697.db2.gz ADCLJYSZLLRKCB-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(F)cc3cc[nH]c32)CC1 ZINC001249526020 1060276704 /nfs/dbraw/zinc/27/67/04/1060276704.db2.gz MFRGDEDAQVHCIT-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(F)cc3cc[nH]c32)CC1 ZINC001249526020 1060276721 /nfs/dbraw/zinc/27/67/21/1060276721.db2.gz MFRGDEDAQVHCIT-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(-c2ccccc2)s1)C1CC1 ZINC001560495860 1060290323 /nfs/dbraw/zinc/29/03/23/1060290323.db2.gz QIKAEIUEMGPQEX-UHFFFAOYSA-N 2 1 314.498 4.379 20 0 DIADMP c1ccc(C[NH2+][C@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC001560615792 1060430247 /nfs/dbraw/zinc/43/02/47/1060430247.db2.gz ATOXHVWUXLTRMN-FSSWDIPSSA-N 2 1 320.480 4.077 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(F)c3ccccc23)C[C@@H]1C ZINC001560636979 1060451423 /nfs/dbraw/zinc/45/14/23/1060451423.db2.gz REZVSIVURMFBNB-RDJZCZTQSA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(F)c3ccccc23)C[C@@H]1C ZINC001560636979 1060451432 /nfs/dbraw/zinc/45/14/32/1060451432.db2.gz REZVSIVURMFBNB-RDJZCZTQSA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(F)c3ccccc23)C[C@@H]1C ZINC001560636979 1060451441 /nfs/dbraw/zinc/45/14/41/1060451441.db2.gz REZVSIVURMFBNB-RDJZCZTQSA-N 2 1 314.448 4.284 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560668784 1060496814 /nfs/dbraw/zinc/49/68/14/1060496814.db2.gz UWVIYICFVKVLBU-HKBOAZHASA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560668784 1060496836 /nfs/dbraw/zinc/49/68/36/1060496836.db2.gz UWVIYICFVKVLBU-HKBOAZHASA-N 2 1 314.517 4.303 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560668784 1060496854 /nfs/dbraw/zinc/49/68/54/1060496854.db2.gz UWVIYICFVKVLBU-HKBOAZHASA-N 2 1 314.517 4.303 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)CC1 ZINC001560670390 1060503051 /nfs/dbraw/zinc/50/30/51/1060503051.db2.gz CAECFEGBULJOPM-SFTDATJTSA-N 2 1 312.501 4.120 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2CCc3ccccc32)CC1 ZINC001560673297 1060508462 /nfs/dbraw/zinc/50/84/62/1060508462.db2.gz LICGXUWDJBYEPD-FQEVSTJZSA-N 2 1 314.517 4.160 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](C[C@@H](C)c2cccc(Cl)c2)CC1 ZINC001560680602 1060523640 /nfs/dbraw/zinc/52/36/40/1060523640.db2.gz HZFLDQIZLNFVIO-MRXNPFEDSA-N 2 1 322.924 4.496 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC001560681001 1060523970 /nfs/dbraw/zinc/52/39/70/1060523970.db2.gz RVIYDHBXUWTFHX-RTWAWAEBSA-N 2 1 314.517 4.303 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC001560681001 1060523989 /nfs/dbraw/zinc/52/39/89/1060523989.db2.gz RVIYDHBXUWTFHX-RTWAWAEBSA-N 2 1 314.517 4.303 20 0 DIADMP Cc1cc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c(C)o1 ZINC001560690514 1060535021 /nfs/dbraw/zinc/53/50/21/1060535021.db2.gz WRRLZHGUWUEMDC-INIZCTEOSA-N 2 1 318.505 4.373 20 0 DIADMP CCc1oc2ccccc2c1C[N@H+](C)CC1CC[NH+](CC)CC1 ZINC001560714992 1060572303 /nfs/dbraw/zinc/57/23/03/1060572303.db2.gz KAIQLCCPXNVZLM-UHFFFAOYSA-N 2 1 314.473 4.159 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001560810833 1060669424 /nfs/dbraw/zinc/66/94/24/1060669424.db2.gz NNYVFKIHYPNTDB-UHFFFAOYSA-N 2 1 322.452 4.435 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CCCC(C)(C)C1 ZINC001560813173 1060670937 /nfs/dbraw/zinc/67/09/37/1060670937.db2.gz PRGKGXCSYLAIDF-KRWDZBQOSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CCCC(C)(C)C1 ZINC001560813173 1060670947 /nfs/dbraw/zinc/67/09/47/1060670947.db2.gz PRGKGXCSYLAIDF-KRWDZBQOSA-N 2 1 305.510 4.374 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1ccccc1C(F)(F)F ZINC001560811297 1060671421 /nfs/dbraw/zinc/67/14/21/1060671421.db2.gz FGVSSSIJWKDXFA-UHFFFAOYSA-N 2 1 316.411 4.259 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1ccccc1C(F)(F)F ZINC001560811297 1060671428 /nfs/dbraw/zinc/67/14/28/1060671428.db2.gz FGVSSSIJWKDXFA-UHFFFAOYSA-N 2 1 316.411 4.259 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](CC3CCC4(CCCCC4)CC3)C2)C1 ZINC001560853611 1060712928 /nfs/dbraw/zinc/71/29/28/1060712928.db2.gz CDCCZDVSOJIWSZ-FQEVSTJZSA-N 2 1 304.522 4.155 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](CC3CCC4(CCCCC4)CC3)C2)C1 ZINC001560853611 1060712941 /nfs/dbraw/zinc/71/29/41/1060712941.db2.gz CDCCZDVSOJIWSZ-FQEVSTJZSA-N 2 1 304.522 4.155 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](CC3CCC4(CCCCC4)CC3)C2)C1 ZINC001560853611 1060712956 /nfs/dbraw/zinc/71/29/56/1060712956.db2.gz CDCCZDVSOJIWSZ-FQEVSTJZSA-N 2 1 304.522 4.155 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCc3ccc(-c4ccccc4)cc3C2)CC1 ZINC001560860717 1060716152 /nfs/dbraw/zinc/71/61/52/1060716152.db2.gz VHXBCABLCAQRRL-UHFFFAOYSA-N 2 1 320.480 4.054 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560861024 1060720929 /nfs/dbraw/zinc/72/09/29/1060720929.db2.gz BWSBVZXNSOHHPR-QZTJIDSGSA-N 2 1 316.533 4.206 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560861024 1060720942 /nfs/dbraw/zinc/72/09/42/1060720942.db2.gz BWSBVZXNSOHHPR-QZTJIDSGSA-N 2 1 316.533 4.206 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560864208 1060722941 /nfs/dbraw/zinc/72/29/41/1060722941.db2.gz NRBKAWGRDVGTCJ-RLLQIKCJSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560864208 1060722954 /nfs/dbraw/zinc/72/29/54/1060722954.db2.gz NRBKAWGRDVGTCJ-RLLQIKCJSA-N 2 1 302.506 4.207 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001560870761 1060730953 /nfs/dbraw/zinc/73/09/53/1060730953.db2.gz PDUBCOCHTQCGNV-UWWQBHOKSA-N 2 1 308.897 4.294 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001560870761 1060730968 /nfs/dbraw/zinc/73/09/68/1060730968.db2.gz PDUBCOCHTQCGNV-UWWQBHOKSA-N 2 1 308.897 4.294 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001560871862 1060732231 /nfs/dbraw/zinc/73/22/31/1060732231.db2.gz UNXJRDZMMCGHNW-LEWJYISDSA-N 2 1 312.501 4.377 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1 ZINC001560870974 1060732270 /nfs/dbraw/zinc/73/22/70/1060732270.db2.gz VATCJBREMJCXQM-YZGWKJHDSA-N 2 1 302.506 4.421 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1 ZINC001560870974 1060732274 /nfs/dbraw/zinc/73/22/74/1060732274.db2.gz VATCJBREMJCXQM-YZGWKJHDSA-N 2 1 302.506 4.421 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCCC[C@H]2c2ccccc2)C1 ZINC001560877889 1060738620 /nfs/dbraw/zinc/73/86/20/1060738620.db2.gz GMLBTQDZMJOFDB-HOJAQTOUSA-N 2 1 300.490 4.034 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC001560877890 1060738895 /nfs/dbraw/zinc/73/88/95/1060738895.db2.gz GMLBTQDZMJOFDB-MISYRCLQSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)(C)[C@@]1(C[NH2+]C2CC=CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001560918581 1060778882 /nfs/dbraw/zinc/77/88/82/1060778882.db2.gz ZATZRIIPYFEMCY-OAQYLSRUSA-N 2 1 312.501 4.233 20 0 DIADMP CC(C)(C)[C@@]1(C[NH2+][C@H]2C=CCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001560922330 1060786922 /nfs/dbraw/zinc/78/69/22/1060786922.db2.gz RIJSJARKXUMRIO-PZJWPPBQSA-N 2 1 312.501 4.233 20 0 DIADMP Cc1cccc(CC[C@H](C)[NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC001560937269 1060799985 /nfs/dbraw/zinc/79/99/85/1060799985.db2.gz ACVJFQNRJFQDGJ-AZUAARDMSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(CC[C@H](C)[NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC001560937269 1060799999 /nfs/dbraw/zinc/79/99/99/1060799999.db2.gz ACVJFQNRJFQDGJ-AZUAARDMSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(CC[C@H](C)[NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC001560937270 1060800059 /nfs/dbraw/zinc/80/00/59/1060800059.db2.gz ACVJFQNRJFQDGJ-ICSRJNTNSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(CC[C@H](C)[NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC001560937270 1060800079 /nfs/dbraw/zinc/80/00/79/1060800079.db2.gz ACVJFQNRJFQDGJ-ICSRJNTNSA-N 2 1 314.517 4.313 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](Cc2ccsc2C)CC1 ZINC001560986738 1060852286 /nfs/dbraw/zinc/85/22/86/1060852286.db2.gz GOKMWJDYQCQTDH-UHFFFAOYSA-N 2 1 306.519 4.287 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCC2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001473206213 1060973176 /nfs/dbraw/zinc/97/31/76/1060973176.db2.gz PZPZGRROXXBZOM-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCC2CCC2)CC[N@H+]1Cc1ccccc1 ZINC001473206213 1060973196 /nfs/dbraw/zinc/97/31/96/1060973196.db2.gz PZPZGRROXXBZOM-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206213 1060973217 /nfs/dbraw/zinc/97/32/17/1060973217.db2.gz PZPZGRROXXBZOM-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206213 1060973237 /nfs/dbraw/zinc/97/32/37/1060973237.db2.gz PZPZGRROXXBZOM-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP CCCc1ccc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)s1 ZINC001462155549 1060978193 /nfs/dbraw/zinc/97/81/93/1060978193.db2.gz MZSRHFXEIHRUSD-UHFFFAOYSA-N 2 1 306.519 4.008 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](CC3CCC(C(C)(C)C)CC3)CC[C@@H]21 ZINC001473219451 1060993835 /nfs/dbraw/zinc/99/38/35/1060993835.db2.gz HRMITUMOAZZBFC-CHPDAQJUSA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](CC3CCC(C(C)(C)C)CC3)CC[C@@H]21 ZINC001473219451 1060993855 /nfs/dbraw/zinc/99/38/55/1060993855.db2.gz HRMITUMOAZZBFC-CHPDAQJUSA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC3CCC(C(C)(C)C)CC3)CC[C@@H]21 ZINC001473219451 1060993880 /nfs/dbraw/zinc/99/38/80/1060993880.db2.gz HRMITUMOAZZBFC-CHPDAQJUSA-N 2 1 306.538 4.255 20 0 DIADMP CC[C@H](C)[C@H](C)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219584 1060994715 /nfs/dbraw/zinc/99/47/15/1060994715.db2.gz KCAMCCIHLRWGNR-JYAXBFRTSA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219584 1060994731 /nfs/dbraw/zinc/99/47/31/1060994731.db2.gz KCAMCCIHLRWGNR-JYAXBFRTSA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219584 1060994748 /nfs/dbraw/zinc/99/47/48/1060994748.db2.gz KCAMCCIHLRWGNR-JYAXBFRTSA-N 2 1 314.517 4.408 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl ZINC001462189491 1061012945 /nfs/dbraw/zinc/01/29/45/1061012945.db2.gz IUXKXKSCGUZCHX-KYJSFNMBSA-N 2 1 308.897 4.296 20 0 DIADMP Cc1ccc([C@H](C)C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)cc1 ZINC001462192197 1061014880 /nfs/dbraw/zinc/01/48/80/1061014880.db2.gz OGRQPDLBEDDEKQ-GOSISDBHSA-N 2 1 324.468 4.345 20 0 DIADMP CC[C@H]1CCC[C@H](C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001462192387 1061015593 /nfs/dbraw/zinc/01/55/93/1061015593.db2.gz OAIHPOSWDWEWGA-PXNSSMCTSA-N 2 1 302.506 4.396 20 0 DIADMP CC[C@H]1CCC[C@@H](C[N@@H+](C)CCCN(C)Cc2ccco2)C1 ZINC001462218955 1061035401 /nfs/dbraw/zinc/03/54/01/1061035401.db2.gz MHVZPMHUQGGKBH-ZWKOTPCHSA-N 2 1 306.494 4.250 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2cc(Cl)cc3ccccc32)CC1 ZINC001473381068 1061124651 /nfs/dbraw/zinc/12/46/51/1061124651.db2.gz XERDQLRBXGJTME-SFHVURJKSA-N 2 1 316.876 4.409 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2cc(Cl)cc3ccccc32)CC1 ZINC001473381068 1061124654 /nfs/dbraw/zinc/12/46/54/1061124654.db2.gz XERDQLRBXGJTME-SFHVURJKSA-N 2 1 316.876 4.409 20 0 DIADMP C[N@H+]1C[C@@H](C[NH2+]C2CCCCCCC2)[C@H](c2ccccc2)C1 ZINC001462370036 1061134503 /nfs/dbraw/zinc/13/45/03/1061134503.db2.gz VNAHKALXPXWDIM-QUCCMNQESA-N 2 1 300.490 4.034 20 0 DIADMP CCc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC001473410298 1061146305 /nfs/dbraw/zinc/14/63/05/1061146305.db2.gz WTWNZYLGRWKQOA-GCJKJVERSA-N 2 1 322.496 4.249 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCc3ccc(Cl)cc3[C@H](C)C2)CC1 ZINC001462413473 1061159083 /nfs/dbraw/zinc/15/90/83/1061159083.db2.gz SZNDGYVMWDFCKK-OAHLLOKOSA-N 2 1 320.908 4.034 20 0 DIADMP CCC(C)(C)[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001462430433 1061170361 /nfs/dbraw/zinc/17/03/61/1061170361.db2.gz TVPDLXZQWUAYCK-LNLFQRSKSA-N 2 1 302.506 4.311 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1 ZINC001462437851 1061173612 /nfs/dbraw/zinc/17/36/12/1061173612.db2.gz NMFAYMAKYXCDQD-HHXXYDBFSA-N 2 1 320.908 4.298 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444762 1061177546 /nfs/dbraw/zinc/17/75/46/1061177546.db2.gz TXVFICCQUSLYTE-CRAIPNDOSA-N 2 1 320.908 4.440 20 0 DIADMP CC[C@H](C)[C@@H](C)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001473465351 1061177557 /nfs/dbraw/zinc/17/75/57/1061177557.db2.gz OLNHJJIGQCUBDZ-NLWGTHIKSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001473465351 1061177563 /nfs/dbraw/zinc/17/75/63/1061177563.db2.gz OLNHJJIGQCUBDZ-NLWGTHIKSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001473465351 1061177568 /nfs/dbraw/zinc/17/75/68/1061177568.db2.gz OLNHJJIGQCUBDZ-NLWGTHIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444762 1061177554 /nfs/dbraw/zinc/17/75/54/1061177554.db2.gz TXVFICCQUSLYTE-CRAIPNDOSA-N 2 1 320.908 4.440 20 0 DIADMP Cc1cccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001462516732 1061225092 /nfs/dbraw/zinc/22/50/92/1061225092.db2.gz FGJNILWGZBJEAW-NQIIRXRSSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001462516732 1061225116 /nfs/dbraw/zinc/22/51/16/1061225116.db2.gz FGJNILWGZBJEAW-NQIIRXRSSA-N 2 1 314.517 4.313 20 0 DIADMP CCCOc1ccc(C[N@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c(C)c1 ZINC001462662994 1061324419 /nfs/dbraw/zinc/32/44/19/1061324419.db2.gz FYWPUZSRBOAIBB-UHFFFAOYSA-N 2 1 318.505 4.136 20 0 DIADMP CCCC[N@@H+](CC1CC(OCC)C1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001473683821 1061343416 /nfs/dbraw/zinc/34/34/16/1061343416.db2.gz VDQKDYGDLWVIKD-UHFFFAOYSA-N 2 1 324.553 4.213 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cc(C)ccc2C)CC1 ZINC001473698658 1061353602 /nfs/dbraw/zinc/35/36/02/1061353602.db2.gz VJGCYRCLASVBLJ-UHFFFAOYSA-N 2 1 300.490 4.144 20 0 DIADMP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724608 1061371770 /nfs/dbraw/zinc/37/17/70/1061371770.db2.gz DLFXBCCMHXVWKA-DNVCBOLYSA-N 2 1 314.860 4.019 20 0 DIADMP C[N@H+]1CC[C@@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724608 1061371787 /nfs/dbraw/zinc/37/17/87/1061371787.db2.gz DLFXBCCMHXVWKA-DNVCBOLYSA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@H+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724608 1061371803 /nfs/dbraw/zinc/37/18/03/1061371803.db2.gz DLFXBCCMHXVWKA-DNVCBOLYSA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724608 1061371820 /nfs/dbraw/zinc/37/18/20/1061371820.db2.gz DLFXBCCMHXVWKA-DNVCBOLYSA-N 2 1 314.860 4.019 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)[C@@H]1CCc2c1cccc2F ZINC001473749931 1061389654 /nfs/dbraw/zinc/38/96/54/1061389654.db2.gz QRQJWRARAZIYGU-LJQANCHMSA-N 2 1 304.453 4.011 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C(C)(C)C1 ZINC001473756717 1061394278 /nfs/dbraw/zinc/39/42/78/1061394278.db2.gz HWRRZDVCMIZXCZ-QGZVFWFLSA-N 2 1 300.490 4.293 20 0 DIADMP CCc1ccccc1C[NH+]1CCC(CC)([NH+]2CCCCC2)CC1 ZINC001473756878 1061395677 /nfs/dbraw/zinc/39/56/77/1061395677.db2.gz NHONTUUDNYFJSV-UHFFFAOYSA-N 2 1 314.517 4.480 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CCN(c3cc[nH+]cc3)C[C@@H]2C)c(C)c1 ZINC001473809774 1061417382 /nfs/dbraw/zinc/41/73/82/1061417382.db2.gz QNVNPZMTZWBGPQ-OALUTQOASA-N 2 1 323.484 4.279 20 0 DIADMP CCCc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)s1 ZINC001473936622 1061482557 /nfs/dbraw/zinc/48/25/57/1061482557.db2.gz DJZMQQRNZTUSCE-MRXNPFEDSA-N 2 1 308.535 4.445 20 0 DIADMP Cc1scc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1C ZINC001473935851 1061483169 /nfs/dbraw/zinc/48/31/69/1061483169.db2.gz QOQUKQZAXWFBGK-GASCZTMLSA-N 2 1 308.535 4.213 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]CC(C(C)C)C(C)C)cc1F ZINC001473954820 1061495985 /nfs/dbraw/zinc/49/59/85/1061495985.db2.gz HBNZDGPFZCSBRR-UHFFFAOYSA-N 2 1 317.452 4.338 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(Cl)c(C)c2Cl)C1 ZINC001473965078 1061507070 /nfs/dbraw/zinc/50/70/70/1061507070.db2.gz UPHXTEIFOHMMQE-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(Cl)c(C)c2Cl)C1 ZINC001473965078 1061507088 /nfs/dbraw/zinc/50/70/88/1061507088.db2.gz UPHXTEIFOHMMQE-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)CC1(C)C ZINC001473969399 1061512676 /nfs/dbraw/zinc/51/26/76/1061512676.db2.gz UGLOLDCEBBMIKT-IAGOWNOFSA-N 2 1 306.469 4.375 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1CC[NH2+]C[C@H](C)CCc1ccccc1 ZINC001473994700 1061538303 /nfs/dbraw/zinc/53/83/03/1061538303.db2.gz BHESBNWBQDEGQA-UYAOXDASSA-N 2 1 302.506 4.109 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1CC[NH2+]C[C@H](C)CCc1ccccc1 ZINC001473994700 1061538319 /nfs/dbraw/zinc/53/83/19/1061538319.db2.gz BHESBNWBQDEGQA-UYAOXDASSA-N 2 1 302.506 4.109 20 0 DIADMP Clc1cc(C[NH2+]CCC[NH+]2CCC2)ccc1-c1ccccc1 ZINC001474100035 1061644923 /nfs/dbraw/zinc/64/49/23/1061644923.db2.gz SMPYFEDCWPFUCN-UHFFFAOYSA-N 2 1 314.860 4.192 20 0 DIADMP C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001474104660 1061654360 /nfs/dbraw/zinc/65/43/60/1061654360.db2.gz YIGWSSPBWNFAHA-SZVBFZGTSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCOc1ccccc1C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001474108945 1061658441 /nfs/dbraw/zinc/65/84/41/1061658441.db2.gz LWSIBNREZFHLIB-GOSISDBHSA-N 2 1 318.505 4.220 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)C1(c2ccccc2)CCCC1 ZINC001474116443 1061666445 /nfs/dbraw/zinc/66/64/45/1061666445.db2.gz UJOPPKMMLOEJJJ-MJGOQNOKSA-N 2 1 314.517 4.349 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+]C/C(C)=C\c1ccc(Cl)cc1 ZINC001474138723 1061684254 /nfs/dbraw/zinc/68/42/54/1061684254.db2.gz HAGHLNKGGWBFIS-NZHZHZHDSA-N 2 1 306.881 4.207 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+]C/C(C)=C\c1ccc(Cl)cc1 ZINC001474138723 1061684269 /nfs/dbraw/zinc/68/42/69/1061684269.db2.gz HAGHLNKGGWBFIS-NZHZHZHDSA-N 2 1 306.881 4.207 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC001474187789 1061737034 /nfs/dbraw/zinc/73/70/34/1061737034.db2.gz XAGSPMRGTIKOIH-PMACEKPBSA-N 2 1 314.517 4.170 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001474189819 1061740318 /nfs/dbraw/zinc/74/03/18/1061740318.db2.gz UFMXOLHZEHTCAK-QBZDTREQSA-N 2 1 320.480 4.025 20 0 DIADMP CC(C)C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC001474223100 1061783240 /nfs/dbraw/zinc/78/32/40/1061783240.db2.gz BTYJEGDMYNUHGS-ZCNNSNEGSA-N 2 1 306.538 4.303 20 0 DIADMP Cc1cc(C)cc(-c2ccc(C[NH2+]CC[C@H](C)[NH+](C)C)cc2)c1 ZINC001474223466 1061784497 /nfs/dbraw/zinc/78/44/97/1061784497.db2.gz JKKSOPPHFWBWBQ-SFHVURJKSA-N 2 1 310.485 4.400 20 0 DIADMP CC(C)C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C1 ZINC001474223098 1061784828 /nfs/dbraw/zinc/78/48/28/1061784828.db2.gz BTYJEGDMYNUHGS-UFYCRDLUSA-N 2 1 306.538 4.303 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H]3C[C@@H]3C3CCCC3)CC2)cc1 ZINC001474301252 1061870255 /nfs/dbraw/zinc/87/02/55/1061870255.db2.gz IIAPFNZYBRSMAP-TZIWHRDSSA-N 2 1 312.501 4.067 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(SC(F)F)cc1 ZINC001474304496 1061872743 /nfs/dbraw/zinc/87/27/43/1061872743.db2.gz UIOYWIOFJBDCDU-ZDUSSCGKSA-N 2 1 316.461 4.211 20 0 DIADMP CCCOc1ccc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)cc1C ZINC001474349967 1061958202 /nfs/dbraw/zinc/95/82/02/1061958202.db2.gz BNXLBLIFKKRRPA-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[N@@H+](C)CC[C@H]2CCCC[NH+]2C)cc1C ZINC001474349967 1061958222 /nfs/dbraw/zinc/95/82/22/1061958222.db2.gz BNXLBLIFKKRRPA-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@H]2CCCC[N@@H+]2C)cc1C ZINC001474349967 1061958240 /nfs/dbraw/zinc/95/82/40/1061958240.db2.gz BNXLBLIFKKRRPA-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@H]2CCCC[N@H+]2C)cc1C ZINC001474349967 1061958262 /nfs/dbraw/zinc/95/82/62/1061958262.db2.gz BNXLBLIFKKRRPA-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCC2)C2CCC(F)(F)CC2)CC1 ZINC001254215814 1062054502 /nfs/dbraw/zinc/05/45/02/1062054502.db2.gz TXYARKWKAJVERR-WKILWMFISA-N 2 1 314.464 4.326 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001474435989 1062111220 /nfs/dbraw/zinc/11/12/20/1062111220.db2.gz RYDLXPLHYIOHRV-MKXGPGLRSA-N 2 1 306.538 4.444 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001254486626 1062127919 /nfs/dbraw/zinc/12/79/19/1062127919.db2.gz FITCZHWNGVJUKC-BURNTYAHSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001254486626 1062127931 /nfs/dbraw/zinc/12/79/31/1062127931.db2.gz FITCZHWNGVJUKC-BURNTYAHSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001254486234 1062128120 /nfs/dbraw/zinc/12/81/20/1062128120.db2.gz WMLRKIJRTOOAQG-PMACEKPBSA-N 2 1 302.506 4.109 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001254484899 1062129042 /nfs/dbraw/zinc/12/90/42/1062129042.db2.gz CHUMOLWNVUBJJX-HAGHYFMRSA-N 2 1 300.490 4.003 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001474451797 1062129622 /nfs/dbraw/zinc/12/96/22/1062129622.db2.gz LDVAUYMZTZOOSJ-ICSRJNTNSA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001474451797 1062129628 /nfs/dbraw/zinc/12/96/28/1062129628.db2.gz LDVAUYMZTZOOSJ-ICSRJNTNSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@H](N[C@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499331 1062140819 /nfs/dbraw/zinc/14/08/19/1062140819.db2.gz CYWXJPASGBQHIK-AAEUAGOBSA-N 2 1 301.261 4.128 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499331 1062140825 /nfs/dbraw/zinc/14/08/25/1062140825.db2.gz CYWXJPASGBQHIK-AAEUAGOBSA-N 2 1 301.261 4.128 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499331 1062140841 /nfs/dbraw/zinc/14/08/41/1062140841.db2.gz CYWXJPASGBQHIK-AAEUAGOBSA-N 2 1 301.261 4.128 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C(C)(C)c2cc(Cl)cc(Cl)c2)CC1 ZINC001254506004 1062150051 /nfs/dbraw/zinc/15/00/51/1062150051.db2.gz NGLKICRIAAQVLZ-HNNXBMFYSA-N 2 1 315.288 4.302 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001254521748 1062156762 /nfs/dbraw/zinc/15/67/62/1062156762.db2.gz WVMUEEJLXUDICQ-FQEVSTJZSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@H]([N@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001254521748 1062156776 /nfs/dbraw/zinc/15/67/76/1062156776.db2.gz WVMUEEJLXUDICQ-FQEVSTJZSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001254521748 1062156790 /nfs/dbraw/zinc/15/67/90/1062156790.db2.gz WVMUEEJLXUDICQ-FQEVSTJZSA-N 2 1 300.490 4.306 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001254524832 1062161340 /nfs/dbraw/zinc/16/13/40/1062161340.db2.gz CMMLDORXQMRUSJ-QFIPXVFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+]1CCC[C@H]([N@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001254524832 1062161360 /nfs/dbraw/zinc/16/13/60/1062161360.db2.gz CMMLDORXQMRUSJ-QFIPXVFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+]1CCC[C@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001254524832 1062161376 /nfs/dbraw/zinc/16/13/76/1062161376.db2.gz CMMLDORXQMRUSJ-QFIPXVFZSA-N 2 1 322.496 4.216 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CCC[NH+](C)CC1 ZINC001254532629 1062163040 /nfs/dbraw/zinc/16/30/40/1062163040.db2.gz VMIUMVWUTKBJSH-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CCC[N@H+](C)CC1 ZINC001254532629 1062163047 /nfs/dbraw/zinc/16/30/47/1062163047.db2.gz VMIUMVWUTKBJSH-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CCC[N@@H+](C)CC1 ZINC001254532629 1062163052 /nfs/dbraw/zinc/16/30/52/1062163052.db2.gz VMIUMVWUTKBJSH-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)C[C@@]2(C)C[C@@H]2c2ccccc2)cc1 ZINC001474500518 1062180630 /nfs/dbraw/zinc/18/06/30/1062180630.db2.gz MFYMQKVGIIOPFC-FGZHOGPDSA-N 2 1 322.496 4.374 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCc2ccccc21 ZINC001474500302 1062180979 /nfs/dbraw/zinc/18/09/79/1062180979.db2.gz HUZCZFWNSZAOFS-NRFANRHFSA-N 2 1 322.496 4.300 20 0 DIADMP CSC(C)(C)CC[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474504228 1062188443 /nfs/dbraw/zinc/18/84/43/1062188443.db2.gz DJPWDNUBEAVDPY-UHFFFAOYSA-N 2 1 320.546 4.115 20 0 DIADMP CSC(C)(C)CC[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474504228 1062188451 /nfs/dbraw/zinc/18/84/51/1062188451.db2.gz DJPWDNUBEAVDPY-UHFFFAOYSA-N 2 1 320.546 4.115 20 0 DIADMP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506043 1062188664 /nfs/dbraw/zinc/18/86/64/1062188664.db2.gz ZPBRPNKUARFRNG-LEWJYISDSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506043 1062188677 /nfs/dbraw/zinc/18/86/77/1062188677.db2.gz ZPBRPNKUARFRNG-LEWJYISDSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506043 1062188694 /nfs/dbraw/zinc/18/86/94/1062188694.db2.gz ZPBRPNKUARFRNG-LEWJYISDSA-N 2 1 312.501 4.260 20 0 DIADMP C[N@@H+](CCCc1cccc2ccccc21)C[C@H]1CCC[NH+](C)C1 ZINC001459537150 1062193991 /nfs/dbraw/zinc/19/39/91/1062193991.db2.gz DBOCTUUZPVCDPZ-SFHVURJKSA-N 2 1 310.485 4.046 20 0 DIADMP C[NH+](CCCc1cccc2ccccc21)C[C@H]1CCC[N@H+](C)C1 ZINC001459537150 1062194012 /nfs/dbraw/zinc/19/40/12/1062194012.db2.gz DBOCTUUZPVCDPZ-SFHVURJKSA-N 2 1 310.485 4.046 20 0 DIADMP C[NH+](CCCc1cccc2ccccc21)C[C@H]1CCC[N@@H+](C)C1 ZINC001459537150 1062194024 /nfs/dbraw/zinc/19/40/24/1062194024.db2.gz DBOCTUUZPVCDPZ-SFHVURJKSA-N 2 1 310.485 4.046 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001474524341 1062208524 /nfs/dbraw/zinc/20/85/24/1062208524.db2.gz VFSPOEMEYZQMOG-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](CCSc2ccc(C)c(C)c2)C1 ZINC001459567548 1062214940 /nfs/dbraw/zinc/21/49/40/1062214940.db2.gz FAPCQERNYPUXCC-SFHVURJKSA-N 2 1 320.546 4.059 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCSc2ccc(C)c(C)c2)C1 ZINC001459567548 1062214964 /nfs/dbraw/zinc/21/49/64/1062214964.db2.gz FAPCQERNYPUXCC-SFHVURJKSA-N 2 1 320.546 4.059 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C1CCC(C2CCC2)CC1 ZINC001474538631 1062225899 /nfs/dbraw/zinc/22/58/99/1062225899.db2.gz WHUIDIZLYUAIRS-MHJFOBGBSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)CCc1ccccc1 ZINC001474538534 1062226822 /nfs/dbraw/zinc/22/68/22/1062226822.db2.gz VCIMAMNOHQEHJX-ICSRJNTNSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CCN1C ZINC001459617672 1062250184 /nfs/dbraw/zinc/25/01/84/1062250184.db2.gz XQBIZNCOGGSRHX-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@@H+]1C ZINC001459617672 1062250208 /nfs/dbraw/zinc/25/02/08/1062250208.db2.gz XQBIZNCOGGSRHX-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@H+]1C ZINC001459617672 1062250228 /nfs/dbraw/zinc/25/02/28/1062250228.db2.gz XQBIZNCOGGSRHX-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617672 1062250244 /nfs/dbraw/zinc/25/02/44/1062250244.db2.gz XQBIZNCOGGSRHX-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617672 1062250266 /nfs/dbraw/zinc/25/02/66/1062250266.db2.gz XQBIZNCOGGSRHX-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474556659 1062257595 /nfs/dbraw/zinc/25/75/95/1062257595.db2.gz FUMRCGFUNCSZKI-KBPBESRZSA-N 2 1 316.411 4.127 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474556659 1062257615 /nfs/dbraw/zinc/25/76/15/1062257615.db2.gz FUMRCGFUNCSZKI-KBPBESRZSA-N 2 1 316.411 4.127 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001474558285 1062262429 /nfs/dbraw/zinc/26/24/29/1062262429.db2.gz NRBKAWGRDVGTCJ-IHPCNDPISA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001474558285 1062262445 /nfs/dbraw/zinc/26/24/45/1062262445.db2.gz NRBKAWGRDVGTCJ-IHPCNDPISA-N 2 1 302.506 4.207 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@@H](C[NH2+][C@H]3C[C@@H]4CCC[C@@H]43)C2)cc1 ZINC001474565022 1062270726 /nfs/dbraw/zinc/27/07/26/1062270726.db2.gz PHTJEFQBNCLJPU-TUFLPTIASA-N 2 1 312.501 4.067 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCSc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC001459665681 1062284184 /nfs/dbraw/zinc/28/41/84/1062284184.db2.gz FIZDRKBSOGZZDV-HKUYNNGSSA-N 2 1 320.546 4.058 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001459668635 1062289572 /nfs/dbraw/zinc/28/95/72/1062289572.db2.gz LVNKDMUUCKRVEI-VQIMIIECSA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001459668635 1062289589 /nfs/dbraw/zinc/28/95/89/1062289589.db2.gz LVNKDMUUCKRVEI-VQIMIIECSA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001459668635 1062289607 /nfs/dbraw/zinc/28/96/07/1062289607.db2.gz LVNKDMUUCKRVEI-VQIMIIECSA-N 2 1 302.506 4.146 20 0 DIADMP C[C@@H]([NH3+])c1cn([C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001255109309 1062315817 /nfs/dbraw/zinc/31/58/17/1062315817.db2.gz QMPLAOITDBNEKD-SJLPKXTDSA-N 2 1 319.452 4.108 20 0 DIADMP CSCC[C@H](C)[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001459699622 1062316380 /nfs/dbraw/zinc/31/63/80/1062316380.db2.gz NNSZNKSKZOTYFJ-KRWDZBQOSA-N 2 1 320.546 4.246 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]CC(c1ccccc1)c1ccccc1 ZINC001474611099 1062324724 /nfs/dbraw/zinc/32/47/24/1062324724.db2.gz GHYPNQRGBKTXSP-UHFFFAOYSA-N 2 1 324.512 4.386 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255136969 1062326396 /nfs/dbraw/zinc/32/63/96/1062326396.db2.gz OOZIILOUIUACIM-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255136969 1062326418 /nfs/dbraw/zinc/32/64/18/1062326418.db2.gz OOZIILOUIUACIM-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255136969 1062326436 /nfs/dbraw/zinc/32/64/36/1062326436.db2.gz OOZIILOUIUACIM-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[N@@H+](Cc1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136682 1062326921 /nfs/dbraw/zinc/32/69/21/1062326921.db2.gz MYZQYGVIIQTORA-KOUNCHBCSA-N 2 1 320.480 4.314 20 0 DIADMP C[NH+](Cc1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136682 1062326941 /nfs/dbraw/zinc/32/69/41/1062326941.db2.gz MYZQYGVIIQTORA-KOUNCHBCSA-N 2 1 320.480 4.314 20 0 DIADMP C[NH+](Cc1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136682 1062326955 /nfs/dbraw/zinc/32/69/55/1062326955.db2.gz MYZQYGVIIQTORA-KOUNCHBCSA-N 2 1 320.480 4.314 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2Cc4ccccc4C2)C3)cc1 ZINC001255136134 1062327293 /nfs/dbraw/zinc/32/72/93/1062327293.db2.gz HCVXRQPWJXIBPZ-KOUNCHBCSA-N 2 1 318.464 4.198 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2Cc4ccccc4C2)C3)cc1 ZINC001255136135 1062327976 /nfs/dbraw/zinc/32/79/76/1062327976.db2.gz HCVXRQPWJXIBPZ-ZBYYUNFXSA-N 2 1 318.464 4.198 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136146 1062328279 /nfs/dbraw/zinc/32/82/79/1062328279.db2.gz HKEFGAARJJDOSU-JNVSZQSJSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136146 1062328306 /nfs/dbraw/zinc/32/83/06/1062328306.db2.gz HKEFGAARJJDOSU-JNVSZQSJSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136146 1062328331 /nfs/dbraw/zinc/32/83/31/1062328331.db2.gz HKEFGAARJJDOSU-JNVSZQSJSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136146 1062328355 /nfs/dbraw/zinc/32/83/55/1062328355.db2.gz HKEFGAARJJDOSU-JNVSZQSJSA-N 2 1 312.501 4.445 20 0 DIADMP CCCC[N@@H+](CC)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255135755 1062329609 /nfs/dbraw/zinc/32/96/09/1062329609.db2.gz FJOYGHMGEYAFBA-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](CC)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255135755 1062329632 /nfs/dbraw/zinc/32/96/32/1062329632.db2.gz FJOYGHMGEYAFBA-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](CC)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135755 1062329647 /nfs/dbraw/zinc/32/96/47/1062329647.db2.gz FJOYGHMGEYAFBA-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@]1(F)CCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137438 1062330431 /nfs/dbraw/zinc/33/04/31/1062330431.db2.gz RVBHBZSFBCSNFC-NMLBUPMWSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@]1(F)CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137438 1062330456 /nfs/dbraw/zinc/33/04/56/1062330456.db2.gz RVBHBZSFBCSNFC-NMLBUPMWSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137438 1062330475 /nfs/dbraw/zinc/33/04/75/1062330475.db2.gz RVBHBZSFBCSNFC-NMLBUPMWSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137438 1062330490 /nfs/dbraw/zinc/33/04/90/1062330490.db2.gz RVBHBZSFBCSNFC-NMLBUPMWSA-N 2 1 316.464 4.006 20 0 DIADMP CCC(CC)[N@@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146385 1062335417 /nfs/dbraw/zinc/33/54/17/1062335417.db2.gz FYJQYFZGAJHTET-ACDBMABISA-N 2 1 300.490 4.302 20 0 DIADMP CCC(CC)[NH+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146385 1062335439 /nfs/dbraw/zinc/33/54/39/1062335439.db2.gz FYJQYFZGAJHTET-ACDBMABISA-N 2 1 300.490 4.302 20 0 DIADMP CCC(CC)[NH+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146385 1062335465 /nfs/dbraw/zinc/33/54/65/1062335465.db2.gz FYJQYFZGAJHTET-ACDBMABISA-N 2 1 300.490 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CC[C@H]4CCC[C@@H]4C2)C3)cc1 ZINC001255141934 1062336210 /nfs/dbraw/zinc/33/62/10/1062336210.db2.gz ORORQTJRBOWPBJ-YXIAPDDASA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CC[C@H]4CCC[C@@H]4C2)C3)cc1 ZINC001255141934 1062336229 /nfs/dbraw/zinc/33/62/29/1062336229.db2.gz ORORQTJRBOWPBJ-YXIAPDDASA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CC[C@H]4CCC[C@@H]4C2)C3)cc1 ZINC001255141934 1062336241 /nfs/dbraw/zinc/33/62/41/1062336241.db2.gz ORORQTJRBOWPBJ-YXIAPDDASA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@H]4CCC[C@@H]42)C3)cc1 ZINC001255143290 1062337895 /nfs/dbraw/zinc/33/78/95/1062337895.db2.gz JRNUMWFLILLAMT-AANPDWTMSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@H]4CCC[C@@H]42)C3)cc1 ZINC001255143290 1062337911 /nfs/dbraw/zinc/33/79/11/1062337911.db2.gz JRNUMWFLILLAMT-AANPDWTMSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCC[C@H]4CCC[C@@H]42)C3)cc1 ZINC001255143290 1062337940 /nfs/dbraw/zinc/33/79/40/1062337940.db2.gz JRNUMWFLILLAMT-AANPDWTMSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCC[C@H]4CCC[C@@H]42)C3)cc1 ZINC001255143290 1062337965 /nfs/dbraw/zinc/33/79/65/1062337965.db2.gz JRNUMWFLILLAMT-AANPDWTMSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150147 1062344768 /nfs/dbraw/zinc/34/47/68/1062344768.db2.gz MFUOHKUPEIKHPS-IJXRJRJASA-N 2 1 310.485 4.056 20 0 DIADMP C[C@@H]1C[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150147 1062344783 /nfs/dbraw/zinc/34/47/83/1062344783.db2.gz MFUOHKUPEIKHPS-IJXRJRJASA-N 2 1 310.485 4.056 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150147 1062344799 /nfs/dbraw/zinc/34/47/99/1062344799.db2.gz MFUOHKUPEIKHPS-IJXRJRJASA-N 2 1 310.485 4.056 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150147 1062344819 /nfs/dbraw/zinc/34/48/19/1062344819.db2.gz MFUOHKUPEIKHPS-IJXRJRJASA-N 2 1 310.485 4.056 20 0 DIADMP CCSc1cccc(C[N@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)c1 ZINC001474646022 1062370479 /nfs/dbraw/zinc/37/04/79/1062370479.db2.gz APSIBTSXABVMCY-QFBILLFUSA-N 2 1 320.546 4.351 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC(C)(C)CC1 ZINC001255308550 1062388412 /nfs/dbraw/zinc/38/84/12/1062388412.db2.gz TZDHVWZABAEOGN-LJQANCHMSA-N 2 1 314.517 4.409 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255319011 1062394865 /nfs/dbraw/zinc/39/48/65/1062394865.db2.gz DUVJKFCRODVJBO-SNRMKQJTSA-N 2 1 306.469 4.476 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255321730 1062397476 /nfs/dbraw/zinc/39/74/76/1062397476.db2.gz WKLBEGPWMUDVQT-KBAYOESNSA-N 2 1 306.469 4.476 20 0 DIADMP CCCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001255332245 1062405205 /nfs/dbraw/zinc/40/52/05/1062405205.db2.gz LKPQKIOCXSDICB-INIZCTEOSA-N 2 1 306.469 4.301 20 0 DIADMP CCCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001255332245 1062405223 /nfs/dbraw/zinc/40/52/23/1062405223.db2.gz LKPQKIOCXSDICB-INIZCTEOSA-N 2 1 306.469 4.301 20 0 DIADMP CCCC[C@H](C)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001255329800 1062405447 /nfs/dbraw/zinc/40/54/47/1062405447.db2.gz POFLXFZMGMCLOC-SFHVURJKSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@@H](C)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001255329035 1062405661 /nfs/dbraw/zinc/40/56/61/1062405661.db2.gz HCTQNIIJOAODSP-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H](C)[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001255329035 1062405667 /nfs/dbraw/zinc/40/56/67/1062405667.db2.gz HCTQNIIJOAODSP-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H](C)[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001255329035 1062405672 /nfs/dbraw/zinc/40/56/72/1062405672.db2.gz HCTQNIIJOAODSP-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)C[N@H+](Cc1cccc(C2CC2)c1)CC1CC[NH+](C)CC1 ZINC001474678552 1062410051 /nfs/dbraw/zinc/41/00/51/1062410051.db2.gz VUUGKGUVYKNFAQ-UHFFFAOYSA-N 2 1 314.517 4.364 20 0 DIADMP c1ccc(CCC[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255376388 1062421487 /nfs/dbraw/zinc/42/14/87/1062421487.db2.gz IHTPGMHPYOYPIO-QFIPXVFZSA-N 2 1 322.496 4.264 20 0 DIADMP Cc1ccccc1C[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255378397 1062421624 /nfs/dbraw/zinc/42/16/24/1062421624.db2.gz NRCHMALWZDSIPM-OAQYLSRUSA-N 2 1 308.469 4.139 20 0 DIADMP Cc1ccnc([C@@H](C)[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255384289 1062421917 /nfs/dbraw/zinc/42/19/17/1062421917.db2.gz XJPJIHFDNCNYGI-QUCCMNQESA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccnc([C@@H](C)[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255384289 1062421926 /nfs/dbraw/zinc/42/19/26/1062421926.db2.gz XJPJIHFDNCNYGI-QUCCMNQESA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255380004 1062422987 /nfs/dbraw/zinc/42/29/87/1062422987.db2.gz YVXWCCGVVQVBBF-JOCHJYFZSA-N 2 1 322.496 4.182 20 0 DIADMP Cc1cccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255379916 1062423843 /nfs/dbraw/zinc/42/38/43/1062423843.db2.gz YMJGKAABWRCFIR-NRFANRHFSA-N 2 1 308.469 4.139 20 0 DIADMP FC1(F)CCC[C@@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255394172 1062427120 /nfs/dbraw/zinc/42/71/20/1062427120.db2.gz TUUNTSGERWWIPM-QZTJIDSGSA-N 2 1 322.443 4.209 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255391456 1062429651 /nfs/dbraw/zinc/42/96/51/1062429651.db2.gz QGKHYGQNVDNMCX-RLLQIKCJSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC(F)(F)C1 ZINC001255386420 1062430012 /nfs/dbraw/zinc/43/00/12/1062430012.db2.gz MPAIFLWFSMLOCR-QGZVFWFLSA-N 2 1 322.443 4.066 20 0 DIADMP C[C@@]1(F)CCCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398957 1062433244 /nfs/dbraw/zinc/43/32/44/1062433244.db2.gz NJNGCEWDNQDVFJ-VQTJNVASSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398957 1062433249 /nfs/dbraw/zinc/43/32/49/1062433249.db2.gz NJNGCEWDNQDVFJ-VQTJNVASSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398957 1062433257 /nfs/dbraw/zinc/43/32/57/1062433257.db2.gz NJNGCEWDNQDVFJ-VQTJNVASSA-N 2 1 318.480 4.255 20 0 DIADMP Cc1ccccc1C[N@H+](C)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255401434 1062433582 /nfs/dbraw/zinc/43/35/82/1062433582.db2.gz AEOVJLKFTJEOPP-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255401434 1062433589 /nfs/dbraw/zinc/43/35/89/1062433589.db2.gz AEOVJLKFTJEOPP-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255401434 1062433596 /nfs/dbraw/zinc/43/35/96/1062433596.db2.gz AEOVJLKFTJEOPP-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3Cc4ccccc4C3)CC2)cc1 ZINC001255399575 1062434724 /nfs/dbraw/zinc/43/47/24/1062434724.db2.gz VJUFPLARKXXUMN-NRFANRHFSA-N 2 1 306.453 4.057 20 0 DIADMP CCC1CC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255398596 1062434981 /nfs/dbraw/zinc/43/49/81/1062434981.db2.gz KYGFUUYTIYQVQR-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255397071 1062436181 /nfs/dbraw/zinc/43/61/81/1062436181.db2.gz DPUMOJVSMCRGFY-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255397071 1062436191 /nfs/dbraw/zinc/43/61/91/1062436191.db2.gz DPUMOJVSMCRGFY-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255397071 1062436199 /nfs/dbraw/zinc/43/61/99/1062436199.db2.gz DPUMOJVSMCRGFY-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[C@@H](C)C[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255405489 1062438751 /nfs/dbraw/zinc/43/87/51/1062438751.db2.gz NOBSAXOFUHNQDW-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@H+](Cc1ccsc1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407134 1062439052 /nfs/dbraw/zinc/43/90/52/1062439052.db2.gz WSPCGXDAQMHJOL-LJQANCHMSA-N 2 1 314.498 4.235 20 0 DIADMP C[N@@H+](Cc1ccsc1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407134 1062439070 /nfs/dbraw/zinc/43/90/70/1062439070.db2.gz WSPCGXDAQMHJOL-LJQANCHMSA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1ccsc1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255407134 1062439077 /nfs/dbraw/zinc/43/90/77/1062439077.db2.gz WSPCGXDAQMHJOL-LJQANCHMSA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1ccsc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255407134 1062439091 /nfs/dbraw/zinc/43/90/91/1062439091.db2.gz WSPCGXDAQMHJOL-LJQANCHMSA-N 2 1 314.498 4.235 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CCC[NH+](Cc3ccccc3)CC2)cc1 ZINC001255403849 1062441853 /nfs/dbraw/zinc/44/18/53/1062441853.db2.gz QIUSCYHIBQDAMB-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccc(C[NH+](C)[C@@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1 ZINC001255403849 1062441864 /nfs/dbraw/zinc/44/18/64/1062441864.db2.gz QIUSCYHIBQDAMB-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccc(C[NH+](C)[C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255403849 1062441880 /nfs/dbraw/zinc/44/18/80/1062441880.db2.gz QIUSCYHIBQDAMB-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP FC(F)[C@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255406127 1062442086 /nfs/dbraw/zinc/44/20/86/1062442086.db2.gz PCSXIUBRWDOTAV-ZWKOTPCHSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255406127 1062442098 /nfs/dbraw/zinc/44/20/98/1062442098.db2.gz PCSXIUBRWDOTAV-ZWKOTPCHSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255406127 1062442108 /nfs/dbraw/zinc/44/21/08/1062442108.db2.gz PCSXIUBRWDOTAV-ZWKOTPCHSA-N 2 1 322.443 4.018 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC[C@H]3c3ccccc3)CC2)cc1 ZINC001255408242 1062443376 /nfs/dbraw/zinc/44/33/76/1062443376.db2.gz IUISIWQDXBJHMV-VXKWHMMOSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CC[C@H]3c3ccccc3)CC2)cc1 ZINC001255408242 1062443388 /nfs/dbraw/zinc/44/33/88/1062443388.db2.gz IUISIWQDXBJHMV-VXKWHMMOSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CC[C@H]3c3ccccc3)CC2)cc1 ZINC001255408242 1062443393 /nfs/dbraw/zinc/44/33/93/1062443393.db2.gz IUISIWQDXBJHMV-VXKWHMMOSA-N 2 1 320.480 4.488 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CC[C@H]2CCc3ccccc32)cc1 ZINC001459872889 1062462875 /nfs/dbraw/zinc/46/28/75/1062462875.db2.gz IJONDQGKOTYROC-OAQYLSRUSA-N 2 1 322.496 4.300 20 0 DIADMP CC(C)C[N@H+](C1CCC(C(F)(F)F)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255512049 1062467568 /nfs/dbraw/zinc/46/75/68/1062467568.db2.gz PWGVMSHYPIVTRH-DHAXNPMCSA-N 2 1 320.443 4.335 20 0 DIADMP C[C@H](CC(F)(F)F)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255643305 1062495781 /nfs/dbraw/zinc/49/57/81/1062495781.db2.gz OSWOEVFAHYITQU-UMVBOHGHSA-N 2 1 306.416 4.232 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC001255676463 1062512082 /nfs/dbraw/zinc/51/20/82/1062512082.db2.gz MXTMBSGAWZCZGZ-RAFMOHDBSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC001255676463 1062512106 /nfs/dbraw/zinc/51/21/06/1062512106.db2.gz MXTMBSGAWZCZGZ-RAFMOHDBSA-N 2 1 300.490 4.441 20 0 DIADMP C[N@H+](Cc1ccc2ccccc2c1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255682444 1062514262 /nfs/dbraw/zinc/51/42/62/1062514262.db2.gz JJMPXOSERSOITO-WCRBZPEASA-N 2 1 308.469 4.287 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255682444 1062514282 /nfs/dbraw/zinc/51/42/82/1062514282.db2.gz JJMPXOSERSOITO-WCRBZPEASA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1ccc2ccccc2c1)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255682444 1062514298 /nfs/dbraw/zinc/51/42/98/1062514298.db2.gz JJMPXOSERSOITO-WCRBZPEASA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1ccc2ccccc2c1)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255682444 1062514319 /nfs/dbraw/zinc/51/43/19/1062514319.db2.gz JJMPXOSERSOITO-WCRBZPEASA-N 2 1 308.469 4.287 20 0 DIADMP CC(C)C[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255703024 1062528696 /nfs/dbraw/zinc/52/86/96/1062528696.db2.gz ZKNHMPVLBADYBL-FPCVCCKLSA-N 2 1 320.443 4.335 20 0 DIADMP C[C@@H](CSc1ccc(F)cc1)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC001255727852 1062545262 /nfs/dbraw/zinc/54/52/62/1062545262.db2.gz IFRBEKVDQYYIAO-HOTGVXAUSA-N 2 1 324.509 4.160 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255725995 1062546747 /nfs/dbraw/zinc/54/67/47/1062546747.db2.gz ZRGYCVYSOODSNY-ZBFHGGJFSA-N 2 1 320.443 4.304 20 0 DIADMP C[C@@H](CSc1ccc(F)cc1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001255737559 1062559826 /nfs/dbraw/zinc/55/98/26/1062559826.db2.gz IULVZWQRDRNHMK-HOTGVXAUSA-N 2 1 324.509 4.147 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001255793631 1062608509 /nfs/dbraw/zinc/60/85/09/1062608509.db2.gz NSMOFWHAGZLMDA-CTNGQTDRSA-N 2 1 314.517 4.266 20 0 DIADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CC1CCC(C(C)(C)C)CC1)C2 ZINC001460136341 1062654319 /nfs/dbraw/zinc/65/43/19/1062654319.db2.gz QVAOQUYVMQYJMR-QLOJAFMTSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CC1CCC(C(C)(C)C)CC1)C2 ZINC001460136341 1062654326 /nfs/dbraw/zinc/65/43/26/1062654326.db2.gz QVAOQUYVMQYJMR-QLOJAFMTSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CC1CCC(C(C)(C)C)CC1)C2 ZINC001460136341 1062654335 /nfs/dbraw/zinc/65/43/35/1062654335.db2.gz QVAOQUYVMQYJMR-QLOJAFMTSA-N 2 1 306.538 4.257 20 0 DIADMP [NH3+]C1(c2cccc(Cl)c2)CC[NH+](C2CCCCCC2)CC1 ZINC001255882826 1062655703 /nfs/dbraw/zinc/65/57/03/1062655703.db2.gz LRRGGZGAESZYDD-UHFFFAOYSA-N 2 1 306.881 4.313 20 0 DIADMP c1ccc(C[N@@H+]2C[C@@H]3C[NH+](C4CCCCCC4)CC[C@@H]3C2)cc1 ZINC001255893295 1062657952 /nfs/dbraw/zinc/65/79/52/1062657952.db2.gz HQZYRLMLXCUFDH-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3C[N@H+](C4CCCCCC4)CC[C@@H]3C2)cc1 ZINC001255893295 1062657960 /nfs/dbraw/zinc/65/79/60/1062657960.db2.gz HQZYRLMLXCUFDH-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3C[N@@H+](C4CCCCCC4)CC[C@@H]3C2)cc1 ZINC001255893295 1062657976 /nfs/dbraw/zinc/65/79/76/1062657976.db2.gz HQZYRLMLXCUFDH-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2C[C@H]3CC[NH+](C4CCCCCC4)C[C@@H]3C2)cc1 ZINC001255893293 1062658288 /nfs/dbraw/zinc/65/82/88/1062658288.db2.gz HQZYRLMLXCUFDH-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3CC[N@@H+](C4CCCCCC4)C[C@@H]3C2)cc1 ZINC001255893293 1062658293 /nfs/dbraw/zinc/65/82/93/1062658293.db2.gz HQZYRLMLXCUFDH-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3CC[N@H+](C4CCCCCC4)C[C@@H]3C2)cc1 ZINC001255893293 1062658318 /nfs/dbraw/zinc/65/83/18/1062658318.db2.gz HQZYRLMLXCUFDH-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(-c2nccs2)cc1 ZINC001255947996 1062668835 /nfs/dbraw/zinc/66/88/35/1062668835.db2.gz CATYDBMXBFULJF-OAHLLOKOSA-N 2 1 317.502 4.020 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](c1ccccc1F)C1CCC1 ZINC001255948658 1062670158 /nfs/dbraw/zinc/67/01/58/1062670158.db2.gz PLBLZWAQUNQRLW-KXBFYZLASA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+](Cc1ccccn1)C1CCCCC1 ZINC001255966457 1062673539 /nfs/dbraw/zinc/67/35/39/1062673539.db2.gz KSBXXVHXMPVXRK-GOSISDBHSA-N 2 1 317.521 4.337 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001255962220 1062674276 /nfs/dbraw/zinc/67/42/76/1062674276.db2.gz SCHHDCOHMBGMTB-LPHOPBHVSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001255962220 1062674281 /nfs/dbraw/zinc/67/42/81/1062674281.db2.gz SCHHDCOHMBGMTB-LPHOPBHVSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001255963698 1062674666 /nfs/dbraw/zinc/67/46/66/1062674666.db2.gz JQOZVOHWMCPUDH-HOTGVXAUSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001255963698 1062674669 /nfs/dbraw/zinc/67/46/69/1062674669.db2.gz JQOZVOHWMCPUDH-HOTGVXAUSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CCCC[C@H]1c1ccccc1F ZINC001255962219 1062674996 /nfs/dbraw/zinc/67/49/96/1062674996.db2.gz SCHHDCOHMBGMTB-APWZRJJASA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CCCC[C@H]1c1ccccc1F ZINC001255962219 1062675008 /nfs/dbraw/zinc/67/50/08/1062675008.db2.gz SCHHDCOHMBGMTB-APWZRJJASA-N 2 1 306.469 4.473 20 0 DIADMP c1ccc(C2([NH2+]C3CC[NH+](C4CC4)CC3)CCCCCC2)cc1 ZINC001256067648 1062691692 /nfs/dbraw/zinc/69/16/92/1062691692.db2.gz XQKCPNMWZFAPBZ-UHFFFAOYSA-N 2 1 312.501 4.453 20 0 DIADMP CC[NH+]1CCC([N@H+](C)[C@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256118216 1062715793 /nfs/dbraw/zinc/71/57/93/1062715793.db2.gz KCHMZHLQMSTYBP-ICSRJNTNSA-N 2 1 300.490 4.129 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)[C@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256118216 1062715816 /nfs/dbraw/zinc/71/58/16/1062715816.db2.gz KCHMZHLQMSTYBP-ICSRJNTNSA-N 2 1 300.490 4.129 20 0 DIADMP CC[N@@H+](C)C1CC[NH+]([C@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256121556 1062721455 /nfs/dbraw/zinc/72/14/55/1062721455.db2.gz VSPSDQJMUJQOTA-ICSRJNTNSA-N 2 1 300.490 4.129 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(SC(F)(F)F)cc1 ZINC001256202028 1062747315 /nfs/dbraw/zinc/74/73/15/1062747315.db2.gz SBTYKVWAABPOLW-LLVKDONJSA-N 2 1 318.408 4.043 20 0 DIADMP CC(C)CC[C@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001256371613 1062796181 /nfs/dbraw/zinc/79/61/81/1062796181.db2.gz RMVHUHZOPOYTGP-SFHVURJKSA-N 2 1 314.517 4.334 20 0 DIADMP CC(C)CC[C@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001256371613 1062796194 /nfs/dbraw/zinc/79/61/94/1062796194.db2.gz RMVHUHZOPOYTGP-SFHVURJKSA-N 2 1 314.517 4.334 20 0 DIADMP Cc1csc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256520479 1062842872 /nfs/dbraw/zinc/84/28/72/1062842872.db2.gz PPPWXBVOESDHQK-AEFFLSMTSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1csc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256520479 1062842896 /nfs/dbraw/zinc/84/28/96/1062842896.db2.gz PPPWXBVOESDHQK-AEFFLSMTSA-N 2 1 314.498 4.199 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC001256526617 1062846732 /nfs/dbraw/zinc/84/67/32/1062846732.db2.gz NUACHYCTNJQEOX-QMMLZNLJSA-N 2 1 323.484 4.175 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC001256526617 1062846763 /nfs/dbraw/zinc/84/67/63/1062846763.db2.gz NUACHYCTNJQEOX-QMMLZNLJSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256536876 1062854220 /nfs/dbraw/zinc/85/42/20/1062854220.db2.gz GXCTWAHDZDMERA-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC[C@@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256536876 1062854247 /nfs/dbraw/zinc/85/42/47/1062854247.db2.gz GXCTWAHDZDMERA-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536876 1062854267 /nfs/dbraw/zinc/85/42/67/1062854267.db2.gz GXCTWAHDZDMERA-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536876 1062854289 /nfs/dbraw/zinc/85/42/89/1062854289.db2.gz GXCTWAHDZDMERA-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)C2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536848 1062856090 /nfs/dbraw/zinc/85/60/90/1062856090.db2.gz JARYTXHSRNNQKD-FXAWDEMLSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)C2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256536848 1062856109 /nfs/dbraw/zinc/85/61/09/1062856109.db2.gz JARYTXHSRNNQKD-FXAWDEMLSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536848 1062856125 /nfs/dbraw/zinc/85/61/25/1062856125.db2.gz JARYTXHSRNNQKD-FXAWDEMLSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536848 1062856156 /nfs/dbraw/zinc/85/61/56/1062856156.db2.gz JARYTXHSRNNQKD-FXAWDEMLSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256529448 1062856316 /nfs/dbraw/zinc/85/63/16/1062856316.db2.gz BZKCHQGGRLDMAV-KDXIVRHGSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256529448 1062856332 /nfs/dbraw/zinc/85/63/32/1062856332.db2.gz BZKCHQGGRLDMAV-KDXIVRHGSA-N 2 1 320.480 4.185 20 0 DIADMP Cc1cccc2c1C[NH+]([C@@H]1CC[N@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536789 1062856408 /nfs/dbraw/zinc/85/64/08/1062856408.db2.gz FWKVWUZLUCQKRO-GHTZIAJQSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[NH+]([C@@H]1CC[N@@H+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536789 1062856429 /nfs/dbraw/zinc/85/64/29/1062856429.db2.gz FWKVWUZLUCQKRO-GHTZIAJQSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@@H]1CC[NH+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536789 1062856452 /nfs/dbraw/zinc/85/64/52/1062856452.db2.gz FWKVWUZLUCQKRO-GHTZIAJQSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@@H]1CC[NH+](Cc3ccccc3)[C@@H](C)C1)C2 ZINC001256536789 1062856460 /nfs/dbraw/zinc/85/64/60/1062856460.db2.gz FWKVWUZLUCQKRO-GHTZIAJQSA-N 2 1 320.480 4.364 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC3(CCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256542955 1062858704 /nfs/dbraw/zinc/85/87/04/1062858704.db2.gz RHMHJROQOYYMQB-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC[C@@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540453 1062859680 /nfs/dbraw/zinc/85/96/80/1062859680.db2.gz HVDHOEZXGDYQRL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC[C@@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256540453 1062859699 /nfs/dbraw/zinc/85/96/99/1062859699.db2.gz HVDHOEZXGDYQRL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540453 1062859710 /nfs/dbraw/zinc/85/97/10/1062859710.db2.gz HVDHOEZXGDYQRL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540453 1062859734 /nfs/dbraw/zinc/85/97/34/1062859734.db2.gz HVDHOEZXGDYQRL-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCC[C@@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540452 1062860760 /nfs/dbraw/zinc/86/07/60/1062860760.db2.gz HVDHOEZXGDYQRL-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCCC[C@@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256540452 1062860784 /nfs/dbraw/zinc/86/07/84/1062860784.db2.gz HVDHOEZXGDYQRL-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540452 1062860801 /nfs/dbraw/zinc/86/08/01/1062860801.db2.gz HVDHOEZXGDYQRL-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540452 1062860821 /nfs/dbraw/zinc/86/08/21/1062860821.db2.gz HVDHOEZXGDYQRL-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256538282 1062863079 /nfs/dbraw/zinc/86/30/79/1062863079.db2.gz SSYGNVZSZSNRMH-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256538282 1062863097 /nfs/dbraw/zinc/86/30/97/1062863097.db2.gz SSYGNVZSZSNRMH-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256537876 1062863465 /nfs/dbraw/zinc/86/34/65/1062863465.db2.gz QPFYNKISZXUECQ-XLIONFOSSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256537876 1062863486 /nfs/dbraw/zinc/86/34/86/1062863486.db2.gz QPFYNKISZXUECQ-XLIONFOSSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256548945 1062867460 /nfs/dbraw/zinc/86/74/60/1062867460.db2.gz CSUAKBICHMBMCY-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256548945 1062867479 /nfs/dbraw/zinc/86/74/79/1062867479.db2.gz CSUAKBICHMBMCY-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256548945 1062867487 /nfs/dbraw/zinc/86/74/87/1062867487.db2.gz CSUAKBICHMBMCY-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256548945 1062867506 /nfs/dbraw/zinc/86/75/06/1062867506.db2.gz CSUAKBICHMBMCY-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP C[C@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256553670 1062878908 /nfs/dbraw/zinc/87/89/08/1062878908.db2.gz IVQSMSCRENJNHO-MJUUVYJYSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256553670 1062878927 /nfs/dbraw/zinc/87/89/27/1062878927.db2.gz IVQSMSCRENJNHO-MJUUVYJYSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256553670 1062878937 /nfs/dbraw/zinc/87/89/37/1062878937.db2.gz IVQSMSCRENJNHO-MJUUVYJYSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256553670 1062878950 /nfs/dbraw/zinc/87/89/50/1062878950.db2.gz IVQSMSCRENJNHO-MJUUVYJYSA-N 2 1 312.501 4.162 20 0 DIADMP CC(C)[N@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256551686 1062879009 /nfs/dbraw/zinc/87/90/09/1062879009.db2.gz UHHXAKYTOLAJHZ-XLIONFOSSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256551686 1062879022 /nfs/dbraw/zinc/87/90/22/1062879022.db2.gz UHHXAKYTOLAJHZ-XLIONFOSSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256551686 1062879038 /nfs/dbraw/zinc/87/90/38/1062879038.db2.gz UHHXAKYTOLAJHZ-XLIONFOSSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256551686 1062879059 /nfs/dbraw/zinc/87/90/59/1062879059.db2.gz UHHXAKYTOLAJHZ-XLIONFOSSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H](c2ccnc(Cl)c2)C2CC2)CC1 ZINC001256563565 1062889235 /nfs/dbraw/zinc/88/92/35/1062889235.db2.gz FKVFFOUBKLWGSE-QGZVFWFLSA-N 2 1 321.896 4.039 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H](c2ccnc(Cl)c2)C2CC2)CC1 ZINC001256563563 1062891143 /nfs/dbraw/zinc/89/11/43/1062891143.db2.gz FKVFFOUBKLWGSE-KRWDZBQOSA-N 2 1 321.896 4.039 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CCC[C@H]2Cc2ccc(F)cc2)CC1 ZINC001256577236 1062899851 /nfs/dbraw/zinc/89/98/51/1062899851.db2.gz FWMLWGXBWILHHI-IBGZPJMESA-N 2 1 318.480 4.096 20 0 DIADMP CCCC[N@@H+](C[C@H]1CCC(C)(C)O1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001460541111 1062902029 /nfs/dbraw/zinc/90/20/29/1062902029.db2.gz IGBNJHSPUQHJGS-QGZVFWFLSA-N 2 1 324.553 4.355 20 0 DIADMP Cc1ccc(C)c(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001256595532 1062907264 /nfs/dbraw/zinc/90/72/64/1062907264.db2.gz FSNHMJJVTZJIDZ-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP Cc1ccc2c(c1)CC[C@H]2[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001256599278 1062908856 /nfs/dbraw/zinc/90/88/56/1062908856.db2.gz OWJRISJPIAUJRS-JOCHJYFZSA-N 2 1 320.480 4.237 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001256599279 1062911205 /nfs/dbraw/zinc/91/12/05/1062911205.db2.gz OWJRISJPIAUJRS-QFIPXVFZSA-N 2 1 320.480 4.237 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccncc1 ZINC001256601627 1062913230 /nfs/dbraw/zinc/91/32/30/1062913230.db2.gz UDJHVFXMUZLGRD-OAQYLSRUSA-N 2 1 323.484 4.177 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cccc3ncccc23)CC1 ZINC001460577218 1062920439 /nfs/dbraw/zinc/92/04/39/1062920439.db2.gz IQGFILUGFNZREQ-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC[C@@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460721487 1063013769 /nfs/dbraw/zinc/01/37/69/1063013769.db2.gz VPGDPIGWLHDBIS-CVEARBPZSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CC[C@@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460721487 1063013793 /nfs/dbraw/zinc/01/37/93/1063013793.db2.gz VPGDPIGWLHDBIS-CVEARBPZSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CC[C@@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460721487 1063013814 /nfs/dbraw/zinc/01/38/14/1063013814.db2.gz VPGDPIGWLHDBIS-CVEARBPZSA-N 2 1 322.443 4.017 20 0 DIADMP CC[C@H]1c2ccccc2CC[N@H+]1C1CCN(c2cc[nH+]cc2)CC1 ZINC001256861827 1063018889 /nfs/dbraw/zinc/01/88/89/1063018889.db2.gz COTKYFWRBBLQKT-NRFANRHFSA-N 2 1 321.468 4.060 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256865222 1063023721 /nfs/dbraw/zinc/02/37/21/1063023721.db2.gz VFYSSXDBLPVOLZ-UHFFFAOYSA-N 2 1 323.484 4.189 20 0 DIADMP CCC1CCC([N@@H+](Cc2ccncc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001256870160 1063024399 /nfs/dbraw/zinc/02/43/99/1063024399.db2.gz NXVSCWWOLIWRNI-YAEFEIELSA-N 2 1 315.505 4.122 20 0 DIADMP CCC1CCC([N@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001256871081 1063028054 /nfs/dbraw/zinc/02/80/54/1063028054.db2.gz IKNUBHCWABIBCB-ZTOOSOLZSA-N 2 1 318.530 4.081 20 0 DIADMP CCC1CCC([N@@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001256871081 1063028071 /nfs/dbraw/zinc/02/80/71/1063028071.db2.gz IKNUBHCWABIBCB-ZTOOSOLZSA-N 2 1 318.530 4.081 20 0 DIADMP CCC1CCC([NH+]2C[C@H]3C[N@@H+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001256871081 1063028084 /nfs/dbraw/zinc/02/80/84/1063028084.db2.gz IKNUBHCWABIBCB-ZTOOSOLZSA-N 2 1 318.530 4.081 20 0 DIADMP CCC1CCC([NH+]2C[C@H]3C[N@H+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001256871081 1063028100 /nfs/dbraw/zinc/02/81/00/1063028100.db2.gz IKNUBHCWABIBCB-ZTOOSOLZSA-N 2 1 318.530 4.081 20 0 DIADMP CC(C)(Cc1ccc(F)cc1)[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256896905 1063037433 /nfs/dbraw/zinc/03/74/33/1063037433.db2.gz FTCATIWTDZKOFN-GOSISDBHSA-N 2 1 318.480 4.143 20 0 DIADMP CC(C)(Cc1ccc(F)cc1)[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256896905 1063037452 /nfs/dbraw/zinc/03/74/52/1063037452.db2.gz FTCATIWTDZKOFN-GOSISDBHSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@H]([NH3+])c1cn([C@H]2CCC[N@H+](C3CCCC3)C2)c2ccccc12 ZINC001256909960 1063046137 /nfs/dbraw/zinc/04/61/37/1063046137.db2.gz VIYXEGLFCHWXBR-RDJZCZTQSA-N 2 1 311.473 4.241 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@@H+]2C2CC[NH+](C(C)C)CC2)cc1 ZINC001257215922 1063142867 /nfs/dbraw/zinc/14/28/67/1063142867.db2.gz AOXIINCAQOQPQW-HXUWFJFHSA-N 2 1 316.489 4.095 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2C2CC[NH+](C(C)C)CC2)cc1 ZINC001257215922 1063142884 /nfs/dbraw/zinc/14/28/84/1063142884.db2.gz AOXIINCAQOQPQW-HXUWFJFHSA-N 2 1 316.489 4.095 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001257221667 1063146264 /nfs/dbraw/zinc/14/62/64/1063146264.db2.gz BWHRVPNVPGTWBO-INIZCTEOSA-N 2 1 306.881 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001257221667 1063146276 /nfs/dbraw/zinc/14/62/76/1063146276.db2.gz BWHRVPNVPGTWBO-INIZCTEOSA-N 2 1 306.881 4.002 20 0 DIADMP CCC[C@H](CC)[NH2+][C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1[NH3+] ZINC001257250401 1063160189 /nfs/dbraw/zinc/16/01/89/1063160189.db2.gz MWAUQDWQPICEMM-VMHNJKNPSA-N 2 1 320.480 4.142 20 0 DIADMP CCC[C@@H](CC)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257264628 1063169038 /nfs/dbraw/zinc/16/90/38/1063169038.db2.gz PLJSQKFVANYKKV-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](CC)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001257271807 1063174165 /nfs/dbraw/zinc/17/41/65/1063174165.db2.gz TVFTWNWFHRSRJZ-ZCNNSNEGSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001257303381 1063190429 /nfs/dbraw/zinc/19/04/29/1063190429.db2.gz OJRJUAXRUYNRDZ-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP CCC(CC)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001257303381 1063190442 /nfs/dbraw/zinc/19/04/42/1063190442.db2.gz OJRJUAXRUYNRDZ-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP CCC(CC)[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001257299027 1063191339 /nfs/dbraw/zinc/19/13/39/1063191339.db2.gz DSNGMFGHFIWXPZ-UFYCRDLUSA-N 2 1 300.490 4.286 20 0 DIADMP CCC(CC)[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001257299027 1063191347 /nfs/dbraw/zinc/19/13/47/1063191347.db2.gz DSNGMFGHFIWXPZ-UFYCRDLUSA-N 2 1 300.490 4.286 20 0 DIADMP CCC(CC)[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001257299027 1063191354 /nfs/dbraw/zinc/19/13/54/1063191354.db2.gz DSNGMFGHFIWXPZ-UFYCRDLUSA-N 2 1 300.490 4.286 20 0 DIADMP CCC(CC)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257301511 1063191390 /nfs/dbraw/zinc/19/13/90/1063191390.db2.gz HVEJDROKYVRCMI-RTBURBONSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257301511 1063191398 /nfs/dbraw/zinc/19/13/98/1063191398.db2.gz HVEJDROKYVRCMI-RTBURBONSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257301511 1063191407 /nfs/dbraw/zinc/19/14/07/1063191407.db2.gz HVEJDROKYVRCMI-RTBURBONSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001461045189 1063211527 /nfs/dbraw/zinc/21/15/27/1063211527.db2.gz QJCZIUYFGMPXRZ-MBOZVWFJSA-N 2 1 300.490 4.197 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257333036 1063213029 /nfs/dbraw/zinc/21/30/29/1063213029.db2.gz DNHBZBZPEOFLCD-UAPYVXQJSA-N 2 1 303.494 4.122 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001461047356 1063215818 /nfs/dbraw/zinc/21/58/18/1063215818.db2.gz VBBPDLGQBPTPMB-GASCZTMLSA-N 2 1 322.924 4.414 20 0 DIADMP CCCC(CCC)[NH+]1C[C@H]2C[NH+](Cc3cccs3)C[C@@H]2C1 ZINC001257338453 1063216785 /nfs/dbraw/zinc/21/67/85/1063216785.db2.gz WOLISDCRXSGUOJ-HZPDHXFCSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC(CCC)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257340010 1063219926 /nfs/dbraw/zinc/21/99/26/1063219926.db2.gz BDHOHPYBAXXEOJ-LJQANCHMSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC(CCC)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257340010 1063219941 /nfs/dbraw/zinc/21/99/41/1063219941.db2.gz BDHOHPYBAXXEOJ-LJQANCHMSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC(CCC)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257340010 1063219956 /nfs/dbraw/zinc/21/99/56/1063219956.db2.gz BDHOHPYBAXXEOJ-LJQANCHMSA-N 2 1 302.506 4.409 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC001461057564 1063224972 /nfs/dbraw/zinc/22/49/72/1063224972.db2.gz HDYVUDSUHLLNMX-FCHUYYIVSA-N 2 1 320.480 4.378 20 0 DIADMP CCCCCC[C@@H](C)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001257365337 1063234442 /nfs/dbraw/zinc/23/44/42/1063234442.db2.gz KSXXOGSXCLVZIU-QZTJIDSGSA-N 2 1 324.553 4.357 20 0 DIADMP CCCC[C@H](CC)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257424078 1063269939 /nfs/dbraw/zinc/26/99/39/1063269939.db2.gz AFRDFXGDMIXQMP-UXHICEINSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@H](CC)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257424078 1063269959 /nfs/dbraw/zinc/26/99/59/1063269959.db2.gz AFRDFXGDMIXQMP-UXHICEINSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@H](CC)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257424078 1063269979 /nfs/dbraw/zinc/26/99/79/1063269979.db2.gz AFRDFXGDMIXQMP-UXHICEINSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@H](CC)[NH+]1C[C@@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257421178 1063270963 /nfs/dbraw/zinc/27/09/63/1063270963.db2.gz UGXLEYWSQJMNCW-ULQDDVLXSA-N 2 1 306.519 4.081 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+](C4CCCCC4)C3)CC2)cc1 ZINC001257460289 1063286606 /nfs/dbraw/zinc/28/66/06/1063286606.db2.gz YKTKHADTLIJAAM-UHFFFAOYSA-N 2 1 312.501 4.307 20 0 DIADMP CCC[C@H](C)CC[C@H](C)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001257471400 1063294746 /nfs/dbraw/zinc/29/47/46/1063294746.db2.gz NOZSHMXTKOBQKF-IRXDYDNUSA-N 3 1 313.574 4.067 20 0 DIADMP CCC[C@H](C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC001461170776 1063308937 /nfs/dbraw/zinc/30/89/37/1063308937.db2.gz MVGMKCZSPNHLCU-AZUAARDMSA-N 2 1 302.506 4.280 20 0 DIADMP CCCCC[C@@H](C)N[C@@H](C[NH3+])c1ccc(Br)cc1 ZINC001257501531 1063310705 /nfs/dbraw/zinc/31/07/05/1063310705.db2.gz BKIVENPUXMTACZ-DOMZBBRYSA-N 2 1 313.283 4.007 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)c1 ZINC001461188318 1063319665 /nfs/dbraw/zinc/31/96/65/1063319665.db2.gz DPTAEDRCZWYUGS-UHFFFAOYSA-N 2 1 312.457 4.254 20 0 DIADMP CCCCC[C@H](C)[NH+]1C[C@H]2C[NH+](Cc3cccs3)C[C@@H]2C1 ZINC001257512925 1063322514 /nfs/dbraw/zinc/32/25/14/1063322514.db2.gz QMJSQWOWBKQWKC-GVDBMIGSSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257517693 1063325473 /nfs/dbraw/zinc/32/54/73/1063325473.db2.gz ZGLUAUDWBFXSHS-QUCCMNQESA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@@H](C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257517693 1063325492 /nfs/dbraw/zinc/32/54/92/1063325492.db2.gz ZGLUAUDWBFXSHS-QUCCMNQESA-N 2 1 302.506 4.409 20 0 DIADMP CCCCC[C@@H](C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257517693 1063325509 /nfs/dbraw/zinc/32/55/09/1063325509.db2.gz ZGLUAUDWBFXSHS-QUCCMNQESA-N 2 1 302.506 4.409 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C[C@@H](c2ccccc2)C(C)C)C1 ZINC001461373848 1063453810 /nfs/dbraw/zinc/45/38/10/1063453810.db2.gz VAHZPFVFOFFCBI-TZIWHRDSSA-N 2 1 316.533 4.384 20 0 DIADMP CCCc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC001461373869 1063454344 /nfs/dbraw/zinc/45/43/44/1063454344.db2.gz VJQCLYSTIJVYDX-MRXNPFEDSA-N 2 1 308.535 4.158 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](c2ccccc2F)C(C)C)CC1 ZINC001258006497 1063460899 /nfs/dbraw/zinc/46/08/99/1063460899.db2.gz ICWBAFYJLXJLQX-LJQANCHMSA-N 2 1 306.469 4.233 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+]C2(c3cccc(Cl)c3)CCC2)CC1 ZINC001258008198 1063462264 /nfs/dbraw/zinc/46/22/64/1063462264.db2.gz KIGYCUDXAXQNHU-UHFFFAOYSA-N 2 1 320.908 4.429 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCC[C@@H]2c2cccc(F)c2)CC1 ZINC001258014390 1063462840 /nfs/dbraw/zinc/46/28/40/1063462840.db2.gz ILKSBTJPSWHPLV-LJQANCHMSA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC1 ZINC001258014390 1063462849 /nfs/dbraw/zinc/46/28/49/1063462849.db2.gz ILKSBTJPSWHPLV-LJQANCHMSA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCCC[C@@H]2c2ccccc2)CC1 ZINC001258012585 1063462891 /nfs/dbraw/zinc/46/28/91/1063462891.db2.gz ZTGZRBMZQYKXQQ-HXUWFJFHSA-N 2 1 300.490 4.334 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1cc(F)cc(F)c1 ZINC001258009398 1063463706 /nfs/dbraw/zinc/46/37/06/1063463706.db2.gz VOYONYONZYJANU-GOSISDBHSA-N 2 1 310.432 4.126 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001258017276 1063465891 /nfs/dbraw/zinc/46/58/91/1063465891.db2.gz YUBIHDWIJFGXHU-QGZVFWFLSA-N 2 1 320.908 4.250 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001258017276 1063465900 /nfs/dbraw/zinc/46/59/00/1063465900.db2.gz YUBIHDWIJFGXHU-QGZVFWFLSA-N 2 1 320.908 4.250 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)C2CC[NH+](CC(C)C)CC2)c1C ZINC001258018735 1063466248 /nfs/dbraw/zinc/46/62/48/1063466248.db2.gz SBUFNAPXUZJGCQ-UHFFFAOYSA-N 2 1 314.517 4.388 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC001258016139 1063468109 /nfs/dbraw/zinc/46/81/09/1063468109.db2.gz BHTTWNZVJSQTOS-OAHLLOKOSA-N 2 1 308.897 4.453 20 0 DIADMP Cc1cccc([C@H]2CCCCC[N@H+]2CCCc2c[nH+]cn2C)c1 ZINC001473178776 1063484390 /nfs/dbraw/zinc/48/43/90/1063484390.db2.gz LBWVEXZWFSCKPG-HXUWFJFHSA-N 2 1 311.473 4.278 20 0 DIADMP Cc1cccc([C@H]2CCCCC[N@@H+]2CCCc2c[nH+]cn2C)c1 ZINC001473178776 1063484411 /nfs/dbraw/zinc/48/44/11/1063484411.db2.gz LBWVEXZWFSCKPG-HXUWFJFHSA-N 2 1 311.473 4.278 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)CCC[NH+]2CCCCC2)cc1 ZINC001473186912 1063498044 /nfs/dbraw/zinc/49/80/44/1063498044.db2.gz NLYBVJJROCUDDT-SFTDATJTSA-N 2 1 314.517 4.439 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001258074011 1063500281 /nfs/dbraw/zinc/50/02/81/1063500281.db2.gz HJRJYUHWMGPYKF-ROUUACIJSA-N 2 1 324.553 4.022 20 0 DIADMP COc1ccccc1C1([NH3+])CC[NH+]([C@@H](C)CCC=C(C)C)CC1 ZINC001258085661 1063509428 /nfs/dbraw/zinc/50/94/28/1063509428.db2.gz NVASMEVNGIUCIY-KRWDZBQOSA-N 2 1 316.489 4.080 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001258089297 1063513674 /nfs/dbraw/zinc/51/36/74/1063513674.db2.gz SQONFWYXQNCCIM-KURKYZTESA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001258089297 1063513694 /nfs/dbraw/zinc/51/36/94/1063513694.db2.gz SQONFWYXQNCCIM-KURKYZTESA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH+]1C[C@H]2C[N@@H+](Cc3cccs3)C[C@H]2C1 ZINC001258089297 1063513714 /nfs/dbraw/zinc/51/37/14/1063513714.db2.gz SQONFWYXQNCCIM-KURKYZTESA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH+]1C[C@H]2C[N@H+](Cc3cccs3)C[C@H]2C1 ZINC001258089297 1063513734 /nfs/dbraw/zinc/51/37/34/1063513734.db2.gz SQONFWYXQNCCIM-KURKYZTESA-N 2 1 318.530 4.247 20 0 DIADMP Cc1ccc(C)c(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC001258131421 1063528368 /nfs/dbraw/zinc/52/83/68/1063528368.db2.gz IWRHYXBHHGPCGY-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP CCCC1CC[NH+](C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC001258142896 1063532944 /nfs/dbraw/zinc/53/29/44/1063532944.db2.gz CQTYEGIXOAWRNI-UHFFFAOYSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@@H]1CC([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@@H](C)C1 ZINC001258160125 1063535492 /nfs/dbraw/zinc/53/54/92/1063535492.db2.gz JSLBAOUUGIWPGA-ROUUACIJSA-N 2 1 314.517 4.455 20 0 DIADMP CSCC[C@@H](C)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258209430 1063560073 /nfs/dbraw/zinc/56/00/73/1063560073.db2.gz PWXGWXJGKNYTJV-KBAYOESNSA-N 2 1 312.567 4.280 20 0 DIADMP CSCC[C@H](C)[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258211890 1063562875 /nfs/dbraw/zinc/56/28/75/1063562875.db2.gz OBCNLZYMWFHPOS-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H](C)CCSC)CC1 ZINC001258219156 1063566642 /nfs/dbraw/zinc/56/66/42/1063566642.db2.gz DATBITIMFGVORE-KRWDZBQOSA-N 2 1 320.546 4.115 20 0 DIADMP Cc1cccc(N(C2CC[NH2+]CC2)C2CCCCCCC2)[nH+]1 ZINC001258244145 1063578493 /nfs/dbraw/zinc/57/84/93/1063578493.db2.gz PVCUTNHLDDJDNC-UHFFFAOYSA-N 2 1 301.478 4.061 20 0 DIADMP CC1(C)CCC[C@@H]([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C1 ZINC001258284194 1063585702 /nfs/dbraw/zinc/58/57/02/1063585702.db2.gz APQNEIIQIYGKCI-GOSISDBHSA-N 2 1 304.522 4.296 20 0 DIADMP CC1(C)CCC[C@@H]([N@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285510 1063586575 /nfs/dbraw/zinc/58/65/75/1063586575.db2.gz MOICOTCICNTSGJ-IXDOHACOSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC[C@@H]([N@@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285510 1063586591 /nfs/dbraw/zinc/58/65/91/1063586591.db2.gz MOICOTCICNTSGJ-IXDOHACOSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC[C@@H]([NH+]2C[C@H]3C[N@@H+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285510 1063586606 /nfs/dbraw/zinc/58/66/06/1063586606.db2.gz MOICOTCICNTSGJ-IXDOHACOSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC[C@@H]([NH+]2C[C@H]3C[N@H+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285510 1063586620 /nfs/dbraw/zinc/58/66/20/1063586620.db2.gz MOICOTCICNTSGJ-IXDOHACOSA-N 2 1 318.530 4.081 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+][C@@H]1CCC[N@@H+](C)CC1 ZINC001258296409 1063591381 /nfs/dbraw/zinc/59/13/81/1063591381.db2.gz WPKHSFKBOXIMQS-JKSUJKDBSA-N 2 1 324.534 4.144 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258330161 1063612972 /nfs/dbraw/zinc/61/29/72/1063612972.db2.gz QRZXJIAIBUSQJH-BFYDXBDKSA-N 2 1 312.567 4.421 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+](Cc1ccccc1)C[C@@H](C)C[NH3+] ZINC001258333986 1063618226 /nfs/dbraw/zinc/61/82/26/1063618226.db2.gz QQASSIUUEZSNES-HOTGVXAUSA-N 2 1 308.535 4.004 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001258346560 1063620417 /nfs/dbraw/zinc/62/04/17/1063620417.db2.gz SZEWOGHJGCJKHU-ULQDDVLXSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258346560 1063620433 /nfs/dbraw/zinc/62/04/33/1063620433.db2.gz SZEWOGHJGCJKHU-ULQDDVLXSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001258346560 1063620445 /nfs/dbraw/zinc/62/04/45/1063620445.db2.gz SZEWOGHJGCJKHU-ULQDDVLXSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001258346559 1063620507 /nfs/dbraw/zinc/62/05/07/1063620507.db2.gz SZEWOGHJGCJKHU-IXDOHACOSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258346559 1063620516 /nfs/dbraw/zinc/62/05/16/1063620516.db2.gz SZEWOGHJGCJKHU-IXDOHACOSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001258346559 1063620529 /nfs/dbraw/zinc/62/05/29/1063620529.db2.gz SZEWOGHJGCJKHU-IXDOHACOSA-N 2 1 312.567 4.245 20 0 DIADMP c1cc(C2CCC2)ccc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461665729 1063647508 /nfs/dbraw/zinc/64/75/08/1063647508.db2.gz UQEJFCUHZHGHPS-LJQANCHMSA-N 2 1 312.501 4.166 20 0 DIADMP CCCCC[C@@H](CC)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258440333 1063654879 /nfs/dbraw/zinc/65/48/79/1063654879.db2.gz PIOLCOUWGMYZOD-QZTJIDSGSA-N 2 1 324.553 4.357 20 0 DIADMP CCCCC[C@H](CC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258444426 1063656495 /nfs/dbraw/zinc/65/64/95/1063656495.db2.gz WZINXTJYASYMBA-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258596980 1063700341 /nfs/dbraw/zinc/70/03/41/1063700341.db2.gz CUTRCTNWWSZTOM-FHWLQOOXSA-N 2 1 300.490 4.337 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001258654175 1063727614 /nfs/dbraw/zinc/72/76/14/1063727614.db2.gz ITKVCOSILDJXRF-SXLOBPIMSA-N 2 1 302.506 4.106 20 0 DIADMP CCCCC[C@@H](CCC)[NH+]1CCC([NH3+])(c2cccnc2)CC1 ZINC001258667723 1063734640 /nfs/dbraw/zinc/73/46/40/1063734640.db2.gz SFOWCTHQNSKRAK-GOSISDBHSA-N 2 1 303.494 4.080 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@H]2C[C@@H](C)CC(C)(C)C2)CC1 ZINC001258688299 1063753868 /nfs/dbraw/zinc/75/38/68/1063753868.db2.gz OAKIIQGWVMEUHC-QAPCUYQASA-N 2 1 315.505 4.163 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@@H]2C[C@@H](C)CC(C)(C)C2)CC1 ZINC001258688297 1063754220 /nfs/dbraw/zinc/75/42/20/1063754220.db2.gz OAKIIQGWVMEUHC-CRAIPNDOSA-N 2 1 315.505 4.163 20 0 DIADMP CC[C@@H]1CCC[C@H](C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC001461861791 1063755910 /nfs/dbraw/zinc/75/59/10/1063755910.db2.gz LQKUMYBUKQEPRC-RMJJICAUSA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001461861791 1063755924 /nfs/dbraw/zinc/75/59/24/1063755924.db2.gz LQKUMYBUKQEPRC-RMJJICAUSA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001461861791 1063755936 /nfs/dbraw/zinc/75/59/36/1063755936.db2.gz LQKUMYBUKQEPRC-RMJJICAUSA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC001461861757 1063756763 /nfs/dbraw/zinc/75/67/63/1063756763.db2.gz LQKUMYBUKQEPRC-AJYBTWMASA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001461861757 1063756771 /nfs/dbraw/zinc/75/67/71/1063756771.db2.gz LQKUMYBUKQEPRC-AJYBTWMASA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001461861757 1063756784 /nfs/dbraw/zinc/75/67/84/1063756784.db2.gz LQKUMYBUKQEPRC-AJYBTWMASA-N 2 1 304.522 4.152 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@H]3CC[N@@H+](CC)[C@H](C)C3)oc21 ZINC001461861967 1063758321 /nfs/dbraw/zinc/75/83/21/1063758321.db2.gz RNMNXEUFQMAFDK-QAPCUYQASA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@H]3CC[N@H+](CC)[C@H](C)C3)oc21 ZINC001461861967 1063758329 /nfs/dbraw/zinc/75/83/29/1063758329.db2.gz RNMNXEUFQMAFDK-QAPCUYQASA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@@H+](C)[C@H]3CC[NH+](CC)[C@H](C)C3)oc21 ZINC001461861967 1063758340 /nfs/dbraw/zinc/75/83/40/1063758340.db2.gz RNMNXEUFQMAFDK-QAPCUYQASA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@H+](C)[C@H]3CC[NH+](CC)[C@H](C)C3)oc21 ZINC001461861967 1063758356 /nfs/dbraw/zinc/75/83/56/1063758356.db2.gz RNMNXEUFQMAFDK-QAPCUYQASA-N 2 1 314.473 4.300 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+](C)C1CC[NH+](CC)CC1 ZINC001258714717 1063770181 /nfs/dbraw/zinc/77/01/81/1063770181.db2.gz RNYYYDBHJRKRCL-HXUWFJFHSA-N 2 1 302.506 4.204 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](C)C1CC[NH+](CC)CC1 ZINC001258714717 1063770196 /nfs/dbraw/zinc/77/01/96/1063770196.db2.gz RNYYYDBHJRKRCL-HXUWFJFHSA-N 2 1 302.506 4.204 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001258775780 1063815859 /nfs/dbraw/zinc/81/58/59/1063815859.db2.gz DGCUXAJIGWLQPY-GOSISDBHSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001258775780 1063815874 /nfs/dbraw/zinc/81/58/74/1063815874.db2.gz DGCUXAJIGWLQPY-GOSISDBHSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2cc(C)cc(C)c2)CC1 ZINC001258777320 1063818833 /nfs/dbraw/zinc/81/88/33/1063818833.db2.gz RBWJYEWTADRXKW-FQEVSTJZSA-N 2 1 300.490 4.315 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H]2c2cc(C)cc(C)c2)CC1 ZINC001258777320 1063818848 /nfs/dbraw/zinc/81/88/48/1063818848.db2.gz RBWJYEWTADRXKW-FQEVSTJZSA-N 2 1 300.490 4.315 20 0 DIADMP CCC[NH+]1CCC([NH+]2CCC(c3ccc(F)cc3F)CC2)CC1 ZINC001258778067 1063819402 /nfs/dbraw/zinc/81/94/02/1063819402.db2.gz UDPCJKDIBATHAS-UHFFFAOYSA-N 2 1 322.443 4.019 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258784708 1063821807 /nfs/dbraw/zinc/82/18/07/1063821807.db2.gz BIVLKXKLZLCOCM-YJBOKZPZSA-N 2 1 306.469 4.290 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786142 1063822996 /nfs/dbraw/zinc/82/29/96/1063822996.db2.gz KPYAZFUIQRELCU-IZBJGVDFSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258785867 1063824441 /nfs/dbraw/zinc/82/44/41/1063824441.db2.gz JNSTXIVMDFMNGE-FFGOWVMKSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786892 1063826388 /nfs/dbraw/zinc/82/63/88/1063826388.db2.gz PSGMXCFKGDAOQV-LEAZDLGRSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@@H](C)C[C@H](CC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258799773 1063835018 /nfs/dbraw/zinc/83/50/18/1063835018.db2.gz IDDDPEXLZKZXSS-WBVHZDCISA-N 2 1 303.494 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258828771 1063852603 /nfs/dbraw/zinc/85/26/03/1063852603.db2.gz QUNFEFFENBAASN-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258828771 1063852616 /nfs/dbraw/zinc/85/26/16/1063852616.db2.gz QUNFEFFENBAASN-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258828771 1063852631 /nfs/dbraw/zinc/85/26/31/1063852631.db2.gz QUNFEFFENBAASN-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001258827729 1063853762 /nfs/dbraw/zinc/85/37/62/1063853762.db2.gz UOQJGBQZCMMQAS-YZGWKJHDSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258827729 1063853779 /nfs/dbraw/zinc/85/37/79/1063853779.db2.gz UOQJGBQZCMMQAS-YZGWKJHDSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258827729 1063853788 /nfs/dbraw/zinc/85/37/88/1063853788.db2.gz UOQJGBQZCMMQAS-YZGWKJHDSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001258842478 1063862356 /nfs/dbraw/zinc/86/23/56/1063862356.db2.gz KWVUVPCYXNEXGL-RTBURBONSA-N 2 1 300.490 4.004 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001258842478 1063862360 /nfs/dbraw/zinc/86/23/60/1063862360.db2.gz KWVUVPCYXNEXGL-RTBURBONSA-N 2 1 300.490 4.004 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[NH2+]CCP(C(C)C)C(C)C ZINC001258905642 1063879171 /nfs/dbraw/zinc/87/91/71/1063879171.db2.gz VINSAPJFMYCJAB-KRWDZBQOSA-N 2 1 302.487 4.385 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001258907911 1063880080 /nfs/dbraw/zinc/88/00/80/1063880080.db2.gz OCHAGTIKFIMJEL-OAHLLOKOSA-N 2 1 308.897 4.209 20 0 DIADMP CNc1ccccc1C[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC001262483215 1063964765 /nfs/dbraw/zinc/96/47/65/1063964765.db2.gz YUBPXAHGZOLFJS-QGZVFWFLSA-N 2 1 323.484 4.044 20 0 DIADMP CNc1ccccc1C[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC001262483214 1063965139 /nfs/dbraw/zinc/96/51/39/1063965139.db2.gz YUBPXAHGZOLFJS-KRWDZBQOSA-N 2 1 323.484 4.044 20 0 DIADMP Cc1cc(F)ccc1C[NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000379615849 1063984430 /nfs/dbraw/zinc/98/44/30/1063984430.db2.gz BHPXZESBPZEOIJ-QGZVFWFLSA-N 2 1 314.448 4.134 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379637609 1063984941 /nfs/dbraw/zinc/98/49/41/1063984941.db2.gz SPAFRROPEFXBAH-SQAAOVBZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379637609 1063984947 /nfs/dbraw/zinc/98/49/47/1063984947.db2.gz SPAFRROPEFXBAH-SQAAOVBZSA-N 2 1 314.517 4.454 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379633480 1063985345 /nfs/dbraw/zinc/98/53/45/1063985345.db2.gz OUBQSUQFVMAFIQ-CMKODMSKSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379633480 1063985351 /nfs/dbraw/zinc/98/53/51/1063985351.db2.gz OUBQSUQFVMAFIQ-CMKODMSKSA-N 2 1 302.506 4.454 20 0 DIADMP Cc1ccc(C)c(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379635005 1063985405 /nfs/dbraw/zinc/98/54/05/1063985405.db2.gz PZTGDESPVQJSQC-DENIHFKCSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c(C)c1 ZINC000379637583 1063985460 /nfs/dbraw/zinc/98/54/60/1063985460.db2.gz SMXOWCWZQJJGMJ-UGKGYDQZSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C)c(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379635009 1063985716 /nfs/dbraw/zinc/98/57/16/1063985716.db2.gz PZTGDESPVQJSQC-SIKLNZKXSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c(C)c1 ZINC000379637578 1063985843 /nfs/dbraw/zinc/98/58/43/1063985843.db2.gz SMXOWCWZQJJGMJ-DENIHFKCSA-N 2 1 322.496 4.446 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379638983 1063986299 /nfs/dbraw/zinc/98/62/99/1063986299.db2.gz VFCXYQNJNHMBOK-XMSQKQJNSA-N 2 1 322.496 4.392 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379638983 1063986305 /nfs/dbraw/zinc/98/63/05/1063986305.db2.gz VFCXYQNJNHMBOK-XMSQKQJNSA-N 2 1 322.496 4.392 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380945859 1063988896 /nfs/dbraw/zinc/98/88/96/1063988896.db2.gz OTJMELRVBAKCPP-MOPGFXCFSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380944340 1063989263 /nfs/dbraw/zinc/98/92/63/1063989263.db2.gz NYQMSHRAMSSRNW-YXYSEUPNSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@@H]([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380944341 1063989491 /nfs/dbraw/zinc/98/94/91/1063989491.db2.gz NYQMSHRAMSSRNW-ZFMNYDKASA-N 2 1 314.517 4.313 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC000381025450 1063991058 /nfs/dbraw/zinc/99/10/58/1063991058.db2.gz XVOOBYVOOULOAO-QCFAMHMHSA-N 2 1 314.517 4.313 20 0 DIADMP CCCC(CCC)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381799714 1063991645 /nfs/dbraw/zinc/99/16/45/1063991645.db2.gz RVLUHPQEERTVRK-MJGOQNOKSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000381310646 1063992235 /nfs/dbraw/zinc/99/22/35/1063992235.db2.gz NROZXSNYZUWQOG-VNTMZGSJSA-N 2 1 300.490 4.065 20 0 DIADMP CCCC(CCC)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381799713 1063992843 /nfs/dbraw/zinc/99/28/43/1063992843.db2.gz RVLUHPQEERTVRK-IEBWSBKVSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)C1 ZINC000381810945 1063993517 /nfs/dbraw/zinc/99/35/17/1063993517.db2.gz ZSOFQPQFINGWNB-BVJIBDCISA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660907 1064166246 /nfs/dbraw/zinc/16/62/46/1064166246.db2.gz PRUIYQBLHFQQSW-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660907 1064166250 /nfs/dbraw/zinc/16/62/50/1064166250.db2.gz PRUIYQBLHFQQSW-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CCC[NH2+]CC1 ZINC000391442021 1064189682 /nfs/dbraw/zinc/18/96/82/1064189682.db2.gz WHVMEWCZKFCOQL-SFHVURJKSA-N 2 1 310.441 4.053 20 0 DIADMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCC13CC4CC(CC(C4)C1)C3)C2 ZINC001279275007 1064338976 /nfs/dbraw/zinc/33/89/76/1064338976.db2.gz AIIHQDLZAZWXHQ-DIGXMAGLSA-N 2 1 316.533 4.011 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCC13CC4CC(CC(C4)C1)C3)C2 ZINC001279275007 1064338989 /nfs/dbraw/zinc/33/89/89/1064338989.db2.gz AIIHQDLZAZWXHQ-DIGXMAGLSA-N 2 1 316.533 4.011 20 0 DIADMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCC13CC4CC(CC(C4)C1)C3)C2 ZINC001279275007 1064338997 /nfs/dbraw/zinc/33/89/97/1064338997.db2.gz AIIHQDLZAZWXHQ-DIGXMAGLSA-N 2 1 316.533 4.011 20 0 DIADMP c1ccc(C2(C[N@@H+]3CCCC4(C[NH+](C5CCCC5)C4)C3)CC2)cc1 ZINC001279466255 1064351849 /nfs/dbraw/zinc/35/18/49/1064351849.db2.gz QQPLIDKGFZATKM-UHFFFAOYSA-N 2 1 324.512 4.059 20 0 DIADMP c1ccc(C2(C[N@H+]3CCCC4(C[NH+](C5CCCC5)C4)C3)CC2)cc1 ZINC001279466255 1064351859 /nfs/dbraw/zinc/35/18/59/1064351859.db2.gz QQPLIDKGFZATKM-UHFFFAOYSA-N 2 1 324.512 4.059 20 0 DIADMP C[N@H+]1CCC[C@@]2(CCC[NH+](CCCc3cccc(Cl)c3)C2)C1 ZINC001279632872 1064361993 /nfs/dbraw/zinc/36/19/93/1064361993.db2.gz RMEAENCGAOMWDJ-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CCC[N@H+](CCCc3cccc(Cl)c3)C2)C1 ZINC001279632872 1064362003 /nfs/dbraw/zinc/36/20/03/1064362003.db2.gz RMEAENCGAOMWDJ-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CCC[N@@H+](CCCc3cccc(Cl)c3)C2)C1 ZINC001279632872 1064362015 /nfs/dbraw/zinc/36/20/15/1064362015.db2.gz RMEAENCGAOMWDJ-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP Cc1cc(N2CCC[C@]3(CCC[N@H+](C4CCCC4)C3)C2)cc[nH+]1 ZINC001279787555 1064365617 /nfs/dbraw/zinc/36/56/17/1064365617.db2.gz POUSMULXDLSPFS-FQEVSTJZSA-N 2 1 313.489 4.015 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CC[C@@]2(C1)CCC[NH+](CCOCC)C2 ZINC001280151315 1064382436 /nfs/dbraw/zinc/38/24/36/1064382436.db2.gz HVZABZYEPVLKMS-PMACEKPBSA-N 2 1 324.553 4.027 20 0 DIADMP FC(F)(F)CCC[N@@H+]1CC[C@]2(C1)CCC[NH+](C1CCCC1)C2 ZINC001280179331 1064383817 /nfs/dbraw/zinc/38/38/17/1064383817.db2.gz HRRAVURMULCPBW-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[N@H+]1CC[C@]2(C1)CCC[NH+](C1CCCC1)C2 ZINC001280179331 1064383826 /nfs/dbraw/zinc/38/38/26/1064383826.db2.gz HRRAVURMULCPBW-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CC[C@]2(C1)CCC[N@@H+](C1CCCC1)C2 ZINC001280179331 1064383837 /nfs/dbraw/zinc/38/38/37/1064383837.db2.gz HRRAVURMULCPBW-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CC[C@]2(C1)CCC[N@H+](C1CCCC1)C2 ZINC001280179331 1064383850 /nfs/dbraw/zinc/38/38/50/1064383850.db2.gz HRRAVURMULCPBW-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP Fc1ccc(C2([NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)CCC2)cc1 ZINC000643467825 1064413115 /nfs/dbraw/zinc/41/31/15/1064413115.db2.gz VTKDBAQBGQHABF-VQTJNVASSA-N 2 1 324.443 4.288 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477730 1065423055 /nfs/dbraw/zinc/42/30/55/1065423055.db2.gz NJFAUHLMXASUTG-LFGUQSLTSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477730 1065423059 /nfs/dbraw/zinc/42/30/59/1065423059.db2.gz NJFAUHLMXASUTG-LFGUQSLTSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477730 1065423062 /nfs/dbraw/zinc/42/30/62/1065423062.db2.gz NJFAUHLMXASUTG-LFGUQSLTSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477734 1065424317 /nfs/dbraw/zinc/42/43/17/1065424317.db2.gz NJFAUHLMXASUTG-XEYPJELSSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477734 1065424330 /nfs/dbraw/zinc/42/43/30/1065424330.db2.gz NJFAUHLMXASUTG-XEYPJELSSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CC[C@@H]2C[C@H]2C2CC2)C1 ZINC001307477734 1065424335 /nfs/dbraw/zinc/42/43/35/1065424335.db2.gz NJFAUHLMXASUTG-XEYPJELSSA-N 2 1 304.522 4.009 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C3CCCC3)cc2)C1 ZINC001307512911 1065453475 /nfs/dbraw/zinc/45/34/75/1065453475.db2.gz GSTOYCHDOKSTIE-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC001307512911 1065453483 /nfs/dbraw/zinc/45/34/83/1065453483.db2.gz GSTOYCHDOKSTIE-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC001307512911 1065453489 /nfs/dbraw/zinc/45/34/89/1065453489.db2.gz GSTOYCHDOKSTIE-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C3CCCC3)cc2)C1 ZINC001307512910 1065453732 /nfs/dbraw/zinc/45/37/32/1065453732.db2.gz GSTOYCHDOKSTIE-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC001307512910 1065453736 /nfs/dbraw/zinc/45/37/36/1065453736.db2.gz GSTOYCHDOKSTIE-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C3CCCC3)cc2)C1 ZINC001307512910 1065453746 /nfs/dbraw/zinc/45/37/46/1065453746.db2.gz GSTOYCHDOKSTIE-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(C)c1 ZINC001307524792 1065461772 /nfs/dbraw/zinc/46/17/72/1065461772.db2.gz ZUJFNALSTLCEBI-GBESFXJTSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001307524792 1065461778 /nfs/dbraw/zinc/46/17/78/1065461778.db2.gz ZUJFNALSTLCEBI-GBESFXJTSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c(C)c1 ZINC001307524792 1065461784 /nfs/dbraw/zinc/46/17/84/1065461784.db2.gz ZUJFNALSTLCEBI-GBESFXJTSA-N 2 1 300.490 4.089 20 0 DIADMP c1ccc([C@@]23CCCC[C@H]2C[N@@H+]3CCC[NH+]2CCCCC2)cc1 ZINC001307534993 1065469120 /nfs/dbraw/zinc/46/91/20/1065469120.db2.gz QLOSKHVSKCMKEW-SFTDATJTSA-N 2 1 312.501 4.264 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+](C)CCCn1cc[nH+]c1C ZINC001307594212 1065503850 /nfs/dbraw/zinc/50/38/50/1065503850.db2.gz BSTGQLSATINCGL-UHFFFAOYSA-N 2 1 321.468 4.429 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)CCCn1cc[nH+]c1C ZINC001307594212 1065503855 /nfs/dbraw/zinc/50/38/55/1065503855.db2.gz BSTGQLSATINCGL-UHFFFAOYSA-N 2 1 321.468 4.429 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@@H]1CCCc1ccccc1 ZINC001307601769 1065505859 /nfs/dbraw/zinc/50/58/59/1065505859.db2.gz ABVWBSZXSVSNOI-LEWJYISDSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@@H]1CCCc1ccccc1 ZINC001307601769 1065505870 /nfs/dbraw/zinc/50/58/70/1065505870.db2.gz ABVWBSZXSVSNOI-LEWJYISDSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@@H]1CCCc1ccccc1 ZINC001307601769 1065505879 /nfs/dbraw/zinc/50/58/79/1065505879.db2.gz ABVWBSZXSVSNOI-LEWJYISDSA-N 2 1 314.517 4.348 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@H](CC1CCCC1)c1ccccc1 ZINC001307634475 1065531080 /nfs/dbraw/zinc/53/10/80/1065531080.db2.gz GRZLIUCWSODFLN-VQTJNVASSA-N 2 1 300.490 4.382 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC001307680620 1065559252 /nfs/dbraw/zinc/55/92/52/1065559252.db2.gz JCVNPUNUPMDYJZ-LJQANCHMSA-N 2 1 310.485 4.318 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001307764741 1065611647 /nfs/dbraw/zinc/61/16/47/1065611647.db2.gz ZGUGKUFYRNINAG-KNQAVFIVSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001307764741 1065611663 /nfs/dbraw/zinc/61/16/63/1065611663.db2.gz ZGUGKUFYRNINAG-KNQAVFIVSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001307764741 1065611668 /nfs/dbraw/zinc/61/16/68/1065611668.db2.gz ZGUGKUFYRNINAG-KNQAVFIVSA-N 2 1 320.480 4.346 20 0 DIADMP FCC[N@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001307824644 1065640370 /nfs/dbraw/zinc/64/03/70/1065640370.db2.gz MMHAEOJFKUZLIH-HXUWFJFHSA-N 2 1 318.480 4.113 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c(C)c1 ZINC001307875813 1065665304 /nfs/dbraw/zinc/66/53/04/1065665304.db2.gz SOZUHHGPIAZCEA-IBGZPJMESA-N 2 1 323.484 4.280 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+]CCCc1cccc2ccccc21 ZINC001307954565 1065700758 /nfs/dbraw/zinc/70/07/58/1065700758.db2.gz MJKQGGUGGZRCPR-UHFFFAOYSA-N 2 1 312.501 4.482 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]CCCc1cccc2ccccc21 ZINC001307954565 1065700767 /nfs/dbraw/zinc/70/07/67/1065700767.db2.gz MJKQGGUGGZRCPR-UHFFFAOYSA-N 2 1 312.501 4.482 20 0 DIADMP CCCCC[N@@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001308007525 1065721565 /nfs/dbraw/zinc/72/15/65/1065721565.db2.gz HTSCGQNPHKBXFG-BGYRXZFFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[N@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001308007525 1065721576 /nfs/dbraw/zinc/72/15/76/1065721576.db2.gz HTSCGQNPHKBXFG-BGYRXZFFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1C[C@]2(C)C[N@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001308007525 1065721586 /nfs/dbraw/zinc/72/15/86/1065721586.db2.gz HTSCGQNPHKBXFG-BGYRXZFFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1C[C@]2(C)C[N@@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001308007525 1065721592 /nfs/dbraw/zinc/72/15/92/1065721592.db2.gz HTSCGQNPHKBXFG-BGYRXZFFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308007529 1065721729 /nfs/dbraw/zinc/72/17/29/1065721729.db2.gz HTSCGQNPHKBXFG-WOJBJXKFSA-N 2 1 300.490 4.021 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](CCc1ccccc1)CCC(C)(C)C ZINC001308031231 1065733221 /nfs/dbraw/zinc/73/32/21/1065733221.db2.gz BMEIORAFSPNETQ-FQEVSTJZSA-N 2 1 316.533 4.452 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](CCc1ccccc1)CCC(C)(C)C ZINC001308031231 1065733235 /nfs/dbraw/zinc/73/32/35/1065733235.db2.gz BMEIORAFSPNETQ-FQEVSTJZSA-N 2 1 316.533 4.452 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](CCc1ccccc1)CCC(C)(C)C ZINC001308031231 1065733244 /nfs/dbraw/zinc/73/32/44/1065733244.db2.gz BMEIORAFSPNETQ-FQEVSTJZSA-N 2 1 316.533 4.452 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)[C@@H]1CCCc2ccccc21 ZINC001308037600 1065737187 /nfs/dbraw/zinc/73/71/87/1065737187.db2.gz DMVDHZLTYPFZGY-HXUWFJFHSA-N 2 1 300.490 4.262 20 0 DIADMP CCc1cccc(C[NH+]2CCC(CC)([NH+]3CCCCC3)CC2)c1 ZINC001308041157 1065738041 /nfs/dbraw/zinc/73/80/41/1065738041.db2.gz CIUMZIZXMBKLDZ-UHFFFAOYSA-N 2 1 314.517 4.480 20 0 DIADMP Cc1ccc(C[N@@H+](CCCc2c[nH+]cn2C)CCCC(C)C)o1 ZINC001308075734 1065752063 /nfs/dbraw/zinc/75/20/63/1065752063.db2.gz PHLGYKNMXUISAI-UHFFFAOYSA-N 2 1 317.477 4.193 20 0 DIADMP Cc1ccc(C[N@H+](CCCc2c[nH+]cn2C)CCCC(C)C)o1 ZINC001308075734 1065752083 /nfs/dbraw/zinc/75/20/83/1065752083.db2.gz PHLGYKNMXUISAI-UHFFFAOYSA-N 2 1 317.477 4.193 20 0 DIADMP CC1(C)CCC[C@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001308182038 1065793636 /nfs/dbraw/zinc/79/36/36/1065793636.db2.gz LJGLFDJKMJIQEJ-IBGZPJMESA-N 2 1 314.517 4.457 20 0 DIADMP CC1=CCC[C@@H](C)[C@@H]1C[NH2+]CCC[N@@H+](C)Cc1ccccc1 ZINC001308187092 1065797762 /nfs/dbraw/zinc/79/77/62/1065797762.db2.gz QNJWAZCZQVYTAN-UYAOXDASSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@H](C(C)(C)C)CC1 ZINC001308196608 1065802993 /nfs/dbraw/zinc/80/29/93/1065802993.db2.gz DKMYCKQTJBXFKY-NJAFHUGGSA-N 2 1 305.510 4.412 20 0 DIADMP Cc1c(Cl)cccc1C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC001308204538 1065811674 /nfs/dbraw/zinc/81/16/74/1065811674.db2.gz ZOLAKUPOWRKVTR-HNNXBMFYSA-N 2 1 308.897 4.393 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H](C)C[C@@H](c3ccccc3)C2)C1 ZINC001308225222 1065831037 /nfs/dbraw/zinc/83/10/37/1065831037.db2.gz OHOVEAMLBNWPSN-VURPSTOHSA-N 2 1 314.517 4.280 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)c2cccc(Cl)c2)CC1(C)C ZINC001308231221 1065838075 /nfs/dbraw/zinc/83/80/75/1065838075.db2.gz IHSGYSIXFLBZEO-INIZCTEOSA-N 2 1 308.897 4.080 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CC(C)(C)C[C@H]2C)c1 ZINC001308281698 1065880243 /nfs/dbraw/zinc/88/02/43/1065880243.db2.gz VXYISMYHVDTUTC-VQIMIIECSA-N 2 1 302.506 4.441 20 0 DIADMP Cc1ccc(F)cc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC001308295544 1065890921 /nfs/dbraw/zinc/89/09/21/1065890921.db2.gz QZOLQWBLWQFHNN-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC001308339191 1065922815 /nfs/dbraw/zinc/92/28/15/1065922815.db2.gz YGZXNPRDGNRPHO-KRWDZBQOSA-N 2 1 322.924 4.414 20 0 DIADMP Cc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC001308368378 1065944879 /nfs/dbraw/zinc/94/48/79/1065944879.db2.gz SJMRHAMTWKILFK-RDJZCZTQSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1scc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC001308367316 1065945341 /nfs/dbraw/zinc/94/53/41/1065945341.db2.gz DVSPLPMBMHZURO-HOCLYGCPSA-N 2 1 306.519 4.108 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1 ZINC001308465575 1066006290 /nfs/dbraw/zinc/00/62/90/1066006290.db2.gz QWOJDAMDSYWEAI-FQEVSTJZSA-N 2 1 322.496 4.484 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562136 1066073054 /nfs/dbraw/zinc/07/30/54/1066073054.db2.gz BOWIDGFSEXIOGQ-YJJPMGAVSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562136 1066073064 /nfs/dbraw/zinc/07/30/64/1066073064.db2.gz BOWIDGFSEXIOGQ-YJJPMGAVSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562127 1066073642 /nfs/dbraw/zinc/07/36/42/1066073642.db2.gz BOWIDGFSEXIOGQ-HCZHMGAMSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562127 1066073652 /nfs/dbraw/zinc/07/36/52/1066073652.db2.gz BOWIDGFSEXIOGQ-HCZHMGAMSA-N 2 1 312.501 4.043 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(CC3CCC3)c2)[C@H](C)C1 ZINC001308567727 1066078178 /nfs/dbraw/zinc/07/81/78/1066078178.db2.gz KLEJUFXXJDBNER-DYESRHJHSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(CC3CCC3)c2)[C@H](C)C1 ZINC001308567727 1066078185 /nfs/dbraw/zinc/07/81/85/1066078185.db2.gz KLEJUFXXJDBNER-DYESRHJHSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(CC3CCC3)c2)[C@H](C)C1 ZINC001308567727 1066078195 /nfs/dbraw/zinc/07/81/95/1066078195.db2.gz KLEJUFXXJDBNER-DYESRHJHSA-N 2 1 314.517 4.191 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCC[C@H]2CCCc2ccccc2)CC1 ZINC001308604446 1066113126 /nfs/dbraw/zinc/11/31/26/1066113126.db2.gz YWXLFSWZFUHXKU-NRFANRHFSA-N 2 1 314.517 4.206 20 0 DIADMP CSC(C)(C)CC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001308617348 1066120821 /nfs/dbraw/zinc/12/08/21/1066120821.db2.gz BGQKITUZBATRLD-KRWDZBQOSA-N 2 1 312.567 4.106 20 0 DIADMP CSC(C)(C)CC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001308617349 1066120836 /nfs/dbraw/zinc/12/08/36/1066120836.db2.gz BGQKITUZBATRLD-QGZVFWFLSA-N 2 1 312.567 4.106 20 0 DIADMP C[C@H]([NH2+]C1CCC2(CCC2)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001308682048 1066154093 /nfs/dbraw/zinc/15/40/93/1066154093.db2.gz KCQDSAZLUSFWTQ-IRXDYDNUSA-N 2 1 304.522 4.342 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CCCC23CC[NH+](C)CC3)c(C)c1 ZINC001308689976 1066182361 /nfs/dbraw/zinc/18/23/61/1066182361.db2.gz SEEMGMKCZDVHQK-FNORWQNLSA-N 2 1 312.501 4.185 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001308729125 1066203706 /nfs/dbraw/zinc/20/37/06/1066203706.db2.gz DMSDWTFDZFJYRL-PZJWPPBQSA-N 2 1 322.496 4.210 20 0 DIADMP CCCC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308730576 1066206480 /nfs/dbraw/zinc/20/64/80/1066206480.db2.gz UTOSVACEXKKQRK-NLWGTHIKSA-N 2 1 302.506 4.313 20 0 DIADMP CCCC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308730578 1066207472 /nfs/dbraw/zinc/20/74/72/1066207472.db2.gz UTOSVACEXKKQRK-NSHGMRRFSA-N 2 1 302.506 4.313 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001308735224 1066208902 /nfs/dbraw/zinc/20/89/02/1066208902.db2.gz CQIACQNILUGZMJ-UWWQBHOKSA-N 2 1 308.897 4.296 20 0 DIADMP CC[N@@H+](CCC(C)(C)SC)Cc1ccc(C[NH+](C)C)cc1 ZINC001308742618 1066216706 /nfs/dbraw/zinc/21/67/06/1066216706.db2.gz HLILDGUMWGBGBM-UHFFFAOYSA-N 2 1 308.535 4.102 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc2cccc(CC)c2o1 ZINC001308743705 1066217897 /nfs/dbraw/zinc/21/78/97/1066217897.db2.gz ACXWDKPSCWGOIH-UHFFFAOYSA-N 2 1 302.462 4.159 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(C2CCC2)cc1 ZINC001308744114 1066220194 /nfs/dbraw/zinc/22/01/94/1066220194.db2.gz AMYAAGZWXOTJQU-UHFFFAOYSA-N 2 1 300.490 4.262 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C1CC(c2ccc(F)cc2)C1 ZINC001308780278 1066252927 /nfs/dbraw/zinc/25/29/27/1066252927.db2.gz YHNJULWSDSIXET-UUKMXZOPSA-N 2 1 318.480 4.172 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1SC ZINC001308797832 1066274896 /nfs/dbraw/zinc/27/48/96/1066274896.db2.gz JRMINLANEQJWCY-JKSUJKDBSA-N 2 1 308.535 4.050 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1SC ZINC001308797832 1066274902 /nfs/dbraw/zinc/27/49/02/1066274902.db2.gz JRMINLANEQJWCY-JKSUJKDBSA-N 2 1 308.535 4.050 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC001308803214 1066279335 /nfs/dbraw/zinc/27/93/35/1066279335.db2.gz XTBFGZIOLQBJEG-IRXDYDNUSA-N 2 1 315.505 4.199 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC001308803214 1066279345 /nfs/dbraw/zinc/27/93/45/1066279345.db2.gz XTBFGZIOLQBJEG-IRXDYDNUSA-N 2 1 315.505 4.199 20 0 DIADMP C[N@H+]1C[C@@H](C[NH2+][C@H]2CCCC23CCCC3)[C@H](c2ccccc2)C1 ZINC001308831551 1066307411 /nfs/dbraw/zinc/30/74/11/1066307411.db2.gz IWPREQSLDZWKHY-AABGKKOBSA-N 2 1 312.501 4.034 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001308848196 1066327832 /nfs/dbraw/zinc/32/78/32/1066327832.db2.gz QRELSMZCQOKOBR-UHFFFAOYSA-N 2 1 316.533 4.454 20 0 DIADMP Clc1cccc(CC[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001308906086 1066386213 /nfs/dbraw/zinc/38/62/13/1066386213.db2.gz PRMIPXPVEKNHNW-LJQANCHMSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1cccc(CC[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001308906086 1066386229 /nfs/dbraw/zinc/38/62/29/1066386229.db2.gz PRMIPXPVEKNHNW-LJQANCHMSA-N 2 1 320.908 4.269 20 0 DIADMP C[NH+]1CCC(C[N@@H+](CCc2ccccc2)CCC(C)(C)C)CC1 ZINC001308915634 1066395430 /nfs/dbraw/zinc/39/54/30/1066395430.db2.gz YMTCWVXQTTYIQI-UHFFFAOYSA-N 2 1 316.533 4.309 20 0 DIADMP C[N@H+]1C[C@@H]2C[NH+](CC3CCC4(CCCCC4)CC3)C[C@]2(C)C1 ZINC001308961241 1066421457 /nfs/dbraw/zinc/42/14/57/1066421457.db2.gz RYXKBOXNOPQDSS-MOPGFXCFSA-N 2 1 304.522 4.011 20 0 DIADMP C[NH+]1C[C@@H]2C[N@H+](CC3CCC4(CCCCC4)CC3)C[C@]2(C)C1 ZINC001308961241 1066421463 /nfs/dbraw/zinc/42/14/63/1066421463.db2.gz RYXKBOXNOPQDSS-MOPGFXCFSA-N 2 1 304.522 4.011 20 0 DIADMP C[NH+]1C[C@@H]2C[N@@H+](CC3CCC4(CCCCC4)CC3)C[C@]2(C)C1 ZINC001308961241 1066421470 /nfs/dbraw/zinc/42/14/70/1066421470.db2.gz RYXKBOXNOPQDSS-MOPGFXCFSA-N 2 1 304.522 4.011 20 0 DIADMP c1cc(CC2CCC2)cc(C[NH+]2CCC([NH2+]C3CCC3)CC2)c1 ZINC001308972431 1066426235 /nfs/dbraw/zinc/42/62/35/1066426235.db2.gz ZSVULLUYGRPAJU-UHFFFAOYSA-N 2 1 312.501 4.136 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCC[C@@H]3C3CCCCC3)[C@H]2C1 ZINC001308985103 1066432951 /nfs/dbraw/zinc/43/29/51/1066432951.db2.gz SDBJXUGGPFZARB-YHDCXSKOSA-N 2 1 304.522 4.055 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)oc2cc1C ZINC000152399227 335056583 /nfs/dbraw/zinc/05/65/83/335056583.db2.gz YRZWUYVOQHRULU-HZPDHXFCSA-N 2 1 312.457 4.185 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)oc2cc1C ZINC000152399227 335056585 /nfs/dbraw/zinc/05/65/85/335056585.db2.gz YRZWUYVOQHRULU-HZPDHXFCSA-N 2 1 312.457 4.185 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)cn1 ZINC000274930781 130275327 /nfs/dbraw/zinc/27/53/27/130275327.db2.gz QTPNQWXFZNFNHX-CABCVRRESA-N 2 1 309.885 4.040 20 0 DIADMP C[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1cccnc1 ZINC000284033858 131042560 /nfs/dbraw/zinc/04/25/60/131042560.db2.gz JMBSWDRYWVIRCP-MDMXATFFSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1cccnc1 ZINC000284033865 131042762 /nfs/dbraw/zinc/04/27/62/131042762.db2.gz JMBSWDRYWVIRCP-RPCJCACASA-N 2 1 323.484 4.175 20 0 DIADMP Cc1c2ccccc2oc1[C@@H]([NH2+]CCc1c[nH+]cn1C)C(C)C ZINC000298594258 132069706 /nfs/dbraw/zinc/06/97/06/132069706.db2.gz YPPTXEHALKSFOO-SFHVURJKSA-N 2 1 311.429 4.004 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCc3sc(Cl)cc32)CC1 ZINC000127469295 332002708 /nfs/dbraw/zinc/00/27/08/332002708.db2.gz KYMPFCZWIJGXTK-AWEZNQCLSA-N 2 1 312.910 4.243 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C/C=C\c2ccccc2)C[C@@H]1c1ccccc1 ZINC000518407649 332027377 /nfs/dbraw/zinc/02/73/77/332027377.db2.gz HONSJOIAGSPZEK-RCPLKNEXSA-N 2 1 306.453 4.125 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C/C=C\c2ccccc2)C[C@@H]1c1ccccc1 ZINC000518407649 332027378 /nfs/dbraw/zinc/02/73/78/332027378.db2.gz HONSJOIAGSPZEK-RCPLKNEXSA-N 2 1 306.453 4.125 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2cc(F)ccc2F)CC1 ZINC000520043928 332032144 /nfs/dbraw/zinc/03/21/44/332032144.db2.gz ARWHEGWNAYXEST-HNNXBMFYSA-N 2 1 324.459 4.470 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2cc(F)ccc2F)CC1 ZINC000520043929 332032194 /nfs/dbraw/zinc/03/21/94/332032194.db2.gz ARWHEGWNAYXEST-OAHLLOKOSA-N 2 1 324.459 4.470 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000569499431 332108427 /nfs/dbraw/zinc/10/84/27/332108427.db2.gz IJOFAQYWVLGMHU-GASCZTMLSA-N 2 1 317.399 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000569499431 332108428 /nfs/dbraw/zinc/10/84/28/332108428.db2.gz IJOFAQYWVLGMHU-GASCZTMLSA-N 2 1 317.399 4.025 20 0 DIADMP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000097465633 335096525 /nfs/dbraw/zinc/09/65/25/335096525.db2.gz GSWKQCRCWQVQPZ-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000097465633 335096526 /nfs/dbraw/zinc/09/65/26/335096526.db2.gz GSWKQCRCWQVQPZ-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)c2ccccc21 ZINC000448032715 332270502 /nfs/dbraw/zinc/27/05/02/332270502.db2.gz XKAHFOBOBJBVFU-IQYLVTRLSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H](C1CC1)[NH+](C)Cc1ccccc1C[N@H+](C)[C@H](C)C1CC1 ZINC000559869109 332287132 /nfs/dbraw/zinc/28/71/32/332287132.db2.gz SWMAMUPYJQYPDH-HZPDHXFCSA-N 2 1 300.490 4.147 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@@H](C)C1 ZINC000560235936 332321070 /nfs/dbraw/zinc/32/10/70/332321070.db2.gz MIIXJXVQWTVWSW-ZFWWWQNUSA-N 2 1 314.926 4.044 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@H](C)C1 ZINC000560235934 332321076 /nfs/dbraw/zinc/32/10/76/332321076.db2.gz MIIXJXVQWTVWSW-HIFRSBDPSA-N 2 1 314.926 4.044 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000560251968 332323652 /nfs/dbraw/zinc/32/36/52/332323652.db2.gz NELGXSKCYRNDED-IAGOWNOFSA-N 2 1 316.489 4.000 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341719554 334473528 /nfs/dbraw/zinc/47/35/28/334473528.db2.gz CGBGIHMMPBBWTR-INMHGKMJSA-N 2 1 322.880 4.016 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C1 ZINC000323351679 332988888 /nfs/dbraw/zinc/98/88/88/332988888.db2.gz SVFHVVWXOWUMJU-HQRMLTQVSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000178296539 333007005 /nfs/dbraw/zinc/00/70/05/333007005.db2.gz CDJKADRKRXCEPK-QMMLZNLJSA-N 2 1 308.469 4.043 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000178296539 333007007 /nfs/dbraw/zinc/00/70/07/333007007.db2.gz CDJKADRKRXCEPK-QMMLZNLJSA-N 2 1 308.469 4.043 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(F)c(F)c2)c1 ZINC000065976631 335119843 /nfs/dbraw/zinc/11/98/43/335119843.db2.gz IWMKHJIAQPNBLS-UHFFFAOYSA-N 2 1 318.411 4.095 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(F)ccc2F)c1 ZINC000065976509 335119946 /nfs/dbraw/zinc/11/99/46/335119946.db2.gz YWJPQOYUJXFUSU-UHFFFAOYSA-N 2 1 318.411 4.095 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C\c2ccc(Cl)cc2)[C@H](C)C1 ZINC000526056645 333096034 /nfs/dbraw/zinc/09/60/34/333096034.db2.gz CWSTUIHTTUWWCI-XSRQRWQSSA-N 2 1 306.881 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C\c2ccc(Cl)cc2)[C@H](C)C1 ZINC000526056645 333096035 /nfs/dbraw/zinc/09/60/35/333096035.db2.gz CWSTUIHTTUWWCI-XSRQRWQSSA-N 2 1 306.881 4.015 20 0 DIADMP CC1(C)CCC([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000462776156 333110890 /nfs/dbraw/zinc/11/08/90/333110890.db2.gz REURBSCDLMDQAQ-LJQANCHMSA-N 2 1 314.517 4.109 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497518138 333258881 /nfs/dbraw/zinc/25/88/81/333258881.db2.gz KTIHRCOYVSPXGD-UZLBHIALSA-N 2 1 316.464 4.083 20 0 DIADMP C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000582112644 333272369 /nfs/dbraw/zinc/27/23/69/333272369.db2.gz OJXWSTIUGLVPMD-HSFDUWRESA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840354 333283922 /nfs/dbraw/zinc/28/39/22/333283922.db2.gz YKKYGMNWFQJMEK-ZWKOTPCHSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840354 333283924 /nfs/dbraw/zinc/28/39/24/333283924.db2.gz YKKYGMNWFQJMEK-ZWKOTPCHSA-N 2 1 318.480 4.331 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497834947 333298585 /nfs/dbraw/zinc/29/85/85/333298585.db2.gz AZLQIFFBDUNNMR-JXFKEZNVSA-N 2 1 316.464 4.083 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000497831357 333299072 /nfs/dbraw/zinc/29/90/72/333299072.db2.gz ISMKRVKQVZHAKV-IBGZPJMESA-N 2 1 304.453 4.082 20 0 DIADMP c1ccc2c(c1)cccc2C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000525786578 333312252 /nfs/dbraw/zinc/31/22/52/333312252.db2.gz FJFJDMFWTULWDY-SFHVURJKSA-N 2 1 308.469 4.148 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525787124 333313323 /nfs/dbraw/zinc/31/33/23/333313323.db2.gz OJVACZQPIQVZBV-ZWKOTPCHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697165 333315698 /nfs/dbraw/zinc/31/56/98/333315698.db2.gz RYJWPSVBBFUWJL-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697165 333315700 /nfs/dbraw/zinc/31/57/00/333315700.db2.gz RYJWPSVBBFUWJL-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000390756993 333324299 /nfs/dbraw/zinc/32/42/99/333324299.db2.gz WXEQOQRNQNMWFQ-AZUAARDMSA-N 2 1 308.469 4.168 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390788135 333393573 /nfs/dbraw/zinc/39/35/73/333393573.db2.gz ACNPIMCSRAGFMW-AFYVEPGGSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000271369324 334021784 /nfs/dbraw/zinc/02/17/84/334021784.db2.gz GJDHJYMHFZEKGV-KRWDZBQOSA-N 2 1 311.473 4.081 20 0 DIADMP C[C@@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000414658083 334059819 /nfs/dbraw/zinc/05/98/19/334059819.db2.gz IXTPBTAIPYJHPO-WBVHZDCISA-N 2 1 312.482 4.007 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414672784 334065370 /nfs/dbraw/zinc/06/53/70/334065370.db2.gz HXZTXCDPNZJAPI-MCIONIFRSA-N 2 1 314.395 4.086 20 0 DIADMP CC[N@H+](Cc1c(Cl)oc2ccccc21)[C@H]1CCC[NH2+]CC1 ZINC000414717560 334073327 /nfs/dbraw/zinc/07/33/27/334073327.db2.gz PUJHAJXQKSWSSO-ZDUSSCGKSA-N 2 1 306.837 4.050 20 0 DIADMP CC[N@@H+](Cc1c(Cl)oc2ccccc21)[C@H]1CCC[NH2+]CC1 ZINC000414717560 334073328 /nfs/dbraw/zinc/07/33/28/334073328.db2.gz PUJHAJXQKSWSSO-ZDUSSCGKSA-N 2 1 306.837 4.050 20 0 DIADMP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)cc1 ZINC000414810124 334105223 /nfs/dbraw/zinc/10/52/23/334105223.db2.gz NNOIZHWLPJLMNY-LLVKDONJSA-N 2 1 309.240 4.303 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)[C@@H]1CCC[NH2+]C1 ZINC000415082615 334272101 /nfs/dbraw/zinc/27/21/01/334272101.db2.gz DFDUIRHMFDEKIB-GRYCIOLGSA-N 2 1 301.261 4.032 20 0 DIADMP c1c2ccccc2oc1CC[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415084292 334272719 /nfs/dbraw/zinc/27/27/19/334272719.db2.gz GSRYDECFBGKONR-QUCCMNQESA-N 2 1 320.436 4.058 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@@H](C)c1ccc(Cl)cc1 ZINC000295116592 334218789 /nfs/dbraw/zinc/21/87/89/334218789.db2.gz WVUIAPUABFIGIA-GYBSPZDESA-N 2 1 306.881 4.047 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)Cc1ccccc1 ZINC000415087424 334275738 /nfs/dbraw/zinc/27/57/38/334275738.db2.gz UHWVPOVJGORSMC-LEWJYISDSA-N 2 1 322.496 4.338 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117068 334283880 /nfs/dbraw/zinc/28/38/80/334283880.db2.gz FWALRRLGILVVJB-KYNGSXCRSA-N 2 1 314.860 4.484 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(F)c(Cl)c1Cl)C1CC1 ZINC000453596964 334288473 /nfs/dbraw/zinc/28/84/73/334288473.db2.gz MMACMLMLBIOHQW-UHFFFAOYSA-N 2 1 319.251 4.097 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000531941217 334301870 /nfs/dbraw/zinc/30/18/70/334301870.db2.gz QOMDLYJBUQUUFG-IBGZPJMESA-N 2 1 314.517 4.418 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303783105 334330557 /nfs/dbraw/zinc/33/05/57/334330557.db2.gz SVEJBGBEKWJULW-NQIIRXRSSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303783105 334330558 /nfs/dbraw/zinc/33/05/58/334330558.db2.gz SVEJBGBEKWJULW-NQIIRXRSSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783105 334330559 /nfs/dbraw/zinc/33/05/59/334330559.db2.gz SVEJBGBEKWJULW-NQIIRXRSSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783105 334330561 /nfs/dbraw/zinc/33/05/61/334330561.db2.gz SVEJBGBEKWJULW-NQIIRXRSSA-N 2 1 308.469 4.172 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972456 334336591 /nfs/dbraw/zinc/33/65/91/334336591.db2.gz YYSCOLBQWBYDOV-XLIONFOSSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000344169738 335227034 /nfs/dbraw/zinc/22/70/34/335227034.db2.gz MOJCAGOJERCWSY-OXJNMPFZSA-N 2 1 311.473 4.349 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000345283789 335313677 /nfs/dbraw/zinc/31/36/77/335313677.db2.gz BLCZVFVILVNPOV-BVGQSLNGSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC[N@H+]1C ZINC000345283789 335313679 /nfs/dbraw/zinc/31/36/79/335313679.db2.gz BLCZVFVILVNPOV-BVGQSLNGSA-N 2 1 306.881 4.254 20 0 DIADMP Clc1ccc([C@H](CC2CC2)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000345682949 335341392 /nfs/dbraw/zinc/34/13/92/335341392.db2.gz NYAGBTZIDFBSLZ-BEFAXECRSA-N 2 1 318.892 4.255 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccccc1)Cc1ccccc1C ZINC000346310599 335398615 /nfs/dbraw/zinc/39/86/15/335398615.db2.gz MWILBRZBXAHARB-UHFFFAOYSA-N 2 1 319.452 4.202 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccccc1)Cc1ccccc1C ZINC000346310599 335398617 /nfs/dbraw/zinc/39/86/17/335398617.db2.gz MWILBRZBXAHARB-UHFFFAOYSA-N 2 1 319.452 4.202 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+]C2CCC3(CCCCC3)CC2)s1 ZINC000352742837 336234221 /nfs/dbraw/zinc/23/42/21/336234221.db2.gz QZCNYHVVSLASCO-UHFFFAOYSA-N 2 1 321.534 4.187 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000352799807 336238518 /nfs/dbraw/zinc/23/85/18/336238518.db2.gz GMCUYFMCXDUXIE-FXAWDEMLSA-N 2 1 311.473 4.445 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000352799807 336238519 /nfs/dbraw/zinc/23/85/19/336238519.db2.gz GMCUYFMCXDUXIE-FXAWDEMLSA-N 2 1 311.473 4.445 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000532441936 336247426 /nfs/dbraw/zinc/24/74/26/336247426.db2.gz LUBYYHSKUNWFQT-SFHVURJKSA-N 2 1 300.490 4.376 20 0 DIADMP Cc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000532485498 336251637 /nfs/dbraw/zinc/25/16/37/336251637.db2.gz RCGMXFZSPVFEMM-PZJWPPBQSA-N 2 1 322.496 4.210 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2cccs2)cc1 ZINC000532507083 336252725 /nfs/dbraw/zinc/25/27/25/336252725.db2.gz VOCFLXXDELDTBX-CVEARBPZSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CCc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000532525381 336254229 /nfs/dbraw/zinc/25/42/29/336254229.db2.gz UWYIAOOHBSFJRQ-STZQEDGTSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CCc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000532525381 336254230 /nfs/dbraw/zinc/25/42/30/336254230.db2.gz UWYIAOOHBSFJRQ-STZQEDGTSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000532525379 336254232 /nfs/dbraw/zinc/25/42/32/336254232.db2.gz UWYIAOOHBSFJRQ-COPCDDAFSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CCc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000532525379 336254233 /nfs/dbraw/zinc/25/42/33/336254233.db2.gz UWYIAOOHBSFJRQ-COPCDDAFSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000532542147 336254790 /nfs/dbraw/zinc/25/47/90/336254790.db2.gz PENZACQCULRHJG-FGSXEWAUSA-N 2 1 322.496 4.214 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000532737702 336268848 /nfs/dbraw/zinc/26/88/48/336268848.db2.gz MOOLAICBTKJHNQ-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000532737702 336268849 /nfs/dbraw/zinc/26/88/49/336268849.db2.gz MOOLAICBTKJHNQ-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000532737702 336268850 /nfs/dbraw/zinc/26/88/50/336268850.db2.gz MOOLAICBTKJHNQ-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000532737702 336268851 /nfs/dbraw/zinc/26/88/51/336268851.db2.gz MOOLAICBTKJHNQ-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000532737702 336268852 /nfs/dbraw/zinc/26/88/52/336268852.db2.gz MOOLAICBTKJHNQ-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000532737702 336268853 /nfs/dbraw/zinc/26/88/53/336268853.db2.gz MOOLAICBTKJHNQ-OGWOLHLISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cscc1C(F)(F)F ZINC000352833201 336270580 /nfs/dbraw/zinc/27/05/80/336270580.db2.gz GZSWHXUOQSXCMA-LBPRGKRZSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1cscc1C(F)(F)F ZINC000352833201 336270581 /nfs/dbraw/zinc/27/05/81/336270581.db2.gz GZSWHXUOQSXCMA-LBPRGKRZSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@@H](CC[NH2+]Cc1cscc1C(F)(F)F)[NH+]1CCCCC1 ZINC000352862129 336282396 /nfs/dbraw/zinc/28/23/96/336282396.db2.gz MCHXFRDJHRKGBA-LBPRGKRZSA-N 2 1 320.424 4.121 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000192952557 336285708 /nfs/dbraw/zinc/28/57/08/336285708.db2.gz KJFUTZARPUCDIW-ZDUSSCGKSA-N 2 1 323.550 4.272 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000417994416 336287118 /nfs/dbraw/zinc/28/71/18/336287118.db2.gz YVNKARUWPISPKG-WBKMXMRLSA-N 2 1 312.501 4.033 20 0 DIADMP CC(C)[N@H+](C)Cc1ccccc1CNc1cc[nH+]cc1Cl ZINC000301584599 336316492 /nfs/dbraw/zinc/31/64/92/336316492.db2.gz OMECDMXPNOSGOE-UHFFFAOYSA-N 2 1 303.837 4.187 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1CNc1cc[nH+]cc1Cl ZINC000301584599 336316493 /nfs/dbraw/zinc/31/64/93/336316493.db2.gz OMECDMXPNOSGOE-UHFFFAOYSA-N 2 1 303.837 4.187 20 0 DIADMP Cc1[nH+]ccn1CCCCNc1c(C)c(C)[nH+]c2ccccc21 ZINC000302063286 336346329 /nfs/dbraw/zinc/34/63/29/336346329.db2.gz DDLJZECVPQRBGT-UHFFFAOYSA-N 2 1 308.429 4.249 20 0 DIADMP Cc1cc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811239 336370117 /nfs/dbraw/zinc/37/01/17/336370117.db2.gz GZGCBPJPKLHMEN-IAGOWNOFSA-N 2 1 319.811 4.040 20 0 DIADMP Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302811239 336370118 /nfs/dbraw/zinc/37/01/18/336370118.db2.gz GZGCBPJPKLHMEN-IAGOWNOFSA-N 2 1 319.811 4.040 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000152443527 336384456 /nfs/dbraw/zinc/38/44/56/336384456.db2.gz JMGQLVPDFBGHPR-JKSUJKDBSA-N 2 1 318.530 4.322 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c1 ZINC000105449360 336387574 /nfs/dbraw/zinc/38/75/74/336387574.db2.gz QZJRGLXPGRWOII-KXBFYZLASA-N 2 1 312.457 4.145 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCSCC(C)C)cc1 ZINC000358364211 336626499 /nfs/dbraw/zinc/62/64/99/336626499.db2.gz HRJSKSWFIWEFNT-OAHLLOKOSA-N 2 1 317.502 4.221 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@H]2CCSc3ccc(F)cc32)CC1 ZINC000359621533 336680724 /nfs/dbraw/zinc/68/07/24/336680724.db2.gz PNXCMISEHSAAKI-KRWDZBQOSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c2ccsc2S1 ZINC000361973872 336780712 /nfs/dbraw/zinc/78/07/12/336780712.db2.gz YXDFZXFXMDVLAA-COMQUAJESA-N 2 1 310.532 4.136 20 0 DIADMP COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000121998754 336987753 /nfs/dbraw/zinc/98/77/53/336987753.db2.gz KOVJBUMNQRYCMZ-HUUCEWRRSA-N 2 1 315.461 4.035 20 0 DIADMP Cc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)s1 ZINC000178097514 337160517 /nfs/dbraw/zinc/16/05/17/337160517.db2.gz BPEKUTXKICBKJZ-UONOGXRCSA-N 2 1 309.523 4.065 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000180404092 337174222 /nfs/dbraw/zinc/17/42/22/337174222.db2.gz DICGJKZTMQGGHS-KRWDZBQOSA-N 2 1 322.880 4.016 20 0 DIADMP Cc1sccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398020094 337304590 /nfs/dbraw/zinc/30/45/90/337304590.db2.gz JPKFGJFMNGBCPS-KXBFYZLASA-N 2 1 314.498 4.057 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC(C2CC2)C2CC2)C3)cc1 ZINC000584429081 337324796 /nfs/dbraw/zinc/32/47/96/337324796.db2.gz HFRRIVSTIGTPTN-WKCHPHFGSA-N 2 1 324.512 4.208 20 0 DIADMP C[C@H]1C[C@H](Nc2nc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000301900371 337386338 /nfs/dbraw/zinc/38/63/38/337386338.db2.gz YZTWYLBVJXQJNG-DOTOQJQBSA-N 2 1 320.440 4.028 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCC2)c2ccccc21 ZINC000422716806 337684041 /nfs/dbraw/zinc/68/40/41/337684041.db2.gz NXAWRKCXHCVQNM-HSALFYBXSA-N 2 1 310.416 4.401 20 0 DIADMP c1csc([C@@H]([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)c1 ZINC000422798625 337687113 /nfs/dbraw/zinc/68/71/13/337687113.db2.gz SBYCBXQLSWJZFP-LNLFQRSKSA-N 2 1 312.482 4.282 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]Cc3cccc4ccccc43)CC[NH2+]2)cc1 ZINC000422918638 337691468 /nfs/dbraw/zinc/69/14/68/337691468.db2.gz HXFZGTWJIBMBEB-RBBKRZOGSA-N 2 1 316.448 4.423 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)c2ccccc21 ZINC000422935310 337692435 /nfs/dbraw/zinc/69/24/35/337692435.db2.gz HEEVKUBKIDYVCW-MSOLQXFVSA-N 2 1 312.844 4.454 20 0 DIADMP C[C@H]([NH2+]C1CCC(c2ccc(F)cc2)CC1)c1c[nH+]ccc1N ZINC000423026482 337696212 /nfs/dbraw/zinc/69/62/12/337696212.db2.gz BIEJVQXBXMXGQU-KTAKPFMOSA-N 2 1 313.420 4.010 20 0 DIADMP C[C@@H]([NH2+][C@@H](C[NH3+])C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC000423261124 337707804 /nfs/dbraw/zinc/70/78/04/337707804.db2.gz JBYJXNHVNIJLBP-XCAIRMDXSA-N 2 1 320.443 4.241 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527663173 337756990 /nfs/dbraw/zinc/75/69/90/337756990.db2.gz XUOWNEIOADTIDO-RFZJPIJTSA-N 2 1 312.501 4.236 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1oc2ccccc2c1C ZINC000121438334 337892988 /nfs/dbraw/zinc/89/29/88/337892988.db2.gz CCVMLQYBEAHQEL-UKRRQHHQSA-N 2 1 311.429 4.233 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000315505931 337988252 /nfs/dbraw/zinc/98/82/52/337988252.db2.gz HKUYJFKVLMWYSZ-ZBFHGGJFSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000315504675 337988279 /nfs/dbraw/zinc/98/82/79/337988279.db2.gz HKUYJFKVLMWYSZ-GDBMZVCRSA-N 2 1 300.446 4.124 20 0 DIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(C(F)(F)F)s1)C(C)(C)C ZINC000428890013 338064721 /nfs/dbraw/zinc/06/47/21/338064721.db2.gz SHTNAXHOKOABJQ-GFCCVEGCSA-N 2 1 322.440 4.223 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)s2)CC1 ZINC000428868173 338063496 /nfs/dbraw/zinc/06/34/96/338063496.db2.gz UOGIZBZVWGFMBH-UHFFFAOYSA-N 2 1 320.424 4.119 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000428994319 338068150 /nfs/dbraw/zinc/06/81/50/338068150.db2.gz BJQXRVDHKWXREZ-OXQOHEQNSA-N 2 1 300.490 4.073 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCCc1ccc(C)cc1 ZINC000429225606 338073809 /nfs/dbraw/zinc/07/38/09/338073809.db2.gz GYHSWXBAPGJQHM-UHFFFAOYSA-N 2 1 313.489 4.099 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCCc1ccc(C)cc1 ZINC000429225606 338073810 /nfs/dbraw/zinc/07/38/10/338073810.db2.gz GYHSWXBAPGJQHM-UHFFFAOYSA-N 2 1 313.489 4.099 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@H](C)CCSc2ccccc2)C1 ZINC000431609976 338134772 /nfs/dbraw/zinc/13/47/72/338134772.db2.gz PGJUNPAIDJMSQL-QZTJIDSGSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@H](C)CCSc2ccccc2)C1 ZINC000431609976 338134773 /nfs/dbraw/zinc/13/47/73/338134773.db2.gz PGJUNPAIDJMSQL-QZTJIDSGSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+]([C@H](C)CCSc2ccccc2)C1 ZINC000431609976 338134774 /nfs/dbraw/zinc/13/47/74/338134774.db2.gz PGJUNPAIDJMSQL-QZTJIDSGSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@H](C)CCSc2ccccc2)C1 ZINC000431609975 338134815 /nfs/dbraw/zinc/13/48/15/338134815.db2.gz PGJUNPAIDJMSQL-MSOLQXFVSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@H](C)CCSc2ccccc2)C1 ZINC000431609975 338134816 /nfs/dbraw/zinc/13/48/16/338134816.db2.gz PGJUNPAIDJMSQL-MSOLQXFVSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@H](C)CCSc2ccccc2)C1 ZINC000431609975 338134817 /nfs/dbraw/zinc/13/48/17/338134817.db2.gz PGJUNPAIDJMSQL-MSOLQXFVSA-N 2 1 320.546 4.221 20 0 DIADMP C[C@H](CCSc1ccccc1)[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000431624826 338134862 /nfs/dbraw/zinc/13/48/62/338134862.db2.gz XLBLPOWUWVJPFS-CVEARBPZSA-N 2 1 315.486 4.160 20 0 DIADMP C[C@H]1C[C@@H](N(C)Cc2ccc(F)c(Cl)c2Cl)CC[N@H+]1C ZINC000432753965 338166553 /nfs/dbraw/zinc/16/65/53/338166553.db2.gz HJKZGFSALZHMLN-JQWIXIFHSA-N 2 1 319.251 4.047 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000432797684 338168341 /nfs/dbraw/zinc/16/83/41/338168341.db2.gz FULOREIKEHMHJW-KRWDZBQOSA-N 2 1 316.420 4.002 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000432797684 338168342 /nfs/dbraw/zinc/16/83/42/338168342.db2.gz FULOREIKEHMHJW-KRWDZBQOSA-N 2 1 316.420 4.002 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434662708 338222627 /nfs/dbraw/zinc/22/26/27/338222627.db2.gz JCFGZIMOZWXSLF-UHFFFAOYSA-N 2 1 323.484 4.216 20 0 DIADMP C[C@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)c1ccccc1 ZINC000434687760 338223456 /nfs/dbraw/zinc/22/34/56/338223456.db2.gz FVBBDNGAVBOHLX-QGZVFWFLSA-N 2 1 323.484 4.203 20 0 DIADMP Cc1ccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c(C)c1 ZINC000435062065 338231530 /nfs/dbraw/zinc/23/15/30/338231530.db2.gz WPBHXJFOPNLHMI-UHFFFAOYSA-N 2 1 323.484 4.216 20 0 DIADMP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436283620 338265774 /nfs/dbraw/zinc/26/57/74/338265774.db2.gz LWDDXPYXFMPIKV-ZFWWWQNUSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436295604 338266966 /nfs/dbraw/zinc/26/69/66/338266966.db2.gz PUXWIQRLMHLMDI-GOEBONIOSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436295600 338267015 /nfs/dbraw/zinc/26/70/15/338267015.db2.gz PUXWIQRLMHLMDI-GDBMZVCRSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CCC[C@@H](N3CCCC3)C2)C1 ZINC000437583460 338314751 /nfs/dbraw/zinc/31/47/51/338314751.db2.gz SRPOGRXBZSZGOF-HBMCJLEFSA-N 2 1 312.501 4.057 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@H](N2CCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000437583460 338314752 /nfs/dbraw/zinc/31/47/52/338314752.db2.gz SRPOGRXBZSZGOF-HBMCJLEFSA-N 2 1 312.501 4.057 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)CCCCCOc2ccccc2)CC1 ZINC000437593539 338315460 /nfs/dbraw/zinc/31/54/60/338315460.db2.gz UPBRJKHGTYATTB-UHFFFAOYSA-N 2 1 318.505 4.042 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(Cl)cc1F ZINC000438086485 338330662 /nfs/dbraw/zinc/33/06/62/338330662.db2.gz HTJIUTKQBQAQJS-CQSZACIVSA-N 2 1 312.860 4.223 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000438089946 338330886 /nfs/dbraw/zinc/33/08/86/338330886.db2.gz XWIJEJLGJKHANH-IRXDYDNUSA-N 2 1 306.469 4.001 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438112805 338332594 /nfs/dbraw/zinc/33/25/94/338332594.db2.gz IGMZTACHNBWPAG-CEWLAPEOSA-N 2 1 314.517 4.161 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438216543 338337021 /nfs/dbraw/zinc/33/70/21/338337021.db2.gz PHNLUEVJFPEYFX-KFWWJZLASA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438216543 338337022 /nfs/dbraw/zinc/33/70/22/338337022.db2.gz PHNLUEVJFPEYFX-KFWWJZLASA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CCN1C ZINC000438847062 338353720 /nfs/dbraw/zinc/35/37/20/338353720.db2.gz CZMRMZQWNWYFQL-WIYYLYMNSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000438847062 338353721 /nfs/dbraw/zinc/35/37/21/338353721.db2.gz CZMRMZQWNWYFQL-WIYYLYMNSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000438847062 338353722 /nfs/dbraw/zinc/35/37/22/338353722.db2.gz CZMRMZQWNWYFQL-WIYYLYMNSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847062 338353723 /nfs/dbraw/zinc/35/37/23/338353723.db2.gz CZMRMZQWNWYFQL-WIYYLYMNSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847062 338353724 /nfs/dbraw/zinc/35/37/24/338353724.db2.gz CZMRMZQWNWYFQL-WIYYLYMNSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC000439311636 338366782 /nfs/dbraw/zinc/36/67/82/338366782.db2.gz CDBGFMFYWIEMSF-AZUAARDMSA-N 2 1 300.490 4.131 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000439331574 338367546 /nfs/dbraw/zinc/36/75/46/338367546.db2.gz RXNCRDWASAQVED-QGZVFWFLSA-N 2 1 324.871 4.085 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449730662 338648093 /nfs/dbraw/zinc/64/80/93/338648093.db2.gz FXCVSICUDUJXBJ-MAUKXSAKSA-N 2 1 306.881 4.050 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000194908249 338778336 /nfs/dbraw/zinc/77/83/36/338778336.db2.gz FXAPJRLYQHBFKC-HNNXBMFYSA-N 2 1 318.530 4.466 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cs1 ZINC000453130790 338797580 /nfs/dbraw/zinc/79/75/80/338797580.db2.gz SVEKZRXPFSDGDM-OAHLLOKOSA-N 2 1 315.486 4.080 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C2CC2)C2CCC2)CC1 ZINC000453131502 338797709 /nfs/dbraw/zinc/79/77/09/338797709.db2.gz VIANRYWGMZNMDO-HRAATJIYSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H](C2CC2)C2CCC2)CC1 ZINC000453131505 338797723 /nfs/dbraw/zinc/79/77/23/338797723.db2.gz VIANRYWGMZNMDO-IERDGZPVSA-N 2 1 312.501 4.380 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC000459369961 339025247 /nfs/dbraw/zinc/02/52/47/339025247.db2.gz FTJPUGWSAQOBCK-UNMCSNQZSA-N 2 1 320.480 4.044 20 0 DIADMP C[C@@H]([NH2+]CCc1cccc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000459454136 339030218 /nfs/dbraw/zinc/03/02/18/339030218.db2.gz BOPMMIMBTHGXDA-WBVHZDCISA-N 2 1 320.908 4.125 20 0 DIADMP Fc1ccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1Cl ZINC000459586631 339037269 /nfs/dbraw/zinc/03/72/69/339037269.db2.gz VOIBXCDUTHELPI-SFHVURJKSA-N 2 1 322.855 4.147 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000459689519 339043193 /nfs/dbraw/zinc/04/31/93/339043193.db2.gz GLJRKEYLNJWGJI-UXHICEINSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000459689519 339043194 /nfs/dbraw/zinc/04/31/94/339043194.db2.gz GLJRKEYLNJWGJI-UXHICEINSA-N 2 1 311.473 4.240 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000459721008 339044276 /nfs/dbraw/zinc/04/42/76/339044276.db2.gz ABYPUDLZTHIBJX-UZLBHIALSA-N 2 1 316.464 4.083 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462103411 339072141 /nfs/dbraw/zinc/07/21/41/339072141.db2.gz FINNFDVYSWNOHG-ZYSHUDEJSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462103411 339072142 /nfs/dbraw/zinc/07/21/42/339072142.db2.gz FINNFDVYSWNOHG-ZYSHUDEJSA-N 2 1 322.924 4.370 20 0 DIADMP C[NH+](C)[C@@H](CNc1cc[nH+]c2ccsc21)c1ccc(F)cc1 ZINC000462775311 339087964 /nfs/dbraw/zinc/08/79/64/339087964.db2.gz GDNNSLIIEQGNJN-INIZCTEOSA-N 2 1 315.417 4.150 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000462780841 339088254 /nfs/dbraw/zinc/08/82/54/339088254.db2.gz ZOCGEDZRURRZMM-NRSPTQNISA-N 2 1 314.517 4.109 20 0 DIADMP CC(C)c1ccc(CC2CC[NH+](C3CC[NH+](C)CC3)CC2)cc1 ZINC000462832299 339093216 /nfs/dbraw/zinc/09/32/16/339093216.db2.gz FIBDMWFCVITIDH-UHFFFAOYSA-N 2 1 314.517 4.159 20 0 DIADMP Cc1cc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462888222 339096309 /nfs/dbraw/zinc/09/63/09/339096309.db2.gz DWUNWBAOGAYJQS-HIFRSBDPSA-N 2 1 317.864 4.400 20 0 DIADMP Fc1ccc(CC[NH+]2CCC([NH2+]CCC3CCCC3)CC2)cc1 ZINC000463112168 339106198 /nfs/dbraw/zinc/10/61/98/339106198.db2.gz SMLHIIJXYGIKKJ-UHFFFAOYSA-N 2 1 318.480 4.003 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463132675 339106809 /nfs/dbraw/zinc/10/68/09/339106809.db2.gz BLTLCEWQNVTXQP-KNQAVFIVSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463132675 339106810 /nfs/dbraw/zinc/10/68/10/339106810.db2.gz BLTLCEWQNVTXQP-KNQAVFIVSA-N 2 1 322.496 4.180 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C(C)(C)C ZINC000463144539 339107137 /nfs/dbraw/zinc/10/71/37/339107137.db2.gz KMUUYWPNOZAQBS-IBGZPJMESA-N 2 1 320.496 4.247 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463146135 339107166 /nfs/dbraw/zinc/10/71/66/339107166.db2.gz FBDVJWMAZBOWSF-QGZVKYPTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463146135 339107167 /nfs/dbraw/zinc/10/71/67/339107167.db2.gz FBDVJWMAZBOWSF-QGZVKYPTSA-N 2 1 300.490 4.208 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463204377 339109287 /nfs/dbraw/zinc/10/92/87/339109287.db2.gz ITASNLBAEXPXPU-YQVWRLOYSA-N 2 1 320.546 4.161 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463204377 339109288 /nfs/dbraw/zinc/10/92/88/339109288.db2.gz ITASNLBAEXPXPU-YQVWRLOYSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(C3CC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000463206514 339109423 /nfs/dbraw/zinc/10/94/23/339109423.db2.gz PPUOKMNCBAQQKF-YLJYHZDGSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(C3CC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000463206514 339109424 /nfs/dbraw/zinc/10/94/24/339109424.db2.gz PPUOKMNCBAQQKF-YLJYHZDGSA-N 2 1 312.501 4.209 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207751 339109588 /nfs/dbraw/zinc/10/95/88/339109588.db2.gz UHDJJAQYKFYJSQ-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207751 339109589 /nfs/dbraw/zinc/10/95/89/339109589.db2.gz UHDJJAQYKFYJSQ-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000463244071 339111562 /nfs/dbraw/zinc/11/15/62/339111562.db2.gz NKFKGHYSEMACJD-LCLWPZTBSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000463244071 339111563 /nfs/dbraw/zinc/11/15/63/339111563.db2.gz NKFKGHYSEMACJD-LCLWPZTBSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)CSCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463281074 339113088 /nfs/dbraw/zinc/11/30/88/339113088.db2.gz JRKFTFMBQVWRSV-HKUYNNGSSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)CSCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463281074 339113089 /nfs/dbraw/zinc/11/30/89/339113089.db2.gz JRKFTFMBQVWRSV-HKUYNNGSSA-N 2 1 320.546 4.018 20 0 DIADMP C[N@H+](CC[NH2+]CC1CCC(C(F)(F)F)CC1)C1CCCCC1 ZINC000466371123 339201272 /nfs/dbraw/zinc/20/12/72/339201272.db2.gz WAQWBYLTKYZNPD-UHFFFAOYSA-N 2 1 320.443 4.209 20 0 DIADMP C[N@@H+](CC[NH2+]CC1CCC(C(F)(F)F)CC1)C1CCCCC1 ZINC000466371123 339201273 /nfs/dbraw/zinc/20/12/73/339201273.db2.gz WAQWBYLTKYZNPD-UHFFFAOYSA-N 2 1 320.443 4.209 20 0 DIADMP C[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000467307769 339230922 /nfs/dbraw/zinc/23/09/22/339230922.db2.gz HLVIFTZIJVEANS-SFHVURJKSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468229251 339256862 /nfs/dbraw/zinc/25/68/62/339256862.db2.gz FZLDQHWLWNORHU-LAUBAEHRSA-N 2 1 312.501 4.187 20 0 DIADMP COC1CC[NH+](C2(C[NH2+][C@@H](C)CCCC(C)C)CCCC2)CC1 ZINC000468554673 339266182 /nfs/dbraw/zinc/26/61/82/339266182.db2.gz NYDCPXSIAUDVGH-SFHVURJKSA-N 2 1 324.553 4.214 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000468791506 339270892 /nfs/dbraw/zinc/27/08/92/339270892.db2.gz BKUALRMNIYHLOV-UONOGXRCSA-N 2 1 317.502 4.109 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCC2)[C@@H](C)C1 ZINC000468988025 339276882 /nfs/dbraw/zinc/27/68/82/339276882.db2.gz NOORDSFKQZLZJL-YJBOKZPZSA-N 2 1 320.908 4.082 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000469741832 339297465 /nfs/dbraw/zinc/29/74/65/339297465.db2.gz MMBDRXCVFJQYKW-IUODEOHRSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000469741832 339297466 /nfs/dbraw/zinc/29/74/66/339297466.db2.gz MMBDRXCVFJQYKW-IUODEOHRSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@@H]1C[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000469867347 339303133 /nfs/dbraw/zinc/30/31/33/339303133.db2.gz VIYFXMVVXFPBES-CHWSQXEVSA-N 2 1 320.889 4.238 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000471245663 339341033 /nfs/dbraw/zinc/34/10/33/339341033.db2.gz VVKSNQGXFIRFGF-UTKZUKDTSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000471245663 339341034 /nfs/dbraw/zinc/34/10/34/339341034.db2.gz VVKSNQGXFIRFGF-UTKZUKDTSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000471245663 339341035 /nfs/dbraw/zinc/34/10/35/339341035.db2.gz VVKSNQGXFIRFGF-UTKZUKDTSA-N 2 1 310.485 4.044 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2cccc(SCC)c2)CC1 ZINC000472057791 339361394 /nfs/dbraw/zinc/36/13/94/339361394.db2.gz LVRJILSLZLWJOU-UHFFFAOYSA-N 2 1 306.519 4.153 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472462681 339372448 /nfs/dbraw/zinc/37/24/48/339372448.db2.gz MDRCLSJGUOINKZ-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472462681 339372449 /nfs/dbraw/zinc/37/24/49/339372449.db2.gz MDRCLSJGUOINKZ-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000472462681 339372450 /nfs/dbraw/zinc/37/24/50/339372450.db2.gz MDRCLSJGUOINKZ-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000472462681 339372451 /nfs/dbraw/zinc/37/24/51/339372451.db2.gz MDRCLSJGUOINKZ-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+]2Cc2cccc(Cl)c2Cl)CC1 ZINC000472601342 339374915 /nfs/dbraw/zinc/37/49/15/339374915.db2.gz RTDNMAMPXPOFEX-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2cccc(Cl)c2Cl)CC1 ZINC000472601342 339374916 /nfs/dbraw/zinc/37/49/16/339374916.db2.gz RTDNMAMPXPOFEX-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP C[N@H+]1CCCC[C@H]1CCN1CCC(=Cc2ccccc2F)CC1 ZINC000473019806 339380157 /nfs/dbraw/zinc/38/01/57/339380157.db2.gz DOAQXUUZUACDIX-IBGZPJMESA-N 2 1 316.464 4.179 20 0 DIADMP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC000473019806 339380158 /nfs/dbraw/zinc/38/01/58/339380158.db2.gz DOAQXUUZUACDIX-IBGZPJMESA-N 2 1 316.464 4.179 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC000473019806 339380159 /nfs/dbraw/zinc/38/01/59/339380159.db2.gz DOAQXUUZUACDIX-IBGZPJMESA-N 2 1 316.464 4.179 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474818100 339428130 /nfs/dbraw/zinc/42/81/30/339428130.db2.gz PTBLGZUBLBFHJO-CABCVRRESA-N 2 1 319.880 4.407 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc2ccccc2o1 ZINC000477921281 339504696 /nfs/dbraw/zinc/50/46/96/339504696.db2.gz WTFQWKPUHBRGPW-HNNXBMFYSA-N 2 1 300.446 4.205 20 0 DIADMP COc1ccc(Cl)cc1[C@@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000480036206 339556225 /nfs/dbraw/zinc/55/62/25/339556225.db2.gz DGCIGFRCMKXHMM-GFCCVEGCSA-N 2 1 324.896 4.308 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000480153037 339560796 /nfs/dbraw/zinc/56/07/96/339560796.db2.gz ZWZYILYXHMREBI-RVKKMQEKSA-N 2 1 323.912 4.286 20 0 DIADMP C[C@H](c1cccc(Cl)c1F)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000480497372 339574883 /nfs/dbraw/zinc/57/48/83/339574883.db2.gz FXMJJBNPVBDTIW-CQSZACIVSA-N 2 1 324.871 4.348 20 0 DIADMP Fc1cc(Cl)cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000485704394 339710252 /nfs/dbraw/zinc/71/02/52/339710252.db2.gz KDMPMZFOYONKEX-UHFFFAOYSA-N 2 1 324.871 4.366 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000499149245 340031136 /nfs/dbraw/zinc/03/11/36/340031136.db2.gz SSQNDJQVROLEAC-KPACCLEDSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501024432 340072566 /nfs/dbraw/zinc/07/25/66/340072566.db2.gz BOSWXPZEHSXCPV-NRFANRHFSA-N 2 1 323.484 4.381 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)CC1 ZINC000502240913 340097498 /nfs/dbraw/zinc/09/74/98/340097498.db2.gz KDWDDWMYVJEUJF-NRSPTQNISA-N 2 1 312.501 4.128 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)[C@H]1c1cccs1 ZINC000502273998 340098413 /nfs/dbraw/zinc/09/84/13/340098413.db2.gz MFXQMTDGZKGPHY-LIEJCIORSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)[C@H]1c1cccs1 ZINC000502273998 340098414 /nfs/dbraw/zinc/09/84/14/340098414.db2.gz MFXQMTDGZKGPHY-LIEJCIORSA-N 2 1 318.530 4.299 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502458287 340104460 /nfs/dbraw/zinc/10/44/60/340104460.db2.gz CLXYJJRXZCEOBP-APWZRJJASA-N 2 1 312.457 4.069 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502458287 340104461 /nfs/dbraw/zinc/10/44/61/340104461.db2.gz CLXYJJRXZCEOBP-APWZRJJASA-N 2 1 312.457 4.069 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000502691100 340110773 /nfs/dbraw/zinc/11/07/73/340110773.db2.gz GHJLAHBZFWINEM-CJNGLKHVSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000502691100 340110774 /nfs/dbraw/zinc/11/07/74/340110774.db2.gz GHJLAHBZFWINEM-CJNGLKHVSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@@H]1CCC[N@@H+]1C ZINC000502691100 340110775 /nfs/dbraw/zinc/11/07/75/340110775.db2.gz GHJLAHBZFWINEM-CJNGLKHVSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@@H]1CCC[N@H+]1C ZINC000502691100 340110776 /nfs/dbraw/zinc/11/07/76/340110776.db2.gz GHJLAHBZFWINEM-CJNGLKHVSA-N 2 1 314.395 4.183 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1CC[C@H]1CCC[NH+]1C ZINC000502693372 340110813 /nfs/dbraw/zinc/11/08/13/340110813.db2.gz HYRRMAQKQHQDRX-AQNXPRMDSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[NH+]1CC[C@H]1CCC[N@@H+]1C ZINC000502693372 340110814 /nfs/dbraw/zinc/11/08/14/340110814.db2.gz HYRRMAQKQHQDRX-AQNXPRMDSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[NH+]1CC[C@H]1CCC[N@H+]1C ZINC000502693372 340110815 /nfs/dbraw/zinc/11/08/15/340110815.db2.gz HYRRMAQKQHQDRX-AQNXPRMDSA-N 2 1 300.490 4.129 20 0 DIADMP Fc1cc(-c2ccccc2)ccc1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000503561927 340130729 /nfs/dbraw/zinc/13/07/29/340130729.db2.gz HAUDTIAHSATMRN-VQTJNVASSA-N 2 1 324.443 4.209 20 0 DIADMP CCc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C(C)C)cc1 ZINC000506127768 340186309 /nfs/dbraw/zinc/18/63/09/340186309.db2.gz TYVNRGSLTHIOIL-HSALFYBXSA-N 2 1 300.490 4.163 20 0 DIADMP CCc1cccnc1[C@H](C)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000507485113 340222130 /nfs/dbraw/zinc/22/21/30/340222130.db2.gz KTMCVRVDJRUNTM-KSZLIROESA-N 2 1 317.521 4.053 20 0 DIADMP CSc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)s1 ZINC000516609708 340240978 /nfs/dbraw/zinc/24/09/78/340240978.db2.gz ZPQRCYUYKTXAIJ-UHFFFAOYSA-N 2 1 312.548 4.022 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508858460 340254543 /nfs/dbraw/zinc/25/45/43/340254543.db2.gz IORRMKWOUQJAGE-IBGZPJMESA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508858460 340254544 /nfs/dbraw/zinc/25/45/44/340254544.db2.gz IORRMKWOUQJAGE-IBGZPJMESA-N 2 1 312.501 4.118 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1 ZINC000509972287 340284275 /nfs/dbraw/zinc/28/42/75/340284275.db2.gz NZCJFXKEGNEDMX-UXHICEINSA-N 2 1 311.473 4.288 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1 ZINC000509972288 340284356 /nfs/dbraw/zinc/28/43/56/340284356.db2.gz NZCJFXKEGNEDMX-VQTJNVASSA-N 2 1 311.473 4.288 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000302988948 340292492 /nfs/dbraw/zinc/29/24/92/340292492.db2.gz FNFGXFQHOUTYMJ-MOPGFXCFSA-N 2 1 300.490 4.192 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCC[C@H]2CCCF)C1 ZINC000510694891 340307133 /nfs/dbraw/zinc/30/71/33/340307133.db2.gz LTGPMOPUMYRITH-RDGPPVDQSA-N 2 1 312.517 4.253 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CCC2)[C@@H]1c1cccs1 ZINC000510739047 340308874 /nfs/dbraw/zinc/30/88/74/340308874.db2.gz SIYNZJBQNNKGIU-SFNKJDCFSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H]2C2CCC2)[C@@H]1c1cccs1 ZINC000510739047 340308875 /nfs/dbraw/zinc/30/88/75/340308875.db2.gz SIYNZJBQNNKGIU-SFNKJDCFSA-N 2 1 318.530 4.299 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@H]2CCCF)c1 ZINC000510738305 340308908 /nfs/dbraw/zinc/30/89/08/340308908.db2.gz UTQWNQLKFLJHTJ-OALUTQOASA-N 2 1 306.469 4.146 20 0 DIADMP c1ccc(CCC[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000303176326 340309644 /nfs/dbraw/zinc/30/96/44/340309644.db2.gz JOUKAMZGVNNMGP-NRFANRHFSA-N 2 1 314.517 4.207 20 0 DIADMP c1ccc(CCC[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000303176328 340309649 /nfs/dbraw/zinc/30/96/49/340309649.db2.gz JOUKAMZGVNNMGP-OAQYLSRUSA-N 2 1 314.517 4.207 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC[C@@H]2C2CCC2)CC1 ZINC000510753975 340309742 /nfs/dbraw/zinc/30/97/42/340309742.db2.gz MVLHLFTYNIKODG-NHCUHLMSSA-N 2 1 312.501 4.128 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000510755193 340309927 /nfs/dbraw/zinc/30/99/27/340309927.db2.gz VTXZYSJXQHMRMM-DBOLQNLKSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000510755193 340309928 /nfs/dbraw/zinc/30/99/28/340309928.db2.gz VTXZYSJXQHMRMM-DBOLQNLKSA-N 2 1 312.501 4.065 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000510931767 340315256 /nfs/dbraw/zinc/31/52/56/340315256.db2.gz JXVMRYMEXQGBGX-QZTJIDSGSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000510931766 340315280 /nfs/dbraw/zinc/31/52/80/340315280.db2.gz JXVMRYMEXQGBGX-MSOLQXFVSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000510992805 340317455 /nfs/dbraw/zinc/31/74/55/340317455.db2.gz CSWZFKMTBVITIQ-NRFANRHFSA-N 2 1 319.452 4.155 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511092581 340320464 /nfs/dbraw/zinc/32/04/64/340320464.db2.gz OTNWOTJXSPQRNF-VQIMIIECSA-N 2 1 322.443 4.033 20 0 DIADMP Cc1ccccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000303517666 340329711 /nfs/dbraw/zinc/32/97/11/340329711.db2.gz CHIUWIDINQHZHU-OALUTQOASA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000303517666 340329712 /nfs/dbraw/zinc/32/97/12/340329712.db2.gz CHIUWIDINQHZHU-OALUTQOASA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000303517666 340329713 /nfs/dbraw/zinc/32/97/13/340329713.db2.gz CHIUWIDINQHZHU-OALUTQOASA-N 2 1 300.490 4.081 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2ncc(C[NH+](C)C)s2)CC(C)(C)C1 ZINC000511772607 340337810 /nfs/dbraw/zinc/33/78/10/340337810.db2.gz MTPMPWKDFUZQMV-CABCVRRESA-N 2 1 323.550 4.147 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc(F)cc(F)c2)C1 ZINC000512181168 340351170 /nfs/dbraw/zinc/35/11/70/340351170.db2.gz OMECPUFYPCYLOJ-JKSUJKDBSA-N 2 1 322.443 4.051 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000512328518 340357308 /nfs/dbraw/zinc/35/73/08/340357308.db2.gz BERYSFOXDJAMRO-HBFSDRIKSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512334073 340357615 /nfs/dbraw/zinc/35/76/15/340357615.db2.gz ZIGZWMDTWRRKES-AUSJPIAWSA-N 2 1 316.464 4.056 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](CC(c2ccccc2)c2ccccc2)CC1 ZINC000513246631 340399151 /nfs/dbraw/zinc/39/91/51/340399151.db2.gz ACNOPTLWEYROSN-NRFANRHFSA-N 2 1 322.496 4.235 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000186341995 340511534 /nfs/dbraw/zinc/51/15/34/340511534.db2.gz DNMGDQFTAHNEED-IAGOWNOFSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2csc(Cl)c2)CC1 ZINC000191155951 340550675 /nfs/dbraw/zinc/55/06/75/340550675.db2.gz ZWEVTPMRIWNSFC-LBPRGKRZSA-N 2 1 300.899 4.173 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1cnc(-c2ccco2)s1)C(C)C ZINC000193135482 340572912 /nfs/dbraw/zinc/57/29/12/340572912.db2.gz BEWDQWWKFUHXPL-UHFFFAOYSA-N 2 1 321.490 4.002 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC000237534218 340671959 /nfs/dbraw/zinc/67/19/59/340671959.db2.gz QDJNSQIRTOSBPF-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC000237541579 340671961 /nfs/dbraw/zinc/67/19/61/340671961.db2.gz QDJNSQIRTOSBPF-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000539079075 340871062 /nfs/dbraw/zinc/87/10/62/340871062.db2.gz RQIUYQGLWZUYCW-KBXCAEBGSA-N 2 1 317.502 4.410 20 0 DIADMP CCC(CC)[C@H]([NH2+]CCCn1cc[nH+]c1C)c1cccs1 ZINC000539277313 340879063 /nfs/dbraw/zinc/87/90/63/340879063.db2.gz SUTKGIZFRZPJKO-KRWDZBQOSA-N 2 1 305.491 4.410 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]C(C)(c1ccccc1)c1ccccc1 ZINC000540404627 340929810 /nfs/dbraw/zinc/92/98/10/340929810.db2.gz REKFZMHOOXRHPP-UHFFFAOYSA-N 2 1 319.452 4.135 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)[NH+](C)C ZINC000069377818 340956909 /nfs/dbraw/zinc/95/69/09/340956909.db2.gz LPUORHMELGBLAM-KKUMJFAQSA-N 2 1 308.432 4.064 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000542486765 341009753 /nfs/dbraw/zinc/00/97/53/341009753.db2.gz MAWRTJDFKBVLAF-LSDHHAIUSA-N 2 1 323.550 4.490 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000542486763 341009777 /nfs/dbraw/zinc/00/97/77/341009777.db2.gz MAWRTJDFKBVLAF-GJZGRUSLSA-N 2 1 323.550 4.490 20 0 DIADMP CC[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(Cl)s1 ZINC000542557138 341013264 /nfs/dbraw/zinc/01/32/64/341013264.db2.gz ZZUBMQVRCUKTES-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C2CCCC2)o1 ZINC000542670854 341016543 /nfs/dbraw/zinc/01/65/43/341016543.db2.gz LDSINCMGEIOENY-FQEVSTJZSA-N 2 1 316.489 4.283 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1F ZINC000542843902 341023217 /nfs/dbraw/zinc/02/32/17/341023217.db2.gz KCWVCHXDBCELLS-UGSOOPFHSA-N 2 1 324.871 4.250 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000543188189 341036013 /nfs/dbraw/zinc/03/60/13/341036013.db2.gz UPTMSDLAHSWKJC-UHFFFAOYSA-N 2 1 308.469 4.208 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)[NH+]1CCCCC1 ZINC000544374604 341078920 /nfs/dbraw/zinc/07/89/20/341078920.db2.gz XPLWJWPDPIQFOZ-OLZOCXBDSA-N 2 1 314.395 4.019 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCc2c(Cl)cccc21 ZINC000544569491 341086227 /nfs/dbraw/zinc/08/62/27/341086227.db2.gz HBXOYADBMWRRDW-GOSISDBHSA-N 2 1 317.864 4.292 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)C[C@H]3C)cc2)c1 ZINC000544825684 341094905 /nfs/dbraw/zinc/09/49/05/341094905.db2.gz OPAWGDFPHJYASX-DYESRHJHSA-N 2 1 308.469 4.092 20 0 DIADMP C[C@@H]1C[C@H]1c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)o1 ZINC000237463904 341214455 /nfs/dbraw/zinc/21/44/55/341214455.db2.gz MRVHGOXZMIPISM-JFIYKMOQSA-N 2 1 304.478 4.005 20 0 DIADMP C[C@H]([NH2+]C1CCC(F)(F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547827886 341235591 /nfs/dbraw/zinc/23/55/91/341235591.db2.gz XKCBKJBUKKILDY-DOTOQJQBSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154530 341249855 /nfs/dbraw/zinc/24/98/55/341249855.db2.gz ABLJTDIIFPXQCF-HNBVOPMISA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cnc(C2CC2)s1 ZINC000548156910 341249985 /nfs/dbraw/zinc/24/99/85/341249985.db2.gz LXASUNGOZHGJMO-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000136369096 341257601 /nfs/dbraw/zinc/25/76/01/341257601.db2.gz CHYCBXMIFZUMEW-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000136369096 341257602 /nfs/dbraw/zinc/25/76/02/341257602.db2.gz CHYCBXMIFZUMEW-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000136369137 341257658 /nfs/dbraw/zinc/25/76/58/341257658.db2.gz CHYCBXMIFZUMEW-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000136369137 341257659 /nfs/dbraw/zinc/25/76/59/341257659.db2.gz CHYCBXMIFZUMEW-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481935 341263175 /nfs/dbraw/zinc/26/31/75/341263175.db2.gz VPYZXKJICQIKDI-RYQLBKOJSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@@H+]1C ZINC000548721908 341270683 /nfs/dbraw/zinc/27/06/83/341270683.db2.gz DAFCTDJJPAMHOK-SDEKRAFDSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000548721908 341270684 /nfs/dbraw/zinc/27/06/84/341270684.db2.gz DAFCTDJJPAMHOK-SDEKRAFDSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721908 341270685 /nfs/dbraw/zinc/27/06/85/341270685.db2.gz DAFCTDJJPAMHOK-SDEKRAFDSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721908 341270686 /nfs/dbraw/zinc/27/06/86/341270686.db2.gz DAFCTDJJPAMHOK-SDEKRAFDSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCC[C@H]3C[C@H]32)C[N@H+]1Cc1ccccc1 ZINC000548884885 341279827 /nfs/dbraw/zinc/27/98/27/341279827.db2.gz BJMWMVYEYUOVOO-RQXATKFSSA-N 2 1 312.501 4.065 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(C)cc(Cl)c2)c1 ZINC000550123167 341310595 /nfs/dbraw/zinc/31/05/95/341310595.db2.gz PPDKCXAXPADOFX-UHFFFAOYSA-N 2 1 316.876 4.390 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550610061 341319402 /nfs/dbraw/zinc/31/94/02/341319402.db2.gz LTPBXTXVLNNCFM-SUMDDJOVSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550610061 341319403 /nfs/dbraw/zinc/31/94/03/341319403.db2.gz LTPBXTXVLNNCFM-SUMDDJOVSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550619950 341319679 /nfs/dbraw/zinc/31/96/79/341319679.db2.gz RIRHYKSHPUFVPZ-RSPOEFSDSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550619950 341319680 /nfs/dbraw/zinc/31/96/80/341319680.db2.gz RIRHYKSHPUFVPZ-RSPOEFSDSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000550624689 341319809 /nfs/dbraw/zinc/31/98/09/341319809.db2.gz XTRLYDFMHGNYTP-IOMROCGXSA-N 2 1 308.469 4.481 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000550624689 341319810 /nfs/dbraw/zinc/31/98/10/341319810.db2.gz XTRLYDFMHGNYTP-IOMROCGXSA-N 2 1 308.469 4.481 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550644355 341320251 /nfs/dbraw/zinc/32/02/51/341320251.db2.gz SBIHGZMPWMMKCU-BHIFYINESA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550644355 341320252 /nfs/dbraw/zinc/32/02/52/341320252.db2.gz SBIHGZMPWMMKCU-BHIFYINESA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](C1CC1)[N@@H+](C)Cc1cccc(C[NH+](C)[C@@H](C)C2CC2)c1 ZINC000550681199 341321395 /nfs/dbraw/zinc/32/13/95/341321395.db2.gz LXMZJRUNIPVFQF-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP C[C@H](C1CC1)[NH+](C)Cc1cccc(C[N@H+](C)[C@@H](C)C2CC2)c1 ZINC000550681199 341321396 /nfs/dbraw/zinc/32/13/96/341321396.db2.gz LXMZJRUNIPVFQF-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP C[C@H](C1CC1)[NH+](C)Cc1cccc(C[N@@H+](C)[C@@H](C)C2CC2)c1 ZINC000550681199 341321397 /nfs/dbraw/zinc/32/13/97/341321397.db2.gz LXMZJRUNIPVFQF-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC2CCC(F)(F)CC2)C[C@@H]1c1ccccc1 ZINC000550797658 341323222 /nfs/dbraw/zinc/32/32/22/341323222.db2.gz UHOKGAJAZWSBNK-ZWKOTPCHSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2CCC(F)(F)CC2)C[C@@H]1c1ccccc1 ZINC000550797658 341323223 /nfs/dbraw/zinc/32/32/23/341323223.db2.gz UHOKGAJAZWSBNK-ZWKOTPCHSA-N 2 1 322.443 4.237 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000550832490 341324096 /nfs/dbraw/zinc/32/40/96/341324096.db2.gz IGRBQOFMAHZQMB-UAPYVXQJSA-N 2 1 300.490 4.209 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@H]1c1ccccc1 ZINC000550847886 341324369 /nfs/dbraw/zinc/32/43/69/341324369.db2.gz PCKKVUWVFLNEGH-ROUUACIJSA-N 2 1 302.506 4.484 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@H]1c1ccccc1 ZINC000550847886 341324370 /nfs/dbraw/zinc/32/43/70/341324370.db2.gz PCKKVUWVFLNEGH-ROUUACIJSA-N 2 1 302.506 4.484 20 0 DIADMP CC(C)C1([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC000550882632 341325335 /nfs/dbraw/zinc/32/53/35/341325335.db2.gz PRFIXUZDLNJVDP-UHFFFAOYSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](F)CC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000550881967 341325344 /nfs/dbraw/zinc/32/53/44/341325344.db2.gz FIFRVERLMQAJJA-IJXRJRJASA-N 2 1 318.480 4.015 20 0 DIADMP CC1=CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931758 341327075 /nfs/dbraw/zinc/32/70/75/341327075.db2.gz UUHILTRPIGJGDA-PMACEKPBSA-N 2 1 312.501 4.376 20 0 DIADMP CC1=CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931758 341327076 /nfs/dbraw/zinc/32/70/76/341327076.db2.gz UUHILTRPIGJGDA-PMACEKPBSA-N 2 1 312.501 4.376 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3F)C[C@H]1c1ccccc1 ZINC000551013899 341329245 /nfs/dbraw/zinc/32/92/45/341329245.db2.gz FWVJYMCBRAXJHM-NDXORKPFSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3F)C[C@H]1c1ccccc1 ZINC000551013899 341329246 /nfs/dbraw/zinc/32/92/46/341329246.db2.gz FWVJYMCBRAXJHM-NDXORKPFSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(F)cc32)C[C@H]1c1ccccc1 ZINC000551085626 341331212 /nfs/dbraw/zinc/33/12/12/341331212.db2.gz DCAMDAOOZUOVTE-JBACZVJFSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc(F)cc32)C[C@H]1c1ccccc1 ZINC000551085626 341331213 /nfs/dbraw/zinc/33/12/13/341331213.db2.gz DCAMDAOOZUOVTE-JBACZVJFSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2(c3ccccc3)CCC2)C[C@H]1c1ccccc1 ZINC000551114766 341331937 /nfs/dbraw/zinc/33/19/37/341331937.db2.gz HHHMARSDICFOSR-RTWAWAEBSA-N 2 1 320.480 4.491 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2(c3ccccc3)CCC2)C[C@H]1c1ccccc1 ZINC000551114766 341331938 /nfs/dbraw/zinc/33/19/38/341331938.db2.gz HHHMARSDICFOSR-RTWAWAEBSA-N 2 1 320.480 4.491 20 0 DIADMP CC[C@@H](C)[C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551268264 341336360 /nfs/dbraw/zinc/33/63/60/341336360.db2.gz TYDFSBATLSSSQN-WSCVDHEUSA-N 2 1 302.506 4.454 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC2(C)C)C[C@H]1c1ccccc1 ZINC000551301050 341337747 /nfs/dbraw/zinc/33/77/47/341337747.db2.gz CLLLDDLZMPQYRU-FHWLQOOXSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC2(C)C)C[C@H]1c1ccccc1 ZINC000551301050 341337748 /nfs/dbraw/zinc/33/77/48/341337748.db2.gz CLLLDDLZMPQYRU-FHWLQOOXSA-N 2 1 300.490 4.238 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000246895008 341358299 /nfs/dbraw/zinc/35/82/99/341358299.db2.gz FOIMJJRCTJCUHZ-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccccc3o2)C1 ZINC000246924195 341358625 /nfs/dbraw/zinc/35/86/25/341358625.db2.gz GOIOSDBCAKYPQG-HZPDHXFCSA-N 2 1 300.446 4.204 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccccc3o2)C1 ZINC000246924195 341358626 /nfs/dbraw/zinc/35/86/26/341358626.db2.gz GOIOSDBCAKYPQG-HZPDHXFCSA-N 2 1 300.446 4.204 20 0 DIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000247094148 341360993 /nfs/dbraw/zinc/36/09/93/341360993.db2.gz OGZDSENAZYLQIY-YZLZLFLDSA-N 2 1 312.457 4.087 20 0 DIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000247094148 341360994 /nfs/dbraw/zinc/36/09/94/341360994.db2.gz OGZDSENAZYLQIY-YZLZLFLDSA-N 2 1 312.457 4.087 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccoc1 ZINC000247192703 341362051 /nfs/dbraw/zinc/36/20/51/341362051.db2.gz VVHZHSSVJRSYOR-IAGOWNOFSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccoc1 ZINC000247192703 341362052 /nfs/dbraw/zinc/36/20/52/341362052.db2.gz VVHZHSSVJRSYOR-IAGOWNOFSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c2ccsc2S1 ZINC000247257721 341362799 /nfs/dbraw/zinc/36/27/99/341362799.db2.gz YXDFZXFXMDVLAA-JLNYLFASSA-N 2 1 310.532 4.136 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1F ZINC000248391483 341376330 /nfs/dbraw/zinc/37/63/30/341376330.db2.gz CHSPSCLBRIKFCS-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1F ZINC000248391483 341376331 /nfs/dbraw/zinc/37/63/31/341376331.db2.gz CHSPSCLBRIKFCS-KKUMJFAQSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)c(F)c1 ZINC000248392447 341376367 /nfs/dbraw/zinc/37/63/67/341376367.db2.gz DBGUYVRWXDPYDN-DZKIICNBSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H](c1cccc(Cl)c1F)N1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000248551235 341379747 /nfs/dbraw/zinc/37/97/47/341379747.db2.gz INJANAXEMLKNSI-DVOMOZLQSA-N 2 1 321.827 4.320 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(-c3cccnc3)c2)C[C@H]1C ZINC000552290282 341384527 /nfs/dbraw/zinc/38/45/27/341384527.db2.gz FNVIGRRSRGEKPV-DYESRHJHSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@H]1C ZINC000552290282 341384528 /nfs/dbraw/zinc/38/45/28/341384528.db2.gz FNVIGRRSRGEKPV-DYESRHJHSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@H]1C ZINC000552290282 341384529 /nfs/dbraw/zinc/38/45/29/341384529.db2.gz FNVIGRRSRGEKPV-DYESRHJHSA-N 2 1 323.484 4.053 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000248993545 341391439 /nfs/dbraw/zinc/39/14/39/341391439.db2.gz LMZZUKLXGOUZKK-HZPDHXFCSA-N 2 1 323.550 4.429 20 0 DIADMP C[C@@H](C1CC1)[NH+](C)Cc1ccc(C[N@H+](C)[C@@H](C)C2CC2)cc1 ZINC000552493843 341396283 /nfs/dbraw/zinc/39/62/83/341396283.db2.gz MLNCAJYCCSYEKR-HOTGVXAUSA-N 2 1 300.490 4.147 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000249434340 341397565 /nfs/dbraw/zinc/39/75/65/341397565.db2.gz FAZCYIVPVDRPSC-HZPDHXFCSA-N 2 1 306.519 4.180 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(C)ccc1OC ZINC000089512954 341405131 /nfs/dbraw/zinc/40/51/31/341405131.db2.gz UXDYCFHWPXHBBJ-GOSISDBHSA-N 2 1 318.505 4.307 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(C)ccc1OC ZINC000089512953 341405214 /nfs/dbraw/zinc/40/52/14/341405214.db2.gz UXDYCFHWPXHBBJ-SFHVURJKSA-N 2 1 318.505 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC(Nc3cccc4cc[nH+]cc43)CC2)cc1 ZINC000310023115 341600343 /nfs/dbraw/zinc/60/03/43/341600343.db2.gz ASXIPMUMPSMELM-UHFFFAOYSA-N 2 1 317.436 4.311 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccco1 ZINC000157023026 341630590 /nfs/dbraw/zinc/63/05/90/341630590.db2.gz WBSXOOUABKYOLE-KRWDZBQOSA-N 2 1 312.457 4.362 20 0 DIADMP CSC1(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCC1 ZINC000368216731 525332204 /nfs/dbraw/zinc/33/22/04/525332204.db2.gz UANLNMCIXGERGQ-GOEBONIOSA-N 2 1 324.559 4.006 20 0 DIADMP CSC1(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CCC1 ZINC000368216731 525332216 /nfs/dbraw/zinc/33/22/16/525332216.db2.gz UANLNMCIXGERGQ-GOEBONIOSA-N 2 1 324.559 4.006 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccccn1 ZINC000159016444 525455225 /nfs/dbraw/zinc/45/52/25/525455225.db2.gz VYHZJZHYLMLNTR-SFHVURJKSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccncc1 ZINC000266423634 525463185 /nfs/dbraw/zinc/46/31/85/525463185.db2.gz BJHBSFUDZHRFDQ-ROUUACIJSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl ZINC000338009276 527423200 /nfs/dbraw/zinc/42/32/00/527423200.db2.gz TXMHWSQGTKECEU-WMZOPIPTSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1cccc2cc[nH+]c(N3CCCC[C@@H]3CC[NH+]3CCCC3)c12 ZINC001165047412 721977356 /nfs/dbraw/zinc/97/73/56/721977356.db2.gz GOWDOQKYSAYUBO-LJQANCHMSA-N 2 1 323.484 4.388 20 0 DIADMP CC(C)C(C)(C)C[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579722489 1035530225 /nfs/dbraw/zinc/53/02/25/1035530225.db2.gz LFUPYYLJZYGKLF-PKOBYXMFSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000643546020 1035591255 /nfs/dbraw/zinc/59/12/55/1035591255.db2.gz HDAQXWNOEDBKOV-ABAIWWIYSA-N 2 1 313.272 4.319 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1Cl ZINC000643546260 1035591837 /nfs/dbraw/zinc/59/18/37/1035591837.db2.gz LKKMVHCAXZAVKW-RYUDHWBXSA-N 2 1 313.272 4.319 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)oc2cc1C ZINC000643546474 1035592014 /nfs/dbraw/zinc/59/20/14/1035592014.db2.gz PHGKQPQUMHPRAI-NVXWUHKLSA-N 2 1 312.457 4.375 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1Cl ZINC000643546259 1035592499 /nfs/dbraw/zinc/59/24/99/1035592499.db2.gz LKKMVHCAXZAVKW-NWDGAFQWSA-N 2 1 313.272 4.319 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCS2 ZINC000643546470 1035592647 /nfs/dbraw/zinc/59/26/47/1035592647.db2.gz PHEHIUGBVPFCLP-HIFRSBDPSA-N 2 1 322.905 4.141 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546088 1035592694 /nfs/dbraw/zinc/59/26/94/1035592694.db2.gz IEVSKVOFMYFOPB-DOMZBBRYSA-N 2 1 322.905 4.141 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144210 1035666930 /nfs/dbraw/zinc/66/69/30/1035666930.db2.gz JUIBCVXRBVIIQG-PKOBYXMFSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144210 1035666946 /nfs/dbraw/zinc/66/69/46/1035666946.db2.gz JUIBCVXRBVIIQG-PKOBYXMFSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1cnccc1O[C@H]1CC[N@@H+](CCC(C)(C)c2ccccc2)C1 ZINC001208674027 1035797079 /nfs/dbraw/zinc/79/70/79/1035797079.db2.gz ZIUCMBBQNXOTIG-IBGZPJMESA-N 2 1 324.468 4.211 20 0 DIADMP CC(C)CCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001208737379 1035845825 /nfs/dbraw/zinc/84/58/25/1035845825.db2.gz ZFNHJTZDWTXYQY-UHFFFAOYSA-N 2 1 302.506 4.267 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)CCC2 ZINC000535621442 1035976569 /nfs/dbraw/zinc/97/65/69/1035976569.db2.gz LRBSBKWVWZSXHQ-UZLBHIALSA-N 2 1 300.490 4.119 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCS2 ZINC000037318633 1036017231 /nfs/dbraw/zinc/01/72/31/1036017231.db2.gz BUMGSEFYKBZCEG-INIZCTEOSA-N 2 1 322.905 4.093 20 0 DIADMP Cc1ccc(F)cc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000180141043 1036043284 /nfs/dbraw/zinc/04/32/84/1036043284.db2.gz OYFRUTOZAWHRFO-UHFFFAOYSA-N 2 1 314.448 4.264 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccsc1 ZINC000398123903 1036242071 /nfs/dbraw/zinc/24/20/71/1036242071.db2.gz HSWQHDDKVNMQRG-TXPKVOOTSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccsc1 ZINC000398123903 1036242090 /nfs/dbraw/zinc/24/20/90/1036242090.db2.gz HSWQHDDKVNMQRG-TXPKVOOTSA-N 2 1 314.498 4.309 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+]C3CCCCCC3)C2)c1 ZINC000236582683 1036293649 /nfs/dbraw/zinc/29/36/49/1036293649.db2.gz PQALTHZDHGRIKU-INIZCTEOSA-N 2 1 306.519 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+]C3CCCCCC3)C2)c1 ZINC000236582683 1036293663 /nfs/dbraw/zinc/29/36/63/1036293663.db2.gz PQALTHZDHGRIKU-INIZCTEOSA-N 2 1 306.519 4.273 20 0 DIADMP C[C@H](C1CC1)[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CC1 ZINC001167262010 1036342922 /nfs/dbraw/zinc/34/29/22/1036342922.db2.gz UAYMTTVEPIYWDV-QGZVFWFLSA-N 2 1 312.501 4.435 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000537952906 1036355730 /nfs/dbraw/zinc/35/57/30/1036355730.db2.gz XYBVSZBQKFMKFV-FXAWDEMLSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCCCCC2)cc1F ZINC000237645468 1036392948 /nfs/dbraw/zinc/39/29/48/1036392948.db2.gz IGFTWIWFNFRZBW-UHFFFAOYSA-N 2 1 301.409 4.132 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc3cc[nH]c3c2)C1 ZINC001648811747 1036493704 /nfs/dbraw/zinc/49/37/04/1036493704.db2.gz YKCMKTGEWSPJJY-CALCHBBNSA-N 2 1 313.489 4.016 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CS1 ZINC000655715670 1036499564 /nfs/dbraw/zinc/49/95/64/1036499564.db2.gz NBNMGFFAJWHTOI-PNBKFKSVSA-N 2 1 324.559 4.005 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CS1 ZINC000655715670 1036499576 /nfs/dbraw/zinc/49/95/76/1036499576.db2.gz NBNMGFFAJWHTOI-PNBKFKSVSA-N 2 1 324.559 4.005 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@@H](C)SC2)CC1 ZINC000655715596 1036500044 /nfs/dbraw/zinc/50/00/44/1036500044.db2.gz MHNAUUORDCBPHQ-GPMSIDNRSA-N 2 1 318.530 4.086 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)o1 ZINC000067668258 1036508808 /nfs/dbraw/zinc/50/88/08/1036508808.db2.gz WYQKVTOSHBOSIU-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CCC(c2ccccc2)CC1 ZINC000121435961 1036580980 /nfs/dbraw/zinc/58/09/80/1036580980.db2.gz CTBOFYVUIDLWRS-DZIBYMRMSA-N 2 1 311.473 4.144 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006015 1036712288 /nfs/dbraw/zinc/71/22/88/1036712288.db2.gz HXQFVGXQEQUNBX-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006015 1036712298 /nfs/dbraw/zinc/71/22/98/1036712298.db2.gz HXQFVGXQEQUNBX-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006015 1036712310 /nfs/dbraw/zinc/71/23/10/1036712310.db2.gz HXQFVGXQEQUNBX-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006015 1036712319 /nfs/dbraw/zinc/71/23/19/1036712319.db2.gz HXQFVGXQEQUNBX-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000683691245 1036715346 /nfs/dbraw/zinc/71/53/46/1036715346.db2.gz XATGUTFIZCKEHC-UIAACRFSSA-N 2 1 311.473 4.302 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000317326572 1036829680 /nfs/dbraw/zinc/82/96/80/1036829680.db2.gz WPLIEEFGPSPITG-NSISKUIASA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000317326572 1036829697 /nfs/dbraw/zinc/82/96/97/1036829697.db2.gz WPLIEEFGPSPITG-NSISKUIASA-N 2 1 300.490 4.380 20 0 DIADMP FCCCCC[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000556501373 1036957623 /nfs/dbraw/zinc/95/76/23/1036957623.db2.gz AEZXLYWNALXZIO-HXUWFJFHSA-N 2 1 318.480 4.114 20 0 DIADMP FCCCCC[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000556501373 1036957634 /nfs/dbraw/zinc/95/76/34/1036957634.db2.gz AEZXLYWNALXZIO-HXUWFJFHSA-N 2 1 318.480 4.114 20 0 DIADMP FCCCCC[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000556501373 1036957642 /nfs/dbraw/zinc/95/76/42/1036957642.db2.gz AEZXLYWNALXZIO-HXUWFJFHSA-N 2 1 318.480 4.114 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCCCCC1 ZINC000398020344 1037084809 /nfs/dbraw/zinc/08/48/09/1037084809.db2.gz JVUXGEFLWVMDQP-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCCCCC1 ZINC000398020344 1037084824 /nfs/dbraw/zinc/08/48/24/1037084824.db2.gz JVUXGEFLWVMDQP-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398019153 1037084966 /nfs/dbraw/zinc/08/49/66/1037084966.db2.gz JCSKRLVSTIEYAJ-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)C1 ZINC000398019153 1037084985 /nfs/dbraw/zinc/08/49/85/1037084985.db2.gz JCSKRLVSTIEYAJ-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398036284 1037104367 /nfs/dbraw/zinc/10/43/67/1037104367.db2.gz QANMETJHPMOMAP-HOJAQTOUSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398036284 1037104372 /nfs/dbraw/zinc/10/43/72/1037104372.db2.gz QANMETJHPMOMAP-HOJAQTOUSA-N 2 1 302.506 4.455 20 0 DIADMP C/C(=C/c1ccccc1)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000255539101 1037148295 /nfs/dbraw/zinc/14/82/95/1037148295.db2.gz ORGHDKXWYYXBHH-SFQCBASQSA-N 2 1 310.485 4.039 20 0 DIADMP C/C(=C/c1ccccc1)C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000255539101 1037148307 /nfs/dbraw/zinc/14/83/07/1037148307.db2.gz ORGHDKXWYYXBHH-SFQCBASQSA-N 2 1 310.485 4.039 20 0 DIADMP C/C(=C/c1ccccc1)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000255539101 1037148318 /nfs/dbraw/zinc/14/83/18/1037148318.db2.gz ORGHDKXWYYXBHH-SFQCBASQSA-N 2 1 310.485 4.039 20 0 DIADMP CC(C)Cc1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC001167429233 1037243491 /nfs/dbraw/zinc/24/34/91/1037243491.db2.gz HUPVNWUBXWWMCD-NRFANRHFSA-N 2 1 314.517 4.193 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000398189039 1037279176 /nfs/dbraw/zinc/27/91/76/1037279176.db2.gz MEPAYFOFOSLYPJ-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000398189039 1037279195 /nfs/dbraw/zinc/27/91/95/1037279195.db2.gz MEPAYFOFOSLYPJ-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CC[C@H]2C2CC2)C[N@H+]1Cc1ccccc1 ZINC000558252601 1037492187 /nfs/dbraw/zinc/49/21/87/1037492187.db2.gz QCWGTAUAMOPBII-LGYWMIHWSA-N 2 1 312.501 4.065 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1C(C)=CCC[C@H]1C ZINC000581694066 1037920523 /nfs/dbraw/zinc/92/05/23/1037920523.db2.gz BLBSHURJJLHISS-QZTJIDSGSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1C(C)=CCC[C@H]1C ZINC000581694066 1037920536 /nfs/dbraw/zinc/92/05/36/1037920536.db2.gz BLBSHURJJLHISS-QZTJIDSGSA-N 2 1 303.494 4.150 20 0 DIADMP CCOc1ccccc1[C@@H](CC)NCC[C@@H]1CCCC[N@H+]1C ZINC000341662859 1038210132 /nfs/dbraw/zinc/21/01/32/1038210132.db2.gz VYJLFAPHTYFCLL-FUHWJXTLSA-N 2 1 304.478 4.000 20 0 DIADMP CCOc1ccccc1[C@@H](CC)[NH2+]CC[C@@H]1CCCC[N@H+]1C ZINC000341662859 1038210160 /nfs/dbraw/zinc/21/01/60/1038210160.db2.gz VYJLFAPHTYFCLL-FUHWJXTLSA-N 2 1 304.478 4.000 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(Cl)c(F)c2)CC1 ZINC000535811997 1038343998 /nfs/dbraw/zinc/34/39/98/1038343998.db2.gz YWMRPCPUYNVJCP-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000604885061 1038463212 /nfs/dbraw/zinc/46/32/12/1038463212.db2.gz FFWWUABVLJJYNP-AABGKKOBSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000604885061 1038463216 /nfs/dbraw/zinc/46/32/16/1038463216.db2.gz FFWWUABVLJJYNP-AABGKKOBSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1)c1ccccc1 ZINC000604885061 1038463218 /nfs/dbraw/zinc/46/32/18/1038463218.db2.gz FFWWUABVLJJYNP-AABGKKOBSA-N 2 1 314.517 4.377 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000707898411 1038498614 /nfs/dbraw/zinc/49/86/14/1038498614.db2.gz IPYHFWIPVATOLC-SLFFLAALSA-N 2 1 321.468 4.021 20 0 DIADMP C[C@@H](C[NH+]1CCC[C@@H]1C1CCC1)C[N@H+]1CCC[C@H]1C1CCC1 ZINC000605573258 1038537350 /nfs/dbraw/zinc/53/73/50/1038537350.db2.gz UGVDFCYUNCTGER-PDFPEKILSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H]1C1CCC1)C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000605573258 1038537354 /nfs/dbraw/zinc/53/73/54/1038537354.db2.gz UGVDFCYUNCTGER-PDFPEKILSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H]1C1CCC1)C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000605573258 1038537357 /nfs/dbraw/zinc/53/73/57/1038537357.db2.gz UGVDFCYUNCTGER-PDFPEKILSA-N 2 1 304.522 4.152 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)c1 ZINC000657314422 1038554615 /nfs/dbraw/zinc/55/46/15/1038554615.db2.gz VIWKTSWWBVRQPF-ROUUACIJSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)cc2)c1 ZINC000657314422 1038554626 /nfs/dbraw/zinc/55/46/26/1038554626.db2.gz VIWKTSWWBVRQPF-ROUUACIJSA-N 2 1 312.482 4.132 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ncccc1C)C(C)(C)C ZINC000934292473 1038582698 /nfs/dbraw/zinc/58/26/98/1038582698.db2.gz QFWRTIGCUVWZRJ-GOSISDBHSA-N 2 1 314.477 4.052 20 0 DIADMP C[C@@H](Cc1cccs1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000684773101 1038596334 /nfs/dbraw/zinc/59/63/34/1038596334.db2.gz CDMOWBWMBIWLAA-RDJZCZTQSA-N 2 1 306.519 4.066 20 0 DIADMP FC1(F)CCCC[N@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207285977 1038634052 /nfs/dbraw/zinc/63/40/52/1038634052.db2.gz ADWSUGDFTBZNOG-UHFFFAOYSA-N 2 1 322.443 4.020 20 0 DIADMP FC1(F)CCCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207285977 1038634056 /nfs/dbraw/zinc/63/40/56/1038634056.db2.gz ADWSUGDFTBZNOG-UHFFFAOYSA-N 2 1 322.443 4.020 20 0 DIADMP C(CC[N@H+]1CCC[C@H]2CCC[C@H]21)C[NH+]1CCC[C@@H]2CCC[C@H]21 ZINC000582339676 1038634852 /nfs/dbraw/zinc/63/48/52/1038634852.db2.gz CPGLNEKTBGXKEJ-IYWMVGAKSA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@@H+]1CCC[C@@H]2CCC[C@H]21)C[NH+]1CCC[C@H]2CCC[C@H]21 ZINC000582339676 1038634854 /nfs/dbraw/zinc/63/48/54/1038634854.db2.gz CPGLNEKTBGXKEJ-IYWMVGAKSA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@H+]1CCC[C@@H]2CCC[C@H]21)C[NH+]1CCC[C@H]2CCC[C@H]21 ZINC000582339676 1038634857 /nfs/dbraw/zinc/63/48/57/1038634857.db2.gz CPGLNEKTBGXKEJ-IYWMVGAKSA-N 2 1 304.522 4.296 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@@H]1CCN(C)[C@H](C)C1 ZINC001167586619 1038713762 /nfs/dbraw/zinc/71/37/62/1038713762.db2.gz OXROSFRCHDDGRJ-VQIMIIECSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC001167586619 1038713771 /nfs/dbraw/zinc/71/37/71/1038713771.db2.gz OXROSFRCHDDGRJ-VQIMIIECSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1 ZINC001167586619 1038713782 /nfs/dbraw/zinc/71/37/82/1038713782.db2.gz OXROSFRCHDDGRJ-VQIMIIECSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC001167586619 1038713791 /nfs/dbraw/zinc/71/37/91/1038713791.db2.gz OXROSFRCHDDGRJ-VQIMIIECSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC001167586619 1038713800 /nfs/dbraw/zinc/71/38/00/1038713800.db2.gz OXROSFRCHDDGRJ-VQIMIIECSA-N 2 1 310.485 4.317 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@]1(C)Cc1ccccc1 ZINC000342682843 1038720392 /nfs/dbraw/zinc/72/03/92/1038720392.db2.gz ULYLOXQSLYEVGP-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@]1(C)Cc1ccccc1 ZINC000342682843 1038720402 /nfs/dbraw/zinc/72/04/02/1038720402.db2.gz ULYLOXQSLYEVGP-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCC1(C)C ZINC000342714405 1038735134 /nfs/dbraw/zinc/73/51/34/1038735134.db2.gz VFHOUTVPGZUNCA-IBGZPJMESA-N 2 1 312.457 4.190 20 0 DIADMP CC[N@H+](CCCn1cc[nH+]c1C)Cc1ccc2ccccc2c1 ZINC000342858300 1038921297 /nfs/dbraw/zinc/92/12/97/1038921297.db2.gz CVNFDKPWJFMVGI-UHFFFAOYSA-N 2 1 307.441 4.257 20 0 DIADMP CC[N@@H+](CCCn1cc[nH+]c1C)Cc1ccc2ccccc2c1 ZINC000342858300 1038921311 /nfs/dbraw/zinc/92/13/11/1038921311.db2.gz CVNFDKPWJFMVGI-UHFFFAOYSA-N 2 1 307.441 4.257 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000342859607 1038923109 /nfs/dbraw/zinc/92/31/09/1038923109.db2.gz JRXCMULWTCTYGR-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000342859607 1038923122 /nfs/dbraw/zinc/92/31/22/1038923122.db2.gz JRXCMULWTCTYGR-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863271 1038930199 /nfs/dbraw/zinc/93/01/99/1038930199.db2.gz HCAOIUWNEKGJHW-CRAIPNDOSA-N 2 1 315.461 4.210 20 0 DIADMP CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863271 1038930216 /nfs/dbraw/zinc/93/02/16/1038930216.db2.gz HCAOIUWNEKGJHW-CRAIPNDOSA-N 2 1 315.461 4.210 20 0 DIADMP CC1(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCC1 ZINC001167648699 1039083271 /nfs/dbraw/zinc/08/32/71/1039083271.db2.gz WYLALHYAZGUXBY-VQTJNVASSA-N 2 1 312.501 4.163 20 0 DIADMP CO[C@H](CC(C)C)C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC001167659867 1039206852 /nfs/dbraw/zinc/20/68/52/1039206852.db2.gz VYCQIWFGUHBNPQ-UYAOXDASSA-N 2 1 324.553 4.024 20 0 DIADMP CSc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCC2 ZINC000647281207 1039221440 /nfs/dbraw/zinc/22/14/40/1039221440.db2.gz BSMCONAQPXLFQM-LJQANCHMSA-N 2 1 316.514 4.002 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498727 1039277872 /nfs/dbraw/zinc/27/78/72/1039277872.db2.gz VIJFDKHCCVHCPD-KBPBESRZSA-N 2 1 320.864 4.469 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498727 1039277883 /nfs/dbraw/zinc/27/78/83/1039277883.db2.gz VIJFDKHCCVHCPD-KBPBESRZSA-N 2 1 320.864 4.469 20 0 DIADMP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000539508133 1039278874 /nfs/dbraw/zinc/27/88/74/1039278874.db2.gz SIGFNDRWAZVJCN-INIZCTEOSA-N 2 1 324.921 4.062 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000539508778 1039281722 /nfs/dbraw/zinc/28/17/22/1039281722.db2.gz ZKMZYYPQQVALEK-KRWDZBQOSA-N 2 1 316.489 4.168 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756770 1039307170 /nfs/dbraw/zinc/30/71/70/1039307170.db2.gz IIOVFXRCUQXRQD-UXHICEINSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756770 1039307182 /nfs/dbraw/zinc/30/71/82/1039307182.db2.gz IIOVFXRCUQXRQD-UXHICEINSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)CCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000539817750 1039344389 /nfs/dbraw/zinc/34/43/89/1039344389.db2.gz OLUHNRMDYSBLOY-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000539817750 1039344401 /nfs/dbraw/zinc/34/44/01/1039344401.db2.gz OLUHNRMDYSBLOY-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000539817750 1039344417 /nfs/dbraw/zinc/34/44/17/1039344417.db2.gz OLUHNRMDYSBLOY-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000539817750 1039344435 /nfs/dbraw/zinc/34/44/35/1039344435.db2.gz OLUHNRMDYSBLOY-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC000539849838 1039369602 /nfs/dbraw/zinc/36/96/02/1039369602.db2.gz NNUFWFLRNRHWKX-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000539849838 1039369614 /nfs/dbraw/zinc/36/96/14/1039369614.db2.gz NNUFWFLRNRHWKX-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000539896605 1039382472 /nfs/dbraw/zinc/38/24/72/1039382472.db2.gz MDRGCOGBOAACOL-UZLBHIALSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000539896605 1039382486 /nfs/dbraw/zinc/38/24/86/1039382486.db2.gz MDRGCOGBOAACOL-UZLBHIALSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000539896605 1039382504 /nfs/dbraw/zinc/38/25/04/1039382504.db2.gz MDRGCOGBOAACOL-UZLBHIALSA-N 2 1 324.468 4.190 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccsc1 ZINC000669850676 1039383786 /nfs/dbraw/zinc/38/37/86/1039383786.db2.gz FFTNHVPFHZOVIY-RVKKMQEKSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000539896600 1039383972 /nfs/dbraw/zinc/38/39/72/1039383972.db2.gz MDRGCOGBOAACOL-OXQOHEQNSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000539896600 1039383994 /nfs/dbraw/zinc/38/39/94/1039383994.db2.gz MDRGCOGBOAACOL-OXQOHEQNSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000539896600 1039384008 /nfs/dbraw/zinc/38/40/08/1039384008.db2.gz MDRGCOGBOAACOL-OXQOHEQNSA-N 2 1 324.468 4.190 20 0 DIADMP C[C@H](CC1CC1)[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540142649 1039423943 /nfs/dbraw/zinc/42/39/43/1039423943.db2.gz DDNMZIOGKCOCGX-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000151125688 1039442381 /nfs/dbraw/zinc/44/23/81/1039442381.db2.gz FOIMJJRCTJCUHZ-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]Cc3ccc(C[NH3+])cc3F)oc2c1 ZINC000650754285 1039460195 /nfs/dbraw/zinc/46/01/95/1039460195.db2.gz FOJYQBOZKFYQCZ-ZDUSSCGKSA-N 2 1 312.388 4.190 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000540261592 1039464711 /nfs/dbraw/zinc/46/47/11/1039464711.db2.gz JHORQZNOTKANCE-KSSFIOAISA-N 2 1 306.881 4.111 20 0 DIADMP Cc1cc([C@@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)ccc1F ZINC000540299881 1039470521 /nfs/dbraw/zinc/47/05/21/1039470521.db2.gz UIRGMTMCAUOJOE-UZLBHIALSA-N 2 1 318.480 4.295 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(CC(C)C)cc1)C1CC1 ZINC000540589909 1039521692 /nfs/dbraw/zinc/52/16/92/1039521692.db2.gz PEMGDKZMJDHOAD-FQEVSTJZSA-N 2 1 311.473 4.131 20 0 DIADMP C[C@@H](CC[NH2+][C@@H]1CCSc2c(F)cccc21)[NH+]1CCCCC1 ZINC000346872542 1039577823 /nfs/dbraw/zinc/57/78/23/1039577823.db2.gz NJLRNIHTVCPBPT-WMLDXEAASA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H](c1ccccc1)[N@H+](CCCc1c[nH+]cn1C)C1CCCC1 ZINC000584121589 1039610995 /nfs/dbraw/zinc/61/09/95/1039610995.db2.gz RCBBGRXJVKSCOB-QGZVFWFLSA-N 2 1 311.473 4.359 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+](CCCc1c[nH+]cn1C)C1CCCC1 ZINC000584121589 1039611011 /nfs/dbraw/zinc/61/10/11/1039611011.db2.gz RCBBGRXJVKSCOB-QGZVFWFLSA-N 2 1 311.473 4.359 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc2cnccc2o1 ZINC000657838854 1039680080 /nfs/dbraw/zinc/68/00/80/1039680080.db2.gz ZNIFVBZEHJQVPE-JKSUJKDBSA-N 2 1 315.461 4.133 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C2CCCCCC2)[C@@H](C)C1 ZINC000541544992 1039696574 /nfs/dbraw/zinc/69/65/74/1039696574.db2.gz CBDZIXUJVKWPTD-NSHGMRRFSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1ccccc1CCC[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000541601905 1039715883 /nfs/dbraw/zinc/71/58/83/1039715883.db2.gz VWESNWHALOUMTI-UYAOXDASSA-N 2 1 314.517 4.170 20 0 DIADMP CCc1ccc(CC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000541601811 1039716090 /nfs/dbraw/zinc/71/60/90/1039716090.db2.gz QJGCKEKIXSSDAV-FXAWDEMLSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081633838 1039724848 /nfs/dbraw/zinc/72/48/48/1039724848.db2.gz FCJMJCJTEAZYIO-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000081633838 1039724866 /nfs/dbraw/zinc/72/48/66/1039724866.db2.gz FCJMJCJTEAZYIO-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000081633838 1039724883 /nfs/dbraw/zinc/72/48/83/1039724883.db2.gz FCJMJCJTEAZYIO-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081633838 1039724900 /nfs/dbraw/zinc/72/49/00/1039724900.db2.gz FCJMJCJTEAZYIO-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915766 1039759107 /nfs/dbraw/zinc/75/91/07/1039759107.db2.gz ZBBIQHMLMQAWTA-SUMWQHHRSA-N 2 1 312.860 4.108 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915766 1039759122 /nfs/dbraw/zinc/75/91/22/1039759122.db2.gz ZBBIQHMLMQAWTA-SUMWQHHRSA-N 2 1 312.860 4.108 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915764 1039759607 /nfs/dbraw/zinc/75/96/07/1039759607.db2.gz ZBBIQHMLMQAWTA-DYVFJYSZSA-N 2 1 312.860 4.108 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915764 1039759621 /nfs/dbraw/zinc/75/96/21/1039759621.db2.gz ZBBIQHMLMQAWTA-DYVFJYSZSA-N 2 1 312.860 4.108 20 0 DIADMP C(=C\[C@H]1CCCCC[N@@H+]1CCC[NH+]1CCCC1)\c1cccs1 ZINC000542134550 1039800002 /nfs/dbraw/zinc/80/00/02/1039800002.db2.gz RSYYTUJEYVTNSI-RXQFDZFGSA-N 2 1 318.530 4.492 20 0 DIADMP C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542151110 1039803619 /nfs/dbraw/zinc/80/36/19/1039803619.db2.gz ADXYQOWMKXKHJF-AOIWGVFYSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@@H](Cc1ccsc1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542151110 1039803641 /nfs/dbraw/zinc/80/36/41/1039803641.db2.gz ADXYQOWMKXKHJF-AOIWGVFYSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@@H](Cc1ccsc1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542151110 1039803660 /nfs/dbraw/zinc/80/36/60/1039803660.db2.gz ADXYQOWMKXKHJF-AOIWGVFYSA-N 2 1 320.546 4.266 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000092071547 1039864162 /nfs/dbraw/zinc/86/41/62/1039864162.db2.gz JJODKGYEFCJLFA-AWEZNQCLSA-N 2 1 303.837 4.060 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc3cnccc3o2)c1 ZINC000657872925 1039964105 /nfs/dbraw/zinc/96/41/05/1039964105.db2.gz UMSKJJGNSZMUTK-OAHLLOKOSA-N 2 1 323.440 4.130 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000647344172 1040006480 /nfs/dbraw/zinc/00/64/80/1040006480.db2.gz KXZVJZAICXZEQC-JQHSSLGASA-N 2 1 314.498 4.053 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CC3)[C@H]1c1cccs1 ZINC000657890311 1040052303 /nfs/dbraw/zinc/05/23/03/1040052303.db2.gz RUJPELRKGZPYQX-PVAVHDDUSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CC3)[C@H]1c1cccs1 ZINC000657890311 1040052322 /nfs/dbraw/zinc/05/23/22/1040052322.db2.gz RUJPELRKGZPYQX-PVAVHDDUSA-N 2 1 304.503 4.053 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000309684121 1040087998 /nfs/dbraw/zinc/08/79/98/1040087998.db2.gz BGLHJZPZFFIYRL-LNLFQRSKSA-N 2 1 312.457 4.149 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000309684121 1040088011 /nfs/dbraw/zinc/08/80/11/1040088011.db2.gz BGLHJZPZFFIYRL-LNLFQRSKSA-N 2 1 312.457 4.149 20 0 DIADMP CCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000309693143 1040090231 /nfs/dbraw/zinc/09/02/31/1040090231.db2.gz CGBOUEGVDDNKSQ-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001648921407 1040090514 /nfs/dbraw/zinc/09/05/14/1040090514.db2.gz YPNBIBXKLBEBTF-GOSISDBHSA-N 2 1 300.490 4.166 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)C(C)(C)C(F)F)[N@@H+](C)Cc1ccccc1 ZINC000657900929 1040097585 /nfs/dbraw/zinc/09/75/85/1040097585.db2.gz UPDGAVBJZBTWQX-HUUCEWRRSA-N 2 1 312.448 4.166 20 0 DIADMP C[C@H](CC1CC1)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000309967470 1040102474 /nfs/dbraw/zinc/10/24/74/1040102474.db2.gz LTDOGYFNQAYQBY-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc2[nH+]1 ZINC000310088810 1040106313 /nfs/dbraw/zinc/10/63/13/1040106313.db2.gz POOVCAGJYMWMQT-SFHVURJKSA-N 2 1 317.436 4.230 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+]C3CC(c4ccccc4)C3)C2)cc1 ZINC000310088696 1040106950 /nfs/dbraw/zinc/10/69/50/1040106950.db2.gz PNOJKJPJCJHAMZ-JSRJAPPDSA-N 2 1 320.480 4.044 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310282567 1040115738 /nfs/dbraw/zinc/11/57/38/1040115738.db2.gz WSDYJRDBZDZVBQ-DXIQSLLYSA-N 2 1 322.496 4.290 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1cscc1C(F)(F)F)C(C)C ZINC000685617602 1040161845 /nfs/dbraw/zinc/16/18/45/1040161845.db2.gz BBJNNVATPPMZMU-UHFFFAOYSA-N 2 1 322.440 4.365 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000685657920 1040197307 /nfs/dbraw/zinc/19/73/07/1040197307.db2.gz QCAMGROJWNLADG-CEXWTWQISA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000685657920 1040197318 /nfs/dbraw/zinc/19/73/18/1040197318.db2.gz QCAMGROJWNLADG-CEXWTWQISA-N 2 1 317.521 4.126 20 0 DIADMP C[C@@H](CC1CCC1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309741372 1040243404 /nfs/dbraw/zinc/24/34/04/1040243404.db2.gz RXEKMIUCYAFOIO-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1)C(C)(C)C(F)F ZINC000658001984 1040264534 /nfs/dbraw/zinc/26/45/34/1040264534.db2.gz DXXLICPPFRVXBH-UKRRQHHQSA-N 2 1 302.453 4.053 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1 ZINC000658064695 1040286624 /nfs/dbraw/zinc/28/66/24/1040286624.db2.gz QDKSKZDRMNINLT-CVEARBPZSA-N 2 1 320.440 4.030 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658228489 1040368731 /nfs/dbraw/zinc/36/87/31/1040368731.db2.gz IUZUUNWSXCXSRW-UONOGXRCSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658228489 1040368746 /nfs/dbraw/zinc/36/87/46/1040368746.db2.gz IUZUUNWSXCXSRW-UONOGXRCSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000658228490 1040368768 /nfs/dbraw/zinc/36/87/68/1040368768.db2.gz IUZUUNWSXCXSRW-ZIAGYGMSSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000658228490 1040368779 /nfs/dbraw/zinc/36/87/79/1040368779.db2.gz IUZUUNWSXCXSRW-ZIAGYGMSSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@@H](C[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310216169 1040454167 /nfs/dbraw/zinc/45/41/67/1040454167.db2.gz VXUFANWVSJZGIG-UGKGYDQZSA-N 2 1 322.496 4.292 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000525709766 1040572473 /nfs/dbraw/zinc/57/24/73/1040572473.db2.gz VGXSLDNOOLFUFU-UHFFFAOYSA-N 2 1 312.457 4.254 20 0 DIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCC[NH+](C)C ZINC000151905792 1040575917 /nfs/dbraw/zinc/57/59/17/1040575917.db2.gz VMFXKVBMFQEALY-AWEZNQCLSA-N 2 1 317.502 4.029 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000531140062 1040619403 /nfs/dbraw/zinc/61/94/03/1040619403.db2.gz HBRJNUWVCJMSHE-CJNGLKHVSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000531140062 1040619414 /nfs/dbraw/zinc/61/94/14/1040619414.db2.gz HBRJNUWVCJMSHE-CJNGLKHVSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000531140062 1040619421 /nfs/dbraw/zinc/61/94/21/1040619421.db2.gz HBRJNUWVCJMSHE-CJNGLKHVSA-N 2 1 314.395 4.010 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000309770702 1040726243 /nfs/dbraw/zinc/72/62/43/1040726243.db2.gz HLESTOZNMPBWKV-AOIWGVFYSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310103789 1040752278 /nfs/dbraw/zinc/75/22/78/1040752278.db2.gz ZBTVDWGIVWGXHG-TZIWHRDSSA-N 2 1 322.496 4.292 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000414062680 1040806824 /nfs/dbraw/zinc/80/68/24/1040806824.db2.gz BZZSHQPKILQRFR-SJLPKXTDSA-N 2 1 317.864 4.161 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)[C@@H]1C[C@@H]1C ZINC000414067277 1040813279 /nfs/dbraw/zinc/81/32/79/1040813279.db2.gz AGTXMJBMLXQJKA-FIYPYCPBSA-N 2 1 300.490 4.236 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@H]1C[C@@H]1C ZINC000414131122 1040904362 /nfs/dbraw/zinc/90/43/62/1040904362.db2.gz XLEJQDDQNFESNO-DNCCFGNJSA-N 2 1 306.519 4.155 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@H]1C[C@@H]1C ZINC000414131122 1040904374 /nfs/dbraw/zinc/90/43/74/1040904374.db2.gz XLEJQDDQNFESNO-DNCCFGNJSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC(C)(C)C1 ZINC000708833465 1040914736 /nfs/dbraw/zinc/91/47/36/1040914736.db2.gz CHPCXGWZMZVMAQ-SXLOBPIMSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000414169228 1040950096 /nfs/dbraw/zinc/95/00/96/1040950096.db2.gz AWLDWWNNLFBNOP-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000414169213 1040950912 /nfs/dbraw/zinc/95/09/12/1040950912.db2.gz AUPYWOVZGIDTCP-CVEARBPZSA-N 2 1 306.519 4.181 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1 ZINC000414212452 1041012870 /nfs/dbraw/zinc/01/28/70/1041012870.db2.gz QCJGSROEFBVIKA-FEKWIAJESA-N 2 1 312.501 4.208 20 0 DIADMP Cc1occc1CNCc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000414282529 1041079083 /nfs/dbraw/zinc/07/90/83/1041079083.db2.gz HMEHPLXNCGURFJ-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000414282529 1041079099 /nfs/dbraw/zinc/07/90/99/1041079099.db2.gz HMEHPLXNCGURFJ-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000414282529 1041079119 /nfs/dbraw/zinc/07/91/19/1041079119.db2.gz HMEHPLXNCGURFJ-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000414287700 1041080732 /nfs/dbraw/zinc/08/07/32/1041080732.db2.gz PBURIDAXBRPTFC-USYVTKNRSA-N 2 1 316.464 4.052 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000414298686 1041096712 /nfs/dbraw/zinc/09/67/12/1041096712.db2.gz ZHQFCNMLRVEZRI-MRXNPFEDSA-N 2 1 312.457 4.252 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2C[C@H]2c2ccco2)CC1 ZINC000414354424 1041163165 /nfs/dbraw/zinc/16/31/65/1041163165.db2.gz XHZZQLLQVKHNIP-NTFDOXNWSA-N 2 1 324.468 4.168 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000414355967 1041164055 /nfs/dbraw/zinc/16/40/55/1041164055.db2.gz CZFBCJIELUSUKI-UHFFFAOYSA-N 2 1 324.424 4.103 20 0 DIADMP Clc1cccc(CC[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001207422282 1041220918 /nfs/dbraw/zinc/22/09/18/1041220918.db2.gz FNCRKKBWUMRAJW-LJQANCHMSA-N 2 1 320.908 4.223 20 0 DIADMP Clc1cccc(CC[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001207422282 1041220935 /nfs/dbraw/zinc/22/09/35/1041220935.db2.gz FNCRKKBWUMRAJW-LJQANCHMSA-N 2 1 320.908 4.223 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(C(F)F)cc2)cc1 ZINC000809737970 1041240857 /nfs/dbraw/zinc/24/08/57/1041240857.db2.gz NXFBOXSCWMPQMQ-UHFFFAOYSA-N 2 1 318.411 4.318 20 0 DIADMP CCc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)s1 ZINC000809738118 1041240930 /nfs/dbraw/zinc/24/09/30/1041240930.db2.gz PUHWSQJYNCRHQF-UHFFFAOYSA-N 2 1 302.487 4.004 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1cc[nH+]cc1Cl ZINC000301527988 1041245876 /nfs/dbraw/zinc/24/58/76/1041245876.db2.gz GPCABOMIWSFPHQ-WMLDXEAASA-N 2 1 315.848 4.058 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1cc[nH+]cc1Cl ZINC000301527988 1041245892 /nfs/dbraw/zinc/24/58/92/1041245892.db2.gz GPCABOMIWSFPHQ-WMLDXEAASA-N 2 1 315.848 4.058 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1CCc2[nH+]ccn2C1)c1cc(C)sc1C ZINC000623934894 1041275191 /nfs/dbraw/zinc/27/51/91/1041275191.db2.gz IZWRVNHWMJECOV-GOEBONIOSA-N 2 1 303.475 4.007 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CC([NH2+]C[C@H]2CC=CCC2)C3)cc1 ZINC000135267705 1041365212 /nfs/dbraw/zinc/36/52/12/1041365212.db2.gz GOOSGWGNBQITPW-XSLAUPDRSA-N 2 1 310.485 4.128 20 0 DIADMP C[C@H](C1CC1)[NH+](C/C=C/C[N@H+]([C@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615536 1041384080 /nfs/dbraw/zinc/38/40/80/1041384080.db2.gz BQCYIYVUHISCJG-OBMMGQTPSA-N 2 1 302.506 4.068 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H](CC)CC(F)F)CC1 ZINC000659847344 1041441815 /nfs/dbraw/zinc/44/18/15/1041441815.db2.gz NIKDGBFZNSMTFK-HNNXBMFYSA-N 2 1 304.469 4.112 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000660113666 1041620808 /nfs/dbraw/zinc/62/08/08/1041620808.db2.gz CNFUKYKNBIRQHE-KNKQGSTJSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000660113666 1041620811 /nfs/dbraw/zinc/62/08/11/1041620811.db2.gz CNFUKYKNBIRQHE-KNKQGSTJSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000660113666 1041620815 /nfs/dbraw/zinc/62/08/15/1041620815.db2.gz CNFUKYKNBIRQHE-KNKQGSTJSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000660113666 1041620817 /nfs/dbraw/zinc/62/08/17/1041620817.db2.gz CNFUKYKNBIRQHE-KNKQGSTJSA-N 2 1 324.512 4.055 20 0 DIADMP C[C@@H](C[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000310216165 1041643998 /nfs/dbraw/zinc/64/39/98/1041643998.db2.gz VXUFANWVSJZGIG-SIKLNZKXSA-N 2 1 322.496 4.292 20 0 DIADMP Cc1cc(N2CCC3(CCC[N@H+](C4CCCC4)C3)CC2)cc[nH+]1 ZINC001279786015 1041658335 /nfs/dbraw/zinc/65/83/35/1041658335.db2.gz GFEIGFCUQZKKOM-UHFFFAOYSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1ccoc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000813789766 1041731604 /nfs/dbraw/zinc/73/16/04/1041731604.db2.gz YQRRXYSIXVVOHO-IHWFROFDSA-N 2 1 324.468 4.263 20 0 DIADMP Cc1ccoc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813789766 1041731607 /nfs/dbraw/zinc/73/16/07/1041731607.db2.gz YQRRXYSIXVVOHO-IHWFROFDSA-N 2 1 324.468 4.263 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC000709355248 1041733774 /nfs/dbraw/zinc/73/37/74/1041733774.db2.gz QTASZMHBGPDHIY-CMPLNLGQSA-N 2 1 301.261 4.175 20 0 DIADMP CCC[C@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881377 1041742054 /nfs/dbraw/zinc/74/20/54/1041742054.db2.gz PKZKOFNFFDLKEW-OHSMVPPVSA-N 2 1 300.490 4.350 20 0 DIADMP CC(C)[C@@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881320 1041742529 /nfs/dbraw/zinc/74/25/29/1041742529.db2.gz OAIKSJJDHIUAKS-VOBGVNJCSA-N 2 1 300.490 4.206 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001170716120 1041746133 /nfs/dbraw/zinc/74/61/33/1041746133.db2.gz PEUAZEMPLIQCQN-JXUYPSSRSA-N 2 1 324.512 4.206 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCNc1ccc2c(c1)[nH]c1cc[nH+]cc12 ZINC001167754808 1041751239 /nfs/dbraw/zinc/75/12/39/1041751239.db2.gz WBYPDQWKZBTMKE-HNNXBMFYSA-N 2 1 322.456 4.393 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(-c2ccncc2)c1 ZINC000364452843 1041794792 /nfs/dbraw/zinc/79/47/92/1041794792.db2.gz ZEOZAOLXASTZKB-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([N@@H+](CC3CCCC3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170736182 1041800641 /nfs/dbraw/zinc/80/06/41/1041800641.db2.gz HQFGBYZHOMAQJM-LMZXCBKASA-N 2 1 304.522 4.183 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170757973 1041848189 /nfs/dbraw/zinc/84/81/89/1041848189.db2.gz MUJHXHVPMGJVRL-OWZKRDHZSA-N 2 1 312.501 4.017 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccsc1)C(C)(C)C ZINC000661135825 1041892851 /nfs/dbraw/zinc/89/28/51/1041892851.db2.gz KRLUABLQMVHNFF-UHFFFAOYSA-N 2 1 305.491 4.334 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccsc1)C(C)(C)C ZINC000661135825 1041892860 /nfs/dbraw/zinc/89/28/60/1041892860.db2.gz KRLUABLQMVHNFF-UHFFFAOYSA-N 2 1 305.491 4.334 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCc2ccc(F)c(Cl)c21 ZINC000651719645 1041892955 /nfs/dbraw/zinc/89/29/55/1041892955.db2.gz ADXXAXXYBHIBKS-HNNXBMFYSA-N 2 1 321.827 4.041 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCCCC23CCCC3)cn1 ZINC000815561513 1041962618 /nfs/dbraw/zinc/96/26/18/1041962618.db2.gz IVWFNFRTLVLNFJ-SFHVURJKSA-N 2 1 324.472 4.168 20 0 DIADMP CC[N@@H+](CCCN[C@@H](C)c1cnc(C)s1)C1CCCCC1 ZINC000652237759 1041979016 /nfs/dbraw/zinc/97/90/16/1041979016.db2.gz CPWFNDOAAJZKHK-AWEZNQCLSA-N 2 1 309.523 4.147 20 0 DIADMP CC[N@H+](CCC[NH2+][C@@H](C)c1cnc(C)s1)C1CCCCC1 ZINC000652237759 1041979022 /nfs/dbraw/zinc/97/90/22/1041979022.db2.gz CPWFNDOAAJZKHK-AWEZNQCLSA-N 2 1 309.523 4.147 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H](C)c1cnc(C)s1)C1CCCCC1 ZINC000652237759 1041979027 /nfs/dbraw/zinc/97/90/27/1041979027.db2.gz CPWFNDOAAJZKHK-AWEZNQCLSA-N 2 1 309.523 4.147 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2CC4(CCC4)C2)C3)cc1 ZINC000652328106 1042006561 /nfs/dbraw/zinc/00/65/61/1042006561.db2.gz VGEKFICKFJYVNP-FNLKRUPLSA-N 2 1 310.485 4.104 20 0 DIADMP CCC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(OC)cc1 ZINC000164599519 1042020016 /nfs/dbraw/zinc/02/00/16/1042020016.db2.gz ZMABIDWAJQOOSJ-LJQANCHMSA-N 2 1 315.461 4.111 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000245744728 1042058902 /nfs/dbraw/zinc/05/89/02/1042058902.db2.gz SKGAHRLDEZLXIN-OQIJWPOYSA-N 2 1 300.490 4.206 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161561060 1042111105 /nfs/dbraw/zinc/11/11/05/1042111105.db2.gz ONIQZCYTWKHSDR-MLGOLLRUSA-N 2 1 310.844 4.004 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1F ZINC000161561060 1042111107 /nfs/dbraw/zinc/11/11/07/1042111107.db2.gz ONIQZCYTWKHSDR-MLGOLLRUSA-N 2 1 310.844 4.004 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2csc(C3CCCC3)n2)[C@@H]1CCC[NH3+] ZINC000662314024 1042114394 /nfs/dbraw/zinc/11/43/94/1042114394.db2.gz BJVUNJSPERTQDJ-RHSMWYFYSA-N 2 1 321.534 4.140 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466101 1042177117 /nfs/dbraw/zinc/17/71/17/1042177117.db2.gz OBPHNTCJSMDMLL-FUHWJXTLSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1nccc2ccccc21 ZINC000663466101 1042177118 /nfs/dbraw/zinc/17/71/18/1042177118.db2.gz OBPHNTCJSMDMLL-FUHWJXTLSA-N 2 1 323.484 4.007 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c(C)s1 ZINC000663472142 1042184926 /nfs/dbraw/zinc/18/49/26/1042184926.db2.gz YYRRWJBUTMIERC-YOEHRIQHSA-N 2 1 306.519 4.138 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1ccccc1F ZINC001167824732 1042212106 /nfs/dbraw/zinc/21/21/06/1042212106.db2.gz GBSXBHCYIZGOPV-APWZRJJASA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC001167826562 1042217128 /nfs/dbraw/zinc/21/71/28/1042217128.db2.gz QDZFOIKYUAYQMP-MRXNPFEDSA-N 2 1 310.913 4.325 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001167833573 1042235932 /nfs/dbraw/zinc/23/59/32/1042235932.db2.gz CRXVFBBWQYDTPX-SJLPKXTDSA-N 2 1 306.469 4.126 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC000316616740 1042244312 /nfs/dbraw/zinc/24/43/12/1042244312.db2.gz KTYCIXRFAZHHMT-QHGAOEGBSA-N 2 1 300.490 4.033 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CC=C(c2ccccc2)CC1 ZINC001167836790 1042248249 /nfs/dbraw/zinc/24/82/49/1042248249.db2.gz HICOUKIBERYTLC-GOSISDBHSA-N 2 1 300.490 4.286 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@@H](C)c1ccccc1OC ZINC001167836752 1042248558 /nfs/dbraw/zinc/24/85/58/1042248558.db2.gz GQXZVSPHKKTYFR-IRXDYDNUSA-N 2 1 306.494 4.199 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCc2c(Cl)cccc2C1 ZINC001167839392 1042249573 /nfs/dbraw/zinc/24/95/73/1042249573.db2.gz XPOQPKKOFBULFX-HNNXBMFYSA-N 2 1 308.897 4.209 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@@H]34)cc2)cc1 ZINC000319790214 1042260391 /nfs/dbraw/zinc/26/03/91/1042260391.db2.gz HWZSPVVOBGDYPN-SFTDATJTSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@@H]34)cc2)cc1 ZINC000319790214 1042260392 /nfs/dbraw/zinc/26/03/92/1042260392.db2.gz HWZSPVVOBGDYPN-SFTDATJTSA-N 2 1 306.453 4.070 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]CC1(C)CCC1 ZINC000434764391 1042304374 /nfs/dbraw/zinc/30/43/74/1042304374.db2.gz NRCLKPDPKCGATO-UHFFFAOYSA-N 2 1 312.457 4.191 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]CC2(C)CCC2)C[N@H+]1Cc1ccccc1 ZINC000434774542 1042305565 /nfs/dbraw/zinc/30/55/65/1042305565.db2.gz HQOKAONRKBWJFY-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@H]34)c2)cc1 ZINC000614328411 1042467256 /nfs/dbraw/zinc/46/72/56/1042467256.db2.gz BUMTXLOOSOZDRT-NHCUHLMSSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@H]34)c2)cc1 ZINC000614328411 1042467259 /nfs/dbraw/zinc/46/72/59/1042467259.db2.gz BUMTXLOOSOZDRT-NHCUHLMSSA-N 2 1 306.453 4.070 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CC2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000513349391 1042534847 /nfs/dbraw/zinc/53/48/47/1042534847.db2.gz YBTLYKBKSSLTFR-UXPWSPDFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CC2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000513349391 1042534852 /nfs/dbraw/zinc/53/48/52/1042534852.db2.gz YBTLYKBKSSLTFR-UXPWSPDFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CC2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000513349390 1042534864 /nfs/dbraw/zinc/53/48/64/1042534864.db2.gz YBTLYKBKSSLTFR-NSISKUIASA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](CC2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000513349390 1042534867 /nfs/dbraw/zinc/53/48/67/1042534867.db2.gz YBTLYKBKSSLTFR-NSISKUIASA-N 2 1 300.490 4.380 20 0 DIADMP Cc1ccsc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000513418751 1042539236 /nfs/dbraw/zinc/53/92/36/1042539236.db2.gz CYWYOMPTBVZJMG-QGZVFWFLSA-N 2 1 306.519 4.145 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]CCCCn1cc[nH+]c1C ZINC000513512265 1042549482 /nfs/dbraw/zinc/54/94/82/1042549482.db2.gz OBVICUPEGLWKHF-FYWRMAATSA-N 2 1 317.864 4.318 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@@H]2CCC[C@@H]21 ZINC000513690597 1042567000 /nfs/dbraw/zinc/56/70/00/1042567000.db2.gz KYKHOAYLMPFFQL-SRVKXCTJSA-N 2 1 319.301 4.017 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@@H]2CCC[C@@H]21 ZINC000513690597 1042567004 /nfs/dbraw/zinc/56/70/04/1042567004.db2.gz KYKHOAYLMPFFQL-SRVKXCTJSA-N 2 1 319.301 4.017 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327633 1042598987 /nfs/dbraw/zinc/59/89/87/1042598987.db2.gz LPPWLPUPEJWZDO-IAGOWNOFSA-N 2 1 318.464 4.078 20 0 DIADMP c1c2ccccc2[nH]c1[C@H]1CCCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000420307652 1042599090 /nfs/dbraw/zinc/59/90/90/1042599090.db2.gz RPVSTQCPBKQUCE-OXQOHEQNSA-N 2 1 311.473 4.085 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cc(C)nc(C)c2)cc1 ZINC000421377160 1042634001 /nfs/dbraw/zinc/63/40/01/1042634001.db2.gz FVBBVTUOZKGSBI-MRXNPFEDSA-N 2 1 320.440 4.043 20 0 DIADMP COc1cc(Cl)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000421824524 1042653239 /nfs/dbraw/zinc/65/32/39/1042653239.db2.gz JEOJBIJGLULIIO-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP COc1cc(Cl)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000421824524 1042653241 /nfs/dbraw/zinc/65/32/41/1042653241.db2.gz JEOJBIJGLULIIO-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3C[C@@H]4CC[C@@H](C4)C3)C2)cc1 ZINC000711147222 1042687162 /nfs/dbraw/zinc/68/71/62/1042687162.db2.gz RMMYOZLSDDSAAD-JSXRDJHFSA-N 2 1 312.501 4.067 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCC2)c2ccccc21 ZINC000422716807 1042689300 /nfs/dbraw/zinc/68/93/00/1042689300.db2.gz NXAWRKCXHCVQNM-VAMGGRTRSA-N 2 1 310.416 4.401 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422816337 1042690684 /nfs/dbraw/zinc/69/06/84/1042690684.db2.gz ZOTQWTIUILLPDI-RZRMAFQFSA-N 2 1 316.489 4.045 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422800518 1042690852 /nfs/dbraw/zinc/69/08/52/1042690852.db2.gz CBVFIIYIDWMZRE-YMRXKLBXSA-N 2 1 318.367 4.083 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C2CCCCC2)cc1)c1c[nH+]ccc1N ZINC000423126508 1042697725 /nfs/dbraw/zinc/69/77/25/1042697725.db2.gz IXKWMVLCKQJPKR-OAHLLOKOSA-N 2 1 309.457 4.393 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]C3CCc4ccccc4CC3)CC[NH2+]2)cc1 ZINC000423155461 1042698825 /nfs/dbraw/zinc/69/88/25/1042698825.db2.gz LDTBQJDAZZYCKQ-FCHUYYIVSA-N 2 1 320.480 4.017 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423189231 1042700612 /nfs/dbraw/zinc/70/06/12/1042700612.db2.gz QQFQBZMNYJTYGH-OAHLLOKOSA-N 2 1 301.261 4.176 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H](C[NH3+])CC(C)C ZINC000423262364 1042702637 /nfs/dbraw/zinc/70/26/37/1042702637.db2.gz METOPKXUQHUEKE-CJNGLKHVSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H](C[NH3+])CC(C)C)cs2)cs1 ZINC000423261493 1042702855 /nfs/dbraw/zinc/70/28/55/1042702855.db2.gz JWJDZFLNXYWVGH-SMDDNHRTSA-N 2 1 323.531 4.204 20 0 DIADMP CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423260184 1042703254 /nfs/dbraw/zinc/70/32/54/1042703254.db2.gz GUOIXPVQIILCCF-HOTGVXAUSA-N 2 1 315.505 4.187 20 0 DIADMP CC(C)([NH3+])C[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423288567 1042703853 /nfs/dbraw/zinc/70/38/53/1042703853.db2.gz SXEKPWXYFRNRNU-HNNXBMFYSA-N 2 1 308.878 4.012 20 0 DIADMP CCC([NH3+])(CC)C[NH2+][C@H](C)c1csc(-c2csc(C)n2)c1 ZINC000423289810 1042704463 /nfs/dbraw/zinc/70/44/63/1042704463.db2.gz YLRNHGHNLWIBRE-LLVKDONJSA-N 2 1 323.531 4.348 20 0 DIADMP [NH3+][C@H](C[NH2+][C@H](Cc1ccccc1Cl)c1cccs1)C1CC1 ZINC000423319732 1042705694 /nfs/dbraw/zinc/70/56/94/1042705694.db2.gz LXJSLOYTJFWEAF-HZPDHXFCSA-N 2 1 320.889 4.012 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cs1 ZINC000423295624 1042706156 /nfs/dbraw/zinc/70/61/56/1042706156.db2.gz XAUSBZYYVSNPTC-QWHCGFSZSA-N 2 1 303.475 4.137 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000423379791 1042709153 /nfs/dbraw/zinc/70/91/53/1042709153.db2.gz NGRWMERROBKXMR-HCKVZZMMSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cc2c(ccc3ccccc23)o1 ZINC000423389312 1042709303 /nfs/dbraw/zinc/70/93/03/1042709303.db2.gz JHZBNDGKUDVFIJ-GLJUWKHASA-N 2 1 308.425 4.235 20 0 DIADMP CC[C@@H]([NH3+])C[NH2+][C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000423457502 1042713858 /nfs/dbraw/zinc/71/38/58/1042713858.db2.gz FZARMTGFXPILAF-QMTHXVAHSA-N 2 1 323.893 4.160 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)c1 ZINC000282052747 1042782870 /nfs/dbraw/zinc/78/28/70/1042782870.db2.gz GMHYCDQGCKYIKO-HNNXBMFYSA-N 2 1 300.446 4.199 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000516826783 1042856321 /nfs/dbraw/zinc/85/63/21/1042856321.db2.gz HLMZPQKVOMIABL-JXFKEZNVSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000516826783 1042856324 /nfs/dbraw/zinc/85/63/24/1042856324.db2.gz HLMZPQKVOMIABL-JXFKEZNVSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H](Cc1ccsc1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000517068691 1042866719 /nfs/dbraw/zinc/86/67/19/1042866719.db2.gz NTOXCGFIPIBQMY-MAUKXSAKSA-N 2 1 306.519 4.066 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144207 1042868968 /nfs/dbraw/zinc/86/89/68/1042868968.db2.gz JUIBCVXRBVIIQG-MJGOQNOKSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000517144207 1042868973 /nfs/dbraw/zinc/86/89/73/1042868973.db2.gz JUIBCVXRBVIIQG-MJGOQNOKSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1ccc(C[N@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)nc1 ZINC000664656871 1042872497 /nfs/dbraw/zinc/87/24/97/1042872497.db2.gz JWNHXZAUKFGBHI-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP Cc1ccc(C[N@@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)nc1 ZINC000664656871 1042872499 /nfs/dbraw/zinc/87/24/99/1042872499.db2.gz JWNHXZAUKFGBHI-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CCCSc2ccc(Cl)cc21)C[NH+](C)C ZINC000425926363 1042875577 /nfs/dbraw/zinc/87/55/77/1042875577.db2.gz RYMAFPWZDSUWQT-IUODEOHRSA-N 2 1 312.910 4.054 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]C3CC[NH+](CC4CC4)CC3)oc2c1 ZINC000425932092 1042876235 /nfs/dbraw/zinc/87/62/35/1042876235.db2.gz UACHJCVZNNAIJP-OAHLLOKOSA-N 2 1 312.457 4.266 20 0 DIADMP C[C@H](C[NH2+][C@H](C)c1nccc2ccccc21)C[NH+]1CCCCC1 ZINC000517441819 1042879978 /nfs/dbraw/zinc/87/99/78/1042879978.db2.gz GLOMLKKXNDZLMQ-IAGOWNOFSA-N 2 1 311.473 4.007 20 0 DIADMP CCCOc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC000517537253 1042883567 /nfs/dbraw/zinc/88/35/67/1042883567.db2.gz KHKYKZTZPAXTAE-SFHVURJKSA-N 2 1 318.505 4.077 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)oc2c1 ZINC000425959871 1042888420 /nfs/dbraw/zinc/88/84/20/1042888420.db2.gz UXXGVVDEURHCGU-HNNXBMFYSA-N 2 1 312.457 4.409 20 0 DIADMP CC(C)Oc1cccc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)c1 ZINC000261951336 1042895467 /nfs/dbraw/zinc/89/54/67/1042895467.db2.gz WHWGXFWATDWVAV-PNHOKKKMSA-N 2 1 310.441 4.269 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2ccc(F)cc2F)CC1 ZINC000519224089 1042939441 /nfs/dbraw/zinc/93/94/41/1042939441.db2.gz LOYVDEOOWANYQE-OAHLLOKOSA-N 2 1 324.459 4.470 20 0 DIADMP C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)c(F)c1 ZINC001167969807 1042960640 /nfs/dbraw/zinc/96/06/40/1042960640.db2.gz DXZDDAOYTZTIHD-FCLXEUQJSA-N 2 1 320.427 4.021 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(F)c(F)c1 ZINC001167969807 1042960644 /nfs/dbraw/zinc/96/06/44/1042960644.db2.gz DXZDDAOYTZTIHD-FCLXEUQJSA-N 2 1 320.427 4.021 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)c(F)c1 ZINC001167969807 1042960645 /nfs/dbraw/zinc/96/06/45/1042960645.db2.gz DXZDDAOYTZTIHD-FCLXEUQJSA-N 2 1 320.427 4.021 20 0 DIADMP C[C@H]([NH3+])c1cn(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc12 ZINC001167981864 1042974933 /nfs/dbraw/zinc/97/49/33/1042974933.db2.gz NNQNNASEFXWMJN-QTXGHNMQSA-N 2 1 323.484 4.239 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1c2cccc(F)c2CC[C@H]1C ZINC000164593368 1043001331 /nfs/dbraw/zinc/00/13/31/1043001331.db2.gz FPDWNWNUFIYUEC-KUHUBIRLSA-N 2 1 315.436 4.024 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC000520200715 1043024029 /nfs/dbraw/zinc/02/40/29/1043024029.db2.gz PKTNXMIVYHWZHR-LJQANCHMSA-N 2 1 308.469 4.175 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417323103 1043045006 /nfs/dbraw/zinc/04/50/06/1043045006.db2.gz NYOOEJMGGYJIBD-VSZNYVQBSA-N 2 1 320.546 4.342 20 0 DIADMP Cc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000112533454 1043048585 /nfs/dbraw/zinc/04/85/85/1043048585.db2.gz MYJBNJQNSAPLAK-UHFFFAOYSA-N 2 1 322.496 4.339 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995084 1043068161 /nfs/dbraw/zinc/06/81/61/1043068161.db2.gz VLUGDJONAHGMDO-JKWVGCSGSA-N 2 1 312.501 4.475 20 0 DIADMP C[N@@H+](Cc1ccccc1C[NH2+]Cc1cc[nH]c1)C1CCCCC1 ZINC000175700202 1043088148 /nfs/dbraw/zinc/08/81/48/1043088148.db2.gz UQPUDYJPYYXIIO-UHFFFAOYSA-N 2 1 311.473 4.069 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000246906792 1043147210 /nfs/dbraw/zinc/14/72/10/1043147210.db2.gz FSAZRIZLIPHJDA-PBHICJAKSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000246906792 1043147212 /nfs/dbraw/zinc/14/72/12/1043147212.db2.gz FSAZRIZLIPHJDA-PBHICJAKSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000246906827 1043148138 /nfs/dbraw/zinc/14/81/38/1043148138.db2.gz FSAZRIZLIPHJDA-YOEHRIQHSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000246906827 1043148145 /nfs/dbraw/zinc/14/81/45/1043148145.db2.gz FSAZRIZLIPHJDA-YOEHRIQHSA-N 2 1 322.493 4.073 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183999715 1043176240 /nfs/dbraw/zinc/17/62/40/1043176240.db2.gz FTMWBLRKQZVZFY-WMLDXEAASA-N 2 1 322.443 4.367 20 0 DIADMP Cc1cncc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000184322615 1043183420 /nfs/dbraw/zinc/18/34/20/1043183420.db2.gz WSOSCOSJJJVAKT-KRWDZBQOSA-N 2 1 311.473 4.081 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382350 1043184607 /nfs/dbraw/zinc/18/46/07/1043184607.db2.gz JYROJYYUEKRLHW-DBXWQHBBSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1cncc([C@@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382350 1043184620 /nfs/dbraw/zinc/18/46/20/1043184620.db2.gz JYROJYYUEKRLHW-DBXWQHBBSA-N 2 1 323.484 4.094 20 0 DIADMP CCC1CCC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000320405155 1043217445 /nfs/dbraw/zinc/21/74/45/1043217445.db2.gz PNCDWTRZCNXCBU-UHFFFAOYSA-N 2 1 314.517 4.252 20 0 DIADMP CC[C@@H]1c2ccccc2CC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001168003278 1043221203 /nfs/dbraw/zinc/22/12/03/1043221203.db2.gz MUPFMQPGEARTII-XQXKNUKBSA-N 2 1 324.512 4.401 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCSc3cc(C)c(C)cc32)C1 ZINC000427610493 1043242733 /nfs/dbraw/zinc/24/27/33/1043242733.db2.gz VAJIAZLGFABCRU-AEFFLSMTSA-N 2 1 318.530 4.162 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168007142 1043261357 /nfs/dbraw/zinc/26/13/57/1043261357.db2.gz QZSOUXVQDRGIEU-VBYALHQYSA-N 2 1 300.490 4.206 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCNc3ccccc32)c1 ZINC000192827925 1043275023 /nfs/dbraw/zinc/27/50/23/1043275023.db2.gz BDCBRBSRWIESAA-NRFANRHFSA-N 2 1 323.484 4.175 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1-c1ccccc1 ZINC000427860280 1043311199 /nfs/dbraw/zinc/31/11/99/1043311199.db2.gz YNSSTOULBRPXLT-YLJYHZDGSA-N 2 1 308.469 4.234 20 0 DIADMP c1ccc([C@H]2CC[C@H]2[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000665274448 1043358035 /nfs/dbraw/zinc/35/80/35/1043358035.db2.gz QINIKEMZXAPTOE-XRXFAXGQSA-N 2 1 306.453 4.016 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000271331964 1043411294 /nfs/dbraw/zinc/41/12/94/1043411294.db2.gz CMJFCKXDWBVIGP-CMKODMSKSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000271331964 1043411301 /nfs/dbraw/zinc/41/13/01/1043411301.db2.gz CMJFCKXDWBVIGP-CMKODMSKSA-N 2 1 323.484 4.094 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C1CCC(C(F)F)CC1 ZINC000442715189 1043413002 /nfs/dbraw/zinc/41/30/02/1043413002.db2.gz ZHPPYSSRGLDAKP-QQFBHYJXSA-N 2 1 302.453 4.055 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000271331963 1043412975 /nfs/dbraw/zinc/41/29/75/1043412975.db2.gz CMJFCKXDWBVIGP-BJLQDIEVSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000271331963 1043412986 /nfs/dbraw/zinc/41/29/86/1043412986.db2.gz CMJFCKXDWBVIGP-BJLQDIEVSA-N 2 1 323.484 4.094 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442776705 1043416064 /nfs/dbraw/zinc/41/60/64/1043416064.db2.gz CJZASBBBWOVIHK-QQFBHYJXSA-N 2 1 316.480 4.301 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442776705 1043416076 /nfs/dbraw/zinc/41/60/76/1043416076.db2.gz CJZASBBBWOVIHK-QQFBHYJXSA-N 2 1 316.480 4.301 20 0 DIADMP CC1(C)C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2S1 ZINC000872017738 1043419724 /nfs/dbraw/zinc/41/97/24/1043419724.db2.gz FHLSRKSRLVNYNL-KRWDZBQOSA-N 2 1 316.514 4.219 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2S1 ZINC000872025955 1043424142 /nfs/dbraw/zinc/42/41/42/1043424142.db2.gz WEIQMXLUHISIKP-VYDXJSESSA-N 2 1 316.514 4.219 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC(C)(C)Sc3ccccc32)CC[N@@H+]1C ZINC000872040697 1043430653 /nfs/dbraw/zinc/43/06/53/1043430653.db2.gz ZSWYNCLTJVBRQC-IIAWOOMASA-N 2 1 304.503 4.074 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC(C)(C)Sc3ccccc32)CC[N@H+]1C ZINC000872040697 1043430658 /nfs/dbraw/zinc/43/06/58/1043430658.db2.gz ZSWYNCLTJVBRQC-IIAWOOMASA-N 2 1 304.503 4.074 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000558161102 1043447417 /nfs/dbraw/zinc/44/74/17/1043447417.db2.gz WRLFCCCTKJCKKF-VWXURSGXSA-N 2 1 312.501 4.478 20 0 DIADMP CCC1([NH3+])CC[NH+]([C@@H](C)c2sc(C(C)(C)C)nc2C)CC1 ZINC000925756359 1043464258 /nfs/dbraw/zinc/46/42/58/1043464258.db2.gz LCTFXYJBKONUNY-ZDUSSCGKSA-N 2 1 309.523 4.013 20 0 DIADMP CCC1([NH3+])CC[NH+]([C@H](C)c2sc(C(C)(C)C)nc2C)CC1 ZINC000925756357 1043464779 /nfs/dbraw/zinc/46/47/79/1043464779.db2.gz LCTFXYJBKONUNY-CYBMUJFWSA-N 2 1 309.523 4.013 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+][C@@H](C)c1c[nH+]ccc1N ZINC000925831085 1043480234 /nfs/dbraw/zinc/48/02/34/1043480234.db2.gz LWDHCGUOGYFHRA-AWEZNQCLSA-N 2 1 305.425 4.061 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC000925832437 1043480281 /nfs/dbraw/zinc/48/02/81/1043480281.db2.gz VTPLYGSFDMEIKO-VDGAXYAQSA-N 2 1 324.468 4.148 20 0 DIADMP C[C@@H]([NH2+]C1CCC2(CC2)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000558408763 1043502539 /nfs/dbraw/zinc/50/25/39/1043502539.db2.gz HIBIVTOWSQAAOI-IEBWSBKVSA-N 2 1 312.501 4.209 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)C/C=C\c1ccc(F)cc1 ZINC000558418927 1043506762 /nfs/dbraw/zinc/50/67/62/1043506762.db2.gz YHPNCFVLRTZSET-XQRVVYSFSA-N 2 1 315.436 4.010 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C=C\c1ccc(F)cc1 ZINC000558418927 1043506773 /nfs/dbraw/zinc/50/67/73/1043506773.db2.gz YHPNCFVLRTZSET-XQRVVYSFSA-N 2 1 315.436 4.010 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C=C\c1ccc(F)cc1 ZINC000558418927 1043506790 /nfs/dbraw/zinc/50/67/90/1043506790.db2.gz YHPNCFVLRTZSET-XQRVVYSFSA-N 2 1 315.436 4.010 20 0 DIADMP COc1ccc(C2CCC([NH2+][C@@H](C)C[N@H+](C)C(C)C)CC2)cc1 ZINC000558501746 1043523841 /nfs/dbraw/zinc/52/38/41/1043523841.db2.gz QBZCSIGEQAKNIO-MUYFXNHWSA-N 2 1 318.505 4.040 20 0 DIADMP COc1ccc(C2CCC([NH2+][C@@H](C)C[N@@H+](C)C(C)C)CC2)cc1 ZINC000558501746 1043523849 /nfs/dbraw/zinc/52/38/49/1043523849.db2.gz QBZCSIGEQAKNIO-MUYFXNHWSA-N 2 1 318.505 4.040 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000388924972 1043544128 /nfs/dbraw/zinc/54/41/28/1043544128.db2.gz VWJSSWZODCTDES-UKRRQHHQSA-N 2 1 318.461 4.127 20 0 DIADMP CCCCc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000314643678 1043557228 /nfs/dbraw/zinc/55/72/28/1043557228.db2.gz FNVCZVAXXRLBLW-WMZOPIPTSA-N 2 1 300.490 4.164 20 0 DIADMP C[C@H]([NH2+]CC[N@H+](C)C1CCCCC1)C1CCC(F)(F)CC1 ZINC000474076629 1043570203 /nfs/dbraw/zinc/57/02/03/1043570203.db2.gz YLGBHNPGHGZYGG-AWEZNQCLSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@H]([NH2+]CC[N@@H+](C)C1CCCCC1)C1CCC(F)(F)CC1 ZINC000474076629 1043570212 /nfs/dbraw/zinc/57/02/12/1043570212.db2.gz YLGBHNPGHGZYGG-AWEZNQCLSA-N 2 1 302.453 4.055 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@H+](C(c2ccccc2)c2ccccc2)CC1 ZINC000558741474 1043587555 /nfs/dbraw/zinc/58/75/55/1043587555.db2.gz IWUIENWFOQQYFW-HXUWFJFHSA-N 2 1 308.469 4.192 20 0 DIADMP COc1cc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc2ccccc21 ZINC000926540605 1043597334 /nfs/dbraw/zinc/59/73/34/1043597334.db2.gz JNWCNMQHNSWDOV-FMJMRLDVSA-N 2 1 324.468 4.124 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2cc3cccc(F)c3o2)CC1 ZINC000474107809 1043615808 /nfs/dbraw/zinc/61/58/08/1043615808.db2.gz UBYZALCDVDOSML-ZDUSSCGKSA-N 2 1 304.409 4.095 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@@H+]1Cc1ccccc1 ZINC000353581336 1043620614 /nfs/dbraw/zinc/62/06/14/1043620614.db2.gz YWQYXLVGOBUPIA-JXFKEZNVSA-N 2 1 321.468 4.424 20 0 DIADMP C[C@H]1C[C@@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@H+]1Cc1ccccc1 ZINC000353581336 1043620620 /nfs/dbraw/zinc/62/06/20/1043620620.db2.gz YWQYXLVGOBUPIA-JXFKEZNVSA-N 2 1 321.468 4.424 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@@H+]1Cc1ccccc1 ZINC000353581347 1043621547 /nfs/dbraw/zinc/62/15/47/1043621547.db2.gz YWQYXLVGOBUPIA-UZLBHIALSA-N 2 1 321.468 4.424 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc(C3CC3)cc[nH+]2)CC[N@H+]1Cc1ccccc1 ZINC000353581347 1043621554 /nfs/dbraw/zinc/62/15/54/1043621554.db2.gz YWQYXLVGOBUPIA-UZLBHIALSA-N 2 1 321.468 4.424 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)[C@@H]1C[C@H]1c1ccccc1 ZINC000558919414 1043637998 /nfs/dbraw/zinc/63/79/98/1043637998.db2.gz LMVOOBOSXZPZEW-QIJZPMMNSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)[C@@H]1C[C@H]1c1ccccc1 ZINC000558919416 1043638016 /nfs/dbraw/zinc/63/80/16/1043638016.db2.gz LMVOOBOSXZPZEW-YHELAOLJSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)[C@@H]1C[C@H]1c1ccccc1 ZINC000558919417 1043638262 /nfs/dbraw/zinc/63/82/62/1043638262.db2.gz LMVOOBOSXZPZEW-ZFMNYDKASA-N 2 1 314.517 4.423 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(C3CCCC3)s2)C[C@H]1C ZINC000353747993 1043639201 /nfs/dbraw/zinc/63/92/01/1043639201.db2.gz BZSGADMNRAVMHG-GDBMZVCRSA-N 2 1 321.534 4.105 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cnc(C3CCCC3)s2)C[C@@H]1C ZINC000353747996 1043639248 /nfs/dbraw/zinc/63/92/48/1043639248.db2.gz BZSGADMNRAVMHG-GOEBONIOSA-N 2 1 321.534 4.105 20 0 DIADMP CCCc1cc(N2CCC(c3[nH]cc[nH+]3)CC2)c2ccccc2[nH+]1 ZINC000443673116 1043654029 /nfs/dbraw/zinc/65/40/29/1043654029.db2.gz GYDDYPDKBZFTPY-UHFFFAOYSA-N 2 1 320.440 4.294 20 0 DIADMP C[NH+](C)C1(CNc2cc[nH+]c3cc(Cl)ccc23)CCCC1 ZINC000113711144 1043663412 /nfs/dbraw/zinc/66/34/12/1043663412.db2.gz CSOFUTJRYUDPFE-UHFFFAOYSA-N 2 1 303.837 4.175 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cncc(F)c2)cc1 ZINC000166690469 1043677209 /nfs/dbraw/zinc/67/72/09/1043677209.db2.gz QVDUPSLVRQEAKK-KBPBESRZSA-N 2 1 324.403 4.127 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](CC(C)C)c2ccccc2)C1 ZINC000474271898 1043718433 /nfs/dbraw/zinc/71/84/33/1043718433.db2.gz PCYKACPVZCFFEU-AZUAARDMSA-N 2 1 302.506 4.090 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccccc1 ZINC000474284508 1043722147 /nfs/dbraw/zinc/72/21/47/1043722147.db2.gz RLMVJOBHLZGMOV-DFQSSKMNSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284508 1043722157 /nfs/dbraw/zinc/72/21/57/1043722157.db2.gz RLMVJOBHLZGMOV-DFQSSKMNSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284508 1043722167 /nfs/dbraw/zinc/72/21/67/1043722167.db2.gz RLMVJOBHLZGMOV-DFQSSKMNSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284508 1043722180 /nfs/dbraw/zinc/72/21/80/1043722180.db2.gz RLMVJOBHLZGMOV-DFQSSKMNSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccccc1 ZINC000474284508 1043722191 /nfs/dbraw/zinc/72/21/91/1043722191.db2.gz RLMVJOBHLZGMOV-DFQSSKMNSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@@H](C[N@@H+](C)CC1CC[NH+](C)CC1)c1ccccc1 ZINC000474275459 1043722580 /nfs/dbraw/zinc/72/25/80/1043722580.db2.gz MALKBBQKAKETAK-FQEVSTJZSA-N 2 1 302.506 4.090 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876917753 1043724201 /nfs/dbraw/zinc/72/42/01/1043724201.db2.gz VMWJRVUNAUBNHI-PLMTUMEDSA-N 2 1 324.468 4.168 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876917753 1043724212 /nfs/dbraw/zinc/72/42/12/1043724212.db2.gz VMWJRVUNAUBNHI-PLMTUMEDSA-N 2 1 324.468 4.168 20 0 DIADMP CCCC[N@H+](C)c1ccc(N[C@@H](C)C2CC[NH+](C)CC2)cc1 ZINC000777684259 1043739396 /nfs/dbraw/zinc/73/93/96/1043739396.db2.gz LHIMEZPCBHYQON-INIZCTEOSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@@H+](C)c1ccc(N[C@@H](C)C2CC[NH+](C)CC2)cc1 ZINC000777684259 1043739401 /nfs/dbraw/zinc/73/94/01/1043739401.db2.gz LHIMEZPCBHYQON-INIZCTEOSA-N 2 1 303.494 4.065 20 0 DIADMP CC[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C(C)C ZINC000777693970 1043759965 /nfs/dbraw/zinc/75/99/65/1043759965.db2.gz KWGPHPUSTLDRDH-FQEVSTJZSA-N 2 1 317.521 4.311 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474468238 1043788771 /nfs/dbraw/zinc/78/87/71/1043788771.db2.gz DXDWRGURAVQETR-RBSFLKMASA-N 2 1 319.880 4.263 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474480133 1043797711 /nfs/dbraw/zinc/79/77/11/1043797711.db2.gz YXPZHGMCYSRGRO-YYFQZIEXSA-N 2 1 324.921 4.110 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000356395829 1043836329 /nfs/dbraw/zinc/83/63/29/1043836329.db2.gz UITPEBIDKNSZTM-ZCPJJFRWSA-N 2 1 309.457 4.150 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000356395829 1043836348 /nfs/dbraw/zinc/83/63/48/1043836348.db2.gz UITPEBIDKNSZTM-ZCPJJFRWSA-N 2 1 309.457 4.150 20 0 DIADMP CC[N@H+](CC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C(C)C ZINC000474602420 1043842995 /nfs/dbraw/zinc/84/29/95/1043842995.db2.gz KTJWLHUJZMDVCB-HZSPNIEDSA-N 2 1 314.926 4.213 20 0 DIADMP CC[N@@H+](CC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C(C)C ZINC000474602420 1043843012 /nfs/dbraw/zinc/84/30/12/1043843012.db2.gz KTJWLHUJZMDVCB-HZSPNIEDSA-N 2 1 314.926 4.213 20 0 DIADMP CC1CC([N@H+](C)C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168039720 1043856734 /nfs/dbraw/zinc/85/67/34/1043856734.db2.gz HQRPAWYGTBRFRC-VZDIDWBNSA-N 2 1 300.490 4.158 20 0 DIADMP CC1CC([N@@H+](C)C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168039720 1043856749 /nfs/dbraw/zinc/85/67/49/1043856749.db2.gz HQRPAWYGTBRFRC-VZDIDWBNSA-N 2 1 300.490 4.158 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC[C@@](C)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039729 1043857562 /nfs/dbraw/zinc/85/75/62/1043857562.db2.gz HUFSMARPTDJDEY-MBOZVWFJSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@@](C)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039729 1043857579 /nfs/dbraw/zinc/85/75/79/1043857579.db2.gz HUFSMARPTDJDEY-MBOZVWFJSA-N 2 1 318.480 4.252 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCCC2(F)F)C[C@@H]1c1ccccc1 ZINC000453244862 1043866153 /nfs/dbraw/zinc/86/61/53/1043866153.db2.gz HPXQSPMTKSTPLS-FGTMMUONSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCCCC2(F)F)C[C@@H]1c1ccccc1 ZINC000453244862 1043866173 /nfs/dbraw/zinc/86/61/73/1043866173.db2.gz HPXQSPMTKSTPLS-FGTMMUONSA-N 2 1 322.443 4.237 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039912 1043869820 /nfs/dbraw/zinc/86/98/20/1043869820.db2.gz IMNSKBUXEYRCHP-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](F)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039912 1043869838 /nfs/dbraw/zinc/86/98/38/1043869838.db2.gz IMNSKBUXEYRCHP-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039912 1043869853 /nfs/dbraw/zinc/86/98/53/1043869853.db2.gz IMNSKBUXEYRCHP-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039912 1043869867 /nfs/dbraw/zinc/86/98/67/1043869867.db2.gz IMNSKBUXEYRCHP-PIKOESSRSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@H+]2C[C@@H]3CCC[C@@H]3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039978 1043871163 /nfs/dbraw/zinc/87/11/63/1043871163.db2.gz JFHZLRYVYSINBX-LFGUQSLTSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCCC[C@@H](F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040048 1043873956 /nfs/dbraw/zinc/87/39/56/1043873956.db2.gz JZSQVEFUWNRDTE-ZHALLVOQSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@H+]2CCCC[C@@H](F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040048 1043873966 /nfs/dbraw/zinc/87/39/66/1043873966.db2.gz JZSQVEFUWNRDTE-ZHALLVOQSA-N 2 1 318.480 4.252 20 0 DIADMP CC[C@@H](C)[N@H+](C)CC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709424 1043897887 /nfs/dbraw/zinc/89/78/87/1043897887.db2.gz NFBWAYMJLOTDRA-ZOBORPQBSA-N 2 1 314.926 4.213 20 0 DIADMP CC[C@@H](C)[N@@H+](C)CC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709424 1043897904 /nfs/dbraw/zinc/89/79/04/1043897904.db2.gz NFBWAYMJLOTDRA-ZOBORPQBSA-N 2 1 314.926 4.213 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)C1CCC(C(F)(F)F)CC1 ZINC000453420137 1043914757 /nfs/dbraw/zinc/91/47/57/1043914757.db2.gz ZGKPJYJGGMJFHJ-WLYUNCDWSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCC[C@@H](C(C)C)C3)CC2)[nH+]c1 ZINC000474796234 1043921409 /nfs/dbraw/zinc/92/14/09/1043921409.db2.gz LPWXTINCBYINCZ-IEBWSBKVSA-N 2 1 315.505 4.163 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000561315286 1043925757 /nfs/dbraw/zinc/92/57/57/1043925757.db2.gz XQEMMFNEASVSTO-OSYNSWQESA-N 2 1 312.501 4.206 20 0 DIADMP CC(C)C[C@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000474808622 1043926096 /nfs/dbraw/zinc/92/60/96/1043926096.db2.gz LTSKSCFCNWOQST-WVVQBRDUSA-N 2 1 314.517 4.421 20 0 DIADMP C[C@@H]1CC([N@@H+]2CC[C@](C)(CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168042070 1043931317 /nfs/dbraw/zinc/93/13/17/1043931317.db2.gz YODDVXFMAJXEPC-MBOZVWFJSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC([N@H+]2CC[C@](C)(CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168042070 1043931328 /nfs/dbraw/zinc/93/13/28/1043931328.db2.gz YODDVXFMAJXEPC-MBOZVWFJSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1nccc2ccccc21 ZINC000290703856 1043979521 /nfs/dbraw/zinc/97/95/21/1043979521.db2.gz NNUOVYSSPMZLRT-HNNXBMFYSA-N 2 1 311.473 4.148 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000443854997 1044040955 /nfs/dbraw/zinc/04/09/55/1044040955.db2.gz OZUCROAYMGLHML-HLNWXESRSA-N 2 1 304.522 4.221 20 0 DIADMP C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984397 1044044807 /nfs/dbraw/zinc/04/48/07/1044044807.db2.gz YNAAQUBTLZGSML-LAUBAEHRSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984397 1044044820 /nfs/dbraw/zinc/04/48/20/1044044820.db2.gz YNAAQUBTLZGSML-LAUBAEHRSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984397 1044044835 /nfs/dbraw/zinc/04/48/35/1044044835.db2.gz YNAAQUBTLZGSML-LAUBAEHRSA-N 2 1 324.468 4.251 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000562058769 1044057088 /nfs/dbraw/zinc/05/70/88/1044057088.db2.gz RRUFRFDWFXLOMI-QRVBRYPASA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000562058769 1044057099 /nfs/dbraw/zinc/05/70/99/1044057099.db2.gz RRUFRFDWFXLOMI-QRVBRYPASA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000358475822 1044073710 /nfs/dbraw/zinc/07/37/10/1044073710.db2.gz WLIQCZZECXTJNC-CDXJDZJCSA-N 2 1 312.501 4.307 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCc2sccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000358474853 1044075015 /nfs/dbraw/zinc/07/50/15/1044075015.db2.gz VEXZQPGMAWWADP-RLFYNMQTSA-N 2 1 318.530 4.368 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCCc4occc43)CC2)C1 ZINC000359113967 1044132345 /nfs/dbraw/zinc/13/23/45/1044132345.db2.gz JLBVPNJZZVAYLO-HHXXYDBFSA-N 2 1 316.489 4.290 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1)c1c[nH+]ccc1N ZINC000562958870 1044210682 /nfs/dbraw/zinc/21/06/82/1044210682.db2.gz ZAVOKRZAANEIQH-DUVNUKRYSA-N 2 1 315.848 4.134 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCOc2ccccc21 ZINC000359949738 1044218467 /nfs/dbraw/zinc/21/84/67/1044218467.db2.gz LMCYDCRDXUNHSX-IEBWSBKVSA-N 2 1 316.489 4.145 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1OC ZINC000360029636 1044228476 /nfs/dbraw/zinc/22/84/76/1044228476.db2.gz QEUQSCIGKJNCEU-ZOBUZTSGSA-N 2 1 322.880 4.016 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1OC ZINC000360029636 1044228488 /nfs/dbraw/zinc/22/84/88/1044228488.db2.gz QEUQSCIGKJNCEU-ZOBUZTSGSA-N 2 1 322.880 4.016 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000883250990 1044245948 /nfs/dbraw/zinc/24/59/48/1044245948.db2.gz XWDXXZZAGQADHI-DOTOQJQBSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(C)CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000883250990 1044245952 /nfs/dbraw/zinc/24/59/52/1044245952.db2.gz XWDXXZZAGQADHI-DOTOQJQBSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCCOC(C)(C)C)C1 ZINC000475066720 1044257488 /nfs/dbraw/zinc/25/74/88/1044257488.db2.gz LKPKBHXFEWCMTN-RBUKOAKNSA-N 2 1 324.553 4.168 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCCOC(C)(C)C)C1 ZINC000475066720 1044257503 /nfs/dbraw/zinc/25/75/03/1044257503.db2.gz LKPKBHXFEWCMTN-RBUKOAKNSA-N 2 1 324.553 4.168 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCCOC(C)(C)C)C1 ZINC000475066719 1044259175 /nfs/dbraw/zinc/25/91/75/1044259175.db2.gz LKPKBHXFEWCMTN-OALUTQOASA-N 2 1 324.553 4.168 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCCOC(C)(C)C)C1 ZINC000475066719 1044259190 /nfs/dbraw/zinc/25/91/90/1044259190.db2.gz LKPKBHXFEWCMTN-OALUTQOASA-N 2 1 324.553 4.168 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC2CCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168055578 1044265136 /nfs/dbraw/zinc/26/51/36/1044265136.db2.gz WJKHDSQWAICBKW-XEMDLRDOSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CC2CCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168055578 1044265147 /nfs/dbraw/zinc/26/51/47/1044265147.db2.gz WJKHDSQWAICBKW-XEMDLRDOSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC2CCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168055578 1044265160 /nfs/dbraw/zinc/26/51/60/1044265160.db2.gz WJKHDSQWAICBKW-XEMDLRDOSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@H]1CC([N@@H+](C)CCC2CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168058703 1044305574 /nfs/dbraw/zinc/30/55/74/1044305574.db2.gz BVWMORQOXIJYID-IRXDYDNUSA-N 2 1 300.490 4.160 20 0 DIADMP Cc1sccc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000293733857 1044319835 /nfs/dbraw/zinc/31/98/35/1044319835.db2.gz ZLWGDVGFCJOLDL-UHFFFAOYSA-N 2 1 302.487 4.187 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC2CCC2)CC1 ZINC001202776562 1044324795 /nfs/dbraw/zinc/32/47/95/1044324795.db2.gz WCSNGSUOZJNBND-UHFFFAOYSA-N 2 1 306.881 4.036 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC2CCC2)CC1 ZINC001202776562 1044324808 /nfs/dbraw/zinc/32/48/08/1044324808.db2.gz WCSNGSUOZJNBND-UHFFFAOYSA-N 2 1 306.881 4.036 20 0 DIADMP Clc1ccc(CC2([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000293780246 1044326592 /nfs/dbraw/zinc/32/65/92/1044326592.db2.gz TVTXDUSABDEVPV-QZTJIDSGSA-N 2 1 318.892 4.022 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475276526 1044339273 /nfs/dbraw/zinc/33/92/73/1044339273.db2.gz PBXGJPVAXGJSAL-PZJWPPBQSA-N 2 1 322.496 4.038 20 0 DIADMP CC[C@@H](C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000475284447 1044343071 /nfs/dbraw/zinc/34/30/71/1044343071.db2.gz DINWXLQWUDYEAZ-RTWAWAEBSA-N 2 1 322.496 4.292 20 0 DIADMP CC[C@H](C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000475284446 1044344947 /nfs/dbraw/zinc/34/49/47/1044344947.db2.gz DINWXLQWUDYEAZ-NHCUHLMSSA-N 2 1 322.496 4.292 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475288857 1044347097 /nfs/dbraw/zinc/34/70/97/1044347097.db2.gz UYUPPFQQJZOYRZ-ICSRJNTNSA-N 2 1 300.490 4.233 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H]3CCCC[C@H]3C3CC3)C2)cc1 ZINC000475285715 1044348101 /nfs/dbraw/zinc/34/81/01/1044348101.db2.gz HDYFLYBXUKRCJE-GIVPXCGWSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000361079553 1044358148 /nfs/dbraw/zinc/35/81/48/1044358148.db2.gz LIQNLEKCCVDCSH-UZLBHIALSA-N 2 1 316.489 4.014 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000361079550 1044358638 /nfs/dbraw/zinc/35/86/38/1044358638.db2.gz LIQNLEKCCVDCSH-JXFKEZNVSA-N 2 1 316.489 4.014 20 0 DIADMP C[C@@H](Nc1cc2c(cn1)CCCC2)c1ccc(-n2ccnc2)cc1 ZINC000361190072 1044373913 /nfs/dbraw/zinc/37/39/13/1044373913.db2.gz OLAIDESRRJUCTN-OAHLLOKOSA-N 2 1 318.424 4.319 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC3(CCC3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168065929 1044416885 /nfs/dbraw/zinc/41/68/85/1044416885.db2.gz ZGSHKNQXSHZMLW-QZTJIDSGSA-N 2 1 312.501 4.304 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000361588526 1044422370 /nfs/dbraw/zinc/42/23/70/1044422370.db2.gz FNGMVRSZOJQPFA-GJZGRUSLSA-N 2 1 317.399 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000361588526 1044422376 /nfs/dbraw/zinc/42/23/76/1044422376.db2.gz FNGMVRSZOJQPFA-GJZGRUSLSA-N 2 1 317.399 4.025 20 0 DIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cnc(C3CCCCC3)s2)C1 ZINC000565271378 1044422651 /nfs/dbraw/zinc/42/26/51/1044422651.db2.gz ISYCDPPPYCTZOR-OAHLLOKOSA-N 2 1 321.534 4.011 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cnc(C3CCCCC3)s2)C1 ZINC000565271378 1044422662 /nfs/dbraw/zinc/42/26/62/1044422662.db2.gz ISYCDPPPYCTZOR-OAHLLOKOSA-N 2 1 321.534 4.011 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000361730588 1044437037 /nfs/dbraw/zinc/43/70/37/1044437037.db2.gz YSNIULSPDLMOMD-FQEVSTJZSA-N 2 1 322.456 4.290 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000361730588 1044437042 /nfs/dbraw/zinc/43/70/42/1044437042.db2.gz YSNIULSPDLMOMD-FQEVSTJZSA-N 2 1 322.456 4.290 20 0 DIADMP Cc1ccc2c(cccc2Nc2ccc3c(c2)C[N@@H+](C)CC3)n1 ZINC001212798660 1044451370 /nfs/dbraw/zinc/45/13/70/1044451370.db2.gz MINYDWZUOCVOIX-UHFFFAOYSA-N 2 1 303.409 4.275 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000566039412 1044471224 /nfs/dbraw/zinc/47/12/24/1044471224.db2.gz OVMONCXDCOGDLM-AQNXPRMDSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000294966347 1044476604 /nfs/dbraw/zinc/47/66/04/1044476604.db2.gz LJGBFRUKQSNSCX-CRAIPNDOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000294966347 1044476612 /nfs/dbraw/zinc/47/66/12/1044476612.db2.gz LJGBFRUKQSNSCX-CRAIPNDOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966347 1044476613 /nfs/dbraw/zinc/47/66/13/1044476613.db2.gz LJGBFRUKQSNSCX-CRAIPNDOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966347 1044476620 /nfs/dbraw/zinc/47/66/20/1044476620.db2.gz LJGBFRUKQSNSCX-CRAIPNDOSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000294966357 1044476826 /nfs/dbraw/zinc/47/68/26/1044476826.db2.gz LJGBFRUKQSNSCX-YJBOKZPZSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000294966357 1044476833 /nfs/dbraw/zinc/47/68/33/1044476833.db2.gz LJGBFRUKQSNSCX-YJBOKZPZSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966357 1044476839 /nfs/dbraw/zinc/47/68/39/1044476839.db2.gz LJGBFRUKQSNSCX-YJBOKZPZSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966357 1044476843 /nfs/dbraw/zinc/47/68/43/1044476843.db2.gz LJGBFRUKQSNSCX-YJBOKZPZSA-N 2 1 322.443 4.017 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000567026873 1044536331 /nfs/dbraw/zinc/53/63/31/1044536331.db2.gz XEVAEGWFNUIDAR-PGRDOPGGSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@@H]2CC[N@H+](C)C[C@@H]2C)c1 ZINC000567026873 1044536347 /nfs/dbraw/zinc/53/63/47/1044536347.db2.gz XEVAEGWFNUIDAR-PGRDOPGGSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)c1 ZINC000567026873 1044536356 /nfs/dbraw/zinc/53/63/56/1044536356.db2.gz XEVAEGWFNUIDAR-PGRDOPGGSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@H+](C)[C@@H]2CC[NH+](C)C[C@@H]2C)c1 ZINC000567026873 1044536366 /nfs/dbraw/zinc/53/63/66/1044536366.db2.gz XEVAEGWFNUIDAR-PGRDOPGGSA-N 2 1 322.496 4.434 20 0 DIADMP Clc1ccc([C@H]2CC[N@@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000444624590 1044580607 /nfs/dbraw/zinc/58/06/07/1044580607.db2.gz FJFDJFIUOBIPLG-KRWDZBQOSA-N 2 1 306.881 4.005 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CCN1C ZINC000444651974 1044583281 /nfs/dbraw/zinc/58/32/81/1044583281.db2.gz QPPFXGVGXLKVCM-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651974 1044583293 /nfs/dbraw/zinc/58/32/93/1044583293.db2.gz QPPFXGVGXLKVCM-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651974 1044583300 /nfs/dbraw/zinc/58/33/00/1044583300.db2.gz QPPFXGVGXLKVCM-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651974 1044583308 /nfs/dbraw/zinc/58/33/08/1044583308.db2.gz QPPFXGVGXLKVCM-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651974 1044583318 /nfs/dbraw/zinc/58/33/18/1044583318.db2.gz QPPFXGVGXLKVCM-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651974 1044583333 /nfs/dbraw/zinc/58/33/33/1044583333.db2.gz QPPFXGVGXLKVCM-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651974 1044583348 /nfs/dbraw/zinc/58/33/48/1044583348.db2.gz QPPFXGVGXLKVCM-QAPCUYQASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CCN1C ZINC000444651972 1044583711 /nfs/dbraw/zinc/58/37/11/1044583711.db2.gz QPPFXGVGXLKVCM-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651972 1044583722 /nfs/dbraw/zinc/58/37/22/1044583722.db2.gz QPPFXGVGXLKVCM-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651972 1044583735 /nfs/dbraw/zinc/58/37/35/1044583735.db2.gz QPPFXGVGXLKVCM-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651972 1044583751 /nfs/dbraw/zinc/58/37/51/1044583751.db2.gz QPPFXGVGXLKVCM-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651972 1044583759 /nfs/dbraw/zinc/58/37/59/1044583759.db2.gz QPPFXGVGXLKVCM-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651972 1044583771 /nfs/dbraw/zinc/58/37/71/1044583771.db2.gz QPPFXGVGXLKVCM-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651972 1044583782 /nfs/dbraw/zinc/58/37/82/1044583782.db2.gz QPPFXGVGXLKVCM-CRAIPNDOSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000885923192 1044592533 /nfs/dbraw/zinc/59/25/33/1044592533.db2.gz SSZUWRSIODVTIB-RBUKOAKNSA-N 2 1 322.537 4.113 20 0 DIADMP CCc1ccccc1CC[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000444669585 1044598737 /nfs/dbraw/zinc/59/87/37/1044598737.db2.gz GTJABBAYXQOIDA-PXNSSMCTSA-N 2 1 314.517 4.034 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2CCc2ccccc2)C1 ZINC000568140564 1044605923 /nfs/dbraw/zinc/60/59/23/1044605923.db2.gz PLUMYDNNCZCHLX-HKBOAZHASA-N 2 1 314.517 4.108 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C3(C4CC4)CCC3)CC23CC3)cc1 ZINC000886392179 1044639873 /nfs/dbraw/zinc/63/98/73/1044639873.db2.gz YZJNQTWBJICLDW-IBGZPJMESA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C3(C4CC4)CCC3)CC23CC3)cc1 ZINC000886392179 1044639885 /nfs/dbraw/zinc/63/98/85/1044639885.db2.gz YZJNQTWBJICLDW-IBGZPJMESA-N 2 1 310.485 4.106 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@H](C)c3cccc(F)c3)CC2)[nH+]c1C ZINC000886666517 1044677393 /nfs/dbraw/zinc/67/73/93/1044677393.db2.gz ULIBFOBXPJGFIB-CQSZACIVSA-N 2 1 301.409 4.106 20 0 DIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000445315715 1044702393 /nfs/dbraw/zinc/70/23/93/1044702393.db2.gz IVJAKSDGQLWYPE-MSOLQXFVSA-N 2 1 324.468 4.423 20 0 DIADMP C[C@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000445315715 1044702409 /nfs/dbraw/zinc/70/24/09/1044702409.db2.gz IVJAKSDGQLWYPE-MSOLQXFVSA-N 2 1 324.468 4.423 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000569748353 1044710262 /nfs/dbraw/zinc/71/02/62/1044710262.db2.gz OVVUCCBHDKYHKA-ZFMNYDKASA-N 2 1 314.517 4.280 20 0 DIADMP Cc1cscc1C[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348409772 1044763725 /nfs/dbraw/zinc/76/37/25/1044763725.db2.gz TZPNIPNFGZEKKI-CQSZACIVSA-N 2 1 311.454 4.401 20 0 DIADMP Cc1[nH+]c2c(n1Cc1cccc(C[NH+]3CCCCC3)c1)CCCC2 ZINC000570643983 1044771544 /nfs/dbraw/zinc/77/15/44/1044771544.db2.gz DEQAAFKRGNEQAV-UHFFFAOYSA-N 2 1 323.484 4.105 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)Cc1ccsc1 ZINC000570760397 1044781469 /nfs/dbraw/zinc/78/14/69/1044781469.db2.gz GUOWSCVSODLQCD-INIZCTEOSA-N 2 1 316.514 4.263 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+]CC[C@H]3CCC[N@H+](C)C3)c2)cc1 ZINC001202749576 1044783783 /nfs/dbraw/zinc/78/37/83/1044783783.db2.gz JQHKHGCZNLGEGU-LJQANCHMSA-N 2 1 322.496 4.484 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2)c1 ZINC000123981213 1044790182 /nfs/dbraw/zinc/79/01/82/1044790182.db2.gz VLGRIQNZJVJRNT-HNNXBMFYSA-N 2 1 300.421 4.128 20 0 DIADMP c1c2ccccc2sc1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000369537355 1044806856 /nfs/dbraw/zinc/80/68/56/1044806856.db2.gz PWCLIJHLYHGOFH-UHFFFAOYSA-N 2 1 300.471 4.008 20 0 DIADMP CCC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1ccccc1 ZINC000126296370 1044811852 /nfs/dbraw/zinc/81/18/52/1044811852.db2.gz HQXCAKQNGSMGHW-LJQANCHMSA-N 2 1 320.440 4.207 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)oc1C ZINC000337390019 1044889379 /nfs/dbraw/zinc/88/93/79/1044889379.db2.gz KFRXZPPRXRWSAK-MRXNPFEDSA-N 2 1 312.457 4.343 20 0 DIADMP CC[N@H+](Cc1ccc(C)cc1)CC1CCN(c2ccccn2)CC1 ZINC000524753246 1044910795 /nfs/dbraw/zinc/91/07/95/1044910795.db2.gz QNIPMZNMMQKMPC-UHFFFAOYSA-N 2 1 323.484 4.129 20 0 DIADMP Clc1ccc(CCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000524893263 1044943155 /nfs/dbraw/zinc/94/31/55/1044943155.db2.gz JEKUEHFWYLILLX-LJQANCHMSA-N 2 1 320.908 4.223 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000373385867 1044975100 /nfs/dbraw/zinc/97/51/00/1044975100.db2.gz FZNFONCIMIKWKC-ZZCKCESHSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000525488192 1045076250 /nfs/dbraw/zinc/07/62/50/1045076250.db2.gz FRFZBXFRSUYRFG-IAGOWNOFSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000525488192 1045076263 /nfs/dbraw/zinc/07/62/63/1045076263.db2.gz FRFZBXFRSUYRFG-IAGOWNOFSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000525488192 1045076275 /nfs/dbraw/zinc/07/62/75/1045076275.db2.gz FRFZBXFRSUYRFG-IAGOWNOFSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000525488192 1045076288 /nfs/dbraw/zinc/07/62/88/1045076288.db2.gz FRFZBXFRSUYRFG-IAGOWNOFSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000525488192 1045076299 /nfs/dbraw/zinc/07/62/99/1045076299.db2.gz FRFZBXFRSUYRFG-IAGOWNOFSA-N 2 1 302.506 4.319 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@@H]2CCC[C@@H]21 ZINC000576774298 1045078268 /nfs/dbraw/zinc/07/82/68/1045078268.db2.gz DUBREGYITUNZGU-GBBGEASQSA-N 2 1 318.892 4.048 20 0 DIADMP C[C@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@@H+]1CCCC[C@@H]1C ZINC000576864232 1045084496 /nfs/dbraw/zinc/08/44/96/1045084496.db2.gz RSEKIOPNLQRDCW-FKMMRDPUSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@H+]1CCCC[C@@H]1C ZINC000576864232 1045084506 /nfs/dbraw/zinc/08/45/06/1045084506.db2.gz RSEKIOPNLQRDCW-FKMMRDPUSA-N 2 1 322.443 4.063 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC[C@H](C)c2ccccc2)CC1 ZINC000447091960 1045093539 /nfs/dbraw/zinc/09/35/39/1045093539.db2.gz WOXMPUYMHCLTGE-KRWDZBQOSA-N 2 1 324.468 4.427 20 0 DIADMP Cc1ccc(-c2ccc(CN(C)[C@H]3CC[N@@H+](C)C[C@@H]3C)o2)cc1 ZINC000577026510 1045094983 /nfs/dbraw/zinc/09/49/83/1045094983.db2.gz PWGNWTLROVAVRO-LPHOPBHVSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(CN(C)[C@H]3CC[N@H+](C)C[C@@H]3C)o2)cc1 ZINC000577026510 1045094993 /nfs/dbraw/zinc/09/49/93/1045094993.db2.gz PWGNWTLROVAVRO-LPHOPBHVSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@H]3CC[N@@H+](C)C[C@@H]3C)o2)cc1 ZINC000577026510 1045095003 /nfs/dbraw/zinc/09/50/03/1045095003.db2.gz PWGNWTLROVAVRO-LPHOPBHVSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@H]3CC[N@H+](C)C[C@@H]3C)o2)cc1 ZINC000577026510 1045095014 /nfs/dbraw/zinc/09/50/14/1045095014.db2.gz PWGNWTLROVAVRO-LPHOPBHVSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CC[NH+](C)C[C@@H]3C)o2)cc1 ZINC000577026510 1045095025 /nfs/dbraw/zinc/09/50/25/1045095025.db2.gz PWGNWTLROVAVRO-LPHOPBHVSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)[C@H]3CC[NH+](C)C[C@@H]3C)o2)cc1 ZINC000577026510 1045095035 /nfs/dbraw/zinc/09/50/35/1045095035.db2.gz PWGNWTLROVAVRO-LPHOPBHVSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@@H]3CC[N@@H+](C)C[C@H]3C)o2)cc1 ZINC000577026512 1045096204 /nfs/dbraw/zinc/09/62/04/1045096204.db2.gz PWGNWTLROVAVRO-VQIMIIECSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)[C@@H]3CC[N@H+](C)C[C@H]3C)o2)cc1 ZINC000577026512 1045096213 /nfs/dbraw/zinc/09/62/13/1045096213.db2.gz PWGNWTLROVAVRO-VQIMIIECSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CC[NH+](C)C[C@H]3C)o2)cc1 ZINC000577026512 1045096221 /nfs/dbraw/zinc/09/62/21/1045096221.db2.gz PWGNWTLROVAVRO-VQIMIIECSA-N 2 1 312.457 4.027 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CC[NH+](C)C[C@H]3C)o2)cc1 ZINC000577026512 1045096228 /nfs/dbraw/zinc/09/62/28/1045096228.db2.gz PWGNWTLROVAVRO-VQIMIIECSA-N 2 1 312.457 4.027 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C2CCCCC2)CC1 ZINC000577074191 1045098829 /nfs/dbraw/zinc/09/88/29/1045098829.db2.gz LOUJFLBWWCBJTK-UHFFFAOYSA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447572423 1045146808 /nfs/dbraw/zinc/14/68/08/1045146808.db2.gz BTIZMLJEFXVXLD-WTGUMLROSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000525991309 1045150769 /nfs/dbraw/zinc/15/07/69/1045150769.db2.gz KSKDCWDPHNQFPV-LNLFQRSKSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447583800 1045153260 /nfs/dbraw/zinc/15/32/60/1045153260.db2.gz CMTPOQALOMSFBO-WTGUMLROSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447594172 1045154564 /nfs/dbraw/zinc/15/45/64/1045154564.db2.gz XIOHIFABYXFNPU-OTNPHJDUSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccccc1SC(F)(F)F ZINC000924574496 1045177929 /nfs/dbraw/zinc/17/79/29/1045177929.db2.gz FCZGWHVSKQERQJ-LLVKDONJSA-N 2 1 318.408 4.043 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1csc2ccccc12 ZINC000924648571 1045187321 /nfs/dbraw/zinc/18/73/21/1045187321.db2.gz LTJVKZRUEFFTGF-KBPBESRZSA-N 2 1 300.471 4.036 20 0 DIADMP Cc1ccccc1C[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccco1 ZINC000924700915 1045191192 /nfs/dbraw/zinc/19/11/92/1045191192.db2.gz ZLTAGTQYKYEJOV-AQNXPRMDSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccco1 ZINC000924700915 1045191199 /nfs/dbraw/zinc/19/11/99/1045191199.db2.gz ZLTAGTQYKYEJOV-AQNXPRMDSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccco1 ZINC000924700915 1045191203 /nfs/dbraw/zinc/19/12/03/1045191203.db2.gz ZLTAGTQYKYEJOV-AQNXPRMDSA-N 2 1 324.468 4.088 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694630 1045191748 /nfs/dbraw/zinc/19/17/48/1045191748.db2.gz FSTHQVYTCSKUOH-DRZSPHRISA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694630 1045191755 /nfs/dbraw/zinc/19/17/55/1045191755.db2.gz FSTHQVYTCSKUOH-DRZSPHRISA-N 2 1 318.408 4.044 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)C[C@@H](C)c2cccc(Cl)c2)CC1 ZINC000527106765 1045196521 /nfs/dbraw/zinc/19/65/21/1045196521.db2.gz CVUCYXRKFHXJHD-OAHLLOKOSA-N 2 1 308.897 4.248 20 0 DIADMP C[C@@H](C[NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000527115756 1045198107 /nfs/dbraw/zinc/19/81/07/1045198107.db2.gz HLXRPRNQQHQAOR-DLBZAZTESA-N 2 1 306.469 4.173 20 0 DIADMP C[C@@H](C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527115758 1045198650 /nfs/dbraw/zinc/19/86/50/1045198650.db2.gz HLXRPRNQQHQAOR-IRXDYDNUSA-N 2 1 306.469 4.173 20 0 DIADMP CCc1c(C)[nH+]c2ccccc2c1N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000557715866 1045222717 /nfs/dbraw/zinc/22/27/17/1045222717.db2.gz WZZUOUBEEYYQEF-SJPCQFCGSA-N 2 1 323.484 4.167 20 0 DIADMP CCC1CC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000578345642 1045233889 /nfs/dbraw/zinc/23/38/89/1045233889.db2.gz UDVFXPFNJHRNKF-KVZIAJEVSA-N 2 1 300.490 4.065 20 0 DIADMP CCC1CC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000578345642 1045233899 /nfs/dbraw/zinc/23/38/99/1045233899.db2.gz UDVFXPFNJHRNKF-KVZIAJEVSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@](C)(Cc1ccc(Cl)cc1)C(C)C ZINC000578343530 1045234035 /nfs/dbraw/zinc/23/40/35/1045234035.db2.gz VFDQPDLNMDAGIB-GOSISDBHSA-N 2 1 319.880 4.092 20 0 DIADMP CCC1CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000578345643 1045234208 /nfs/dbraw/zinc/23/42/08/1045234208.db2.gz UDVFXPFNJHRNKF-NKELODKYSA-N 2 1 300.490 4.065 20 0 DIADMP CCC1CC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000578345643 1045234219 /nfs/dbraw/zinc/23/42/19/1045234219.db2.gz UDVFXPFNJHRNKF-NKELODKYSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)Cc3ccccc3)C2)s1 ZINC000578401074 1045240881 /nfs/dbraw/zinc/24/08/81/1045240881.db2.gz ZKLLEHACZBXPCF-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)Cc3ccccc3)C2)s1 ZINC000578401074 1045240885 /nfs/dbraw/zinc/24/08/85/1045240885.db2.gz ZKLLEHACZBXPCF-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)Cc3ccccc3)C2)s1 ZINC000578401074 1045240891 /nfs/dbraw/zinc/24/08/91/1045240891.db2.gz ZKLLEHACZBXPCF-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000527637700 1045243029 /nfs/dbraw/zinc/24/30/29/1045243029.db2.gz OAJXVUIWTBPZHX-RLLQIKCJSA-N 2 1 312.501 4.177 20 0 DIADMP Cc1ncccc1C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000527987906 1045294587 /nfs/dbraw/zinc/29/45/87/1045294587.db2.gz PWZSJYQBNAUHTB-UHFFFAOYSA-N 2 1 317.521 4.159 20 0 DIADMP CC(C)C[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000579135646 1045295974 /nfs/dbraw/zinc/29/59/74/1045295974.db2.gz SOCOPFQOHUSYIX-ZCTYVAAUSA-N 2 1 320.908 4.500 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000697101668 1045310498 /nfs/dbraw/zinc/31/04/98/1045310498.db2.gz PNYJELRJUWJHNV-NVXWUHKLSA-N 2 1 324.459 4.311 20 0 DIADMP C[NH+](C)C1CCN(c2ccc([NH2+]CCC(C)(C)C)cc2)CC1 ZINC000188214844 1045335565 /nfs/dbraw/zinc/33/55/65/1045335565.db2.gz STANUZFZIZRQGM-UHFFFAOYSA-N 2 1 303.494 4.065 20 0 DIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)C2)cc1 ZINC000449078395 1045345307 /nfs/dbraw/zinc/34/53/07/1045345307.db2.gz UWQOBFWAKANCPW-KYJSFNMBSA-N 2 1 318.892 4.050 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cs1 ZINC000449162677 1045356965 /nfs/dbraw/zinc/35/69/65/1045356965.db2.gz SSEGCNCHLNMIHP-NVXWUHKLSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cs1 ZINC000449162677 1045356970 /nfs/dbraw/zinc/35/69/70/1045356970.db2.gz SSEGCNCHLNMIHP-NVXWUHKLSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cs1 ZINC000449162680 1045357211 /nfs/dbraw/zinc/35/72/11/1045357211.db2.gz SSEGCNCHLNMIHP-WBVHZDCISA-N 2 1 320.527 4.291 20 0 DIADMP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cs1 ZINC000449162680 1045357214 /nfs/dbraw/zinc/35/72/14/1045357214.db2.gz SSEGCNCHLNMIHP-WBVHZDCISA-N 2 1 320.527 4.291 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cccc(C)c2F)cc1 ZINC000449189769 1045358107 /nfs/dbraw/zinc/35/81/07/1045358107.db2.gz MQQXDEDVZIRTGI-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc2ccoc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000449234784 1045363139 /nfs/dbraw/zinc/36/31/39/1045363139.db2.gz RDAGPYDPLLXMSO-QAPCUYQASA-N 2 1 312.457 4.175 20 0 DIADMP CSCC1CCC([NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000449231298 1045365599 /nfs/dbraw/zinc/36/55/99/1045365599.db2.gz DCUZWTHDMBVVOX-NALMEZQBSA-N 2 1 324.578 4.151 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449254766 1045367899 /nfs/dbraw/zinc/36/78/99/1045367899.db2.gz YLRHIIUQUSPHNN-LJQANCHMSA-N 2 1 316.876 4.127 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC(C)(C)C(C)(F)F ZINC000697138464 1045414048 /nfs/dbraw/zinc/41/40/48/1045414048.db2.gz ZXMUSYSNJJIQBR-WBVHZDCISA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CC(F)(F)C1 ZINC000529547225 1045492840 /nfs/dbraw/zinc/49/28/40/1045492840.db2.gz VYUCIYVTAKRGGN-RLFYNMQTSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CC(F)(F)C1 ZINC000529547225 1045492838 /nfs/dbraw/zinc/49/28/38/1045492838.db2.gz VYUCIYVTAKRGGN-RLFYNMQTSA-N 2 1 322.443 4.063 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@]2(C)CCCS2)[C@H]1c1cccs1 ZINC000628217969 1045546108 /nfs/dbraw/zinc/54/61/08/1045546108.db2.gz ORSCKOUBEWMHPY-HYVNUMGLSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@@]2(C)CCCS2)[C@H]1c1cccs1 ZINC000628217969 1045546119 /nfs/dbraw/zinc/54/61/19/1045546119.db2.gz ORSCKOUBEWMHPY-HYVNUMGLSA-N 2 1 324.559 4.006 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]C[C@]2(C)CCCS2)CC1 ZINC000628217229 1045546265 /nfs/dbraw/zinc/54/62/65/1045546265.db2.gz PGUXTPYAUKYRMJ-LPHOPBHVSA-N 2 1 318.530 4.087 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@]2(C)CCCS2)[C@H]1c1cccs1 ZINC000628217971 1045547887 /nfs/dbraw/zinc/54/78/87/1045547887.db2.gz ORSCKOUBEWMHPY-PVAVHDDUSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@]2(C)CCCS2)[C@H]1c1cccs1 ZINC000628217971 1045547899 /nfs/dbraw/zinc/54/78/99/1045547899.db2.gz ORSCKOUBEWMHPY-PVAVHDDUSA-N 2 1 324.559 4.006 20 0 DIADMP C[C@H]([NH2+]CC/C=C/c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450729082 1045554747 /nfs/dbraw/zinc/55/47/47/1045554747.db2.gz QZVBWZXESBVYED-OVQHYLNESA-N 2 1 312.501 4.333 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380965853 1045555651 /nfs/dbraw/zinc/55/56/51/1045555651.db2.gz CPMMROXMAICYBW-YZGWKJHDSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000381772226 1045583238 /nfs/dbraw/zinc/58/32/38/1045583238.db2.gz SWOIDUKWPLSEIO-NQIIRXRSSA-N 2 1 308.469 4.249 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000381772224 1045584005 /nfs/dbraw/zinc/58/40/05/1045584005.db2.gz SWOIDUKWPLSEIO-GHTZIAJQSA-N 2 1 308.469 4.249 20 0 DIADMP Cc1nccn1CCCC[N@H+]1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000451191844 1045643600 /nfs/dbraw/zinc/64/36/00/1045643600.db2.gz UWSXLXKOJWDAKQ-HLIPFELVSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000451191844 1045643603 /nfs/dbraw/zinc/64/36/03/1045643603.db2.gz UWSXLXKOJWDAKQ-HLIPFELVSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000451191844 1045643608 /nfs/dbraw/zinc/64/36/08/1045643608.db2.gz UWSXLXKOJWDAKQ-HLIPFELVSA-N 2 1 311.473 4.238 20 0 DIADMP Clc1oc2ccccc2c1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000629522715 1045676920 /nfs/dbraw/zinc/67/69/20/1045676920.db2.gz HCDAOVDJJOMJGO-CWRNSKLLSA-N 2 1 318.848 4.097 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194261 1045831094 /nfs/dbraw/zinc/83/10/94/1045831094.db2.gz WWSWFRVTSKUGEH-MOPGFXCFSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@H]3CCCC34CC4)CC23CC3)cc1 ZINC000631194261 1045831112 /nfs/dbraw/zinc/83/11/12/1045831112.db2.gz WWSWFRVTSKUGEH-MOPGFXCFSA-N 2 1 310.485 4.106 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCSC(C)(C)C)C1 ZINC000801921414 1045839099 /nfs/dbraw/zinc/83/90/99/1045839099.db2.gz BYVAOZMLEMFYJP-SJORKVTESA-N 2 1 312.567 4.105 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCSC(C)(C)C)C1 ZINC000801921414 1045839116 /nfs/dbraw/zinc/83/91/16/1045839116.db2.gz BYVAOZMLEMFYJP-SJORKVTESA-N 2 1 312.567 4.105 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCSC(C)(C)C)C1 ZINC000801921414 1045839129 /nfs/dbraw/zinc/83/91/29/1045839129.db2.gz BYVAOZMLEMFYJP-SJORKVTESA-N 2 1 312.567 4.105 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ncccc32)c1 ZINC000631577720 1045878424 /nfs/dbraw/zinc/87/84/24/1045878424.db2.gz VGFWQFZDPRYQFB-NRFANRHFSA-N 2 1 323.484 4.089 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2ccccc2)CC1 ZINC000531701003 1045900568 /nfs/dbraw/zinc/90/05/68/1045900568.db2.gz VULACSCLPUOSRZ-SFHVURJKSA-N 2 1 308.469 4.310 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)s1 ZINC000631706514 1045907391 /nfs/dbraw/zinc/90/73/91/1045907391.db2.gz GTWKHJWTSLEKOC-GRDNDAEWSA-N 2 1 321.534 4.145 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1csc2ccccc12 ZINC000754733982 1045920401 /nfs/dbraw/zinc/92/04/01/1045920401.db2.gz DRNJZZFUSVGBOA-HUUCEWRRSA-N 2 1 302.487 4.426 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1csc2ccccc12 ZINC000754793415 1045927512 /nfs/dbraw/zinc/92/75/12/1045927512.db2.gz HLHPSDZTKOLJBW-SOUVJXGZSA-N 2 1 300.471 4.179 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1csc2ccccc12 ZINC000754793414 1045928510 /nfs/dbraw/zinc/92/85/10/1045928510.db2.gz HLHPSDZTKOLJBW-RRFJBIMHSA-N 2 1 300.471 4.179 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CC[C@@H](C)c2ccsc21 ZINC000453106340 1045938834 /nfs/dbraw/zinc/93/88/34/1045938834.db2.gz ISQFXMGQVAELPH-XJKCOSOUSA-N 2 1 303.475 4.117 20 0 DIADMP CC[C@@H]([NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccncc1 ZINC000453147714 1045950331 /nfs/dbraw/zinc/95/03/31/1045950331.db2.gz YMRSCAFENRKBOI-YLJYHZDGSA-N 2 1 311.473 4.033 20 0 DIADMP CC[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccncc1 ZINC000453147710 1045950623 /nfs/dbraw/zinc/95/06/23/1045950623.db2.gz YMRSCAFENRKBOI-FXAWDEMLSA-N 2 1 311.473 4.033 20 0 DIADMP CCNc1ccccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000902291906 1045965303 /nfs/dbraw/zinc/96/53/03/1045965303.db2.gz PVIZGLGOZDWLNM-UHFFFAOYSA-N 2 1 315.505 4.005 20 0 DIADMP [NH3+]CCCC[C@@H]([NH2+]Cc1ccccc1F)c1ccc(F)cc1F ZINC000902331979 1045976379 /nfs/dbraw/zinc/97/63/79/1045976379.db2.gz XTUMCZIAFHLVNN-GOSISDBHSA-N 2 1 322.374 4.064 20 0 DIADMP C[C@H](C[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1)C(C)(C)C ZINC000802647358 1046023417 /nfs/dbraw/zinc/02/34/17/1046023417.db2.gz KGLQZMIXCIQECQ-MRXNPFEDSA-N 2 1 317.521 4.311 20 0 DIADMP Cc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CCCC2)o1 ZINC000453336024 1046042943 /nfs/dbraw/zinc/04/29/43/1046042943.db2.gz FHBICVOVQOEPLH-RGPMPMONSA-N 2 1 302.462 4.034 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CCCC2)o1 ZINC000453336024 1046042974 /nfs/dbraw/zinc/04/29/74/1046042974.db2.gz FHBICVOVQOEPLH-RGPMPMONSA-N 2 1 302.462 4.034 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[C@@H]2c2ccccc2)CC[N@H+]1C ZINC000453341088 1046044851 /nfs/dbraw/zinc/04/48/51/1046044851.db2.gz DWVKXJZQABPGIG-VBSBHUPXSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[C@H]2c2ccccc2)CC[N@H+]1C ZINC000453341082 1046045323 /nfs/dbraw/zinc/04/53/23/1046045323.db2.gz DWVKXJZQABPGIG-AFYVEPGGSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753824 1046060406 /nfs/dbraw/zinc/06/04/06/1046060406.db2.gz UGOGPCWDGAWWSG-TUAOUCFPSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753824 1046060419 /nfs/dbraw/zinc/06/04/19/1046060419.db2.gz UGOGPCWDGAWWSG-TUAOUCFPSA-N 2 1 318.408 4.044 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)oc2cc1C ZINC000453378776 1046072990 /nfs/dbraw/zinc/07/29/90/1046072990.db2.gz ZQUZOMFHGUXEIZ-MIGBEJBISA-N 2 1 312.457 4.325 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)oc2cc1C ZINC000453378776 1046073005 /nfs/dbraw/zinc/07/30/05/1046073005.db2.gz ZQUZOMFHGUXEIZ-MIGBEJBISA-N 2 1 312.457 4.325 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1C[C@@H](c2ccccc2)C1(C)C)C1CC1 ZINC000453403395 1046076739 /nfs/dbraw/zinc/07/67/39/1046076739.db2.gz OHUDZPZKJIIVAM-OALUTQOASA-N 2 1 300.490 4.033 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1C[C@H](c2ccccc2)C1(C)C)C1CC1 ZINC000453403400 1046076872 /nfs/dbraw/zinc/07/68/72/1046076872.db2.gz OHUDZPZKJIIVAM-RTBURBONSA-N 2 1 300.490 4.033 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCCOc2c(Cl)cccc21)C1CC1 ZINC000453410009 1046080359 /nfs/dbraw/zinc/08/03/59/1046080359.db2.gz UOOABAPSTZIHEU-KRWDZBQOSA-N 2 1 322.880 4.018 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCCOc2ccc(Cl)cc21)C1CC1 ZINC000453390762 1046081058 /nfs/dbraw/zinc/08/10/58/1046081058.db2.gz DMDKXXFBQRKWBJ-KRWDZBQOSA-N 2 1 322.880 4.018 20 0 DIADMP C[N@@H+](CCCC[NH2+]C1CC(c2cccc(Cl)c2)C1)C1CC1 ZINC000453394837 1046082513 /nfs/dbraw/zinc/08/25/13/1046082513.db2.gz HIXKUCKXYFMDBP-UHFFFAOYSA-N 2 1 306.881 4.050 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(F)ccc1F ZINC000453396416 1046083667 /nfs/dbraw/zinc/08/36/67/1046083667.db2.gz IRPJAFRCGWKFMH-SFHVURJKSA-N 2 1 310.432 4.126 20 0 DIADMP Cc1cc([C@H]([NH2+]CCCC[N@H+](C)C2CC2)C2CC2)ccc1F ZINC000453421014 1046086824 /nfs/dbraw/zinc/08/68/24/1046086824.db2.gz ZZQJKIAHEPDYAM-LJQANCHMSA-N 2 1 304.453 4.049 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1csc(Cl)c1Cl)C1CC1 ZINC000453591463 1046096066 /nfs/dbraw/zinc/09/60/66/1046096066.db2.gz CEDDEHWGWGWWJH-UHFFFAOYSA-N 2 1 307.290 4.019 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000532233658 1046120757 /nfs/dbraw/zinc/12/07/57/1046120757.db2.gz BYMRDOQDZPGEGA-ZACQAIPSSA-N 2 1 320.546 4.268 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903015738 1046143017 /nfs/dbraw/zinc/14/30/17/1046143017.db2.gz BRBAXWXWOVQFNQ-RYUDHWBXSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069631 1046154435 /nfs/dbraw/zinc/15/44/35/1046154435.db2.gz IPVYBLVPJGBSGD-RYUDHWBXSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069631 1046154450 /nfs/dbraw/zinc/15/44/50/1046154450.db2.gz IPVYBLVPJGBSGD-RYUDHWBXSA-N 2 1 320.424 4.149 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000903068664 1046154900 /nfs/dbraw/zinc/15/49/00/1046154900.db2.gz JXGZUIBHGCJLJD-OAQYLSRUSA-N 2 1 323.484 4.163 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccc(F)cc1F ZINC000903098026 1046163124 /nfs/dbraw/zinc/16/31/24/1046163124.db2.gz KTKYDYHHGAPUHB-RFXRPKLXSA-N 2 1 320.427 4.163 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(F)cc1F ZINC000903098026 1046163128 /nfs/dbraw/zinc/16/31/28/1046163128.db2.gz KTKYDYHHGAPUHB-RFXRPKLXSA-N 2 1 320.427 4.163 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2sc3ccccc3c2C)CC1 ZINC001138464540 1046191261 /nfs/dbraw/zinc/19/12/61/1046191261.db2.gz XDRYFZMPUHFPEY-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2sc3ccccc3c2C)CC1 ZINC001138464540 1046191267 /nfs/dbraw/zinc/19/12/67/1046191267.db2.gz XDRYFZMPUHFPEY-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP CCCc1ccc(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3C)C2)s1 ZINC001138528703 1046212282 /nfs/dbraw/zinc/21/22/82/1046212282.db2.gz BJLUYPWLAKFUBA-HNNXBMFYSA-N 2 1 316.470 4.057 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3C)C2)s1 ZINC001138528703 1046212300 /nfs/dbraw/zinc/21/23/00/1046212300.db2.gz BJLUYPWLAKFUBA-HNNXBMFYSA-N 2 1 316.470 4.057 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)cc1 ZINC001138549010 1046221293 /nfs/dbraw/zinc/22/12/93/1046221293.db2.gz NRRBIPFBYCKKBU-AZUAARDMSA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)cc1 ZINC001138549010 1046221305 /nfs/dbraw/zinc/22/13/05/1046221305.db2.gz NRRBIPFBYCKKBU-AZUAARDMSA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](Cc2ccccc2)C2CC2)cc1 ZINC001138549041 1046223701 /nfs/dbraw/zinc/22/37/01/1046223701.db2.gz OQMWOCCZTUZSDL-UHFFFAOYSA-N 2 1 317.436 4.345 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](Cc2ccccc2)C2CC2)cc1 ZINC001138549041 1046223714 /nfs/dbraw/zinc/22/37/14/1046223714.db2.gz OQMWOCCZTUZSDL-UHFFFAOYSA-N 2 1 317.436 4.345 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](CCc1ccc(F)cc1)C1CCCC1 ZINC001168165496 1046224758 /nfs/dbraw/zinc/22/47/58/1046224758.db2.gz YNOPVHXZLLWNEC-LJQANCHMSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC001168165496 1046224766 /nfs/dbraw/zinc/22/47/66/1046224766.db2.gz YNOPVHXZLLWNEC-LJQANCHMSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC001168165496 1046224775 /nfs/dbraw/zinc/22/47/75/1046224775.db2.gz YNOPVHXZLLWNEC-LJQANCHMSA-N 2 1 318.480 4.097 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCc3cc(C)ccc3C2)cc1 ZINC001138552152 1046226554 /nfs/dbraw/zinc/22/65/54/1046226554.db2.gz XCAULZFWQPWCTJ-UHFFFAOYSA-N 2 1 317.436 4.047 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCc3cc(C)ccc3C2)cc1 ZINC001138552152 1046226566 /nfs/dbraw/zinc/22/65/66/1046226566.db2.gz XCAULZFWQPWCTJ-UHFFFAOYSA-N 2 1 317.436 4.047 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC001138551874 1046226869 /nfs/dbraw/zinc/22/68/69/1046226869.db2.gz QCNONACCMXUGGV-NRFANRHFSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC001138551874 1046226882 /nfs/dbraw/zinc/22/68/82/1046226882.db2.gz QCNONACCMXUGGV-NRFANRHFSA-N 2 1 317.436 4.300 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001168172058 1046250286 /nfs/dbraw/zinc/25/02/86/1046250286.db2.gz ZMHJACDUOBDBGE-WBVHZDCISA-N 2 1 308.897 4.112 20 0 DIADMP CC[N@@H+](CCn1ccnc1)Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001138684117 1046266538 /nfs/dbraw/zinc/26/65/38/1046266538.db2.gz DVDQSFSQZGPOOR-UHFFFAOYSA-N 2 1 323.415 4.211 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1cc2cc(Cl)cnc2o1)C(C)C ZINC000648470686 1046292939 /nfs/dbraw/zinc/29/29/39/1046292939.db2.gz UDNKGWAQUWDNKD-UHFFFAOYSA-N 2 1 323.868 4.080 20 0 DIADMP c1csc(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000638280807 1046307679 /nfs/dbraw/zinc/30/76/79/1046307679.db2.gz KIZAJAOBJHHQQV-VQIMIIECSA-N 2 1 312.482 4.206 20 0 DIADMP c1csc(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000638280807 1046307692 /nfs/dbraw/zinc/30/76/92/1046307692.db2.gz KIZAJAOBJHHQQV-VQIMIIECSA-N 2 1 312.482 4.206 20 0 DIADMP c1cc(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)cs1 ZINC000638277913 1046309967 /nfs/dbraw/zinc/30/99/67/1046309967.db2.gz WVKMTZKZFZBCFH-PKOBYXMFSA-N 2 1 312.482 4.206 20 0 DIADMP c1cc(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)cs1 ZINC000638277913 1046309984 /nfs/dbraw/zinc/30/99/84/1046309984.db2.gz WVKMTZKZFZBCFH-PKOBYXMFSA-N 2 1 312.482 4.206 20 0 DIADMP c1cc(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)cs1 ZINC000638277910 1046310278 /nfs/dbraw/zinc/31/02/78/1046310278.db2.gz WVKMTZKZFZBCFH-MJGOQNOKSA-N 2 1 312.482 4.206 20 0 DIADMP c1cc(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)cs1 ZINC000638277910 1046310295 /nfs/dbraw/zinc/31/02/95/1046310295.db2.gz WVKMTZKZFZBCFH-MJGOQNOKSA-N 2 1 312.482 4.206 20 0 DIADMP [NH3+]CC1([C@@H]2CCCC[N@H+]2Cc2ccc(C(F)F)cc2)CCC1 ZINC000903811852 1046325645 /nfs/dbraw/zinc/32/56/45/1046325645.db2.gz OSRVYPUFFHCPJI-INIZCTEOSA-N 2 1 308.416 4.108 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC000643468960 1046345420 /nfs/dbraw/zinc/34/54/20/1046345420.db2.gz RLYWEBNSIMGIQY-NRSPTQNISA-N 2 1 306.453 4.065 20 0 DIADMP C[N@@H+](Cc1ccc(F)c2ccccc12)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000639161626 1046366538 /nfs/dbraw/zinc/36/65/38/1046366538.db2.gz FECCOLAIMMYUIJ-SJPCQFCGSA-N 2 1 312.432 4.036 20 0 DIADMP C[NH+](Cc1ccc(F)c2ccccc12)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000639161626 1046366549 /nfs/dbraw/zinc/36/65/49/1046366549.db2.gz FECCOLAIMMYUIJ-SJPCQFCGSA-N 2 1 312.432 4.036 20 0 DIADMP C[NH+](Cc1ccc(F)c2ccccc12)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000639161626 1046366563 /nfs/dbraw/zinc/36/65/63/1046366563.db2.gz FECCOLAIMMYUIJ-SJPCQFCGSA-N 2 1 312.432 4.036 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)CC(F)F ZINC000639284252 1046378078 /nfs/dbraw/zinc/37/80/78/1046378078.db2.gz WHXYPIQHCWHIQO-LESCRADOSA-N 2 1 322.443 4.235 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)CC(F)F ZINC000639284252 1046378095 /nfs/dbraw/zinc/37/80/95/1046378095.db2.gz WHXYPIQHCWHIQO-LESCRADOSA-N 2 1 322.443 4.235 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3cccc(C)c23)CC1 ZINC001139198532 1046409177 /nfs/dbraw/zinc/40/91/77/1046409177.db2.gz SCOISYPDOFZIDZ-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000781428093 1046444591 /nfs/dbraw/zinc/44/45/91/1046444591.db2.gz ZNLIGNIKFJYZRA-MMOPVJDHSA-N 2 1 312.501 4.225 20 0 DIADMP CC[C@H]1CCC[C@H](C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202939853 1046454053 /nfs/dbraw/zinc/45/40/53/1046454053.db2.gz UJRLFDUQJHMKDP-MMKMLUHNSA-N 2 1 314.517 4.138 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124777795 1046460839 /nfs/dbraw/zinc/46/08/39/1046460839.db2.gz STRQEZSKIGLZPJ-QAPCUYQASA-N 2 1 315.461 4.346 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124777795 1046460849 /nfs/dbraw/zinc/46/08/49/1046460849.db2.gz STRQEZSKIGLZPJ-QAPCUYQASA-N 2 1 315.461 4.346 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000126491872 1046476089 /nfs/dbraw/zinc/47/60/89/1046476089.db2.gz MJMWZAFFQQDUJU-OHRKKDJYSA-N 2 1 321.534 4.241 20 0 DIADMP c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677237933 1046476281 /nfs/dbraw/zinc/47/62/81/1046476281.db2.gz RCEITCHBXXSCLL-TUFLPTIASA-N 2 1 312.501 4.004 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)c1 ZINC000677241903 1046476296 /nfs/dbraw/zinc/47/62/96/1046476296.db2.gz UCSNPMGPBSPFNN-SLFFLAALSA-N 2 1 316.464 4.273 20 0 DIADMP CC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1ccc(C)cc1 ZINC000126318031 1046476708 /nfs/dbraw/zinc/47/67/08/1046476708.db2.gz BFJANXXJROFMEN-IBGZPJMESA-N 2 1 320.440 4.125 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)c2)c1 ZINC000677238214 1046477036 /nfs/dbraw/zinc/47/70/36/1046477036.db2.gz YCVZYEWGCQTAMH-VXKWHMMOSA-N 2 1 320.480 4.378 20 0 DIADMP c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000677237932 1046477295 /nfs/dbraw/zinc/47/72/95/1046477295.db2.gz RCEITCHBXXSCLL-BURNTYAHSA-N 2 1 312.501 4.004 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCCc4ccccc43)CC2)[nH+]1 ZINC000128213103 1046490969 /nfs/dbraw/zinc/49/09/69/1046490969.db2.gz DVFZZNJKNNLKHM-FQEVSTJZSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000782183662 1046497994 /nfs/dbraw/zinc/49/79/94/1046497994.db2.gz OUURPHXFSIRKAI-CYBMUJFWSA-N 2 1 314.395 4.040 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000782191502 1046498924 /nfs/dbraw/zinc/49/89/24/1046498924.db2.gz WMEKFDPMBRFAJJ-KXBFYZLASA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000782191502 1046498928 /nfs/dbraw/zinc/49/89/28/1046498928.db2.gz WMEKFDPMBRFAJJ-KXBFYZLASA-N 2 1 318.892 4.135 20 0 DIADMP CCCC[N@H+](CCCn1cc[nH+]c1C)[C@@H](C)c1ccc(C)o1 ZINC000677818187 1046529217 /nfs/dbraw/zinc/52/92/17/1046529217.db2.gz HBWXQWMXLQXXHL-INIZCTEOSA-N 2 1 303.450 4.346 20 0 DIADMP CCCC[N@@H+](CCCn1cc[nH+]c1C)[C@@H](C)c1ccc(C)o1 ZINC000677818187 1046529226 /nfs/dbraw/zinc/52/92/26/1046529226.db2.gz HBWXQWMXLQXXHL-INIZCTEOSA-N 2 1 303.450 4.346 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[NH+]1CCC([NH+]2CCC2)CC1 ZINC001139860676 1046537991 /nfs/dbraw/zinc/53/79/91/1046537991.db2.gz IOTPQOBEESWRJL-UHFFFAOYSA-N 2 1 320.436 4.256 20 0 DIADMP CC(C)Oc1ccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1 ZINC000322096348 1046585101 /nfs/dbraw/zinc/58/51/01/1046585101.db2.gz LDAOLVMGBVGAGG-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)Oc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1 ZINC000322096348 1046585114 /nfs/dbraw/zinc/58/51/14/1046585114.db2.gz LDAOLVMGBVGAGG-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000237536922 1046596267 /nfs/dbraw/zinc/59/62/67/1046596267.db2.gz QRTOCTVONVNSNF-VQIMIIECSA-N 2 1 312.457 4.190 20 0 DIADMP c1cc2cnccc2c(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001140145042 1046600702 /nfs/dbraw/zinc/60/07/02/1046600702.db2.gz XYXQOWREDAJBAW-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967806 1046630569 /nfs/dbraw/zinc/63/05/69/1046630569.db2.gz VGRGTLDBGHYHDA-MAUKXSAKSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967806 1046630577 /nfs/dbraw/zinc/63/05/77/1046630577.db2.gz VGRGTLDBGHYHDA-MAUKXSAKSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000532967810 1046631130 /nfs/dbraw/zinc/63/11/30/1046631130.db2.gz VGRGTLDBGHYHDA-YJBOKZPZSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000532967810 1046631133 /nfs/dbraw/zinc/63/11/33/1046631133.db2.gz VGRGTLDBGHYHDA-YJBOKZPZSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967802 1046631501 /nfs/dbraw/zinc/63/15/01/1046631501.db2.gz VGRGTLDBGHYHDA-CRAIPNDOSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000532967802 1046631509 /nfs/dbraw/zinc/63/15/09/1046631509.db2.gz VGRGTLDBGHYHDA-CRAIPNDOSA-N 2 1 306.881 4.351 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)oc2cc1C ZINC000643546475 1046671399 /nfs/dbraw/zinc/67/13/99/1046671399.db2.gz PHGKQPQUMHPRAI-RDJZCZTQSA-N 2 1 312.457 4.375 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1OC(F)F ZINC000643547004 1046671639 /nfs/dbraw/zinc/67/16/39/1046671639.db2.gz YFJJBTMQHMGILW-DZGCQCFKSA-N 2 1 324.415 4.003 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)oc2cc1C ZINC000643546476 1046671747 /nfs/dbraw/zinc/67/17/47/1046671747.db2.gz PHGKQPQUMHPRAI-WBVHZDCISA-N 2 1 312.457 4.375 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547325 1046671910 /nfs/dbraw/zinc/67/19/10/1046671910.db2.gz CUTOYNKPFBJPGU-NHCUHLMSSA-N 2 1 320.480 4.349 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C2CCCC2)o1 ZINC000643548661 1046672645 /nfs/dbraw/zinc/67/26/45/1046672645.db2.gz SUCUWERXWKQLSB-SJLPKXTDSA-N 2 1 302.462 4.084 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)cc1Cl ZINC000834908045 1046718682 /nfs/dbraw/zinc/71/86/82/1046718682.db2.gz GOFJVXJQUXJNHF-AWEZNQCLSA-N 2 1 324.896 4.182 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(C)c(OC)c(Cl)c2)C1 ZINC000796703052 1046719961 /nfs/dbraw/zinc/71/99/61/1046719961.db2.gz QBQKYHCRPUCFMQ-GJZGRUSLSA-N 2 1 324.896 4.040 20 0 DIADMP CCCCC[C@@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)C(C)(C)C ZINC000796307229 1046872241 /nfs/dbraw/zinc/87/22/41/1046872241.db2.gz IBSZZTKUPOPCBY-OAHLLOKOSA-N 2 1 311.539 4.289 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+]C(C2CCCC2)C2CCCC2)s1 ZINC000796313494 1046887745 /nfs/dbraw/zinc/88/77/45/1046887745.db2.gz ZIYUHFVBONZQIN-UHFFFAOYSA-N 2 1 321.534 4.043 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)o1 ZINC000067668271 1046891965 /nfs/dbraw/zinc/89/19/65/1046891965.db2.gz YKCUGXXLZHYTMF-MRXNPFEDSA-N 2 1 312.457 4.252 20 0 DIADMP c1oc2ccccc2c1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001140786088 1046898983 /nfs/dbraw/zinc/89/89/83/1046898983.db2.gz YCHJKWLBXUVGKC-GOSISDBHSA-N 2 1 312.457 4.273 20 0 DIADMP CC(C)[N@@H+](CCCc1ccccc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206581534 1046902675 /nfs/dbraw/zinc/90/26/75/1046902675.db2.gz JXBXYQSXLOFYLX-QGZVFWFLSA-N 2 1 308.897 4.125 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1F ZINC000679773142 1046904238 /nfs/dbraw/zinc/90/42/38/1046904238.db2.gz RCEKCKBTQNEPOI-DAYGRLMNSA-N 2 1 324.871 4.393 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1F ZINC000679773142 1046904249 /nfs/dbraw/zinc/90/42/49/1046904249.db2.gz RCEKCKBTQNEPOI-DAYGRLMNSA-N 2 1 324.871 4.393 20 0 DIADMP Fc1ccccc1C1CC[NH+](Cc2c[nH]c3cc[nH+]cc23)CC1 ZINC001140803389 1046907386 /nfs/dbraw/zinc/90/73/86/1046907386.db2.gz PIBPWQWGDQLHCV-UHFFFAOYSA-N 2 1 309.388 4.082 20 0 DIADMP Clc1cccc([C@H]2CC[N@H+](Cc3c[nH]c4cc[nH+]cc34)C2)c1 ZINC001140805071 1046908066 /nfs/dbraw/zinc/90/80/66/1046908066.db2.gz QIJCELYOMBFKAG-AWEZNQCLSA-N 2 1 311.816 4.206 20 0 DIADMP Clc1cccc([C@H]2CC[N@@H+](Cc3c[nH]c4cc[nH+]cc34)C2)c1 ZINC001140805071 1046908070 /nfs/dbraw/zinc/90/80/70/1046908070.db2.gz QIJCELYOMBFKAG-AWEZNQCLSA-N 2 1 311.816 4.206 20 0 DIADMP C[N@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1ccc(C(F)(F)F)cc1 ZINC001140805120 1046908737 /nfs/dbraw/zinc/90/87/37/1046908737.db2.gz SLKVRWXUYAODSK-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP C[N@@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1ccc(C(F)(F)F)cc1 ZINC001140805120 1046908752 /nfs/dbraw/zinc/90/87/52/1046908752.db2.gz SLKVRWXUYAODSK-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccccc1SC(C)(C)C ZINC000798183806 1046934790 /nfs/dbraw/zinc/93/47/90/1046934790.db2.gz TWRLCCCXDPCQEA-CQSZACIVSA-N 2 1 317.502 4.204 20 0 DIADMP CSc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000647282973 1046966444 /nfs/dbraw/zinc/96/64/44/1046966444.db2.gz BXVQZTATCNRMOV-FRQCXROJSA-N 2 1 316.514 4.002 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccncc1 ZINC000647294676 1046969985 /nfs/dbraw/zinc/96/99/85/1046969985.db2.gz KIDBLFYMYDKMMJ-UYAOXDASSA-N 2 1 317.521 4.126 20 0 DIADMP C[C@@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)CC(F)F ZINC000647319276 1046976945 /nfs/dbraw/zinc/97/69/45/1046976945.db2.gz UVGTYNRDTNIEOY-FAEJEUNOSA-N 2 1 324.459 4.311 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(F)c1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000680401116 1046978800 /nfs/dbraw/zinc/97/88/00/1046978800.db2.gz DGWJEMGFJAPTGG-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(F)c1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000680401116 1046978813 /nfs/dbraw/zinc/97/88/13/1046978813.db2.gz DGWJEMGFJAPTGG-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000647344626 1046985205 /nfs/dbraw/zinc/98/52/05/1046985205.db2.gz VTWBAUWJHWHVMD-HXHBTQRASA-N 2 1 322.496 4.114 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCC(F)CC1 ZINC000647349368 1046989290 /nfs/dbraw/zinc/98/92/90/1046989290.db2.gz MHNJLIYNACLQAW-CLPROHDKSA-N 2 1 318.480 4.015 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCC(F)CC1 ZINC000647349369 1046989482 /nfs/dbraw/zinc/98/94/82/1046989482.db2.gz MHNJLIYNACLQAW-KTLDDFEXSA-N 2 1 318.480 4.015 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](CCCc3ccccc3Cl)C2)CC1 ZINC000799178571 1047008957 /nfs/dbraw/zinc/00/89/57/1047008957.db2.gz VNEBZAFKMLNYAQ-UHFFFAOYSA-N 2 1 320.908 4.080 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799177104 1047009308 /nfs/dbraw/zinc/00/93/08/1047009308.db2.gz LDCJKAFCDUJNMY-GOSISDBHSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccs1 ZINC000379624684 1047082311 /nfs/dbraw/zinc/08/23/11/1047082311.db2.gz JPYCVHBPRMTJKU-BQFCYCMXSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccs1 ZINC000379624684 1047082324 /nfs/dbraw/zinc/08/23/24/1047082324.db2.gz JPYCVHBPRMTJKU-BQFCYCMXSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccs1 ZINC000379624687 1047082439 /nfs/dbraw/zinc/08/24/39/1047082439.db2.gz JPYCVHBPRMTJKU-SOLBZPMBSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccs1 ZINC000379624687 1047082458 /nfs/dbraw/zinc/08/24/58/1047082458.db2.gz JPYCVHBPRMTJKU-SOLBZPMBSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536724770 1047088305 /nfs/dbraw/zinc/08/83/05/1047088305.db2.gz SRDJEMYDODSDCM-GOSISDBHSA-N 2 1 323.484 4.381 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379646899 1047091229 /nfs/dbraw/zinc/09/12/29/1047091229.db2.gz JQRIKUFUDAJGET-WIYYLYMNSA-N 2 1 308.469 4.138 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379646899 1047091245 /nfs/dbraw/zinc/09/12/45/1047091245.db2.gz JQRIKUFUDAJGET-WIYYLYMNSA-N 2 1 308.469 4.138 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379644487 1047091493 /nfs/dbraw/zinc/09/14/93/1047091493.db2.gz CIYIMEKMYMOVCX-QRQLOZEOSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000379644487 1047091507 /nfs/dbraw/zinc/09/15/07/1047091507.db2.gz CIYIMEKMYMOVCX-QRQLOZEOSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379644481 1047092034 /nfs/dbraw/zinc/09/20/34/1047092034.db2.gz CIYIMEKMYMOVCX-BHIYHBOVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000379644481 1047092052 /nfs/dbraw/zinc/09/20/52/1047092052.db2.gz CIYIMEKMYMOVCX-BHIYHBOVSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CCCC1 ZINC000379654476 1047093534 /nfs/dbraw/zinc/09/35/34/1047093534.db2.gz IPWACZFBMFWBCO-FUHIMQAGSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CCCC1 ZINC000379654476 1047093548 /nfs/dbraw/zinc/09/35/48/1047093548.db2.gz IPWACZFBMFWBCO-FUHIMQAGSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379657110 1047096957 /nfs/dbraw/zinc/09/69/57/1047096957.db2.gz RSUASWGEEWRONX-AGHHOFFYSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000379657110 1047096971 /nfs/dbraw/zinc/09/69/71/1047096971.db2.gz RSUASWGEEWRONX-AGHHOFFYSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657512 1047097789 /nfs/dbraw/zinc/09/77/89/1047097789.db2.gz TUMSJRMAXGHLMA-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657512 1047097803 /nfs/dbraw/zinc/09/78/03/1047097803.db2.gz TUMSJRMAXGHLMA-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc2c(s1)CCCC2 ZINC000536864485 1047115413 /nfs/dbraw/zinc/11/54/13/1047115413.db2.gz NWZVAONBOVQIFK-KGLIPLIRSA-N 2 1 317.502 4.119 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)CCCc2ccccc2)CC[N@H+]1C ZINC000536875741 1047118141 /nfs/dbraw/zinc/11/81/41/1047118141.db2.gz JVKHZHAXUXCRMD-IEBWSBKVSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CCCc2ccccc2)CC[N@H+]1C ZINC000536875743 1047118324 /nfs/dbraw/zinc/11/83/24/1047118324.db2.gz JVKHZHAXUXCRMD-MJGOQNOKSA-N 2 1 302.506 4.108 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2ccc(CC[NH+](C)C)cc2)cc1 ZINC001212970893 1047126972 /nfs/dbraw/zinc/12/69/72/1047126972.db2.gz PCDSQCLDXLWRPE-UHFFFAOYSA-N 2 1 311.473 4.381 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000537015890 1047131736 /nfs/dbraw/zinc/13/17/36/1047131736.db2.gz ORQNKDZKFOPIBH-DJJJIMSYSA-N 2 1 315.436 4.016 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC)C2)cc1 ZINC001116387293 1047135510 /nfs/dbraw/zinc/13/55/10/1047135510.db2.gz DVCTYMQGVKUUAR-HZPDHXFCSA-N 2 1 306.519 4.181 20 0 DIADMP CC[C@@H](C)[C@@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000537113192 1047140542 /nfs/dbraw/zinc/14/05/42/1047140542.db2.gz BQRDUVCDXUGHNQ-CXAGYDPISA-N 2 1 305.853 4.222 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCc2ccccc21 ZINC000682068987 1047167813 /nfs/dbraw/zinc/16/78/13/1047167813.db2.gz BIQPSGOEALLWSS-UGKGYDQZSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCc2ccccc21 ZINC000682068987 1047167820 /nfs/dbraw/zinc/16/78/20/1047167820.db2.gz BIQPSGOEALLWSS-UGKGYDQZSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCc2ccccc21 ZINC000682068987 1047167827 /nfs/dbraw/zinc/16/78/27/1047167827.db2.gz BIQPSGOEALLWSS-UGKGYDQZSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCSC(C)(C)C ZINC000398178831 1047327663 /nfs/dbraw/zinc/32/76/63/1047327663.db2.gz WMXISQJNVYVDFB-WMZOPIPTSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC000652204776 1047346453 /nfs/dbraw/zinc/34/64/53/1047346453.db2.gz BTENAESUJNSTES-XVLXNVKGSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H](c2cccnc2)C2CCCCC2)C1 ZINC000652208758 1047346585 /nfs/dbraw/zinc/34/65/85/1047346585.db2.gz OHCBVOISXFUNIN-FXAWDEMLSA-N 2 1 315.505 4.025 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H](c1cccnc1)C1CCCCC1)C1CC1 ZINC000652207841 1047347000 /nfs/dbraw/zinc/34/70/00/1047347000.db2.gz VBUJBBOOCMZNJH-HXUWFJFHSA-N 2 1 315.505 4.167 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000108428246 1047400010 /nfs/dbraw/zinc/40/00/10/1047400010.db2.gz HUJQKYKGZGZQBD-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000108428246 1047400015 /nfs/dbraw/zinc/40/00/15/1047400015.db2.gz HUJQKYKGZGZQBD-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2)cc1 ZINC000086279404 1047440592 /nfs/dbraw/zinc/44/05/92/1047440592.db2.gz OPEMPHSYAUUVCU-INIZCTEOSA-N 2 1 305.425 4.340 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001168322976 1047445866 /nfs/dbraw/zinc/44/58/66/1047445866.db2.gz LAZGJINKLNVGER-LADRWXRNSA-N 2 1 304.453 4.226 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000537618161 1047456882 /nfs/dbraw/zinc/45/68/82/1047456882.db2.gz OXBUZESXVQAPGE-UWJYYQICSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000537618161 1047456888 /nfs/dbraw/zinc/45/68/88/1047456888.db2.gz OXBUZESXVQAPGE-UWJYYQICSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618161 1047456893 /nfs/dbraw/zinc/45/68/93/1047456893.db2.gz OXBUZESXVQAPGE-UWJYYQICSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618161 1047456896 /nfs/dbraw/zinc/45/68/96/1047456896.db2.gz OXBUZESXVQAPGE-UWJYYQICSA-N 2 1 308.469 4.268 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC001168329860 1047469024 /nfs/dbraw/zinc/46/90/24/1047469024.db2.gz JQFIUHKGFACHHR-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CCCO2 ZINC000089513098 1047484433 /nfs/dbraw/zinc/48/44/33/1047484433.db2.gz JOOMCACHROOMSU-SFHVURJKSA-N 2 1 316.489 4.061 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC000121224168 1047514617 /nfs/dbraw/zinc/51/46/17/1047514617.db2.gz VTCVFZRTGNJERZ-OALUTQOASA-N 2 1 322.496 4.138 20 0 DIADMP C[C@H](c1ccc(Cl)cc1Cl)[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843363915 1047543394 /nfs/dbraw/zinc/54/33/94/1047543394.db2.gz UUQMTSYPVYSPSK-GFCCVEGCSA-N 2 1 313.272 4.130 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(C(F)F)cc2)CC1 ZINC001143251454 1047544776 /nfs/dbraw/zinc/54/47/76/1047544776.db2.gz SGNIQDHNWVEGFN-UHFFFAOYSA-N 2 1 310.432 4.176 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cccc(-c3ccccc3)c2)C1 ZINC000537649370 1047561973 /nfs/dbraw/zinc/56/19/73/1047561973.db2.gz JIYGKLNZVAXPEG-LJQANCHMSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC000537649370 1047561976 /nfs/dbraw/zinc/56/19/76/1047561976.db2.gz JIYGKLNZVAXPEG-LJQANCHMSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC000537649370 1047561981 /nfs/dbraw/zinc/56/19/81/1047561981.db2.gz JIYGKLNZVAXPEG-LJQANCHMSA-N 2 1 308.469 4.127 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCCC[C@@H](C[NH3+])C3)cc2)c1 ZINC001206632027 1047568604 /nfs/dbraw/zinc/56/86/04/1047568604.db2.gz DWBLXHQCPRFOHG-IBGZPJMESA-N 2 1 308.469 4.223 20 0 DIADMP C[C@@H](c1cccnc1)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000476976283 1047586754 /nfs/dbraw/zinc/58/67/54/1047586754.db2.gz WANXZWBVWHCHKX-ROUUACIJSA-N 2 1 315.505 4.119 20 0 DIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000477016923 1047589166 /nfs/dbraw/zinc/58/91/66/1047589166.db2.gz BTNNOOARTXHZEE-UHFFFAOYSA-N 2 1 320.440 4.213 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)CC(C)(C)c2ccccc2)C1 ZINC000314961580 1047592011 /nfs/dbraw/zinc/59/20/11/1047592011.db2.gz UWAFAHHRZDUCQX-QZTJIDSGSA-N 2 1 302.506 4.063 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(F)c(-c3ccccc3)c2)C1 ZINC001206648607 1047630310 /nfs/dbraw/zinc/63/03/10/1047630310.db2.gz NHVWYCWONLEXHZ-QGZVFWFLSA-N 2 1 312.432 4.054 20 0 DIADMP CC[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000537940632 1047644731 /nfs/dbraw/zinc/64/47/31/1047644731.db2.gz RAAIDAVFKVOBMW-QRFRQXIXSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000050337928 1047649044 /nfs/dbraw/zinc/64/90/44/1047649044.db2.gz WRPIPLATZXIPMS-HNNXBMFYSA-N 2 1 300.471 4.063 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)Cc2ccsc2)c1 ZINC000537971767 1047651501 /nfs/dbraw/zinc/65/15/01/1047651501.db2.gz GMONYVAWIIFWJB-MRXNPFEDSA-N 2 1 316.514 4.309 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000538099166 1047657678 /nfs/dbraw/zinc/65/76/78/1047657678.db2.gz RUJVHEQRXXGMBJ-PXNSSMCTSA-N 2 1 300.490 4.156 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1cccc(Cl)c1)C1CCCC1 ZINC000538223888 1047663867 /nfs/dbraw/zinc/66/38/67/1047663867.db2.gz YQTNLQDGQUMZGU-SFHVURJKSA-N 2 1 317.864 4.366 20 0 DIADMP CC(C)CCOc1ccc([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000538406272 1047672333 /nfs/dbraw/zinc/67/23/33/1047672333.db2.gz XOHDTOGMJNUMCX-KRWDZBQOSA-N 2 1 316.489 4.024 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000538405676 1047672988 /nfs/dbraw/zinc/67/29/88/1047672988.db2.gz AQWDACRNFRJVDP-KRWDZBQOSA-N 2 1 322.452 4.391 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2cccs2)cc1 ZINC000538405675 1047673054 /nfs/dbraw/zinc/67/30/54/1047673054.db2.gz AFYCAQMFRFRDAQ-OAHLLOKOSA-N 2 1 312.482 4.328 20 0 DIADMP CC(C)(C)C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1 ZINC000538398079 1047675088 /nfs/dbraw/zinc/67/50/88/1047675088.db2.gz DDRWCGPBTQQQDV-HNAYVOBHSA-N 2 1 318.480 4.377 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(F)c1F ZINC000538453656 1047679653 /nfs/dbraw/zinc/67/96/53/1047679653.db2.gz BBWCRXIFBNLOLJ-CABCVRRESA-N 2 1 310.432 4.128 20 0 DIADMP C[C@H]1C[C@@H](N(C)Cc2ccc(-c3ccccc3F)o2)CC[N@H+]1C ZINC000538720079 1047699846 /nfs/dbraw/zinc/69/98/46/1047699846.db2.gz FEJSJXRGJISVDD-GJZGRUSLSA-N 2 1 316.420 4.000 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720079 1047699848 /nfs/dbraw/zinc/69/98/48/1047699848.db2.gz FEJSJXRGJISVDD-GJZGRUSLSA-N 2 1 316.420 4.000 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720079 1047699852 /nfs/dbraw/zinc/69/98/52/1047699852.db2.gz FEJSJXRGJISVDD-GJZGRUSLSA-N 2 1 316.420 4.000 20 0 DIADMP C[C@H]1C[C@H](N(C)Cc2ccc(-c3ccccc3F)o2)CC[N@H+]1C ZINC000538720081 1047699890 /nfs/dbraw/zinc/69/98/90/1047699890.db2.gz FEJSJXRGJISVDD-LSDHHAIUSA-N 2 1 316.420 4.000 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720081 1047699896 /nfs/dbraw/zinc/69/98/96/1047699896.db2.gz FEJSJXRGJISVDD-LSDHHAIUSA-N 2 1 316.420 4.000 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720081 1047699909 /nfs/dbraw/zinc/69/99/09/1047699909.db2.gz FEJSJXRGJISVDD-LSDHHAIUSA-N 2 1 316.420 4.000 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(OCC(C)C)cc2)C[C@H]1C ZINC000538738357 1047704479 /nfs/dbraw/zinc/70/44/79/1047704479.db2.gz QAKSICCJYWJIOG-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(OCC(C)C)cc2)C[C@H]1C ZINC000538738357 1047704486 /nfs/dbraw/zinc/70/44/86/1047704486.db2.gz QAKSICCJYWJIOG-MJGOQNOKSA-N 2 1 318.505 4.026 20 0 DIADMP Cc1ccc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)[nH+]c1C ZINC001156315958 1047707767 /nfs/dbraw/zinc/70/77/67/1047707767.db2.gz DJNQVXHEXYDHOH-XUVXKRRUSA-N 2 1 321.468 4.021 20 0 DIADMP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCCn1cc[nH+]c1C ZINC000538781409 1047709952 /nfs/dbraw/zinc/70/99/52/1047709952.db2.gz ACAYHWITSQFGRV-PMACEKPBSA-N 2 1 311.473 4.240 20 0 DIADMP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCCn1cc[nH+]c1C ZINC000538781409 1047709956 /nfs/dbraw/zinc/70/99/56/1047709956.db2.gz ACAYHWITSQFGRV-PMACEKPBSA-N 2 1 311.473 4.240 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)CCC2 ZINC000539046042 1047732124 /nfs/dbraw/zinc/73/21/24/1047732124.db2.gz GAKJEVVANMSAKE-BPAFIMBUSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)CCC2 ZINC000539046042 1047732128 /nfs/dbraw/zinc/73/21/28/1047732128.db2.gz GAKJEVVANMSAKE-BPAFIMBUSA-N 2 1 300.490 4.260 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CCN(C(C)C)CC2)C2CCCC2)o1 ZINC000539394823 1047750702 /nfs/dbraw/zinc/75/07/02/1047750702.db2.gz WLZSTTDCHSMUIO-IBGZPJMESA-N 2 1 304.478 4.282 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+](C(C)C)CC2)C2CCCC2)o1 ZINC000539394823 1047750708 /nfs/dbraw/zinc/75/07/08/1047750708.db2.gz WLZSTTDCHSMUIO-IBGZPJMESA-N 2 1 304.478 4.282 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc2ccccc2n1 ZINC000477919640 1047759691 /nfs/dbraw/zinc/75/96/91/1047759691.db2.gz SODJLIQLPYKLOK-INIZCTEOSA-N 2 1 311.473 4.007 20 0 DIADMP Fc1ccccc1[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CCC1 ZINC001168360486 1047763100 /nfs/dbraw/zinc/76/31/00/1047763100.db2.gz QXYZJXFASIFRQI-HXUWFJFHSA-N 2 1 316.464 4.131 20 0 DIADMP Cc1ccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[nH+]c1C ZINC001159294444 1047827211 /nfs/dbraw/zinc/82/72/11/1047827211.db2.gz UIQHVXFYXABIHS-OWZKRDHZSA-N 2 1 321.468 4.306 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(Nc2ccc([C@H]3CCC[NH2+]3)cc2)cc1 ZINC001159511144 1047857452 /nfs/dbraw/zinc/85/74/52/1047857452.db2.gz ZLKNYXCEHMPHOM-HXUWFJFHSA-N 2 1 318.424 4.349 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](Cc2ccc(C3CCC3)cc2)CC1 ZINC001183196657 1047904304 /nfs/dbraw/zinc/90/43/04/1047904304.db2.gz FMIVKJJIOVMFFH-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cccc3ccoc32)CC1 ZINC001183239017 1047906254 /nfs/dbraw/zinc/90/62/54/1047906254.db2.gz RRKGEXSZBQAZGU-UHFFFAOYSA-N 2 1 312.457 4.273 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(F)c(F)c1 ZINC000479528522 1047915114 /nfs/dbraw/zinc/91/51/14/1047915114.db2.gz PHLDQCXIMNPUGB-RJYAGPCLSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(F)c(F)c1 ZINC000479528522 1047915123 /nfs/dbraw/zinc/91/51/23/1047915123.db2.gz PHLDQCXIMNPUGB-RJYAGPCLSA-N 2 1 322.443 4.268 20 0 DIADMP CC[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(Cl)cc1 ZINC000479523854 1047915707 /nfs/dbraw/zinc/91/57/07/1047915707.db2.gz AGMURELJIPNNSI-ABHNRTSZSA-N 2 1 306.881 4.398 20 0 DIADMP CCC[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(OC)cc1 ZINC000479520373 1047919856 /nfs/dbraw/zinc/91/98/56/1047919856.db2.gz ZSAYQBFQHGGXEV-QLOJAFMTSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000479537146 1047921168 /nfs/dbraw/zinc/92/11/68/1047921168.db2.gz GMFJSSXBYKLPHX-LELZANKISA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc2c(c1)CCCC2 ZINC000479538443 1047921997 /nfs/dbraw/zinc/92/19/97/1047921997.db2.gz BWGYJPSSFSWPCO-YMTQGWHGSA-N 2 1 312.501 4.233 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001183378720 1047925823 /nfs/dbraw/zinc/92/58/23/1047925823.db2.gz ATXPOVCAKHXJNY-OXQOHEQNSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001183378720 1047925830 /nfs/dbraw/zinc/92/58/30/1047925830.db2.gz ATXPOVCAKHXJNY-OXQOHEQNSA-N 2 1 318.480 4.143 20 0 DIADMP CC[C@@H](C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1)c1ccccc1 ZINC001183464655 1047931266 /nfs/dbraw/zinc/93/12/66/1047931266.db2.gz VQXCJNLULNFJFY-FQEVSTJZSA-N 2 1 316.533 4.480 20 0 DIADMP Cc1cc(Nc2ccc3c(c2)C[N@H+](Cc2ccccc2)C3)cc[nH+]1 ZINC001174655938 1047937687 /nfs/dbraw/zinc/93/76/87/1047937687.db2.gz XVWXCVHYAZZUQY-UHFFFAOYSA-N 2 1 315.420 4.071 20 0 DIADMP c1ccc(O[C@@H]2CCC[NH2+]C2)c(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001160233619 1048006694 /nfs/dbraw/zinc/00/66/94/1048006694.db2.gz RAZAEDNZIHWIBT-GOSISDBHSA-N 2 1 319.408 4.109 20 0 DIADMP CC[NH+]1CCC(C[N@@H+]2CC=C(c3cccc(C)c3C)CC2)CC1 ZINC001184250683 1048017987 /nfs/dbraw/zinc/01/79/87/1048017987.db2.gz HPODWQKWYUGBJE-UHFFFAOYSA-N 2 1 312.501 4.124 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@@H]2C1 ZINC001184304044 1048021849 /nfs/dbraw/zinc/02/18/49/1048021849.db2.gz UTSANQYYJUXGQY-GVDBMIGSSA-N 2 1 320.908 4.065 20 0 DIADMP CC1(C)C[NH2+]Cc2cc(Nc3cccc4cc[nH+]cc43)ccc21 ZINC001160284548 1048023593 /nfs/dbraw/zinc/02/35/93/1048023593.db2.gz CJAIYAVGHGAAHN-UHFFFAOYSA-N 2 1 303.409 4.359 20 0 DIADMP COc1ccc(Cl)cc1[C@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000480036207 1048029896 /nfs/dbraw/zinc/02/98/96/1048029896.db2.gz DGCIGFRCMKXHMM-LBPRGKRZSA-N 2 1 324.896 4.308 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+]C[C@@]1(C)CCCCO1)c1ccccc1 ZINC001184340361 1048031201 /nfs/dbraw/zinc/03/12/01/1048031201.db2.gz VWARQNLNWREFIU-VQTJNVASSA-N 2 1 318.505 4.008 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205296693 1048036448 /nfs/dbraw/zinc/03/64/48/1048036448.db2.gz SNMAEKVYMGHHEW-HNNXBMFYSA-N 2 1 301.261 4.005 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205296693 1048036459 /nfs/dbraw/zinc/03/64/59/1048036459.db2.gz SNMAEKVYMGHHEW-HNNXBMFYSA-N 2 1 301.261 4.005 20 0 DIADMP CC[C@H](C[NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccccc1 ZINC001199238897 1048047836 /nfs/dbraw/zinc/04/78/36/1048047836.db2.gz VVYNEDYTYREDSU-LJQANCHMSA-N 2 1 322.496 4.218 20 0 DIADMP CC[C@H](C[NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccccc1 ZINC001199238897 1048047851 /nfs/dbraw/zinc/04/78/51/1048047851.db2.gz VVYNEDYTYREDSU-LJQANCHMSA-N 2 1 322.496 4.218 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc(Cl)cs2)C1 ZINC001199320707 1048056648 /nfs/dbraw/zinc/05/66/48/1048056648.db2.gz PXCFORQIQYGACX-OKILXGFUSA-N 2 1 314.926 4.249 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@@H+]1CCC[C@@H](C)C1 ZINC000480226196 1048097831 /nfs/dbraw/zinc/09/78/31/1048097831.db2.gz LMRAHOLMTXCBRM-KGLIPLIRSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000480226196 1048097839 /nfs/dbraw/zinc/09/78/39/1048097839.db2.gz LMRAHOLMTXCBRM-KGLIPLIRSA-N 2 1 308.432 4.208 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001199329586 1048058827 /nfs/dbraw/zinc/05/88/27/1048058827.db2.gz WMXDLDWRDUSDNF-HOTGVXAUSA-N 2 1 314.473 4.199 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](CC)c2cc(Cl)ccc2OC)CC1 ZINC000480139223 1048063646 /nfs/dbraw/zinc/06/36/46/1048063646.db2.gz OEFAJSPWBPTPDV-QGZVFWFLSA-N 2 1 324.896 4.264 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000554348390 1048074948 /nfs/dbraw/zinc/07/49/48/1048074948.db2.gz ATEAXITYRFTVNG-MOPGFXCFSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)CCCC(F)(F)F)c1 ZINC000480210029 1048093111 /nfs/dbraw/zinc/09/31/11/1048093111.db2.gz PIYOCYMNTSDDCW-CQSZACIVSA-N 2 1 316.411 4.349 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480239318 1048102425 /nfs/dbraw/zinc/10/24/25/1048102425.db2.gz DYEWXQXWFZJRRY-XHSDSOJGSA-N 2 1 322.459 4.455 20 0 DIADMP C[C@@H](NCc1ccsc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000480275588 1048108450 /nfs/dbraw/zinc/10/84/50/1048108450.db2.gz RWVFEIKQGIZJJV-OCCSQVGLSA-N 2 1 312.910 4.144 20 0 DIADMP CC(C)(C)C[NH+]1CCC([NH2+]C(C)(C)c2ccnc(Cl)c2)CC1 ZINC001161212514 1048115691 /nfs/dbraw/zinc/11/56/91/1048115691.db2.gz MBPSVKQAKLJDTI-UHFFFAOYSA-N 2 1 323.912 4.070 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2cnc(C)n2C)o1 ZINC000667658065 1048119289 /nfs/dbraw/zinc/11/92/89/1048119289.db2.gz YQEYEPOGHULCLL-KRWDZBQOSA-N 2 1 301.434 4.001 20 0 DIADMP CCc1ccc([C@@H]2CCCCCN2Cc2cnc(C)n2C)o1 ZINC000667658065 1048119296 /nfs/dbraw/zinc/11/92/96/1048119296.db2.gz YQEYEPOGHULCLL-KRWDZBQOSA-N 2 1 301.434 4.001 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)ccc1F ZINC000480613772 1048192138 /nfs/dbraw/zinc/19/21/38/1048192138.db2.gz QBDRMEIQVZKRLW-LSDHHAIUSA-N 2 1 310.432 4.270 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1F ZINC000480611145 1048192443 /nfs/dbraw/zinc/19/24/43/1048192443.db2.gz KEPAVDHLWMVUGO-LSDHHAIUSA-N 2 1 310.432 4.128 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000554819889 1048196417 /nfs/dbraw/zinc/19/64/17/1048196417.db2.gz JTTKSBZPUWFTAZ-GOSISDBHSA-N 2 1 308.469 4.050 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000554819889 1048196423 /nfs/dbraw/zinc/19/64/23/1048196423.db2.gz JTTKSBZPUWFTAZ-GOSISDBHSA-N 2 1 308.469 4.050 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000554819889 1048196431 /nfs/dbraw/zinc/19/64/31/1048196431.db2.gz JTTKSBZPUWFTAZ-GOSISDBHSA-N 2 1 308.469 4.050 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)c2ccccc12 ZINC000480633698 1048201371 /nfs/dbraw/zinc/20/13/71/1048201371.db2.gz YNTSJNIQDNVAMG-CWFSZBLJSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)c2ccccc12 ZINC000480633698 1048201379 /nfs/dbraw/zinc/20/13/79/1048201379.db2.gz YNTSJNIQDNVAMG-CWFSZBLJSA-N 2 1 324.468 4.126 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1cccc2F ZINC000480635034 1048202578 /nfs/dbraw/zinc/20/25/78/1048202578.db2.gz VJLRKOOKYQEMBK-DNVCBOLYSA-N 2 1 304.453 4.057 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)oc2cc1C ZINC000480738099 1048230530 /nfs/dbraw/zinc/23/05/30/1048230530.db2.gz JOAFZSXLJSETHK-CGTJXYLNSA-N 2 1 312.457 4.327 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)oc2cc1C ZINC000480738099 1048230534 /nfs/dbraw/zinc/23/05/34/1048230534.db2.gz JOAFZSXLJSETHK-CGTJXYLNSA-N 2 1 312.457 4.327 20 0 DIADMP c1cc(C[N@@H+]2CCC3(C2)CC[NH+](CC2CCCCC2)CC3)co1 ZINC001201393712 1048248567 /nfs/dbraw/zinc/24/85/67/1048248567.db2.gz MDEKVWQKGZYOCC-UHFFFAOYSA-N 2 1 316.489 4.148 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001201417731 1048260812 /nfs/dbraw/zinc/26/08/12/1048260812.db2.gz IMZGLDRQBDDRKI-LJQANCHMSA-N 2 1 312.501 4.329 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+](C[C@@H]4CC=CCC4)C3)CC2)cc1 ZINC001201416933 1048261958 /nfs/dbraw/zinc/26/19/58/1048261958.db2.gz CPKPQGFHJDGACO-OAQYLSRUSA-N 2 1 324.512 4.331 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CC(C)(C)C)C[C@@H]21 ZINC001201435924 1048272333 /nfs/dbraw/zinc/27/23/33/1048272333.db2.gz YLAFHGVHNBFSDL-BPQIPLTHSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CC(C)(C)C)C[C@@H]21 ZINC001201435924 1048272351 /nfs/dbraw/zinc/27/23/51/1048272351.db2.gz YLAFHGVHNBFSDL-BPQIPLTHSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](CC(C)(C)C)C[C@@H]21 ZINC001201435924 1048272360 /nfs/dbraw/zinc/27/23/60/1048272360.db2.gz YLAFHGVHNBFSDL-BPQIPLTHSA-N 2 1 320.546 4.327 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)Cc2cccc(Cl)c2)CC1(C)C ZINC001201442056 1048275069 /nfs/dbraw/zinc/27/50/69/1048275069.db2.gz GPOOZKBTMKMLFR-QGZVFWFLSA-N 2 1 322.924 4.371 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450729 1048277956 /nfs/dbraw/zinc/27/79/56/1048277956.db2.gz ZSVGWJLVVLSAMA-AQNXPRMDSA-N 2 1 312.501 4.352 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450729 1048277966 /nfs/dbraw/zinc/27/79/66/1048277966.db2.gz ZSVGWJLVVLSAMA-AQNXPRMDSA-N 2 1 312.501 4.352 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)C1 ZINC000481035352 1048297937 /nfs/dbraw/zinc/29/79/37/1048297937.db2.gz KTZQABQVVXOHTP-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC000481045781 1048298993 /nfs/dbraw/zinc/29/89/93/1048298993.db2.gz GTDNOOUHBDPBCV-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP CCC(CC)C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001201534709 1048299413 /nfs/dbraw/zinc/29/94/13/1048299413.db2.gz OUVKKTYXCOFYDE-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001201534709 1048299425 /nfs/dbraw/zinc/29/94/25/1048299425.db2.gz OUVKKTYXCOFYDE-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201541183 1048300681 /nfs/dbraw/zinc/30/06/81/1048300681.db2.gz DFFAWXUSRJPJCD-MJGOQNOKSA-N 2 1 318.505 4.392 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC000481042446 1048300965 /nfs/dbraw/zinc/30/09/65/1048300965.db2.gz QVXGIZWCXCDEEK-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC000481042446 1048300978 /nfs/dbraw/zinc/30/09/78/1048300978.db2.gz QVXGIZWCXCDEEK-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC([N@H+](C)Cc2cccc(F)c2)CC1 ZINC001201554105 1048306718 /nfs/dbraw/zinc/30/67/18/1048306718.db2.gz UVKZVTASILAWBM-MRXNPFEDSA-N 2 1 306.469 4.158 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001201554105 1048306727 /nfs/dbraw/zinc/30/67/27/1048306727.db2.gz UVKZVTASILAWBM-MRXNPFEDSA-N 2 1 306.469 4.158 20 0 DIADMP CCC(CC)C[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201525965 1048310479 /nfs/dbraw/zinc/31/04/79/1048310479.db2.gz MPHBQXLXHFEWAZ-LJQANCHMSA-N 2 1 318.505 4.392 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001205922832 1048310961 /nfs/dbraw/zinc/31/09/61/1048310961.db2.gz BLILRRIWGBGLGW-RYUDHWBXSA-N 2 1 308.878 4.114 20 0 DIADMP CC[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1 ZINC001201559500 1048316300 /nfs/dbraw/zinc/31/63/00/1048316300.db2.gz ZCSISKNWKXPTBZ-MOPGFXCFSA-N 2 1 302.506 4.138 20 0 DIADMP CC[C@H](C[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1 ZINC001201559503 1048318143 /nfs/dbraw/zinc/31/81/43/1048318143.db2.gz ZCSISKNWKXPTBZ-RTBURBONSA-N 2 1 302.506 4.138 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC[N@H+]1C ZINC000481178446 1048320478 /nfs/dbraw/zinc/32/04/78/1048320478.db2.gz GJRYOGBMOUEISM-VQIMIIECSA-N 2 1 318.480 4.100 20 0 DIADMP C[N@@H+](CCc1ccccc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001201603043 1048329736 /nfs/dbraw/zinc/32/97/36/1048329736.db2.gz AZCJCPIFRGNZGM-UHFFFAOYSA-N 2 1 322.496 4.073 20 0 DIADMP c1ccc(C[N@@H+]2CC=C(Nc3cc[nH+]c(C4CC4)c3)CC2)cc1 ZINC001175505414 1048340151 /nfs/dbraw/zinc/34/01/51/1048340151.db2.gz PJLZCNAKIMKALL-UHFFFAOYSA-N 2 1 305.425 4.161 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(-c3ccccc3)c2)C1 ZINC000481296746 1048355326 /nfs/dbraw/zinc/35/53/26/1048355326.db2.gz URAVNERIUWYVDY-QZTJIDSGSA-N 2 1 308.469 4.346 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3cccs3)cc2)C1 ZINC000481305069 1048359374 /nfs/dbraw/zinc/35/93/74/1048359374.db2.gz JZFMJXADGATFQX-JKSUJKDBSA-N 2 1 314.498 4.408 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)C1 ZINC000481324279 1048366862 /nfs/dbraw/zinc/36/68/62/1048366862.db2.gz YATOKPFQGBZMBE-UNMCSNQZSA-N 2 1 322.496 4.292 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3cccc(F)c3)CCCCC2)CC[N@H+]1C ZINC000481539970 1048428536 /nfs/dbraw/zinc/42/85/36/1048428536.db2.gz FPCBNCFNVAEUPA-LPHOPBHVSA-N 2 1 318.480 4.100 20 0 DIADMP C[NH+]1CCC([N@H+](CCC(C)(C)C)Cc2ccc(F)cc2)CC1 ZINC001202114982 1048453389 /nfs/dbraw/zinc/45/33/89/1048453389.db2.gz KVKJTYKQIHFWFR-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[NH+]1CCC([N@@H+](CCC(C)(C)C)Cc2ccc(F)cc2)CC1 ZINC001202114982 1048453392 /nfs/dbraw/zinc/45/33/92/1048453392.db2.gz KVKJTYKQIHFWFR-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[N@@H+](CC1CCCC1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001202178134 1048471637 /nfs/dbraw/zinc/47/16/37/1048471637.db2.gz JAXFHTJENBFPKZ-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP Clc1oc2ccccc2c1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000629522717 1048496925 /nfs/dbraw/zinc/49/69/25/1048496925.db2.gz HCDAOVDJJOMJGO-NUEKZKHPSA-N 2 1 318.848 4.097 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccccc32)C[C@H]1c1ccccc1 ZINC000556039290 1048520146 /nfs/dbraw/zinc/52/01/46/1048520146.db2.gz UYCNXKFWFRXTDX-BVSLBCMMSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccccc32)C[C@H]1c1ccccc1 ZINC000556039290 1048520161 /nfs/dbraw/zinc/52/01/61/1048520161.db2.gz UYCNXKFWFRXTDX-BVSLBCMMSA-N 2 1 320.480 4.489 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@H]3CC[N@H+](C)C[C@@H]3C)c2)c1 ZINC000481935508 1048533990 /nfs/dbraw/zinc/53/39/90/1048533990.db2.gz YTRZFXARXLLPFB-UWJYYQICSA-N 2 1 308.469 4.092 20 0 DIADMP CCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000482357175 1048593758 /nfs/dbraw/zinc/59/37/58/1048593758.db2.gz KHDNYBPHZDXIEB-MSOLQXFVSA-N 2 1 318.505 4.246 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000482448287 1048608259 /nfs/dbraw/zinc/60/82/59/1048608259.db2.gz FSCJAPCJWSDSRQ-CTNGQTDRSA-N 2 1 322.496 4.210 20 0 DIADMP Cc1ccc2c(C)cc(N3CCC[C@@](C)(C[NH3+])CC3)[nH+]c2c1C ZINC001164247442 1048612056 /nfs/dbraw/zinc/61/20/56/1048612056.db2.gz JMUGOCLAZSSTPI-HXUWFJFHSA-N 2 1 311.473 4.115 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001176262120 1048626765 /nfs/dbraw/zinc/62/67/65/1048626765.db2.gz GYJAYEKEUZGKNG-BWAGFHJFSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001176262120 1048626771 /nfs/dbraw/zinc/62/67/71/1048626771.db2.gz GYJAYEKEUZGKNG-BWAGFHJFSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001176262120 1048626774 /nfs/dbraw/zinc/62/67/74/1048626774.db2.gz GYJAYEKEUZGKNG-BWAGFHJFSA-N 2 1 320.480 4.202 20 0 DIADMP Cc1cc[nH+]c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1C ZINC001164487828 1048634625 /nfs/dbraw/zinc/63/46/25/1048634625.db2.gz ZALPLPURTMGPJK-HSALFYBXSA-N 2 1 321.468 4.021 20 0 DIADMP Cc1ccc(C)c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)[nH+]1 ZINC001164486707 1048634818 /nfs/dbraw/zinc/63/48/18/1048634818.db2.gz QGRUDFQZQBYSLF-HSALFYBXSA-N 2 1 321.468 4.021 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000850381623 1048644287 /nfs/dbraw/zinc/64/42/87/1048644287.db2.gz HUXKJJCVSZVIBI-QLFBSQMISA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000850381623 1048644294 /nfs/dbraw/zinc/64/42/94/1048644294.db2.gz HUXKJJCVSZVIBI-QLFBSQMISA-N 2 1 318.427 4.104 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000482692252 1048661110 /nfs/dbraw/zinc/66/11/10/1048661110.db2.gz LGNXVPBWLVCEQB-FQEVSTJZSA-N 2 1 300.490 4.132 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2CC3CCC2CC3)CC1 ZINC001190407597 1048731987 /nfs/dbraw/zinc/73/19/87/1048731987.db2.gz PYBRZSWPEQIDRH-LYBXBRPPSA-N 2 1 306.538 4.257 20 0 DIADMP CCC[C@H](C)[C@@H](CC)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000483202807 1048753850 /nfs/dbraw/zinc/75/38/50/1048753850.db2.gz RLGSFRXSYRGDCJ-MAUKXSAKSA-N 2 1 303.494 4.163 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC=C(c2cccc3ccccc32)CC1 ZINC001190628358 1048770854 /nfs/dbraw/zinc/77/08/54/1048770854.db2.gz XEKBCHNCQMKHRO-FQEVSTJZSA-N 2 1 320.480 4.413 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001190628358 1048770867 /nfs/dbraw/zinc/77/08/67/1048770867.db2.gz XEKBCHNCQMKHRO-FQEVSTJZSA-N 2 1 320.480 4.413 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CC=C(c2cccc3ccccc32)CC1 ZINC001190628358 1048770870 /nfs/dbraw/zinc/77/08/70/1048770870.db2.gz XEKBCHNCQMKHRO-FQEVSTJZSA-N 2 1 320.480 4.413 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCC(C)(C)C2CC2)C1 ZINC001191048757 1048846361 /nfs/dbraw/zinc/84/63/61/1048846361.db2.gz TWKJTRGLNQBCPM-ROUUACIJSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCC(C)(C)C2CC2)C1 ZINC001191048757 1048846386 /nfs/dbraw/zinc/84/63/86/1048846386.db2.gz TWKJTRGLNQBCPM-ROUUACIJSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCC(C)(C)C2CC2)C1 ZINC001191048757 1048846391 /nfs/dbraw/zinc/84/63/91/1048846391.db2.gz TWKJTRGLNQBCPM-ROUUACIJSA-N 2 1 306.538 4.399 20 0 DIADMP CC[NH+](CC)[C@H](C[NH2+][C@H]1CCCc2ccccc2C1)CC(C)C ZINC001177210216 1048847107 /nfs/dbraw/zinc/84/71/07/1048847107.db2.gz ZWBQIFSJZFVURC-SFTDATJTSA-N 2 1 316.533 4.280 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483737220 1048851533 /nfs/dbraw/zinc/85/15/33/1048851533.db2.gz UBIWGHYQEAGBOS-QGTPRVQTSA-N 2 1 308.897 4.500 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483737220 1048851553 /nfs/dbraw/zinc/85/15/53/1048851553.db2.gz UBIWGHYQEAGBOS-QGTPRVQTSA-N 2 1 308.897 4.500 20 0 DIADMP CC(C)[C@H]1CCC[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC001177245013 1048854227 /nfs/dbraw/zinc/85/42/27/1048854227.db2.gz KLHVFPOYPTWSLT-FPOVZHCZSA-N 2 1 314.517 4.239 20 0 DIADMP CC(C)[C@H]1CCC[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC001177245013 1048854237 /nfs/dbraw/zinc/85/42/37/1048854237.db2.gz KLHVFPOYPTWSLT-FPOVZHCZSA-N 2 1 314.517 4.239 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc(C3CC3)cc2)C1 ZINC001177294602 1048856813 /nfs/dbraw/zinc/85/68/13/1048856813.db2.gz MNGBWQWBHCKFSF-CALCHBBNSA-N 2 1 300.490 4.022 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cc3ccccc3s2)C1 ZINC001177294984 1048857229 /nfs/dbraw/zinc/85/72/29/1048857229.db2.gz VGFZLOKRNWGALU-IYBDPMFKSA-N 2 1 316.514 4.359 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001177298410 1048861321 /nfs/dbraw/zinc/86/13/21/1048861321.db2.gz BLPIPSOEQFMRCV-CQSZACIVSA-N 2 1 312.860 4.223 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)c1 ZINC001177261990 1048862287 /nfs/dbraw/zinc/86/22/87/1048862287.db2.gz MULJWQVZTYUQMA-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c1 ZINC001177261990 1048862300 /nfs/dbraw/zinc/86/23/00/1048862300.db2.gz MULJWQVZTYUQMA-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H](C)[N@@H+]1CCCC[C@@H]1C ZINC001177278362 1048865338 /nfs/dbraw/zinc/86/53/38/1048865338.db2.gz WSZSKBBKKISGQU-CEXWTWQISA-N 2 1 302.506 4.108 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC001177278362 1048865347 /nfs/dbraw/zinc/86/53/47/1048865347.db2.gz WSZSKBBKKISGQU-CEXWTWQISA-N 2 1 302.506 4.108 20 0 DIADMP CCc1cccc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC001177276734 1048867510 /nfs/dbraw/zinc/86/75/10/1048867510.db2.gz GKZLJQVYWMVRCH-UHFFFAOYSA-N 2 1 310.485 4.379 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@H](C)C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177458786 1048889634 /nfs/dbraw/zinc/88/96/34/1048889634.db2.gz IGPLOINXOJVVNB-YSTOQKLRSA-N 2 1 316.533 4.211 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177458786 1048889652 /nfs/dbraw/zinc/88/96/52/1048889652.db2.gz IGPLOINXOJVVNB-YSTOQKLRSA-N 2 1 316.533 4.211 20 0 DIADMP CC(C)C1CCC(C[NH2+][C@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001177458580 1048889810 /nfs/dbraw/zinc/88/98/10/1048889810.db2.gz DZYCDOJJYWLRSP-HUFQQLBRSA-N 2 1 308.554 4.405 20 0 DIADMP CC(C)C1CCC(C[NH2+][C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001177458580 1048889828 /nfs/dbraw/zinc/88/98/28/1048889828.db2.gz DZYCDOJJYWLRSP-HUFQQLBRSA-N 2 1 308.554 4.405 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001191255185 1048897393 /nfs/dbraw/zinc/89/73/93/1048897393.db2.gz CECIOLBAVLARTH-RBUKOAKNSA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001191255185 1048897405 /nfs/dbraw/zinc/89/74/05/1048897405.db2.gz CECIOLBAVLARTH-RBUKOAKNSA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+](C)CC[C@H]2CCCC[N@H+]2C)c(C)c1 ZINC001191255185 1048897415 /nfs/dbraw/zinc/89/74/15/1048897415.db2.gz CECIOLBAVLARTH-RBUKOAKNSA-N 2 1 302.506 4.479 20 0 DIADMP CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1CCC[NH+](CC)CC ZINC001191233224 1048904944 /nfs/dbraw/zinc/90/49/44/1048904944.db2.gz LRKIUKXCBYOVSI-VQTJNVASSA-N 2 1 302.506 4.377 20 0 DIADMP C[N@@H+](CCC1=CCCCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191234392 1048906331 /nfs/dbraw/zinc/90/63/31/1048906331.db2.gz SWMLZPBTMBLQFI-NRFANRHFSA-N 2 1 312.501 4.331 20 0 DIADMP C[NH+](CCC1=CCCCC1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191234392 1048906337 /nfs/dbraw/zinc/90/63/37/1048906337.db2.gz SWMLZPBTMBLQFI-NRFANRHFSA-N 2 1 312.501 4.331 20 0 DIADMP C[NH+](CCC1=CCCCC1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191234392 1048906342 /nfs/dbraw/zinc/90/63/42/1048906342.db2.gz SWMLZPBTMBLQFI-NRFANRHFSA-N 2 1 312.501 4.331 20 0 DIADMP CC(C)CCC[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001191382375 1048929947 /nfs/dbraw/zinc/92/99/47/1048929947.db2.gz WPBRLVGERLIMKM-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001191382375 1048929953 /nfs/dbraw/zinc/92/99/53/1048929953.db2.gz WPBRLVGERLIMKM-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001191382375 1048929965 /nfs/dbraw/zinc/92/99/65/1048929965.db2.gz WPBRLVGERLIMKM-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001191382375 1048929978 /nfs/dbraw/zinc/92/99/78/1048929978.db2.gz WPBRLVGERLIMKM-QUCCMNQESA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382374 1048930627 /nfs/dbraw/zinc/93/06/27/1048930627.db2.gz WPBRLVGERLIMKM-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382374 1048930632 /nfs/dbraw/zinc/93/06/32/1048930632.db2.gz WPBRLVGERLIMKM-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382374 1048930643 /nfs/dbraw/zinc/93/06/43/1048930643.db2.gz WPBRLVGERLIMKM-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382374 1048930653 /nfs/dbraw/zinc/93/06/53/1048930653.db2.gz WPBRLVGERLIMKM-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)C1 ZINC001177913408 1048960546 /nfs/dbraw/zinc/96/05/46/1048960546.db2.gz ZBQPDYCTOBSPLH-XLMAVXFVSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)C1 ZINC001177913408 1048960561 /nfs/dbraw/zinc/96/05/61/1048960561.db2.gz ZBQPDYCTOBSPLH-XLMAVXFVSA-N 2 1 306.519 4.299 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001203709922 1048972454 /nfs/dbraw/zinc/97/24/54/1048972454.db2.gz VNASNGLZQDAXQT-UHFFFAOYSA-N 2 1 320.480 4.018 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001203709922 1048972464 /nfs/dbraw/zinc/97/24/64/1048972464.db2.gz VNASNGLZQDAXQT-UHFFFAOYSA-N 2 1 320.480 4.018 20 0 DIADMP CCCc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC001178248586 1049001944 /nfs/dbraw/zinc/00/19/44/1049001944.db2.gz DFPAWXDGHYTDJN-HXUWFJFHSA-N 2 1 302.506 4.097 20 0 DIADMP c1ccc(C[N@@H+]2C[C@H]3CCC[C@@H]([NH2+]C[C@H]4CC=CCC4)[C@@H]3C2)cc1 ZINC001178285409 1049011257 /nfs/dbraw/zinc/01/12/57/1049011257.db2.gz QELSUCHLRVGEFG-BDKRGJGYSA-N 2 1 324.512 4.233 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)CC1 ZINC001206327025 1049025452 /nfs/dbraw/zinc/02/54/52/1049025452.db2.gz RMXIJRSLRPAJEZ-OAHLLOKOSA-N 2 1 319.251 4.083 20 0 DIADMP C[C@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904309366 1049027705 /nfs/dbraw/zinc/02/77/05/1049027705.db2.gz IUEPSSPUSAFVGR-OIISXLGYSA-N 2 1 300.471 4.049 20 0 DIADMP CCc1oc2ccccc2c1C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001178463058 1049044021 /nfs/dbraw/zinc/04/40/21/1049044021.db2.gz MIXVWGIKKYDYQZ-MRXNPFEDSA-N 2 1 314.473 4.349 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2c[nH+]ccc2N(C)C)CC(C)(C)C1 ZINC001178601297 1049065115 /nfs/dbraw/zinc/06/51/15/1049065115.db2.gz NTACQAHQRCSESQ-HZPDHXFCSA-N 2 1 303.494 4.090 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192324791 1049077896 /nfs/dbraw/zinc/07/78/96/1049077896.db2.gz LURIUJXBCNIBIK-FPOVZHCZSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001192324791 1049077909 /nfs/dbraw/zinc/07/79/09/1049077909.db2.gz LURIUJXBCNIBIK-FPOVZHCZSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001192324791 1049077923 /nfs/dbraw/zinc/07/79/23/1049077923.db2.gz LURIUJXBCNIBIK-FPOVZHCZSA-N 2 1 312.501 4.259 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001178811784 1049092716 /nfs/dbraw/zinc/09/27/16/1049092716.db2.gz XXXKLKVXJHZUCR-OTBHMBEGSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC001178811784 1049092729 /nfs/dbraw/zinc/09/27/29/1049092729.db2.gz XXXKLKVXJHZUCR-OTBHMBEGSA-N 2 1 314.517 4.454 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(C)cc(Cl)cc2C)C[C@@H]1C ZINC001204238195 1049117861 /nfs/dbraw/zinc/11/78/61/1049117861.db2.gz OZCPPJHOUHPMPY-RDJZCZTQSA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@@H]1C ZINC001204238195 1049117869 /nfs/dbraw/zinc/11/78/69/1049117869.db2.gz OZCPPJHOUHPMPY-RDJZCZTQSA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@@H]1C ZINC001204238195 1049117875 /nfs/dbraw/zinc/11/78/75/1049117875.db2.gz OZCPPJHOUHPMPY-RDJZCZTQSA-N 2 1 308.897 4.261 20 0 DIADMP c1cc(C[N@H+]2CCCC3(CC[NH+](Cc4ccccc4)CC3)C2)co1 ZINC001204244578 1049120920 /nfs/dbraw/zinc/12/09/20/1049120920.db2.gz LRYKWIBVQVWSJQ-UHFFFAOYSA-N 2 1 324.468 4.158 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC001204315294 1049140502 /nfs/dbraw/zinc/14/05/02/1049140502.db2.gz KQMNRPHNPONWIE-UHFFFAOYSA-N 2 1 318.505 4.029 20 0 DIADMP CC(C)Oc1ccc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001204454668 1049166101 /nfs/dbraw/zinc/16/61/01/1049166101.db2.gz FBUMFFIDCKGFGZ-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CC[C@H](Cc2ccc(C(C)C)cc2)C1 ZINC001193068249 1049170863 /nfs/dbraw/zinc/17/08/63/1049170863.db2.gz JHFFPQNFYYGNOT-HXUWFJFHSA-N 2 1 316.533 4.406 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(F)c(C(F)(F)F)c1 ZINC001204488896 1049174108 /nfs/dbraw/zinc/17/41/08/1049174108.db2.gz IGEKRXZUFDPBSO-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(F)c(C(F)(F)F)c1 ZINC001204488896 1049174113 /nfs/dbraw/zinc/17/41/13/1049174113.db2.gz IGEKRXZUFDPBSO-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2c(C)cc(Cl)cc2C)C1 ZINC001204550063 1049187427 /nfs/dbraw/zinc/18/74/27/1049187427.db2.gz FOLWQLRGCBBRDE-MRXNPFEDSA-N 2 1 308.897 4.121 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2c(C)cc(Cl)cc2C)C1 ZINC001204550063 1049187430 /nfs/dbraw/zinc/18/74/30/1049187430.db2.gz FOLWQLRGCBBRDE-MRXNPFEDSA-N 2 1 308.897 4.121 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2c(C)cc(Cl)cc2C)C1 ZINC001204550059 1049188210 /nfs/dbraw/zinc/18/82/10/1049188210.db2.gz FOLWQLRGCBBRDE-INIZCTEOSA-N 2 1 308.897 4.121 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2c(C)cc(Cl)cc2C)C1 ZINC001204550059 1049188216 /nfs/dbraw/zinc/18/82/16/1049188216.db2.gz FOLWQLRGCBBRDE-INIZCTEOSA-N 2 1 308.897 4.121 20 0 DIADMP CC(C)[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Cl)cc1F ZINC001193260144 1049192425 /nfs/dbraw/zinc/19/24/25/1049192425.db2.gz GADBHMBMXKXUDT-YOEHRIQHSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[C@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Cl)cc1F ZINC001193260144 1049192438 /nfs/dbraw/zinc/19/24/38/1049192438.db2.gz GADBHMBMXKXUDT-YOEHRIQHSA-N 2 1 312.860 4.250 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000858098520 1049217113 /nfs/dbraw/zinc/21/71/13/1049217113.db2.gz NQUYMSPQFVKCAW-MHTWAQMVSA-N 2 1 312.501 4.319 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001179877732 1049225809 /nfs/dbraw/zinc/22/58/09/1049225809.db2.gz IKZUNAYEUXISBC-ROUUACIJSA-N 2 1 323.484 4.104 20 0 DIADMP c1ccc(CCCCCC[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000858223521 1049227532 /nfs/dbraw/zinc/22/75/32/1049227532.db2.gz USDUSPZZGZTHHA-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924893 1049228538 /nfs/dbraw/zinc/22/85/38/1049228538.db2.gz LQRNZMNUKZNUGQ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924893 1049228547 /nfs/dbraw/zinc/22/85/47/1049228547.db2.gz LQRNZMNUKZNUGQ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001179924893 1049228555 /nfs/dbraw/zinc/22/85/55/1049228555.db2.gz LQRNZMNUKZNUGQ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001179924893 1049228564 /nfs/dbraw/zinc/22/85/64/1049228564.db2.gz LQRNZMNUKZNUGQ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP CC(C)(C)C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000195616658 1049240263 /nfs/dbraw/zinc/24/02/63/1049240263.db2.gz UVPBWJAKPPGGIM-LJQANCHMSA-N 2 1 300.490 4.380 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCCC3(CC[NH2+]CC3)C2)cc1 ZINC001204735226 1049244894 /nfs/dbraw/zinc/24/48/94/1049244894.db2.gz OXRDQSLZEQWBES-UHFFFAOYSA-N 2 1 320.480 4.319 20 0 DIADMP c1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000195651605 1049245739 /nfs/dbraw/zinc/24/57/39/1049245739.db2.gz PDMUWXNQHQIYHH-UTKZUKDTSA-N 2 1 312.501 4.382 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1Cl ZINC000858491099 1049264109 /nfs/dbraw/zinc/26/41/09/1049264109.db2.gz YCOPIGDDKHYMMA-GJZGRUSLSA-N 2 1 324.896 4.040 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1Cl ZINC000858491098 1049265003 /nfs/dbraw/zinc/26/50/03/1049265003.db2.gz YCOPIGDDKHYMMA-CABCVRRESA-N 2 1 324.896 4.040 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001180129054 1049276919 /nfs/dbraw/zinc/27/69/19/1049276919.db2.gz HGFKKKJYLQSDBI-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@H]1C[C@@H](N(C)CC[C@@H]2CCCC[N@H+]2C)c2ccsc2S1 ZINC001180099259 1049287349 /nfs/dbraw/zinc/28/73/49/1049287349.db2.gz XIKGBECDBUWRAY-OFQRWUPVSA-N 2 1 324.559 4.480 20 0 DIADMP [NH3+]Cc1cccc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c1 ZINC001204870476 1049291666 /nfs/dbraw/zinc/29/16/66/1049291666.db2.gz WCKLKRKMLWMFDM-UHFFFAOYSA-N 2 1 312.844 4.088 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001204931884 1049315500 /nfs/dbraw/zinc/31/55/00/1049315500.db2.gz GCFOCLBIUUEDLE-GOSISDBHSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001204931884 1049315512 /nfs/dbraw/zinc/31/55/12/1049315512.db2.gz GCFOCLBIUUEDLE-GOSISDBHSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@]1([NH3+])CCC[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204940211 1049317696 /nfs/dbraw/zinc/31/76/96/1049317696.db2.gz WJRDRZOBQWLIQS-IBGZPJMESA-N 2 1 310.466 4.368 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204940211 1049317701 /nfs/dbraw/zinc/31/77/01/1049317701.db2.gz WJRDRZOBQWLIQS-IBGZPJMESA-N 2 1 310.466 4.368 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001205009579 1049338737 /nfs/dbraw/zinc/33/87/37/1049338737.db2.gz XSVDGFAUEMNRKA-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001205009579 1049338747 /nfs/dbraw/zinc/33/87/47/1049338747.db2.gz XSVDGFAUEMNRKA-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(C)cc3)cc2)C1 ZINC001205009643 1049340599 /nfs/dbraw/zinc/34/05/99/1049340599.db2.gz ZWBLRQTZCYABCH-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H]2CC=CCC2)CC1)CC1CC1 ZINC001180322664 1049344798 /nfs/dbraw/zinc/34/47/98/1049344798.db2.gz LXJKUENDAKJEDG-LJQANCHMSA-N 2 1 304.522 4.177 20 0 DIADMP Cc1ccccc1[C@@H](C)[N@@H+](CCCc1c[nH+]cn1C)CC(C)C ZINC001194299124 1049354976 /nfs/dbraw/zinc/35/49/76/1049354976.db2.gz DEOFEEUBDXGMHI-GOSISDBHSA-N 2 1 313.489 4.380 20 0 DIADMP Cc1ccccc1[C@@H](C)[N@H+](CCCc1c[nH+]cn1C)CC(C)C ZINC001194299124 1049354984 /nfs/dbraw/zinc/35/49/84/1049354984.db2.gz DEOFEEUBDXGMHI-GOSISDBHSA-N 2 1 313.489 4.380 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000777130156 1049358971 /nfs/dbraw/zinc/35/89/71/1049358971.db2.gz PTTPZECTUCXSOG-DSJDWBEOSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000777130156 1049358982 /nfs/dbraw/zinc/35/89/82/1049358982.db2.gz PTTPZECTUCXSOG-DSJDWBEOSA-N 2 1 300.490 4.064 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@H+]3CCC[C@@H]([NH3+])CC3)ccc21 ZINC001205109468 1049379591 /nfs/dbraw/zinc/37/95/91/1049379591.db2.gz GROODRQMWLSOGU-QGZVFWFLSA-N 2 1 321.468 4.128 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccc3sc4ccccc4c3c2)CC1 ZINC001205124125 1049385528 /nfs/dbraw/zinc/38/55/28/1049385528.db2.gz KNHQDPMWWDYVGR-HNNXBMFYSA-N 2 1 310.466 4.368 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H]([NH3+])CC2)ccc1Oc1ccccc1 ZINC001205124641 1049386623 /nfs/dbraw/zinc/38/66/23/1049386623.db2.gz XAHKHHNEVLZYJB-SFHVURJKSA-N 2 1 310.441 4.101 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001180622769 1049387289 /nfs/dbraw/zinc/38/72/89/1049387289.db2.gz JXQOWNKUVHCEOF-ZUQLYSRVSA-N 2 1 312.501 4.161 20 0 DIADMP CCc1cccc2cc(C[N@H+]3CCCC34CC[NH+](C)CC4)oc21 ZINC001180885793 1049409981 /nfs/dbraw/zinc/40/99/81/1049409981.db2.gz UXKYJCKYOQVQCN-UHFFFAOYSA-N 2 1 312.457 4.055 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC001205265648 1049421814 /nfs/dbraw/zinc/42/18/14/1049421814.db2.gz QIZMKEHKHGUJKZ-GOSISDBHSA-N 2 1 318.848 4.303 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 ZINC001205274569 1049422788 /nfs/dbraw/zinc/42/27/88/1049422788.db2.gz XWHQRCLFRYLMTP-SFHVURJKSA-N 2 1 318.848 4.303 20 0 DIADMP COc1ccc(-c2ccccc2)cc1C[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205274061 1049423114 /nfs/dbraw/zinc/42/31/14/1049423114.db2.gz SQXJUMLRNOZPFA-OAQYLSRUSA-N 2 1 324.468 4.066 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@](C)([NH3+])CC3)c(C)c12 ZINC001205281309 1049426596 /nfs/dbraw/zinc/42/65/96/1049426596.db2.gz SCMHHSFVCUJBOS-INIZCTEOSA-N 2 1 308.516 4.283 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2sccc2Oc2ccccc2)CC1 ZINC001205280925 1049426656 /nfs/dbraw/zinc/42/66/56/1049426656.db2.gz LZBRUBSKLKTLIL-GOSISDBHSA-N 2 1 316.470 4.244 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)cn2)c1C ZINC001205288361 1049429071 /nfs/dbraw/zinc/42/90/71/1049429071.db2.gz JOZDMGSNYPOOOP-OAQYLSRUSA-N 2 1 323.484 4.069 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1 ZINC001205303338 1049432639 /nfs/dbraw/zinc/43/26/39/1049432639.db2.gz CRHZPNCPVHKFQL-MJGOQNOKSA-N 2 1 318.505 4.062 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccc(C4CCC4)cc3)C2)CC1 ZINC001205540121 1049494560 /nfs/dbraw/zinc/49/45/60/1049494560.db2.gz BHXNGKOVCJDTLU-UHFFFAOYSA-N 2 1 312.501 4.262 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccccc2)C1(C)C ZINC001195250619 1049502326 /nfs/dbraw/zinc/50/23/26/1049502326.db2.gz MUXYQQVBILIKLH-IBGZPJMESA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccccc2)C1(C)C ZINC001195250619 1049502341 /nfs/dbraw/zinc/50/23/41/1049502341.db2.gz MUXYQQVBILIKLH-IBGZPJMESA-N 2 1 311.473 4.240 20 0 DIADMP c1cc2cc(C[NH+]3CCC4(CCC[N@H+]4CC4CC4)CC3)ccc2[nH]1 ZINC001205576845 1049502835 /nfs/dbraw/zinc/50/28/35/1049502835.db2.gz HSZTXYCPWZVBEW-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP c1cc2cc(C[NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)ccc2[nH]1 ZINC001205576845 1049502843 /nfs/dbraw/zinc/50/28/43/1049502843.db2.gz HSZTXYCPWZVBEW-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)CC1 ZINC001205591279 1049504820 /nfs/dbraw/zinc/50/48/20/1049504820.db2.gz JLCJWTNDBUXUPF-HXUWFJFHSA-N 2 1 318.480 4.387 20 0 DIADMP C[C@@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)CC[C@H]1C[NH3+] ZINC001205599856 1049506223 /nfs/dbraw/zinc/50/62/23/1049506223.db2.gz AIQTXPYRVQRCCY-NQIIRXRSSA-N 2 1 322.496 4.125 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccs3)s2)CC[C@@H]1C[NH3+] ZINC001205618120 1049511191 /nfs/dbraw/zinc/51/11/91/1049511191.db2.gz RQQFCKRFYIRAFZ-UONOGXRCSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205616765 1049512645 /nfs/dbraw/zinc/51/26/45/1049512645.db2.gz GWLAUBPOMRNZSM-UKRRQHHQSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)CC[C@@H]1C[NH3+] ZINC001205626736 1049514196 /nfs/dbraw/zinc/51/41/96/1049514196.db2.gz IRQUZQQVTMVZLB-PKOBYXMFSA-N 2 1 308.469 4.160 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)cccc1-c1ccccc1 ZINC001205651941 1049524063 /nfs/dbraw/zinc/52/40/63/1049524063.db2.gz MGFFHIHRWPXACS-FXAWDEMLSA-N 2 1 322.496 4.469 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@@H]1CC1(C)C ZINC000487270524 1049539370 /nfs/dbraw/zinc/53/93/70/1049539370.db2.gz PXKOXCBUWLAWMJ-JKQORVJESA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@@H]1CC1(C)C ZINC000487270524 1049539383 /nfs/dbraw/zinc/53/93/83/1049539383.db2.gz PXKOXCBUWLAWMJ-JKQORVJESA-N 2 1 306.519 4.155 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001205902197 1049596770 /nfs/dbraw/zinc/59/67/70/1049596770.db2.gz IOSDFYXSEOZCBZ-GDBMZVCRSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc2oc3ccccc3c2c1 ZINC001205902199 1049597189 /nfs/dbraw/zinc/59/71/89/1049597189.db2.gz IOSDFYXSEOZCBZ-HOCLYGCPSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001205903708 1049597343 /nfs/dbraw/zinc/59/73/43/1049597343.db2.gz QVJDAQGJEQHSEI-KGLIPLIRSA-N 2 1 318.848 4.159 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@@H](C[NH3+])[C@H]2C)cccc1-c1ccccc1 ZINC001205912383 1049600500 /nfs/dbraw/zinc/60/05/00/1049600500.db2.gz ABMIMSDXQUPPOW-MJGOQNOKSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@H](C[NH3+])[C@@H]1C ZINC001205915874 1049601571 /nfs/dbraw/zinc/60/15/71/1049601571.db2.gz RFJIBKFTSGMXHP-ZWKOTPCHSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CCC[C@H]1C[NH3+] ZINC001205996317 1049620416 /nfs/dbraw/zinc/62/04/16/1049620416.db2.gz WBVVPCVRGVSPAK-MJGOQNOKSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3)cc2)CCC[C@H]1C[NH3+] ZINC001205996178 1049621721 /nfs/dbraw/zinc/62/17/21/1049621721.db2.gz VSWUNPHHODJHTB-UWJYYQICSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2Oc2ccccc2)CCC[C@H]1C[NH3+] ZINC001206005980 1049627416 /nfs/dbraw/zinc/62/74/16/1049627416.db2.gz ZTLVNYKKSUKHOP-ROUUACIJSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2Oc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206005979 1049628225 /nfs/dbraw/zinc/62/82/25/1049628225.db2.gz ZTLVNYKKSUKHOP-QZTJIDSGSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(-c3ccccc3)c2)CCC[C@@H]1C[NH3+] ZINC001206011856 1049629251 /nfs/dbraw/zinc/62/92/51/1049629251.db2.gz GYEFKLNHPGCYFK-DYESRHJHSA-N 2 1 308.469 4.160 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000488368226 1049642932 /nfs/dbraw/zinc/64/29/32/1049642932.db2.gz QBTMEUXZVXMAAA-FFGOWVMKSA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)CS1 ZINC000488415153 1049647600 /nfs/dbraw/zinc/64/76/00/1049647600.db2.gz PDCZAEFUMGSPHX-MOPGFXCFSA-N 2 1 320.546 4.147 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC001206083972 1049650601 /nfs/dbraw/zinc/65/06/01/1049650601.db2.gz BHQDWFZUAQADGH-SJORKVTESA-N 2 1 315.505 4.199 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC001206083972 1049650604 /nfs/dbraw/zinc/65/06/04/1049650604.db2.gz BHQDWFZUAQADGH-SJORKVTESA-N 2 1 315.505 4.199 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000488470310 1049661227 /nfs/dbraw/zinc/66/12/27/1049661227.db2.gz VHWPMIQDLDALSN-ZJXIFLPPSA-N 2 1 300.490 4.031 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)CC1 ZINC001206154152 1049672325 /nfs/dbraw/zinc/67/23/25/1049672325.db2.gz GWOHPRDVWJHDKW-IPMKNSEASA-N 2 1 308.485 4.221 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)CC1 ZINC001206154152 1049672341 /nfs/dbraw/zinc/67/23/41/1049672341.db2.gz GWOHPRDVWJHDKW-IPMKNSEASA-N 2 1 308.485 4.221 20 0 DIADMP C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000488584474 1049681333 /nfs/dbraw/zinc/68/13/33/1049681333.db2.gz RNGLALDLDGCGFS-OVWQWFNUSA-N 2 1 324.578 4.149 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC001206215056 1049682009 /nfs/dbraw/zinc/68/20/09/1049682009.db2.gz KFJOVBPRMSENFP-LJQANCHMSA-N 2 1 322.496 4.140 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001206284969 1049700861 /nfs/dbraw/zinc/70/08/61/1049700861.db2.gz KBSLQSCNGDDHRR-CQSZACIVSA-N 2 1 310.466 4.096 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001206284969 1049700868 /nfs/dbraw/zinc/70/08/68/1049700868.db2.gz KBSLQSCNGDDHRR-CQSZACIVSA-N 2 1 310.466 4.096 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001206296326 1049702762 /nfs/dbraw/zinc/70/27/62/1049702762.db2.gz QZFCKNWOYBRLOT-NRFANRHFSA-N 2 1 324.468 4.430 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)c(Cl)c1Cl ZINC001206318556 1049709235 /nfs/dbraw/zinc/70/92/35/1049709235.db2.gz REGYPDQQNQXZNX-MRXNPFEDSA-N 2 1 315.288 4.253 20 0 DIADMP CC(C)Oc1ccc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)cc1Cl ZINC001206318238 1049709744 /nfs/dbraw/zinc/70/97/44/1049709744.db2.gz OGECWVKBYDKVOX-SFHVURJKSA-N 2 1 324.896 4.078 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001206317330 1049709859 /nfs/dbraw/zinc/70/98/59/1049709859.db2.gz FYTYLHJYRGTFEP-HNNXBMFYSA-N 2 1 319.251 4.083 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001206317033 1049710458 /nfs/dbraw/zinc/71/04/58/1049710458.db2.gz BGOYYVUMPITCHC-QFIPXVFZSA-N 2 1 322.496 4.228 20 0 DIADMP Cc1cc(Cl)c(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)c(Cl)c1 ZINC001206324437 1049711713 /nfs/dbraw/zinc/71/17/13/1049711713.db2.gz BHXCVMQJZHEALX-INIZCTEOSA-N 2 1 315.288 4.253 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206327086 1049713995 /nfs/dbraw/zinc/71/39/95/1049713995.db2.gz SJPVMHHMHORMJP-INIZCTEOSA-N 2 1 312.910 4.013 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2ccccc2-c2cccs2)C1 ZINC001206351865 1049718076 /nfs/dbraw/zinc/71/80/76/1049718076.db2.gz JXXKMXLWQKSQRL-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2ccccc2-c2cccs2)C1 ZINC001206351865 1049718082 /nfs/dbraw/zinc/71/80/82/1049718082.db2.gz JXXKMXLWQKSQRL-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC001206360774 1049721203 /nfs/dbraw/zinc/72/12/03/1049721203.db2.gz BHAGOMYGABPCJX-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC001206360774 1049721216 /nfs/dbraw/zinc/72/12/16/1049721216.db2.gz BHAGOMYGABPCJX-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3cccs3)s2)C1 ZINC001206549378 1049753618 /nfs/dbraw/zinc/75/36/18/1049753618.db2.gz MDEALKFGZQTTPV-QGZVFWFLSA-N 2 1 320.527 4.428 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)C1 ZINC001206541785 1049753784 /nfs/dbraw/zinc/75/37/84/1049753784.db2.gz KICGZEXDEYVOFG-NRFANRHFSA-N 2 1 324.468 4.430 20 0 DIADMP COc1cc(C)c(C[N@H+]2CCCC[C@](C)(C[NH3+])C2)cc1C(C)C ZINC001206563909 1049757869 /nfs/dbraw/zinc/75/78/69/1049757869.db2.gz KGOMZELWSKXIPH-HXUWFJFHSA-N 2 1 318.505 4.078 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2c1cccc2Cl)[C@H]1CCC[NH2+]CC1 ZINC001206591581 1049763615 /nfs/dbraw/zinc/76/36/15/1049763615.db2.gz TUROUPNJDIEXCX-HNNXBMFYSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2ccncc2)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206591029 1049763627 /nfs/dbraw/zinc/76/36/27/1049763627.db2.gz PGPDXMPFKWOKEU-NRFANRHFSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2cccc(Cl)c12)[C@H]1CCC[NH2+]CC1 ZINC001206590037 1049763823 /nfs/dbraw/zinc/76/38/23/1049763823.db2.gz LCKUXJQPWAXXGV-HNNXBMFYSA-N 2 1 319.880 4.174 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206599093 1049765209 /nfs/dbraw/zinc/76/52/09/1049765209.db2.gz NNILGFNHIYDSQI-QGZVFWFLSA-N 2 1 308.897 4.309 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCCC[C@H](C[NH3+])C2)cc1 ZINC001206606118 1049769138 /nfs/dbraw/zinc/76/91/38/1049769138.db2.gz DSEWDWJHVJEPAV-PKOBYXMFSA-N 2 1 302.506 4.049 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001206616054 1049769773 /nfs/dbraw/zinc/76/97/73/1049769773.db2.gz MWJLBKMHSSLUKO-KRWDZBQOSA-N 2 1 312.432 4.054 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(-c3cccs3)s2)C1 ZINC001206615487 1049769889 /nfs/dbraw/zinc/76/98/89/1049769889.db2.gz FVWIJCGTEXMXFG-ZDUSSCGKSA-N 2 1 306.500 4.037 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001206616051 1049770376 /nfs/dbraw/zinc/77/03/76/1049770376.db2.gz MNBNKCBGEUTDMX-CQSZACIVSA-N 2 1 318.848 4.161 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001206647151 1049774817 /nfs/dbraw/zinc/77/48/17/1049774817.db2.gz FWNAUONRVHOTFU-GOSISDBHSA-N 2 1 300.490 4.295 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001206769089 1049795329 /nfs/dbraw/zinc/79/53/29/1049795329.db2.gz NJWCXKBOKNTZFK-WMZOPIPTSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001206769050 1049795816 /nfs/dbraw/zinc/79/58/16/1049795816.db2.gz MZHGNELOLRGWSW-DOTOQJQBSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001206770638 1049796435 /nfs/dbraw/zinc/79/64/35/1049796435.db2.gz SXSDMGJZFVHKPM-DOTOQJQBSA-N 2 1 312.432 4.052 20 0 DIADMP CC[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(F)cn1 ZINC000490152906 1049803285 /nfs/dbraw/zinc/80/32/85/1049803285.db2.gz YURWWNJMEJAYPR-JZXOWHBKSA-N 2 1 321.484 4.020 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001206807220 1049804888 /nfs/dbraw/zinc/80/48/88/1049804888.db2.gz HTSIFBYPYNWKEK-AEFFLSMTSA-N 2 1 300.490 4.294 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001206810544 1049805283 /nfs/dbraw/zinc/80/52/83/1049805283.db2.gz NUXWHHYTCGIELQ-VXGBXAGGSA-N 2 1 308.878 4.114 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001206811469 1049805963 /nfs/dbraw/zinc/80/59/63/1049805963.db2.gz UZACRYWEYKBJGZ-DOTOQJQBSA-N 2 1 312.432 4.052 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c1C ZINC001207093639 1049836295 /nfs/dbraw/zinc/83/62/95/1049836295.db2.gz MUETXFRPKKLWIS-KUHUBIRLSA-N 2 1 320.546 4.498 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCCN1Cc1cccc(C(F)F)c1 ZINC001207133433 1049844096 /nfs/dbraw/zinc/84/40/96/1049844096.db2.gz RZZVFVSIYQMIBB-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc(C(F)F)c1 ZINC001207133433 1049844110 /nfs/dbraw/zinc/84/41/10/1049844110.db2.gz RZZVFVSIYQMIBB-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc(C(F)F)c1 ZINC001207133433 1049844117 /nfs/dbraw/zinc/84/41/17/1049844117.db2.gz RZZVFVSIYQMIBB-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc(C(F)F)c1 ZINC001207133433 1049844132 /nfs/dbraw/zinc/84/41/32/1049844132.db2.gz RZZVFVSIYQMIBB-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC001207133433 1049844144 /nfs/dbraw/zinc/84/41/44/1049844144.db2.gz RZZVFVSIYQMIBB-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001207289877 1049875401 /nfs/dbraw/zinc/87/54/01/1049875401.db2.gz YPVDVCZAWOBAKB-LEWJYISDSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CCC34CCCCC4)CC2)cc1 ZINC001207287714 1049875482 /nfs/dbraw/zinc/87/54/82/1049875482.db2.gz XBMVNUIHWFGFPM-UHFFFAOYSA-N 2 1 312.501 4.307 20 0 DIADMP C[NH+](C)CC(C)(C)C[NH+]1CCC(c2ccccc2Cl)CC1 ZINC001207288262 1049875636 /nfs/dbraw/zinc/87/56/36/1049875636.db2.gz MADNRULFIFMIHX-UHFFFAOYSA-N 2 1 308.897 4.107 20 0 DIADMP C[C@H]1CC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)[C@@H](C)C1 ZINC001207291903 1049875685 /nfs/dbraw/zinc/87/56/85/1049875685.db2.gz FWTWRCKWXWKZPK-ROUUACIJSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001207289878 1049876274 /nfs/dbraw/zinc/87/62/74/1049876274.db2.gz YPVDVCZAWOBAKB-NHCUHLMSSA-N 2 1 312.501 4.021 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2c3cc(C)ccc3C[C@H]2C)c1 ZINC000491028149 1049880202 /nfs/dbraw/zinc/88/02/02/1049880202.db2.gz CVEQERKWADBRDO-VGSWGCGISA-N 2 1 322.496 4.470 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2c3cc(C)ccc3C[C@@H]2C)c1 ZINC000491028147 1049880458 /nfs/dbraw/zinc/88/04/58/1049880458.db2.gz CVEQERKWADBRDO-JTSKRJEESA-N 2 1 322.496 4.470 20 0 DIADMP CC[N@H+](Cc1ccc(Cl)cc1Cl)CC1CC[NH+](C)CC1 ZINC001207402024 1049887344 /nfs/dbraw/zinc/88/73/44/1049887344.db2.gz UPJVKIVXEIKVBU-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001207393552 1049888098 /nfs/dbraw/zinc/88/80/98/1049888098.db2.gz CGVUGFGJHFUKRM-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP Clc1cccc(CCC[NH+]2CCC([NH+]3CCCCC3)CC2)c1 ZINC001207584597 1049912043 /nfs/dbraw/zinc/91/20/43/1049912043.db2.gz KSLGGYDRNFSEFJ-UHFFFAOYSA-N 2 1 320.908 4.223 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCC(C)(C)C2)C[C@H]1c1ccccc1 ZINC000571174364 1049924016 /nfs/dbraw/zinc/92/40/16/1049924016.db2.gz PXCDNYQUVJHTNZ-OTWHNJEPSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCC(C)(C)C2)C[C@H]1c1ccccc1 ZINC000571174364 1049924019 /nfs/dbraw/zinc/92/40/19/1049924019.db2.gz PXCDNYQUVJHTNZ-OTWHNJEPSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCC(C)(C)C2)C[C@H]1c1ccccc1 ZINC000571174361 1049924444 /nfs/dbraw/zinc/92/44/44/1049924444.db2.gz PXCDNYQUVJHTNZ-FHWLQOOXSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCC(C)(C)C2)C[C@H]1c1ccccc1 ZINC000571174361 1049924448 /nfs/dbraw/zinc/92/44/48/1049924448.db2.gz PXCDNYQUVJHTNZ-FHWLQOOXSA-N 2 1 300.490 4.380 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)C1CC[NH+](CC2CC2)CC1 ZINC001168379016 1049937020 /nfs/dbraw/zinc/93/70/20/1049937020.db2.gz BJGBNDOUFFNKLD-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1CC1(c2ccccc2)CC1 ZINC001207839682 1049943279 /nfs/dbraw/zinc/94/32/79/1049943279.db2.gz TWQWWBOTPROXFP-PMACEKPBSA-N 2 1 312.501 4.057 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CC1(c2ccccc2)CC1 ZINC001207839682 1049943284 /nfs/dbraw/zinc/94/32/84/1049943284.db2.gz TWQWWBOTPROXFP-PMACEKPBSA-N 2 1 312.501 4.057 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CC1(c2ccccc2)CC1 ZINC001207839682 1049943293 /nfs/dbraw/zinc/94/32/93/1049943293.db2.gz TWQWWBOTPROXFP-PMACEKPBSA-N 2 1 312.501 4.057 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)c1ccccc1 ZINC001207912070 1049954725 /nfs/dbraw/zinc/95/47/25/1049954725.db2.gz NDRPOGLQHIKLSE-HOJAQTOUSA-N 2 1 300.490 4.129 20 0 DIADMP C[C@H](C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC001207912070 1049954729 /nfs/dbraw/zinc/95/47/29/1049954729.db2.gz NDRPOGLQHIKLSE-HOJAQTOUSA-N 2 1 300.490 4.129 20 0 DIADMP C[C@H](C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC001207912070 1049954732 /nfs/dbraw/zinc/95/47/32/1049954732.db2.gz NDRPOGLQHIKLSE-HOJAQTOUSA-N 2 1 300.490 4.129 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](C[C@@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001207936454 1049958232 /nfs/dbraw/zinc/95/82/32/1049958232.db2.gz GXCWUQSXXWKCRU-SFHVURJKSA-N 2 1 316.533 4.405 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CCc3[nH+]ccn3CC2)CC1 ZINC001207937834 1049960679 /nfs/dbraw/zinc/96/06/79/1049960679.db2.gz OUGAMGZVKBVLIB-IBGZPJMESA-N 2 1 313.489 4.214 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CCc3[nH+]ccn3CC2)CC1 ZINC001207937834 1049960697 /nfs/dbraw/zinc/96/06/97/1049960697.db2.gz OUGAMGZVKBVLIB-IBGZPJMESA-N 2 1 313.489 4.214 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[NH+]2C[C@H]3CC[N@H+](C)C[C@H]3C2)CC1 ZINC001207942172 1049963700 /nfs/dbraw/zinc/96/37/00/1049963700.db2.gz VXQIBOWZPBXMAF-NJYVYQBISA-N 2 1 316.533 4.343 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)CC1 ZINC001207942172 1049963706 /nfs/dbraw/zinc/96/37/06/1049963706.db2.gz VXQIBOWZPBXMAF-NJYVYQBISA-N 2 1 316.533 4.343 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2C[C@H]3CC[NH+](C)C[C@H]3C2)CC1 ZINC001207942172 1049963709 /nfs/dbraw/zinc/96/37/09/1049963709.db2.gz VXQIBOWZPBXMAF-NJYVYQBISA-N 2 1 316.533 4.343 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C/C=C\c2ccccc2)c1 ZINC000588178268 1049973670 /nfs/dbraw/zinc/97/36/70/1049973670.db2.gz AOBACHSPDXXYNU-JYRVWZFOSA-N 2 1 308.469 4.330 20 0 DIADMP Cc1ccc([C@@H](C)CC[NH+]2CCC([NH+]3CCCCC3)CC2)o1 ZINC001208152742 1049977792 /nfs/dbraw/zinc/97/77/92/1049977792.db2.gz VSRRWSFELSYTJC-INIZCTEOSA-N 2 1 304.478 4.032 20 0 DIADMP CC[NH+]1CCC([N@H+](C)CC[C@@H](C)CCCC(C)(C)OC)CC1 ZINC001208206822 1049985604 /nfs/dbraw/zinc/98/56/04/1049985604.db2.gz SXWBRFGVBHNELC-KRWDZBQOSA-N 2 1 312.542 4.024 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)CC[C@@H](C)CCCC(C)(C)OC)CC1 ZINC001208206822 1049985607 /nfs/dbraw/zinc/98/56/07/1049985607.db2.gz SXWBRFGVBHNELC-KRWDZBQOSA-N 2 1 312.542 4.024 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](CC[C@H](C)CCCC(C)(C)OC)CC1 ZINC001208214601 1049986332 /nfs/dbraw/zinc/98/63/32/1049986332.db2.gz UYJIVCURSXEGDK-QGZVFWFLSA-N 2 1 312.542 4.024 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)CC1 ZINC001208597165 1049997588 /nfs/dbraw/zinc/99/75/88/1049997588.db2.gz DJHQVBUEFJEHEQ-CQSZACIVSA-N 2 1 312.910 4.270 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001208599407 1049997988 /nfs/dbraw/zinc/99/79/88/1049997988.db2.gz GWBZKUYJEFDCHB-IBGZPJMESA-N 2 1 304.453 4.085 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206346 1049998753 /nfs/dbraw/zinc/99/87/53/1049998753.db2.gz PUOYKCZOLCUVSX-AXIYNFMDSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206346 1049998758 /nfs/dbraw/zinc/99/87/58/1049998758.db2.gz PUOYKCZOLCUVSX-AXIYNFMDSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206346 1049998764 /nfs/dbraw/zinc/99/87/64/1049998764.db2.gz PUOYKCZOLCUVSX-AXIYNFMDSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206346 1049998770 /nfs/dbraw/zinc/99/87/70/1049998770.db2.gz PUOYKCZOLCUVSX-AXIYNFMDSA-N 2 1 314.517 4.232 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+](CCC2CCCC2)CC1 ZINC001208695385 1050003200 /nfs/dbraw/zinc/00/32/00/1050003200.db2.gz PBCDUUTYVWIPHD-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)CCC[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001208733937 1050007364 /nfs/dbraw/zinc/00/73/64/1050007364.db2.gz XJWWHWADKFXOFL-UHFFFAOYSA-N 2 1 320.546 4.472 20 0 DIADMP C[N@@H+](CCCc1ccc(F)cc1)Cc1ccc(-n2ccnc2)cc1 ZINC001208775716 1050009622 /nfs/dbraw/zinc/00/96/22/1050009622.db2.gz UUIJEELTRGJSCS-UHFFFAOYSA-N 2 1 323.415 4.076 20 0 DIADMP Cc1cccc(C[N@@H+](C)C[C@H]2CCC[NH+](Cc3ccccc3)C2)c1 ZINC001208934331 1050024018 /nfs/dbraw/zinc/02/40/18/1050024018.db2.gz ZXXHDFYLJWRBAF-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC001208934331 1050024023 /nfs/dbraw/zinc/02/40/23/1050024023.db2.gz ZXXHDFYLJWRBAF-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC001208934331 1050024028 /nfs/dbraw/zinc/02/40/28/1050024028.db2.gz ZXXHDFYLJWRBAF-JOCHJYFZSA-N 2 1 322.496 4.339 20 0 DIADMP C[C@@H]1CCCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931796 1050024139 /nfs/dbraw/zinc/02/41/39/1050024139.db2.gz MVMFFXHRURRPMO-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931796 1050024143 /nfs/dbraw/zinc/02/41/43/1050024143.db2.gz MVMFFXHRURRPMO-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931796 1050024151 /nfs/dbraw/zinc/02/41/51/1050024151.db2.gz MVMFFXHRURRPMO-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929848 1050024631 /nfs/dbraw/zinc/02/46/31/1050024631.db2.gz VLKNGMQETVLFFG-JOCHJYFZSA-N 2 1 322.496 4.421 20 0 DIADMP CC[N@H+](Cc1ccccc1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929848 1050024635 /nfs/dbraw/zinc/02/46/35/1050024635.db2.gz VLKNGMQETVLFFG-JOCHJYFZSA-N 2 1 322.496 4.421 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929848 1050024641 /nfs/dbraw/zinc/02/46/41/1050024641.db2.gz VLKNGMQETVLFFG-JOCHJYFZSA-N 2 1 322.496 4.421 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929848 1050024647 /nfs/dbraw/zinc/02/46/47/1050024647.db2.gz VLKNGMQETVLFFG-JOCHJYFZSA-N 2 1 322.496 4.421 20 0 DIADMP C[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935149 1050025836 /nfs/dbraw/zinc/02/58/36/1050025836.db2.gz INGFUMKCZXDROI-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935149 1050025841 /nfs/dbraw/zinc/02/58/41/1050025841.db2.gz INGFUMKCZXDROI-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935149 1050025846 /nfs/dbraw/zinc/02/58/46/1050025846.db2.gz INGFUMKCZXDROI-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935149 1050025850 /nfs/dbraw/zinc/02/58/50/1050025850.db2.gz INGFUMKCZXDROI-QWFCFKBJSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CC[C@@H]3c3ccccc3)C2)cc1 ZINC001208938724 1050026943 /nfs/dbraw/zinc/02/69/43/1050026943.db2.gz DLYMZZVQHMQBQO-RBBKRZOGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CC[C@@H]3c3ccccc3)C2)cc1 ZINC001208938724 1050026953 /nfs/dbraw/zinc/02/69/53/1050026953.db2.gz DLYMZZVQHMQBQO-RBBKRZOGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CC[C@@H]3c3ccccc3)C2)cc1 ZINC001208938724 1050026957 /nfs/dbraw/zinc/02/69/57/1050026957.db2.gz DLYMZZVQHMQBQO-RBBKRZOGSA-N 2 1 320.480 4.346 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940076 1050027384 /nfs/dbraw/zinc/02/73/84/1050027384.db2.gz ONZVBBMPDIRCGQ-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940076 1050027391 /nfs/dbraw/zinc/02/73/91/1050027391.db2.gz ONZVBBMPDIRCGQ-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208940076 1050027395 /nfs/dbraw/zinc/02/73/95/1050027395.db2.gz ONZVBBMPDIRCGQ-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208940076 1050027401 /nfs/dbraw/zinc/02/74/01/1050027401.db2.gz ONZVBBMPDIRCGQ-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CC[N@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935421 1050027796 /nfs/dbraw/zinc/02/77/96/1050027796.db2.gz JARYDZVTSOWRRX-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935421 1050027803 /nfs/dbraw/zinc/02/78/03/1050027803.db2.gz JARYDZVTSOWRRX-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935421 1050027808 /nfs/dbraw/zinc/02/78/08/1050027808.db2.gz JARYDZVTSOWRRX-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935421 1050027811 /nfs/dbraw/zinc/02/78/11/1050027811.db2.gz JARYDZVTSOWRRX-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[N@H+](CC)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208941412 1050028872 /nfs/dbraw/zinc/02/88/72/1050028872.db2.gz ZNALBWBKYRUQLH-IBGZPJMESA-N 2 1 302.506 4.409 20 0 DIADMP CCC(CC)[N@@H+](CC)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208941412 1050028877 /nfs/dbraw/zinc/02/88/77/1050028877.db2.gz ZNALBWBKYRUQLH-IBGZPJMESA-N 2 1 302.506 4.409 20 0 DIADMP CCC(CC)[NH+](CC)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208941412 1050028881 /nfs/dbraw/zinc/02/88/81/1050028881.db2.gz ZNALBWBKYRUQLH-IBGZPJMESA-N 2 1 302.506 4.409 20 0 DIADMP CCC(CC)[NH+](CC)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208941412 1050028886 /nfs/dbraw/zinc/02/88/86/1050028886.db2.gz ZNALBWBKYRUQLH-IBGZPJMESA-N 2 1 302.506 4.409 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC4(C3)CCCCC4)C2)cc1 ZINC001208963585 1050030556 /nfs/dbraw/zinc/03/05/56/1050030556.db2.gz OWXHDWDGGHLPCY-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCC4(C3)CCCCC4)C2)cc1 ZINC001208963585 1050030562 /nfs/dbraw/zinc/03/05/62/1050030562.db2.gz OWXHDWDGGHLPCY-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCC4(C3)CCCCC4)C2)cc1 ZINC001208963585 1050030568 /nfs/dbraw/zinc/03/05/68/1050030568.db2.gz OWXHDWDGGHLPCY-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP C[N@H+](CCC[NH+]1CCCCC1)Cc1ccc(C(F)(F)F)cc1 ZINC001209451468 1050061165 /nfs/dbraw/zinc/06/11/65/1050061165.db2.gz ZUDVFWLSWOJEMS-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCCC1)Cc1ccc(C(F)(F)F)cc1 ZINC001209451468 1050061169 /nfs/dbraw/zinc/06/11/69/1050061169.db2.gz ZUDVFWLSWOJEMS-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP C[N@H+](CCC[NH+]1CCCCC1)Cc1ccccc1C(F)(F)F ZINC001209451400 1050061598 /nfs/dbraw/zinc/06/15/98/1050061598.db2.gz XSKPIZRFGYAHRD-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCCC1)Cc1ccccc1C(F)(F)F ZINC001209451400 1050061604 /nfs/dbraw/zinc/06/16/04/1050061604.db2.gz XSKPIZRFGYAHRD-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP Cc1ccc2[nH]cc(C[N@H+](C)CC3CC[NH+](C(C)C)CC3)c2c1 ZINC001209496116 1050064166 /nfs/dbraw/zinc/06/41/66/1050064166.db2.gz BMABOSIYOMCPLY-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000573127391 1050133824 /nfs/dbraw/zinc/13/38/24/1050133824.db2.gz ZZHFGTTZAFUIDF-GDBMZVCRSA-N 2 1 306.881 4.083 20 0 DIADMP CSC1(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)CC1 ZINC000347931525 1050161939 /nfs/dbraw/zinc/16/19/39/1050161939.db2.gz ZHHDUVIMDPJGNF-MRXNPFEDSA-N 2 1 318.530 4.046 20 0 DIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)[C@H]1CCc2ccccc21 ZINC000348070178 1050174397 /nfs/dbraw/zinc/17/43/97/1050174397.db2.gz IQOVLHVRVQSCLE-FQEVSTJZSA-N 2 1 311.473 4.371 20 0 DIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)[C@H]1CCc2ccccc21 ZINC000348070178 1050174404 /nfs/dbraw/zinc/17/44/04/1050174404.db2.gz IQOVLHVRVQSCLE-FQEVSTJZSA-N 2 1 311.473 4.371 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc(F)cc1)C(C)C ZINC000348077062 1050176882 /nfs/dbraw/zinc/17/68/82/1050176882.db2.gz QOIPSXZZJCZBMU-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000348077062 1050176885 /nfs/dbraw/zinc/17/68/85/1050176885.db2.gz QOIPSXZZJCZBMU-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP CC[N@H+](CCC1CC[NH+](C/C(Cl)=C\Cl)CC1)CC1CC1 ZINC000771474638 1050253387 /nfs/dbraw/zinc/25/33/87/1050253387.db2.gz ANPCODKLQDDIHQ-LFIBNONCSA-N 2 1 319.320 4.139 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C/C(Cl)=C\Cl)CC1)CC1CC1 ZINC000771474638 1050253399 /nfs/dbraw/zinc/25/33/99/1050253399.db2.gz ANPCODKLQDDIHQ-LFIBNONCSA-N 2 1 319.320 4.139 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000574204193 1050376675 /nfs/dbraw/zinc/37/66/75/1050376675.db2.gz UBGOKCKHXHXZGU-QYZOEREBSA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000574204193 1050376687 /nfs/dbraw/zinc/37/66/87/1050376687.db2.gz UBGOKCKHXHXZGU-QYZOEREBSA-N 2 1 317.521 4.126 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171131120 1050454216 /nfs/dbraw/zinc/45/42/16/1050454216.db2.gz VKIRGXMLYFEZBM-IBGZPJMESA-N 2 1 320.908 4.004 20 0 DIADMP F[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000574452387 1050478043 /nfs/dbraw/zinc/47/80/43/1050478043.db2.gz FVECYSWYZGVAJJ-LTFPLMDUSA-N 2 1 316.464 4.052 20 0 DIADMP CC(C)CCC[C@@H](C)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170070984 1050579243 /nfs/dbraw/zinc/57/92/43/1050579243.db2.gz HQMWRHVEGHPJBI-QWFCFKBJSA-N 2 1 317.521 4.368 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045816 1050626461 /nfs/dbraw/zinc/62/64/61/1050626461.db2.gz SHYJMICTZFVQNB-QYZOEREBSA-N 2 1 316.464 4.054 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045816 1050626467 /nfs/dbraw/zinc/62/64/67/1050626467.db2.gz SHYJMICTZFVQNB-QYZOEREBSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc(Cl)sc1Cl ZINC000575060395 1050628914 /nfs/dbraw/zinc/62/89/14/1050628914.db2.gz XVXNEEQCRLXKPV-VIFPVBQESA-N 2 1 315.269 4.364 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(-c2ccccc2)cn1 ZINC000845941160 1050636312 /nfs/dbraw/zinc/63/63/12/1050636312.db2.gz CSKXNQJTMCATGP-VDGAXYAQSA-N 2 1 323.484 4.272 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000069754022 1050641873 /nfs/dbraw/zinc/64/18/73/1050641873.db2.gz KMZSDDHXIAKVNJ-UHFFFAOYSA-N 2 1 305.425 4.038 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc2cc[nH]c21 ZINC001144718627 1050668556 /nfs/dbraw/zinc/66/85/56/1050668556.db2.gz UFRWLYAOHGYGDZ-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc2cc[nH]c21 ZINC001144718627 1050668560 /nfs/dbraw/zinc/66/85/60/1050668560.db2.gz UFRWLYAOHGYGDZ-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc2cc[nH]c21 ZINC001144718627 1050668564 /nfs/dbraw/zinc/66/85/64/1050668564.db2.gz UFRWLYAOHGYGDZ-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246609809 1050733946 /nfs/dbraw/zinc/73/39/46/1050733946.db2.gz NVSSYCWQCNDHAU-SJLPKXTDSA-N 2 1 312.567 4.152 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001170109370 1050839173 /nfs/dbraw/zinc/83/91/73/1050839173.db2.gz OJXJARCTJQSDJW-MEZGBDMJSA-N 2 1 312.501 4.303 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4cccs4)C3)CC2)C1 ZINC001170137057 1050962451 /nfs/dbraw/zinc/96/24/51/1050962451.db2.gz MRXIYWBBPHTDHJ-IAGOWNOFSA-N 2 1 318.530 4.225 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000348188641 1051003623 /nfs/dbraw/zinc/00/36/23/1051003623.db2.gz RMUWAWIPDYQWRX-KXBFYZLASA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000348188641 1051003632 /nfs/dbraw/zinc/00/36/32/1051003632.db2.gz RMUWAWIPDYQWRX-KXBFYZLASA-N 2 1 315.436 4.194 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+]([C@H]3CC[C@@H](C)C3)C[C@@H]21 ZINC001170145907 1051006976 /nfs/dbraw/zinc/00/69/76/1051006976.db2.gz WVMXJYPONKVETJ-ZALSBGIRSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+]([C@H]3CC[C@@H](C)C3)C[C@@H]21 ZINC001170145907 1051006987 /nfs/dbraw/zinc/00/69/87/1051006987.db2.gz WVMXJYPONKVETJ-ZALSBGIRSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+]([C@H]3CC[C@@H](C)C3)C[C@@H]21 ZINC001170145907 1051007001 /nfs/dbraw/zinc/00/70/01/1051007001.db2.gz WVMXJYPONKVETJ-ZALSBGIRSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccccc1SC(C)(C)C ZINC000791136043 1051032314 /nfs/dbraw/zinc/03/23/14/1051032314.db2.gz LROGAYZGWYPAHS-AWEZNQCLSA-N 2 1 306.519 4.322 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001170151286 1051037630 /nfs/dbraw/zinc/03/76/30/1051037630.db2.gz QLOUWWXWBLNKMA-PXNSSMCTSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1cccc2c1CC[C@H]([N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171559055 1051166463 /nfs/dbraw/zinc/16/64/63/1051166463.db2.gz UQVPSTHSDJJPKZ-UFYCRDLUSA-N 2 1 314.517 4.080 20 0 DIADMP CC(C)C[N@@H+]([C@@H](C)Cc1ccccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170263919 1051168089 /nfs/dbraw/zinc/16/80/89/1051168089.db2.gz RKBQWDUNWYIQOJ-SZMVWBNQSA-N 2 1 322.924 4.499 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC001170250187 1051171603 /nfs/dbraw/zinc/17/16/03/1051171603.db2.gz HDONSUKWHNXTLB-HOTGVXAUSA-N 2 1 308.897 4.125 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(F)c(Cl)c2)CC1(C)C ZINC001171618758 1051177906 /nfs/dbraw/zinc/17/79/06/1051177906.db2.gz BLFIMBLOEZMBIA-UHFFFAOYSA-N 2 1 312.860 4.220 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]C(C)(C)c2cc(F)cc(F)c2)CC1(C)C ZINC001171624827 1051179011 /nfs/dbraw/zinc/17/90/11/1051179011.db2.gz ZCTIYNTZRFSYMY-UHFFFAOYSA-N 2 1 324.459 4.441 20 0 DIADMP CC[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ncccc1C ZINC001171619513 1051180299 /nfs/dbraw/zinc/18/02/99/1051180299.db2.gz NKLZWFVOCQOPRB-INIZCTEOSA-N 2 1 303.494 4.082 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]C2(c3ccc(F)cc3)CC2)CC1(C)C ZINC001171626284 1051181783 /nfs/dbraw/zinc/18/17/83/1051181783.db2.gz WPSFQMRNIIVOKF-UHFFFAOYSA-N 2 1 304.453 4.056 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+]2CCCC[C@H](CCC[NH3+])C2)cc1 ZINC001171664477 1051187492 /nfs/dbraw/zinc/18/74/92/1051187492.db2.gz AKDQHQJPNJLFHL-UYAOXDASSA-N 2 1 302.506 4.157 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@H](c3ccc(F)cc3)C2)CC1(C)C ZINC001171639971 1051193981 /nfs/dbraw/zinc/19/39/81/1051193981.db2.gz XFMGJNRTGKEIRR-INIZCTEOSA-N 2 1 318.480 4.266 20 0 DIADMP C[N@@H+](CCCc1ccccc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171636544 1051194710 /nfs/dbraw/zinc/19/47/10/1051194710.db2.gz HYZWYDXYAWFXDQ-UHFFFAOYSA-N 2 1 302.506 4.202 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+]2Cc3ccc(Cl)cc3C2)CC1(C)C ZINC001171641152 1051196357 /nfs/dbraw/zinc/19/63/57/1051196357.db2.gz DXBBTTMNKYKIJX-UHFFFAOYSA-N 2 1 306.881 4.307 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2Cc3ccc(Cl)cc3C2)CC1(C)C ZINC001171641152 1051196362 /nfs/dbraw/zinc/19/63/62/1051196362.db2.gz DXBBTTMNKYKIJX-UHFFFAOYSA-N 2 1 306.881 4.307 20 0 DIADMP Cc1ccc([C@H]2CCC[N@@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)cn1 ZINC001171643066 1051197689 /nfs/dbraw/zinc/19/76/89/1051197689.db2.gz RIDZJYDTZVZKGZ-GOSISDBHSA-N 2 1 315.505 4.178 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171641163 1051197801 /nfs/dbraw/zinc/19/78/01/1051197801.db2.gz NFRWTBSWHPVZRB-UHFFFAOYSA-N 2 1 302.506 4.468 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+]2CCc3cccc(Cl)c3C2)CC1(C)C ZINC001171644040 1051197851 /nfs/dbraw/zinc/19/78/51/1051197851.db2.gz ZNYYKEDORAWSGQ-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCc3cccc(Cl)c3C2)CC1(C)C ZINC001171644040 1051197860 /nfs/dbraw/zinc/19/78/60/1051197860.db2.gz ZNYYKEDORAWSGQ-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@]1(C)Cc1ccccc1Cl ZINC001171900193 1051235621 /nfs/dbraw/zinc/23/56/21/1051235621.db2.gz ITGMKKKMRDVXDN-LJQANCHMSA-N 2 1 322.924 4.469 20 0 DIADMP CC1CC(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171963554 1051248549 /nfs/dbraw/zinc/24/85/49/1051248549.db2.gz IBNPLOIQCWLNNX-KVZIAJEVSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)C[C@@H]([NH2+]Cc2cccs2)CC[N@H+]1Cc1ccccc1 ZINC001171964632 1051248934 /nfs/dbraw/zinc/24/89/34/1051248934.db2.gz MAWJMMAXSRJJEB-KRWDZBQOSA-N 2 1 314.498 4.281 20 0 DIADMP CC1(C)C[C@H]([NH2+]Cc2ccsc2)CC[N@@H+]1Cc1ccccc1 ZINC001171967391 1051249878 /nfs/dbraw/zinc/24/98/78/1051249878.db2.gz ZFKUQWSZBRPGOG-GOSISDBHSA-N 2 1 314.498 4.281 20 0 DIADMP CC1(C)C[C@H]([NH2+]Cc2ccsc2)CC[N@H+]1Cc1ccccc1 ZINC001171967391 1051249888 /nfs/dbraw/zinc/24/98/88/1051249888.db2.gz ZFKUQWSZBRPGOG-GOSISDBHSA-N 2 1 314.498 4.281 20 0 DIADMP CC1(C)C[C@H]([NH2+]Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001171965058 1051249944 /nfs/dbraw/zinc/24/99/44/1051249944.db2.gz NVMXUPBVQPXTCY-HXUWFJFHSA-N 2 1 308.469 4.219 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCCC[C@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976324 1051262759 /nfs/dbraw/zinc/26/27/59/1051262759.db2.gz KDZIJNTZCSDMQI-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCCC[C@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976324 1051262771 /nfs/dbraw/zinc/26/27/71/1051262771.db2.gz KDZIJNTZCSDMQI-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCCC[C@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976324 1051262782 /nfs/dbraw/zinc/26/27/82/1051262782.db2.gz KDZIJNTZCSDMQI-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCCC[C@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976324 1051262794 /nfs/dbraw/zinc/26/27/94/1051262794.db2.gz KDZIJNTZCSDMQI-OALUTQOASA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCCC[C@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976325 1051264983 /nfs/dbraw/zinc/26/49/83/1051264983.db2.gz KDZIJNTZCSDMQI-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCCC[C@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976325 1051265000 /nfs/dbraw/zinc/26/50/00/1051265000.db2.gz KDZIJNTZCSDMQI-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCCC[C@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976325 1051265015 /nfs/dbraw/zinc/26/50/15/1051265015.db2.gz KDZIJNTZCSDMQI-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCCC[C@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976325 1051265027 /nfs/dbraw/zinc/26/50/27/1051265027.db2.gz KDZIJNTZCSDMQI-RBUKOAKNSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C1CCC1 ZINC001171981216 1051268064 /nfs/dbraw/zinc/26/80/64/1051268064.db2.gz ZSGCLMVDMLDZOV-QFBILLFUSA-N 2 1 300.490 4.208 20 0 DIADMP CC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171978201 1051268540 /nfs/dbraw/zinc/26/85/40/1051268540.db2.gz XBTQVUYQLGNVKT-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP CC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171978201 1051268546 /nfs/dbraw/zinc/26/85/46/1051268546.db2.gz XBTQVUYQLGNVKT-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP C[N@H+](C1CC(F)(F)C1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171978242 1051269447 /nfs/dbraw/zinc/26/94/47/1051269447.db2.gz XITPMSYYWHKPRN-INIZCTEOSA-N 2 1 322.443 4.159 20 0 DIADMP C[N@@H+](C1CC(F)(F)C1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171978242 1051269456 /nfs/dbraw/zinc/26/94/56/1051269456.db2.gz XITPMSYYWHKPRN-INIZCTEOSA-N 2 1 322.443 4.159 20 0 DIADMP C[NH+](C1CC(F)(F)C1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171978242 1051269463 /nfs/dbraw/zinc/26/94/63/1051269463.db2.gz XITPMSYYWHKPRN-INIZCTEOSA-N 2 1 322.443 4.159 20 0 DIADMP C[NH+](C1CC(F)(F)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171978242 1051269468 /nfs/dbraw/zinc/26/94/68/1051269468.db2.gz XITPMSYYWHKPRN-INIZCTEOSA-N 2 1 322.443 4.159 20 0 DIADMP CC1(C)[C@@H]2C[N@@H+]([C@@H]3CC[NH+](Cc4ccccc4)C(C)(C)C3)C[C@@H]21 ZINC001171986261 1051272383 /nfs/dbraw/zinc/27/23/83/1051272383.db2.gz GHLCOSAZJSQPIF-QRVBRYPASA-N 2 1 312.501 4.017 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@@H]3CC[N@H+](Cc4ccccc4)C(C)(C)C3)C[C@@H]21 ZINC001171986261 1051272390 /nfs/dbraw/zinc/27/23/90/1051272390.db2.gz GHLCOSAZJSQPIF-QRVBRYPASA-N 2 1 312.501 4.017 20 0 DIADMP CC1(C)[C@@H]2C[NH+]([C@@H]3CC[N@@H+](Cc4ccccc4)C(C)(C)C3)C[C@@H]21 ZINC001171986261 1051272402 /nfs/dbraw/zinc/27/24/02/1051272402.db2.gz GHLCOSAZJSQPIF-QRVBRYPASA-N 2 1 312.501 4.017 20 0 DIADMP CC1(C)CC([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172075224 1051273976 /nfs/dbraw/zinc/27/39/76/1051273976.db2.gz DJSDXRQXDNCIQW-FNLKRUPLSA-N 2 1 312.501 4.350 20 0 DIADMP C[N@H+]([C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1)C(C)(C)C ZINC001172072167 1051274684 /nfs/dbraw/zinc/27/46/84/1051274684.db2.gz HTVUEXNQXCXYKH-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@@H+]([C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1)C(C)(C)C ZINC001172072167 1051274689 /nfs/dbraw/zinc/27/46/89/1051274689.db2.gz HTVUEXNQXCXYKH-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]([C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC001172072167 1051274691 /nfs/dbraw/zinc/27/46/91/1051274691.db2.gz HTVUEXNQXCXYKH-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]([C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC001172072167 1051274699 /nfs/dbraw/zinc/27/46/99/1051274699.db2.gz HTVUEXNQXCXYKH-BWTSREIZSA-N 2 1 300.490 4.302 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C4CCC2CC4)C3)cc1 ZINC001172073824 1051274866 /nfs/dbraw/zinc/27/48/66/1051274866.db2.gz CRRHBKLHUXPBDZ-HNZUOSPBSA-N 2 1 310.485 4.199 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C4CCC2CC4)C3)cc1 ZINC001172073824 1051274877 /nfs/dbraw/zinc/27/48/77/1051274877.db2.gz CRRHBKLHUXPBDZ-HNZUOSPBSA-N 2 1 310.485 4.199 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CC4(CCC4)C2)C3)cc1 ZINC001172070340 1051275241 /nfs/dbraw/zinc/27/52/41/1051275241.db2.gz ZHDZOGUVOWPZES-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP C[N@H+](C1CCCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074909 1051275912 /nfs/dbraw/zinc/27/59/12/1051275912.db2.gz MSWJHUQVIDXBLO-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@@H+](C1CCCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074909 1051275923 /nfs/dbraw/zinc/27/59/23/1051275923.db2.gz MSWJHUQVIDXBLO-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172074909 1051275938 /nfs/dbraw/zinc/27/59/38/1051275938.db2.gz MSWJHUQVIDXBLO-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172074909 1051275948 /nfs/dbraw/zinc/27/59/48/1051275948.db2.gz MSWJHUQVIDXBLO-AERCQKQUSA-N 2 1 312.501 4.447 20 0 DIADMP CC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172079992 1051279072 /nfs/dbraw/zinc/27/90/72/1051279072.db2.gz RUGIQADYWJRQPZ-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP CC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001172079992 1051279084 /nfs/dbraw/zinc/27/90/84/1051279084.db2.gz RUGIQADYWJRQPZ-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076189 1051279256 /nfs/dbraw/zinc/27/92/56/1051279256.db2.gz WSCZAWSCGRUOJW-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076189 1051279265 /nfs/dbraw/zinc/27/92/65/1051279265.db2.gz WSCZAWSCGRUOJW-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076189 1051279272 /nfs/dbraw/zinc/27/92/72/1051279272.db2.gz WSCZAWSCGRUOJW-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001172076189 1051279282 /nfs/dbraw/zinc/27/92/82/1051279282.db2.gz WSCZAWSCGRUOJW-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2CC=CCC2)C3)cc1 ZINC001172065879 1051283582 /nfs/dbraw/zinc/28/35/82/1051283582.db2.gz AQHTWSHYEGAGQR-BURNTYAHSA-N 2 1 310.485 4.270 20 0 DIADMP CC1CC([N@H+](C)[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172067534 1051284489 /nfs/dbraw/zinc/28/44/89/1051284489.db2.gz CVAFZRXNWSLOKD-MDGDRNLVSA-N 2 1 312.501 4.302 20 0 DIADMP CC1CC([N@@H+](C)[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172067534 1051284501 /nfs/dbraw/zinc/28/45/01/1051284501.db2.gz CVAFZRXNWSLOKD-MDGDRNLVSA-N 2 1 312.501 4.302 20 0 DIADMP CC1CC([NH+](C)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172067534 1051284516 /nfs/dbraw/zinc/28/45/16/1051284516.db2.gz CVAFZRXNWSLOKD-MDGDRNLVSA-N 2 1 312.501 4.302 20 0 DIADMP CC1CC([NH+](C)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172067534 1051284528 /nfs/dbraw/zinc/28/45/28/1051284528.db2.gz CVAFZRXNWSLOKD-MDGDRNLVSA-N 2 1 312.501 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2CC=CCC2)C3)cc1 ZINC001172065882 1051284735 /nfs/dbraw/zinc/28/47/35/1051284735.db2.gz AQHTWSHYEGAGQR-XSDIEEQYSA-N 2 1 310.485 4.270 20 0 DIADMP CC1CC(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172064085 1051285668 /nfs/dbraw/zinc/28/56/68/1051285668.db2.gz FLCOESMCVYEUCA-CBRFPRNKSA-N 2 1 312.501 4.208 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCSc1ccc(Cl)cc1)C2 ZINC001172100249 1051286301 /nfs/dbraw/zinc/28/63/01/1051286301.db2.gz CAFVEFFMFILZKW-PHZGNYQRSA-N 2 1 324.921 4.037 20 0 DIADMP C[N@H+](Cc1ccc2ccccc2c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127687 1051290084 /nfs/dbraw/zinc/29/00/84/1051290084.db2.gz JJMPXOSERSOITO-WKCHPHFGSA-N 2 1 308.469 4.287 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172127687 1051290099 /nfs/dbraw/zinc/29/00/99/1051290099.db2.gz JJMPXOSERSOITO-WKCHPHFGSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1ccc2ccccc2c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172127687 1051290109 /nfs/dbraw/zinc/29/01/09/1051290109.db2.gz JJMPXOSERSOITO-WKCHPHFGSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1ccc2ccccc2c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172127687 1051290121 /nfs/dbraw/zinc/29/01/21/1051290121.db2.gz JJMPXOSERSOITO-WKCHPHFGSA-N 2 1 308.469 4.287 20 0 DIADMP C[C@@H]1C[C@@H](F)C[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070063 1051290516 /nfs/dbraw/zinc/29/05/16/1051290516.db2.gz WLIVRYIJUBRUMN-RACLHMPKSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@@H](F)C[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070063 1051290526 /nfs/dbraw/zinc/29/05/26/1051290526.db2.gz WLIVRYIJUBRUMN-RACLHMPKSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@@H](F)C[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070063 1051290548 /nfs/dbraw/zinc/29/05/48/1051290548.db2.gz WLIVRYIJUBRUMN-RACLHMPKSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@@H](F)C[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070063 1051290557 /nfs/dbraw/zinc/29/05/57/1051290557.db2.gz WLIVRYIJUBRUMN-RACLHMPKSA-N 2 1 316.464 4.004 20 0 DIADMP CCCC[C@@H](CC)COCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172107879 1051295433 /nfs/dbraw/zinc/29/54/33/1051295433.db2.gz LCTVGHSSRIERHH-WTGUMLROSA-N 2 1 324.553 4.214 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103104 1051295788 /nfs/dbraw/zinc/29/57/88/1051295788.db2.gz RWQFEVKJUYBCNI-VMYOGZALSA-N 2 1 316.533 4.196 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103104 1051295804 /nfs/dbraw/zinc/29/58/04/1051295804.db2.gz RWQFEVKJUYBCNI-VMYOGZALSA-N 2 1 316.533 4.196 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1c3ccccc3-c3ccccc31)C2 ZINC001172108387 1051296879 /nfs/dbraw/zinc/29/68/79/1051296879.db2.gz VWUWEEBUGDSDKN-OSYLJGHBSA-N 2 1 318.464 4.361 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)C2 ZINC001172102305 1051297359 /nfs/dbraw/zinc/29/73/59/1051297359.db2.gz LWRZZDSZEIJMHY-QDMKHBRRSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)C2 ZINC001172102305 1051297367 /nfs/dbraw/zinc/29/73/67/1051297367.db2.gz LWRZZDSZEIJMHY-QDMKHBRRSA-N 2 1 313.272 4.098 20 0 DIADMP CCCC[C@H](CC)COCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172107877 1051298307 /nfs/dbraw/zinc/29/83/07/1051298307.db2.gz LCTVGHSSRIERHH-HAGHYFMRSA-N 2 1 324.553 4.214 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112455 1051299919 /nfs/dbraw/zinc/29/99/19/1051299919.db2.gz XCUDCSBLPPZMEG-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112455 1051299932 /nfs/dbraw/zinc/29/99/32/1051299932.db2.gz XCUDCSBLPPZMEG-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP CSc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172110647 1051301483 /nfs/dbraw/zinc/30/14/83/1051301483.db2.gz PQVKARYYJVRJDL-QSPRXWTASA-N 2 1 304.503 4.074 20 0 DIADMP CSc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172110647 1051301492 /nfs/dbraw/zinc/30/14/92/1051301492.db2.gz PQVKARYYJVRJDL-QSPRXWTASA-N 2 1 304.503 4.074 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C(C)C)c1 ZINC001172111582 1051303021 /nfs/dbraw/zinc/30/30/21/1051303021.db2.gz VRAHVWLQIIOMIT-YSTOQKLRSA-N 2 1 300.490 4.297 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)C(C)C)c1 ZINC001172111582 1051303037 /nfs/dbraw/zinc/30/30/37/1051303037.db2.gz VRAHVWLQIIOMIT-YSTOQKLRSA-N 2 1 300.490 4.297 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1C ZINC001172116211 1051303898 /nfs/dbraw/zinc/30/38/98/1051303898.db2.gz YDNOAJPFHOYQTA-AJYBTWMASA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1C ZINC001172116211 1051303903 /nfs/dbraw/zinc/30/39/03/1051303903.db2.gz YDNOAJPFHOYQTA-AJYBTWMASA-N 2 1 300.490 4.359 20 0 DIADMP C[N@H+](Cc1cccc2ccccc21)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172122896 1051304597 /nfs/dbraw/zinc/30/45/97/1051304597.db2.gz UZMGFCPUMKTISH-PMOLBWCYSA-N 2 1 308.469 4.287 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172122896 1051304604 /nfs/dbraw/zinc/30/46/04/1051304604.db2.gz UZMGFCPUMKTISH-PMOLBWCYSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1cccc2ccccc21)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172122896 1051304611 /nfs/dbraw/zinc/30/46/11/1051304611.db2.gz UZMGFCPUMKTISH-PMOLBWCYSA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1cccc2ccccc21)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172122896 1051304617 /nfs/dbraw/zinc/30/46/17/1051304617.db2.gz UZMGFCPUMKTISH-PMOLBWCYSA-N 2 1 308.469 4.287 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(C)(C)c1cccc(Cl)c1)C2 ZINC001172117569 1051305108 /nfs/dbraw/zinc/30/51/08/1051305108.db2.gz MPQRZTJLTXOKMN-BJWYYQGGSA-N 2 1 306.881 4.180 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(C)(C)c1cccc(Cl)c1)C2 ZINC001172117569 1051305112 /nfs/dbraw/zinc/30/51/12/1051305112.db2.gz MPQRZTJLTXOKMN-BJWYYQGGSA-N 2 1 306.881 4.180 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001172121562 1051305912 /nfs/dbraw/zinc/30/59/12/1051305912.db2.gz KOSBPJMTMZRVRV-PASDCYSWSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001172121562 1051305923 /nfs/dbraw/zinc/30/59/23/1051305923.db2.gz KOSBPJMTMZRVRV-PASDCYSWSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001172121562 1051305930 /nfs/dbraw/zinc/30/59/30/1051305930.db2.gz KOSBPJMTMZRVRV-PASDCYSWSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121781 1051306046 /nfs/dbraw/zinc/30/60/46/1051306046.db2.gz MLIBZZVJJLZRRQ-CLWJZODNSA-N 2 1 316.464 4.368 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121781 1051306052 /nfs/dbraw/zinc/30/60/52/1051306052.db2.gz MLIBZZVJJLZRRQ-CLWJZODNSA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121781 1051306058 /nfs/dbraw/zinc/30/60/58/1051306058.db2.gz MLIBZZVJJLZRRQ-CLWJZODNSA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCCC[C@H]1c1ccccc1F)C2 ZINC001172121781 1051306062 /nfs/dbraw/zinc/30/60/62/1051306062.db2.gz MLIBZZVJJLZRRQ-CLWJZODNSA-N 2 1 316.464 4.368 20 0 DIADMP COc1cccc2cc(C[NH2+]CCC[NH+](C(C)C)C(C)C)oc21 ZINC000746052924 1051312572 /nfs/dbraw/zinc/31/25/72/1051312572.db2.gz FKLFTKUMEWWDGE-UHFFFAOYSA-N 2 1 318.461 4.040 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(Nc2cc[nH+]cc2C(F)(F)F)cc1 ZINC001215743252 1051337683 /nfs/dbraw/zinc/33/76/83/1051337683.db2.gz UOGRQMMWVXHNGZ-UHFFFAOYSA-N 2 1 323.362 4.012 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(Nc2cccc3[nH+]cn(C)c32)cc1 ZINC001215746502 1051340257 /nfs/dbraw/zinc/34/02/57/1051340257.db2.gz MNTHYGDSKBYFTD-UHFFFAOYSA-N 2 1 308.429 4.063 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000379882621 1051357637 /nfs/dbraw/zinc/35/76/37/1051357637.db2.gz VSDXRUCPSGIJLK-QFIPXVFZSA-N 2 1 320.480 4.237 20 0 DIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334220 1051359072 /nfs/dbraw/zinc/35/90/72/1051359072.db2.gz LUVRTLABZPNOJJ-XMTFNYHQSA-N 2 1 312.542 4.198 20 0 DIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334218 1051359090 /nfs/dbraw/zinc/35/90/90/1051359090.db2.gz LUVRTLABZPNOJJ-BRSBDYLESA-N 2 1 312.542 4.198 20 0 DIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334466 1051359142 /nfs/dbraw/zinc/35/91/42/1051359142.db2.gz MLOMUUMUZUBSHP-HNBVOPMISA-N 2 1 324.553 4.342 20 0 DIADMP CC[C@@H](C)OCC[C@@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338543 1051361265 /nfs/dbraw/zinc/36/12/65/1051361265.db2.gz ZADRAMOMJLNGBD-YWTNHNAXSA-N 2 1 310.526 4.095 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C[C@H]1C ZINC001172370949 1051378033 /nfs/dbraw/zinc/37/80/33/1051378033.db2.gz RPUWECGCHPXJJN-BZUAXINKSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C[C@@H]1C ZINC001172369402 1051378064 /nfs/dbraw/zinc/37/80/64/1051378064.db2.gz LXEXAMRCLIGVNQ-RVKKMQEKSA-N 2 1 320.908 4.415 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001172403639 1051380953 /nfs/dbraw/zinc/38/09/53/1051380953.db2.gz NGSXTQUWAIJGHD-PMACEKPBSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@@H](CC(C)C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172403639 1051380961 /nfs/dbraw/zinc/38/09/61/1051380961.db2.gz NGSXTQUWAIJGHD-PMACEKPBSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@@H](CC(C)C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172403639 1051380971 /nfs/dbraw/zinc/38/09/71/1051380971.db2.gz NGSXTQUWAIJGHD-PMACEKPBSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@@H](CC(C)C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001172399778 1051398081 /nfs/dbraw/zinc/39/80/81/1051398081.db2.gz DFBCKJRYERAKSH-FQEVSTJZSA-N 2 1 314.517 4.334 20 0 DIADMP CC[C@@H](CC(C)C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001172399778 1051398093 /nfs/dbraw/zinc/39/80/93/1051398093.db2.gz DFBCKJRYERAKSH-FQEVSTJZSA-N 2 1 314.517 4.334 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001170451063 1051412606 /nfs/dbraw/zinc/41/26/06/1051412606.db2.gz GYGPSIMOOSIHQT-LAUBAEHRSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001170451063 1051412614 /nfs/dbraw/zinc/41/26/14/1051412614.db2.gz GYGPSIMOOSIHQT-LAUBAEHRSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001170451063 1051412620 /nfs/dbraw/zinc/41/26/20/1051412620.db2.gz GYGPSIMOOSIHQT-LAUBAEHRSA-N 2 1 314.517 4.463 20 0 DIADMP CC(C)COCC[C@@H](C)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172468038 1051416337 /nfs/dbraw/zinc/41/63/37/1051416337.db2.gz NLDOVFDLAJQMJE-KZNAEPCWSA-N 2 1 312.542 4.056 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172549515 1051432967 /nfs/dbraw/zinc/43/29/67/1051432967.db2.gz PPZPQOZJMDWHFA-WIYYLYMNSA-N 2 1 312.501 4.271 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CC[N@@H+](CC4CCCC4)C3)C2)cc1 ZINC001172558212 1051440953 /nfs/dbraw/zinc/44/09/53/1051440953.db2.gz UDLHITPLPQALJV-HKBOAZHASA-N 2 1 312.501 4.177 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CC[N@H+](CC4CCCC4)C3)C2)cc1 ZINC001172558212 1051440960 /nfs/dbraw/zinc/44/09/60/1051440960.db2.gz UDLHITPLPQALJV-HKBOAZHASA-N 2 1 312.501 4.177 20 0 DIADMP CCCCCC[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168826578 1051446491 /nfs/dbraw/zinc/44/64/91/1051446491.db2.gz VMZQXLCLDQOIPP-UHFFFAOYSA-N 2 1 303.494 4.200 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([NH+]3CC4(C3)CC[N@@H+](CC3CC3)C4)C2)cc1 ZINC001172539884 1051453408 /nfs/dbraw/zinc/45/34/08/1051453408.db2.gz DYFJSDUGGDXDRO-NHCUHLMSSA-N 2 1 324.512 4.131 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([NH+]3CC4(C3)CC[N@H+](CC3CC3)C4)C2)cc1 ZINC001172539884 1051453418 /nfs/dbraw/zinc/45/34/18/1051453418.db2.gz DYFJSDUGGDXDRO-NHCUHLMSSA-N 2 1 324.512 4.131 20 0 DIADMP CCC(CC)[N@H+](C1CC(C)(C)OC(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172653504 1051472240 /nfs/dbraw/zinc/47/22/40/1051472240.db2.gz KONTXAOVYKKMIH-JCNLHEQBSA-N 2 1 324.553 4.483 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001169070419 1051505824 /nfs/dbraw/zinc/50/58/24/1051505824.db2.gz QCTOMPZCUMVUHF-HMXCVIKNSA-N 2 1 316.533 4.352 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169099577 1051508988 /nfs/dbraw/zinc/50/89/88/1051508988.db2.gz BTENAESUJNSTES-RDGPPVDQSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001169101628 1051512809 /nfs/dbraw/zinc/51/28/09/1051512809.db2.gz USCKXQJOSUXHQT-GGXPGOJBSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001169101628 1051512821 /nfs/dbraw/zinc/51/28/21/1051512821.db2.gz USCKXQJOSUXHQT-GGXPGOJBSA-N 2 1 304.453 4.128 20 0 DIADMP Cc1ccc2c(c1)C[C@@H]([N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828016 1051518938 /nfs/dbraw/zinc/51/89/38/1051518938.db2.gz HWEAYXRBOUJBAB-ACRUOGEOSA-N 2 1 314.517 4.080 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169090702 1051519148 /nfs/dbraw/zinc/51/91/48/1051519148.db2.gz LLQIBZCQMQUABC-BTTYYORXSA-N 2 1 313.272 4.017 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N[C@@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116973 1051519181 /nfs/dbraw/zinc/51/91/81/1051519181.db2.gz VBPXXTLNPVUCRJ-LJCCNALRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H](CC1CCC1)c1ccccc1F)C2 ZINC001169116973 1051519190 /nfs/dbraw/zinc/51/91/90/1051519190.db2.gz VBPXXTLNPVUCRJ-LJCCNALRSA-N 2 1 316.464 4.272 20 0 DIADMP CC(C)Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001169117873 1051522245 /nfs/dbraw/zinc/52/22/45/1051522245.db2.gz BBQCWDYAGOPYHC-QLIIJSOBSA-N 2 1 300.490 4.161 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(c3cccc(Cl)c3)CC1)C2 ZINC001169126102 1051522939 /nfs/dbraw/zinc/52/29/39/1051522939.db2.gz PNIYQBXCIHMKBB-REPLKXPHSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169125837 1051523110 /nfs/dbraw/zinc/52/31/10/1051523110.db2.gz MKDSXQLSFIGGMZ-AERCQKQUSA-N 2 1 320.480 4.333 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169125837 1051523123 /nfs/dbraw/zinc/52/31/23/1051523123.db2.gz MKDSXQLSFIGGMZ-AERCQKQUSA-N 2 1 320.480 4.333 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169125837 1051523137 /nfs/dbraw/zinc/52/31/37/1051523137.db2.gz MKDSXQLSFIGGMZ-AERCQKQUSA-N 2 1 320.480 4.333 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142624 1051532868 /nfs/dbraw/zinc/53/28/68/1051532868.db2.gz DRTACHJURWTTNI-CRWXNKLISA-N 2 1 310.894 4.164 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142624 1051532876 /nfs/dbraw/zinc/53/28/76/1051532876.db2.gz DRTACHJURWTTNI-CRWXNKLISA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142624 1051532888 /nfs/dbraw/zinc/53/28/88/1051532888.db2.gz DRTACHJURWTTNI-CRWXNKLISA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142624 1051532898 /nfs/dbraw/zinc/53/28/98/1051532898.db2.gz DRTACHJURWTTNI-CRWXNKLISA-N 2 1 310.894 4.164 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001172856367 1051541541 /nfs/dbraw/zinc/54/15/41/1051541541.db2.gz GNYCISKDLGTYPF-CYBMUJFWSA-N 2 1 324.871 4.004 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc3oc4ccccc4c3c2)CCC[C@@H]1C[NH3+] ZINC001206003859 1051547033 /nfs/dbraw/zinc/54/70/33/1051547033.db2.gz MZFVOQCKEPUECG-NVXWUHKLSA-N 2 1 322.452 4.393 20 0 DIADMP CC[NH+]1CCC([NH2+]C(C)(C)c2ccccc2C(F)(F)F)CC1 ZINC001169237960 1051560831 /nfs/dbraw/zinc/56/08/31/1051560831.db2.gz DHIJTTGWOVPRPW-UHFFFAOYSA-N 2 1 314.395 4.014 20 0 DIADMP CC[NH+]1CCC([NH+]2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001169247039 1051562161 /nfs/dbraw/zinc/56/21/61/1051562161.db2.gz XAUXNMZIKJFVHF-UHFFFAOYSA-N 2 1 306.881 4.004 20 0 DIADMP CC[NH+]1CCC([N@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001169246690 1051563014 /nfs/dbraw/zinc/56/30/14/1051563014.db2.gz UZUBYCZQBSABIF-UHFFFAOYSA-N 2 1 300.490 4.306 20 0 DIADMP CC[NH+]1CCC([N@@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001169246690 1051563023 /nfs/dbraw/zinc/56/30/23/1051563023.db2.gz UZUBYCZQBSABIF-UHFFFAOYSA-N 2 1 300.490 4.306 20 0 DIADMP COCCC[C@@H](C)[NH2+]CC1([NH2+][C@@H](C)c2ccccc2)CCCC1 ZINC000178532774 1051577741 /nfs/dbraw/zinc/57/77/41/1051577741.db2.gz LWQLIVAMBDTWPF-MSOLQXFVSA-N 2 1 318.505 4.055 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+]2Cc3ccccc3[C@@H](C)C2)CC1 ZINC001173109044 1051610222 /nfs/dbraw/zinc/61/02/22/1051610222.db2.gz VTQNQHGPSBEHAW-IVMQYODDSA-N 2 1 300.490 4.259 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)CC/C=C/c2cccnc2)CC1 ZINC001173113014 1051611916 /nfs/dbraw/zinc/61/19/16/1051611916.db2.gz GSBRUEZOFJXRNX-RMKNXTFCSA-N 2 1 315.505 4.070 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173250304 1051653665 /nfs/dbraw/zinc/65/36/65/1051653665.db2.gz RVNNBWVGOJBEQJ-OZOXKJRCSA-N 2 1 314.517 4.304 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272209 1051669279 /nfs/dbraw/zinc/66/92/79/1051669279.db2.gz UAPBFTAJONPKPM-OWYHZJEWSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272210 1051669463 /nfs/dbraw/zinc/66/94/63/1051669463.db2.gz UAPBFTAJONPKPM-WNHJNPCNSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272207 1051669639 /nfs/dbraw/zinc/66/96/39/1051669639.db2.gz UAPBFTAJONPKPM-NXWXRZEISA-N 2 1 318.480 4.476 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@@H](C[NH3+])[C@@H](C)C3)c(C)c12 ZINC001206014568 1051669674 /nfs/dbraw/zinc/66/96/74/1051669674.db2.gz XSNAVRNQCRNJII-FZMZJTMJSA-N 2 1 322.543 4.386 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)C1 ZINC001173273489 1051670995 /nfs/dbraw/zinc/67/09/95/1051670995.db2.gz FGZBHDDODWKUKW-RMVXJAJNSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291779 1051693483 /nfs/dbraw/zinc/69/34/83/1051693483.db2.gz CLGMSLMYJXKJKH-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291779 1051693488 /nfs/dbraw/zinc/69/34/88/1051693488.db2.gz CLGMSLMYJXKJKH-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP C[NH+]1CCC2(CC[N@H+]([C@H]3CCCC4(CCCCC4)C3)C2)CC1 ZINC001173342994 1051703052 /nfs/dbraw/zinc/70/30/52/1051703052.db2.gz FSWNHVMTEKEJKW-SFHVURJKSA-N 2 1 304.522 4.297 20 0 DIADMP c1[nH+]cn([C@H]2CCCC3(CCCCC3)C2)c1C1CC[NH2+]CC1 ZINC001173347805 1051705203 /nfs/dbraw/zinc/70/52/03/1051705203.db2.gz AVCQYBIIUIDECV-KRWDZBQOSA-N 2 1 301.478 4.416 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)c(F)c1 ZINC000183199151 1051709712 /nfs/dbraw/zinc/70/97/12/1051709712.db2.gz DBGUYVRWXDPYDN-OFQRWUPVSA-N 2 1 322.443 4.268 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000183185580 1051710025 /nfs/dbraw/zinc/71/00/25/1051710025.db2.gz VPHBYAIICHPPAD-JENIJYKNSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)ccc1F ZINC000183190370 1051710332 /nfs/dbraw/zinc/71/03/32/1051710332.db2.gz QBMKSMAFRZWAQU-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1F ZINC000183190370 1051710341 /nfs/dbraw/zinc/71/03/41/1051710341.db2.gz QBMKSMAFRZWAQU-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183197368 1051710734 /nfs/dbraw/zinc/71/07/34/1051710734.db2.gz XIBVETZKLCZBTH-DKICVRJWSA-N 2 1 316.464 4.056 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)o1 ZINC000183184709 1051712047 /nfs/dbraw/zinc/71/20/47/1051712047.db2.gz DBAFEGDFLDAWQY-HRCADAONSA-N 2 1 304.478 4.146 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000183184709 1051712058 /nfs/dbraw/zinc/71/20/58/1051712058.db2.gz DBAFEGDFLDAWQY-HRCADAONSA-N 2 1 304.478 4.146 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000183979145 1051724338 /nfs/dbraw/zinc/72/43/38/1051724338.db2.gz HGVLKBQTJFVDLT-AEFFLSMTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC000183979145 1051724350 /nfs/dbraw/zinc/72/43/50/1051724350.db2.gz HGVLKBQTJFVDLT-AEFFLSMTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000183979145 1051724362 /nfs/dbraw/zinc/72/43/62/1051724362.db2.gz HGVLKBQTJFVDLT-AEFFLSMTSA-N 2 1 320.427 4.073 20 0 DIADMP Cc1ccccc1[C@@H](C)[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001169899514 1051724666 /nfs/dbraw/zinc/72/46/66/1051724666.db2.gz IMJGKHLDUOBHFE-NRSPTQNISA-N 2 1 320.480 4.120 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001169899514 1051724675 /nfs/dbraw/zinc/72/46/75/1051724675.db2.gz IMJGKHLDUOBHFE-NRSPTQNISA-N 2 1 320.480 4.120 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001169899514 1051724679 /nfs/dbraw/zinc/72/46/79/1051724679.db2.gz IMJGKHLDUOBHFE-NRSPTQNISA-N 2 1 320.480 4.120 20 0 DIADMP C[C@@H](C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1)CC(C)(C)C ZINC001169898911 1051725097 /nfs/dbraw/zinc/72/50/97/1051725097.db2.gz FYJUFMKQLDZNBM-RLLQIKCJSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@@H](C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)CC(C)(C)C ZINC001169898911 1051725108 /nfs/dbraw/zinc/72/51/08/1051725108.db2.gz FYJUFMKQLDZNBM-RLLQIKCJSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@@H](C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)CC(C)(C)C ZINC001169898911 1051725123 /nfs/dbraw/zinc/72/51/23/1051725123.db2.gz FYJUFMKQLDZNBM-RLLQIKCJSA-N 2 1 314.517 4.123 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001206025681 1051732746 /nfs/dbraw/zinc/73/27/46/1051732746.db2.gz OZBSLYSRKBAJHF-CHWSQXEVSA-N 2 1 315.288 4.109 20 0 DIADMP CC[C@H]1CC[C@H]1Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000806158003 1051760915 /nfs/dbraw/zinc/76/09/15/1051760915.db2.gz VJXQVJQSBWJAEQ-FXAWDEMLSA-N 2 1 315.505 4.065 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)CC2CCC(C(F)(F)F)CC2)CC1 ZINC000185500914 1051771381 /nfs/dbraw/zinc/77/13/81/1051771381.db2.gz VRWBCCMKHCPZTL-UHFFFAOYSA-N 2 1 320.443 4.161 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)s1 ZINC001206214181 1051789637 /nfs/dbraw/zinc/78/96/37/1051789637.db2.gz XNRMJWQUZRTZLK-IRXDYDNUSA-N 2 1 312.498 4.132 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccccc1SC(C)(C)C ZINC000798183804 1051879981 /nfs/dbraw/zinc/87/99/81/1051879981.db2.gz TWRLCCCXDPCQEA-AWEZNQCLSA-N 2 1 317.502 4.204 20 0 DIADMP Cc1cscc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000494495251 1051905147 /nfs/dbraw/zinc/90/51/47/1051905147.db2.gz MVBVNIHJBOCKMS-BEFAXECRSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768267606 1051912973 /nfs/dbraw/zinc/91/29/73/1051912973.db2.gz VSUJWBNLKPMNHL-CQSZACIVSA-N 2 1 318.411 4.219 20 0 DIADMP C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768267606 1051912984 /nfs/dbraw/zinc/91/29/84/1051912984.db2.gz VSUJWBNLKPMNHL-CQSZACIVSA-N 2 1 318.411 4.219 20 0 DIADMP C[C@H](c1ccc(F)cc1F)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768269354 1051913022 /nfs/dbraw/zinc/91/30/22/1051913022.db2.gz RMJNNNGNFGPABL-CQSZACIVSA-N 2 1 318.411 4.219 20 0 DIADMP C[C@H](c1ccc(F)cc1F)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768269354 1051913035 /nfs/dbraw/zinc/91/30/35/1051913035.db2.gz RMJNNNGNFGPABL-CQSZACIVSA-N 2 1 318.411 4.219 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768330725 1051918784 /nfs/dbraw/zinc/91/87/84/1051918784.db2.gz ZCGVRYHXKWJIOE-HNNXBMFYSA-N 2 1 300.421 4.080 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccc(C[NH2+]C3CC(C(F)F)C3)cc2)C1 ZINC000768677962 1051947985 /nfs/dbraw/zinc/94/79/85/1051947985.db2.gz LTOGKZZYCNZOFI-NNGSBXSVSA-N 2 1 322.443 4.052 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](Cc2ccccc2-c2ccccc2)CC1 ZINC000769231647 1052011312 /nfs/dbraw/zinc/01/13/12/1052011312.db2.gz GFHPJIMNLORGDQ-UHFFFAOYSA-N 2 1 308.469 4.316 20 0 DIADMP C[C@H]([NH2+]Cc1cc(Cl)cs1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206622 1052033734 /nfs/dbraw/zinc/03/37/34/1052033734.db2.gz ADJKPMGGYUXKKA-STQMWFEESA-N 2 1 312.910 4.144 20 0 DIADMP CCCCC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)C(C)(C)C ZINC000808696459 1052083579 /nfs/dbraw/zinc/08/35/79/1052083579.db2.gz UQYNAKBAGDNSCS-MOPGFXCFSA-N 2 1 324.553 4.214 20 0 DIADMP c1ccc(C[N@H+]2CCC=C(Nc3cc[nH+]c(C4CC4)c3)C2)cc1 ZINC001174394311 1052115869 /nfs/dbraw/zinc/11/58/69/1052115869.db2.gz FSECPQRWDYCSJN-UHFFFAOYSA-N 2 1 305.425 4.161 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)[C@@H]1C ZINC000495077912 1052210276 /nfs/dbraw/zinc/21/02/76/1052210276.db2.gz HISVIZFLVKYFFV-QINHECLXSA-N 2 1 312.457 4.046 20 0 DIADMP CCC[C@@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)[C@H](C)CC ZINC001218292276 1052218096 /nfs/dbraw/zinc/21/80/96/1052218096.db2.gz POBJXJLTQNKEQZ-OXQOHEQNSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@@H](C)C[C@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218297184 1052219208 /nfs/dbraw/zinc/21/92/08/1052219208.db2.gz ZYDDZVBLSCOEIU-APWZRJJASA-N 2 1 318.505 4.203 20 0 DIADMP CCC[C@@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)[C@H](C)CC ZINC001218292782 1052219263 /nfs/dbraw/zinc/21/92/63/1052219263.db2.gz TVMMZRXCOLICAF-VQIMIIECSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)=CCC[C@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218317439 1052224669 /nfs/dbraw/zinc/22/46/69/1052224669.db2.gz MZMAOMOTLLAPLP-KRWDZBQOSA-N 2 1 316.489 4.123 20 0 DIADMP Cc1cccc([C@H](C)Oc2ccc(C[NH+]3CCC([NH3+])CC3)cc2)c1 ZINC001218326211 1052225900 /nfs/dbraw/zinc/22/59/00/1052225900.db2.gz RSDUVYMNZOPMHR-KRWDZBQOSA-N 2 1 324.468 4.058 20 0 DIADMP CC[C@@H](C)CC[C@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218356129 1052231013 /nfs/dbraw/zinc/23/10/13/1052231013.db2.gz AELKRYLHYZSRJM-SJORKVTESA-N 2 1 318.505 4.203 20 0 DIADMP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309671831 1052231658 /nfs/dbraw/zinc/23/16/58/1052231658.db2.gz TWMYTTMJEQYOJB-RLLQIKCJSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309716070 1052236357 /nfs/dbraw/zinc/23/63/57/1052236357.db2.gz KVDUGXHJARSGQP-HOJAQTOUSA-N 2 1 300.490 4.067 20 0 DIADMP CCC[C@H](C)[C@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218438285 1052238242 /nfs/dbraw/zinc/23/82/42/1052238242.db2.gz IRPRMWYCDJJVTR-JXFKEZNVSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309813020 1052251539 /nfs/dbraw/zinc/25/15/39/1052251539.db2.gz NFVBXTNRCWRFHN-ICSRJNTNSA-N 2 1 302.506 4.170 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1C ZINC000315189639 1052334337 /nfs/dbraw/zinc/33/43/37/1052334337.db2.gz KOSHYQJQEHZMDL-UHFFFAOYSA-N 2 1 302.506 4.356 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000495409562 1052339048 /nfs/dbraw/zinc/33/90/48/1052339048.db2.gz OJWYBMHPMDVAQE-QWFCFKBJSA-N 2 1 314.517 4.108 20 0 DIADMP CCCCOc1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000236682249 1052429025 /nfs/dbraw/zinc/42/90/25/1052429025.db2.gz MWMYKDRGXZNKTI-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP CC[C@@H](C)C[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000237020263 1052434720 /nfs/dbraw/zinc/43/47/20/1052434720.db2.gz XFRPXLOPYGHBFL-MSOLQXFVSA-N 2 1 302.506 4.108 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)C1CCCCC1 ZINC000237095108 1052435459 /nfs/dbraw/zinc/43/54/59/1052435459.db2.gz GSLRCAAMJXXRDJ-CABCVRRESA-N 2 1 320.443 4.352 20 0 DIADMP Fc1ccccc1CCC[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222153967 1052451954 /nfs/dbraw/zinc/45/19/54/1052451954.db2.gz DRKCISQOWGPMCR-FQEVSTJZSA-N 2 1 318.480 4.004 20 0 DIADMP Cc1c(C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222154668 1052452817 /nfs/dbraw/zinc/45/28/17/1052452817.db2.gz PHFJIRPJXWJLRF-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)c2)cs1 ZINC001222155202 1052452862 /nfs/dbraw/zinc/45/28/62/1052452862.db2.gz XQADFQKTOYQFRO-QGZVFWFLSA-N 2 1 318.511 4.052 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222161921 1052454186 /nfs/dbraw/zinc/45/41/86/1052454186.db2.gz TVZBWGITQIYEFL-LJQANCHMSA-N 2 1 318.530 4.154 20 0 DIADMP Clc1cccc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162114 1052454284 /nfs/dbraw/zinc/45/42/84/1052454284.db2.gz YPCYIJJOJZKFJF-GOSISDBHSA-N 2 1 306.881 4.086 20 0 DIADMP Clc1cccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162114 1052454287 /nfs/dbraw/zinc/45/42/87/1052454287.db2.gz YPCYIJJOJZKFJF-GOSISDBHSA-N 2 1 306.881 4.086 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222168238 1052456206 /nfs/dbraw/zinc/45/62/06/1052456206.db2.gz YJCOWQCBPJKDOE-IBGZPJMESA-N 2 1 322.443 4.370 20 0 DIADMP CSc1ccccc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222167223 1052456230 /nfs/dbraw/zinc/45/62/30/1052456230.db2.gz IGNRTTGUKJGVEL-LJQANCHMSA-N 2 1 318.530 4.154 20 0 DIADMP c1cc2cccc(C[N@H+]3CCCC[C@@]4(CCCC[NH2+]C4)C3)c2o1 ZINC001222173534 1052457302 /nfs/dbraw/zinc/45/73/02/1052457302.db2.gz UNFPYTMEASGUPM-HXUWFJFHSA-N 2 1 312.457 4.179 20 0 DIADMP Cc1c(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)ccc(F)c1F ZINC001222172410 1052457414 /nfs/dbraw/zinc/45/74/14/1052457414.db2.gz KOOKHTBZCJVCKB-LJQANCHMSA-N 2 1 322.443 4.019 20 0 DIADMP Cc1c(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)ccc(F)c1F ZINC001222172410 1052457419 /nfs/dbraw/zinc/45/74/19/1052457419.db2.gz KOOKHTBZCJVCKB-LJQANCHMSA-N 2 1 322.443 4.019 20 0 DIADMP Fc1ccc(-c2cccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]C4)c2)cc1 ZINC001222243812 1052467999 /nfs/dbraw/zinc/46/79/99/1052467999.db2.gz OUYRAHCORAZQKH-OAQYLSRUSA-N 2 1 324.443 4.211 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CCC[C@@]34CCC[NH2+]C4)c2)cc1 ZINC001222243812 1052468002 /nfs/dbraw/zinc/46/80/02/1052468002.db2.gz OUYRAHCORAZQKH-OAQYLSRUSA-N 2 1 324.443 4.211 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]C2CCCC2)C1 ZINC000915684426 1052468700 /nfs/dbraw/zinc/46/87/00/1052468700.db2.gz MFJQJOGUADBTCF-CALCHBBNSA-N 2 1 300.490 4.197 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)s1 ZINC001222265047 1052471063 /nfs/dbraw/zinc/47/10/63/1052471063.db2.gz MOZAGWUWUNWRHZ-GOSISDBHSA-N 2 1 306.519 4.056 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001168498647 1052475380 /nfs/dbraw/zinc/47/53/80/1052475380.db2.gz URCAVKRXBBBFAU-VDGAXYAQSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001168498647 1052475383 /nfs/dbraw/zinc/47/53/83/1052475383.db2.gz URCAVKRXBBBFAU-VDGAXYAQSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001168498647 1052475384 /nfs/dbraw/zinc/47/53/84/1052475384.db2.gz URCAVKRXBBBFAU-VDGAXYAQSA-N 2 1 318.480 4.096 20 0 DIADMP CCCCc1ccc(C[NH+]2CCC3(CCCC[NH2+]3)CC2)cc1 ZINC001222297539 1052476062 /nfs/dbraw/zinc/47/60/62/1052476062.db2.gz HDZRSHGORSIBEQ-UHFFFAOYSA-N 2 1 300.490 4.137 20 0 DIADMP c1ccc(C2(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)CCCC2)cc1 ZINC001222308117 1052478573 /nfs/dbraw/zinc/47/85/73/1052478573.db2.gz HAQVWMFMLRXCOZ-OAQYLSRUSA-N 2 1 312.501 4.107 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222308640 1052478718 /nfs/dbraw/zinc/47/87/18/1052478718.db2.gz KUSSFKFOIXCKIM-UYAOXDASSA-N 2 1 324.553 4.216 20 0 DIADMP Fc1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000393391072 1052481608 /nfs/dbraw/zinc/48/16/08/1052481608.db2.gz CFAVITVRYUMNNI-QHAWAJNXSA-N 2 1 324.443 4.132 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385017 1052493800 /nfs/dbraw/zinc/49/38/00/1052493800.db2.gz CUFFCVHOWBOCDO-NEWSRXKRSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385017 1052493810 /nfs/dbraw/zinc/49/38/10/1052493810.db2.gz CUFFCVHOWBOCDO-NEWSRXKRSA-N 2 1 318.892 4.052 20 0 DIADMP C[C@H](C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421148 1052498093 /nfs/dbraw/zinc/49/80/93/1052498093.db2.gz JFTOWHWIHYOWSR-DYESRHJHSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2)c1cccc2ccccc21 ZINC001222421148 1052498098 /nfs/dbraw/zinc/49/80/98/1052498098.db2.gz JFTOWHWIHYOWSR-DYESRHJHSA-N 2 1 308.469 4.161 20 0 DIADMP C(=C/c1ccc(C[N@H+]2CC[C@H]3C[NH2+]CC[C@H]32)cc1)\c1ccccc1 ZINC001222620246 1052518327 /nfs/dbraw/zinc/51/83/27/1052518327.db2.gz IOTWYVVRZMKXMQ-SUFHBLLTSA-N 2 1 318.464 4.041 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001235882474 1052536596 /nfs/dbraw/zinc/53/65/96/1052536596.db2.gz MLFKZPKVOIXXJR-AWEZNQCLSA-N 2 1 315.288 4.302 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C(C)(C)C ZINC000670267651 1052544859 /nfs/dbraw/zinc/54/48/59/1052544859.db2.gz NXTUHNZIAAKMAX-INMHGKMJSA-N 2 1 308.535 4.403 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C(C)(C)C ZINC000670267651 1052544862 /nfs/dbraw/zinc/54/48/62/1052544862.db2.gz NXTUHNZIAAKMAX-INMHGKMJSA-N 2 1 308.535 4.403 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CC1(C)C ZINC000397769964 1052549651 /nfs/dbraw/zinc/54/96/51/1052549651.db2.gz GWRNFTSTPPWCFG-VNVJMFPYSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1CC1(C)C ZINC000397769962 1052550292 /nfs/dbraw/zinc/55/02/92/1052550292.db2.gz GWRNFTSTPPWCFG-PANBIXPWSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccs1 ZINC000398111288 1052565461 /nfs/dbraw/zinc/56/54/61/1052565461.db2.gz DEAYZMXQFAVABY-XYJFISCASA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccs1 ZINC000398111288 1052565467 /nfs/dbraw/zinc/56/54/67/1052565467.db2.gz DEAYZMXQFAVABY-XYJFISCASA-N 2 1 314.498 4.309 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)c(Cl)c2)CC1 ZINC000037149837 1052605905 /nfs/dbraw/zinc/60/59/05/1052605905.db2.gz DZBBNQJQMYWGFG-ZDUSSCGKSA-N 2 1 312.860 4.394 20 0 DIADMP CC(C)(CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CC1 ZINC000328549543 1052625902 /nfs/dbraw/zinc/62/59/02/1052625902.db2.gz RKFKVTIYQZLEPZ-UHFFFAOYSA-N 2 1 314.517 4.109 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CC)C1)c1ccc(Cl)c(Cl)c1 ZINC000037644464 1052627950 /nfs/dbraw/zinc/62/79/50/1052627950.db2.gz ZBAXFELYDGROSV-BLLLJJGKSA-N 2 1 315.288 4.376 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649133 1052628252 /nfs/dbraw/zinc/62/82/52/1052628252.db2.gz PWNZGQAVMARMGW-NWDGAFQWSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1Cl ZINC000037649133 1052628258 /nfs/dbraw/zinc/62/82/58/1052628258.db2.gz PWNZGQAVMARMGW-NWDGAFQWSA-N 2 1 313.272 4.128 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)C(c2ccccc2)c2ccccc2)C1 ZINC000124154432 1052637835 /nfs/dbraw/zinc/63/78/35/1052637835.db2.gz BPGPHKLBTWVOKX-RBUKOAKNSA-N 2 1 322.496 4.138 20 0 DIADMP c1ccc(C[C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000124356925 1052640323 /nfs/dbraw/zinc/64/03/23/1052640323.db2.gz DKAOWVSEUOXQAC-SIKLNZKXSA-N 2 1 320.480 4.044 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000125415936 1052647639 /nfs/dbraw/zinc/64/76/39/1052647639.db2.gz NMTQVVOXCYNUSL-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000125415936 1052647643 /nfs/dbraw/zinc/64/76/43/1052647643.db2.gz NMTQVVOXCYNUSL-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000125529978 1052650632 /nfs/dbraw/zinc/65/06/32/1052650632.db2.gz XINPBTLUPDKAKL-UHFFFAOYSA-N 2 1 315.461 4.400 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000125529978 1052650634 /nfs/dbraw/zinc/65/06/34/1052650634.db2.gz XINPBTLUPDKAKL-UHFFFAOYSA-N 2 1 315.461 4.400 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)s2)C1 ZINC000125786528 1052653735 /nfs/dbraw/zinc/65/37/35/1052653735.db2.gz KNXDNVZRMQPHIP-STQMWFEESA-N 2 1 300.899 4.173 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125906174 1052656157 /nfs/dbraw/zinc/65/61/57/1052656157.db2.gz XXWWKGDVZVAVQQ-ZWKOTPCHSA-N 2 1 318.505 4.245 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cnc2ccsc2c1 ZINC000126442693 1052670385 /nfs/dbraw/zinc/67/03/85/1052670385.db2.gz SBLLCAOSRNJJEX-CABCVRRESA-N 2 1 317.502 4.211 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cnc2ccsc2c1 ZINC000126442693 1052670387 /nfs/dbraw/zinc/67/03/87/1052670387.db2.gz SBLLCAOSRNJJEX-CABCVRRESA-N 2 1 317.502 4.211 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cnc2ccsc2c1 ZINC000126442928 1052670480 /nfs/dbraw/zinc/67/04/80/1052670480.db2.gz SBLLCAOSRNJJEX-GJZGRUSLSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cnc2ccsc2c1 ZINC000126442928 1052670482 /nfs/dbraw/zinc/67/04/82/1052670482.db2.gz SBLLCAOSRNJJEX-GJZGRUSLSA-N 2 1 317.502 4.211 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1cccc(O)c1 ZINC000126610042 1052672475 /nfs/dbraw/zinc/67/24/75/1052672475.db2.gz YTSOPTORALKPIU-JTDSTZFVSA-N 2 1 316.489 4.086 20 0 DIADMP C[C@@H]1CC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@@H](C)C1 ZINC000321335308 1052674221 /nfs/dbraw/zinc/67/42/21/1052674221.db2.gz QGHAQJVOQFGLTI-ROUUACIJSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@@H](C)C1 ZINC000321335310 1052674333 /nfs/dbraw/zinc/67/43/33/1052674333.db2.gz QGHAQJVOQFGLTI-WGMWDUQUSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126888300 1052683748 /nfs/dbraw/zinc/68/37/48/1052683748.db2.gz GVOGDTWVSBVWCE-JKSUJKDBSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126888300 1052683750 /nfs/dbraw/zinc/68/37/50/1052683750.db2.gz GVOGDTWVSBVWCE-JKSUJKDBSA-N 2 1 306.519 4.128 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2cc3c(s2)CCCC3)CC1 ZINC000129348414 1052784467 /nfs/dbraw/zinc/78/44/67/1052784467.db2.gz UXEQESHHRGLSNQ-CQSZACIVSA-N 2 1 306.519 4.150 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000556060398 1052795506 /nfs/dbraw/zinc/79/55/06/1052795506.db2.gz GQTLYDQLNXAWGU-APWZRJJASA-N 2 1 314.498 4.236 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)s1 ZINC000556060398 1052795509 /nfs/dbraw/zinc/79/55/09/1052795509.db2.gz GQTLYDQLNXAWGU-APWZRJJASA-N 2 1 314.498 4.236 20 0 DIADMP CCc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556093419 1052797076 /nfs/dbraw/zinc/79/70/76/1052797076.db2.gz IBTXPRGPUNBIHW-NHCUHLMSSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556093419 1052797078 /nfs/dbraw/zinc/79/70/78/1052797078.db2.gz IBTXPRGPUNBIHW-NHCUHLMSSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556093981 1052797545 /nfs/dbraw/zinc/79/75/45/1052797545.db2.gz NXIUUKJEKACCDQ-FCHUYYIVSA-N 2 1 322.496 4.217 20 0 DIADMP CCc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000556093981 1052797550 /nfs/dbraw/zinc/79/75/50/1052797550.db2.gz NXIUUKJEKACCDQ-FCHUYYIVSA-N 2 1 322.496 4.217 20 0 DIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556118481 1052803508 /nfs/dbraw/zinc/80/35/08/1052803508.db2.gz DAIPHDPEWLCYTF-RTBURBONSA-N 2 1 320.546 4.191 20 0 DIADMP CC(C)CSCCC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556118481 1052803510 /nfs/dbraw/zinc/80/35/10/1052803510.db2.gz DAIPHDPEWLCYTF-RTBURBONSA-N 2 1 320.546 4.191 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556178293 1052817121 /nfs/dbraw/zinc/81/71/21/1052817121.db2.gz YZZCEXQWCRXFOE-OAGGEKHMSA-N 2 1 314.395 4.143 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556178293 1052817124 /nfs/dbraw/zinc/81/71/24/1052817124.db2.gz YZZCEXQWCRXFOE-OAGGEKHMSA-N 2 1 314.395 4.143 20 0 DIADMP c1ccc([C@@H]2CCCC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000498374845 1052826256 /nfs/dbraw/zinc/82/62/56/1052826256.db2.gz NRNPGPKJRUGETJ-MHTWAQMVSA-N 2 1 312.501 4.319 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000556867624 1052889720 /nfs/dbraw/zinc/88/97/20/1052889720.db2.gz HFLXBMLZLNQPQO-GTAWCEEGSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000556867624 1052889724 /nfs/dbraw/zinc/88/97/24/1052889724.db2.gz HFLXBMLZLNQPQO-GTAWCEEGSA-N 2 1 300.490 4.064 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(C)cc(Cl)c1 ZINC000556868574 1052890920 /nfs/dbraw/zinc/89/09/20/1052890920.db2.gz SEKWBNSEMKMMHB-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(C)cc(Cl)c1 ZINC000556868574 1052890923 /nfs/dbraw/zinc/89/09/23/1052890923.db2.gz SEKWBNSEMKMMHB-UHFFFAOYSA-N 2 1 319.880 4.320 20 0 DIADMP CC(C)[C@H](C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499251319 1052919177 /nfs/dbraw/zinc/91/91/77/1052919177.db2.gz OAUNNPAOTAGWOU-RSPOEFSDSA-N 2 1 300.490 4.064 20 0 DIADMP CCCc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1 ZINC001318480791 1053170600 /nfs/dbraw/zinc/17/06/00/1053170600.db2.gz DQULVJFBPYFTPE-UHFFFAOYSA-N 2 1 302.506 4.191 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1F ZINC000089512983 1053205200 /nfs/dbraw/zinc/20/52/00/1053205200.db2.gz IULKNBQGNCPAKR-CYBMUJFWSA-N 2 1 324.509 4.461 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1F ZINC000089512982 1053206357 /nfs/dbraw/zinc/20/63/57/1053206357.db2.gz IULKNBQGNCPAKR-ZDUSSCGKSA-N 2 1 324.509 4.461 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000251196526 1053225848 /nfs/dbraw/zinc/22/58/48/1053225848.db2.gz UNIVSXZCMZXEIR-SQNIBIBYSA-N 2 1 306.881 4.398 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)cc1 ZINC000251449592 1053233715 /nfs/dbraw/zinc/23/37/15/1053233715.db2.gz CFXKMYBLAGPAOW-QUCCMNQESA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000251449592 1053233723 /nfs/dbraw/zinc/23/37/23/1053233723.db2.gz CFXKMYBLAGPAOW-QUCCMNQESA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000251449592 1053233733 /nfs/dbraw/zinc/23/37/33/1053233733.db2.gz CFXKMYBLAGPAOW-QUCCMNQESA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000251449592 1053233745 /nfs/dbraw/zinc/23/37/45/1053233745.db2.gz CFXKMYBLAGPAOW-QUCCMNQESA-N 2 1 300.490 4.081 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000090585303 1053237834 /nfs/dbraw/zinc/23/78/34/1053237834.db2.gz SCZWJOGMKIZNSL-GDBMZVCRSA-N 2 1 323.550 4.033 20 0 DIADMP CC[NH+](CC)C1CC[NH+](CCCSCc2ccccc2)CC1 ZINC001319568609 1053251073 /nfs/dbraw/zinc/25/10/73/1053251073.db2.gz OAMWFBAKUBJTGD-UHFFFAOYSA-N 2 1 320.546 4.116 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1 ZINC000091333124 1053260708 /nfs/dbraw/zinc/26/07/08/1053260708.db2.gz LFMIGLLLWVPZRC-NRFANRHFSA-N 2 1 308.469 4.379 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc(Cl)s1 ZINC000252189521 1053261827 /nfs/dbraw/zinc/26/18/27/1053261827.db2.gz RJUGKTVRKXSXES-CHWSQXEVSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)s1 ZINC000252189521 1053261838 /nfs/dbraw/zinc/26/18/38/1053261838.db2.gz RJUGKTVRKXSXES-CHWSQXEVSA-N 2 1 300.899 4.317 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867430 1053367994 /nfs/dbraw/zinc/36/79/94/1053367994.db2.gz VWFRUJPPQMXVJM-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867430 1053368008 /nfs/dbraw/zinc/36/80/08/1053368008.db2.gz VWFRUJPPQMXVJM-CVEARBPZSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867434 1053368710 /nfs/dbraw/zinc/36/87/10/1053368710.db2.gz VWFRUJPPQMXVJM-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867434 1053368724 /nfs/dbraw/zinc/36/87/24/1053368724.db2.gz VWFRUJPPQMXVJM-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631680 1053529096 /nfs/dbraw/zinc/52/90/96/1053529096.db2.gz BVGZMJTUJSTVKV-IAGOWNOFSA-N 2 1 312.457 4.329 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631680 1053529107 /nfs/dbraw/zinc/52/91/07/1053529107.db2.gz BVGZMJTUJSTVKV-IAGOWNOFSA-N 2 1 312.457 4.329 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634020 1053529780 /nfs/dbraw/zinc/52/97/80/1053529780.db2.gz PHQGCFUXIOLIND-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634020 1053529798 /nfs/dbraw/zinc/52/97/98/1053529798.db2.gz PHQGCFUXIOLIND-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CC(C)(C)CCCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001200323777 1053556850 /nfs/dbraw/zinc/55/68/50/1053556850.db2.gz VJIJPQIHKCPENB-UHFFFAOYSA-N 2 1 316.533 4.500 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)C3C[C@H]4CC[C@@H](C3)[NH+]4C)o2)cc1 ZINC000572564118 1053561052 /nfs/dbraw/zinc/56/10/52/1053561052.db2.gz YWXLPKJCCIIDLH-DFNIBXOVSA-N 2 1 324.468 4.312 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)C3C[C@H]4CC[C@@H](C3)[NH+]4C)o2)cc1 ZINC000572564118 1053561072 /nfs/dbraw/zinc/56/10/72/1053561072.db2.gz YWXLPKJCCIIDLH-DFNIBXOVSA-N 2 1 324.468 4.312 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)C3C[C@H]4CC[C@@H](C3)[N@H+]4C)o2)cc1 ZINC000572564118 1053561092 /nfs/dbraw/zinc/56/10/92/1053561092.db2.gz YWXLPKJCCIIDLH-DFNIBXOVSA-N 2 1 324.468 4.312 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+](C)C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)o2)cc1 ZINC000572564118 1053561107 /nfs/dbraw/zinc/56/11/07/1053561107.db2.gz YWXLPKJCCIIDLH-DFNIBXOVSA-N 2 1 324.468 4.312 20 0 DIADMP CC[N@@H+](C[C@@H]1CCC[NH2+]C1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000262535920 1053578008 /nfs/dbraw/zinc/57/80/08/1053578008.db2.gz QHVHGAUJFNASPZ-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CCC(C(F)F)CC2)C[C@@H]1c1ccccc1 ZINC000414171873 1053671756 /nfs/dbraw/zinc/67/17/56/1053671756.db2.gz DFSVMERBMQZZOZ-OPQOLIRYSA-N 2 1 322.443 4.235 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CCC(C(F)F)CC2)C[C@@H]1c1ccccc1 ZINC000414171873 1053671768 /nfs/dbraw/zinc/67/17/68/1053671768.db2.gz DFSVMERBMQZZOZ-OPQOLIRYSA-N 2 1 322.443 4.235 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001324735567 1053676270 /nfs/dbraw/zinc/67/62/70/1053676270.db2.gz KRPVWLPIZPZZGY-MRXNPFEDSA-N 2 1 300.490 4.043 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cccn2C2CC2)CC1 ZINC001325117959 1053700160 /nfs/dbraw/zinc/70/01/60/1053700160.db2.gz PKNIVQPLGAQXLC-QGZVFWFLSA-N 2 1 323.484 4.138 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270907 1053725340 /nfs/dbraw/zinc/72/53/40/1053725340.db2.gz QCFVFHQCTSVAMT-NUEKZKHPSA-N 2 1 314.395 4.000 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)CC(F)(F)F ZINC000414270907 1053725347 /nfs/dbraw/zinc/72/53/47/1053725347.db2.gz QCFVFHQCTSVAMT-NUEKZKHPSA-N 2 1 314.395 4.000 20 0 DIADMP Cc1ccc(C)c(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000620755243 1053729545 /nfs/dbraw/zinc/72/95/45/1053729545.db2.gz LRTYKKMIQLCVNK-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000163233021 1053745498 /nfs/dbraw/zinc/74/54/98/1053745498.db2.gz UWVOPQVYSRBOKP-HOTGVXAUSA-N 2 1 300.446 4.042 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)C1 ZINC000163233021 1053745507 /nfs/dbraw/zinc/74/55/07/1053745507.db2.gz UWVOPQVYSRBOKP-HOTGVXAUSA-N 2 1 300.446 4.042 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(-c2cccs2)cc1 ZINC001231430015 1053748256 /nfs/dbraw/zinc/74/82/56/1053748256.db2.gz DBJMVCMQQMAYDK-UHFFFAOYSA-N 2 1 302.487 4.189 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(-c2cccs2)cc1 ZINC001231430015 1053748263 /nfs/dbraw/zinc/74/82/63/1053748263.db2.gz DBJMVCMQQMAYDK-UHFFFAOYSA-N 2 1 302.487 4.189 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2ccccc21 ZINC000154851946 1053751372 /nfs/dbraw/zinc/75/13/72/1053751372.db2.gz QOOOGPOTGJLNLL-OAQYLSRUSA-N 2 1 308.469 4.304 20 0 DIADMP CC(C)(CCCc1ccccc1)C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001200562946 1053764966 /nfs/dbraw/zinc/76/49/66/1053764966.db2.gz RZAAKKLARJIWRJ-UXHICEINSA-N 2 1 314.517 4.252 20 0 DIADMP Cc1c(C)c(C)c(C[NH+]2CCC([NH+]3CCCC3)CC2)c(C)c1C ZINC001231492055 1053769449 /nfs/dbraw/zinc/76/94/49/1053769449.db2.gz GIACJWJDFUAXMZ-UHFFFAOYSA-N 2 1 314.517 4.289 20 0 DIADMP CC[N@H+](Cc1c(C)c(C)c(C)c(C)c1C)C1CC[NH+](C)CC1 ZINC001231493661 1053769498 /nfs/dbraw/zinc/76/94/98/1053769498.db2.gz NTXOLCIIEVSBOV-UHFFFAOYSA-N 2 1 302.506 4.145 20 0 DIADMP CC[N@@H+](Cc1c(C)c(C)c(C)c(C)c1C)C1CC[NH+](C)CC1 ZINC001231493661 1053769505 /nfs/dbraw/zinc/76/95/05/1053769505.db2.gz NTXOLCIIEVSBOV-UHFFFAOYSA-N 2 1 302.506 4.145 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C)c1c(Cl)cccc1Cl ZINC000155947041 1053791662 /nfs/dbraw/zinc/79/16/62/1053791662.db2.gz QIYMWGROPSQQMB-XUJVJEKNSA-N 2 1 315.288 4.027 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2c(C)sc3ccccc32)CC1 ZINC001231644041 1053814838 /nfs/dbraw/zinc/81/48/38/1053814838.db2.gz OBASXVBBGDHDPA-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2c(C)sc3ccccc32)CC1 ZINC001231644041 1053814849 /nfs/dbraw/zinc/81/48/49/1053814849.db2.gz OBASXVBBGDHDPA-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000157152361 1053842542 /nfs/dbraw/zinc/84/25/42/1053842542.db2.gz LSVPRMSAUQUSGM-QGZVFWFLSA-N 2 1 314.498 4.352 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001327723091 1053873269 /nfs/dbraw/zinc/87/32/69/1053873269.db2.gz RDXDCYAAEMNDFT-WNTWWTRPSA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001231878285 1053901333 /nfs/dbraw/zinc/90/13/33/1053901333.db2.gz GPRXYOXKSZLPQC-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP C[N@@H+](Cc1cc2c[nH+]ccc2[nH]1)Cc1cccc(C(F)(F)F)c1 ZINC001232014072 1053938667 /nfs/dbraw/zinc/93/86/67/1053938667.db2.gz JGFHEQHGZLSFSC-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC001232151552 1053970499 /nfs/dbraw/zinc/97/04/99/1053970499.db2.gz OPSKPPDUDQLDNJ-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC[N@@H+]1C ZINC000164399814 1054056737 /nfs/dbraw/zinc/05/67/37/1054056737.db2.gz QPIVLGKDGSUXDF-MDASCCDHSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CC[N@H+]1C ZINC000164399814 1054056747 /nfs/dbraw/zinc/05/67/47/1054056747.db2.gz QPIVLGKDGSUXDF-MDASCCDHSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H](NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccco1 ZINC000164991112 1054066627 /nfs/dbraw/zinc/06/66/27/1054066627.db2.gz MFQHDDWFCPFCJE-ZQIUZPCESA-N 2 1 304.459 4.075 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCN(C)[C@@H]1c1cccs1)c1ccco1 ZINC000164991112 1054066638 /nfs/dbraw/zinc/06/66/38/1054066638.db2.gz MFQHDDWFCPFCJE-ZQIUZPCESA-N 2 1 304.459 4.075 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001333000131 1054135897 /nfs/dbraw/zinc/13/58/97/1054135897.db2.gz ISPXWIKKPZUDLI-AJYBTWMASA-N 2 1 316.464 4.225 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001333000131 1054135906 /nfs/dbraw/zinc/13/59/06/1054135906.db2.gz ISPXWIKKPZUDLI-AJYBTWMASA-N 2 1 316.464 4.225 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)sc1C ZINC001233685969 1054332982 /nfs/dbraw/zinc/33/29/82/1054332982.db2.gz UKIOTGNKIFPMDA-KRWDZBQOSA-N 2 1 306.519 4.205 20 0 DIADMP CCCc1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC001339360310 1054337293 /nfs/dbraw/zinc/33/72/93/1054337293.db2.gz PDNPQJLHVSYWNZ-HXUWFJFHSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1ccc2c(C)cc(NC3CC([NH+]4CCCCC4)C3)[nH+]c2c1 ZINC000480839993 1054396078 /nfs/dbraw/zinc/39/60/78/1054396078.db2.gz KIKQLJLTQAADQG-UHFFFAOYSA-N 2 1 309.457 4.280 20 0 DIADMP Cc1sccc1C[NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000339289939 1054496305 /nfs/dbraw/zinc/49/63/05/1054496305.db2.gz KFTVBISMUYOPRI-OAHLLOKOSA-N 2 1 302.487 4.057 20 0 DIADMP Cc1sccc1C[NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000339289939 1054496307 /nfs/dbraw/zinc/49/63/07/1054496307.db2.gz KFTVBISMUYOPRI-OAHLLOKOSA-N 2 1 302.487 4.057 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000671294821 1054526180 /nfs/dbraw/zinc/52/61/80/1054526180.db2.gz LQKHKYHIGLIKLS-YTQUADARSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000623335745 1054563453 /nfs/dbraw/zinc/56/34/53/1054563453.db2.gz BTDFYVYUBVBPAQ-WFASDCNBSA-N 2 1 314.395 4.229 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623363041 1054571775 /nfs/dbraw/zinc/57/17/75/1054571775.db2.gz VOMUTNRACNFHTQ-GJZGRUSLSA-N 2 1 300.446 4.265 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623363041 1054571784 /nfs/dbraw/zinc/57/17/84/1054571784.db2.gz VOMUTNRACNFHTQ-GJZGRUSLSA-N 2 1 300.446 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)CC1(C)C ZINC000623511882 1054609527 /nfs/dbraw/zinc/60/95/27/1054609527.db2.gz KQRJBGXLYXFDNO-XIRDDKMYSA-N 2 1 306.881 4.048 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)CC1(C)C ZINC000623533937 1054612791 /nfs/dbraw/zinc/61/27/91/1054612791.db2.gz OHOKHQIUPDLPSL-KKUMJFAQSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cccc2ccccc21 ZINC000177295285 1054616599 /nfs/dbraw/zinc/61/65/99/1054616599.db2.gz UQAQHYLJTDDMFJ-CVEARBPZSA-N 2 1 307.441 4.332 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001234995268 1054638454 /nfs/dbraw/zinc/63/84/54/1054638454.db2.gz VBJIRYNYPNXBSE-WIYYLYMNSA-N 2 1 314.517 4.064 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235016626 1054640303 /nfs/dbraw/zinc/64/03/03/1054640303.db2.gz GOLKTOQEFFVQRZ-HSALFYBXSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235016626 1054640312 /nfs/dbraw/zinc/64/03/12/1054640312.db2.gz GOLKTOQEFFVQRZ-HSALFYBXSA-N 2 1 302.506 4.143 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccoc1 ZINC000178036006 1054640633 /nfs/dbraw/zinc/64/06/33/1054640633.db2.gz OCZCCIHRMDKLDO-SJORKVTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccoc1 ZINC000178036018 1054640982 /nfs/dbraw/zinc/64/09/82/1054640982.db2.gz OCZCCIHRMDKLDO-IRXDYDNUSA-N 2 1 312.457 4.362 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)cc2)c1 ZINC001235001150 1054641321 /nfs/dbraw/zinc/64/13/21/1054641321.db2.gz TZCVXGPXNKAPLD-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP C(=C/c1ccc(C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1)\c1ccccc1 ZINC001235034026 1054643203 /nfs/dbraw/zinc/64/32/03/1054643203.db2.gz SJPAUTLRSJSPTR-WMWRJIBUSA-N 2 1 318.464 4.042 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235037813 1054643860 /nfs/dbraw/zinc/64/38/60/1054643860.db2.gz IJELIDRXUISTKD-HXUWFJFHSA-N 2 1 310.441 4.055 20 0 DIADMP CCc1cc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)ccc1Cl ZINC001235037081 1054644152 /nfs/dbraw/zinc/64/41/52/1054644152.db2.gz DDNSFPZKHQXWIB-SFHVURJKSA-N 2 1 306.881 4.011 20 0 DIADMP CCc1cc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)ccc1Cl ZINC001235037081 1054644158 /nfs/dbraw/zinc/64/41/58/1054644158.db2.gz DDNSFPZKHQXWIB-SFHVURJKSA-N 2 1 306.881 4.011 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccoc1 ZINC000178092140 1054644201 /nfs/dbraw/zinc/64/42/01/1054644201.db2.gz VVHZHSSVJRSYOR-IRXDYDNUSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccoc1 ZINC000178092140 1054644207 /nfs/dbraw/zinc/64/42/07/1054644207.db2.gz VVHZHSSVJRSYOR-IRXDYDNUSA-N 2 1 312.457 4.362 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)s1 ZINC001235045695 1054646763 /nfs/dbraw/zinc/64/67/63/1054646763.db2.gz MEHAPQCJPMTIHC-GOSISDBHSA-N 2 1 306.519 4.199 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1CCC12CC[NH2+]CC2 ZINC001235102012 1054656713 /nfs/dbraw/zinc/65/67/13/1054656713.db2.gz KGVQAJJDXNGWKB-UHFFFAOYSA-N 2 1 322.452 4.115 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC12CC[NH2+]CC2 ZINC001235102012 1054656727 /nfs/dbraw/zinc/65/67/27/1054656727.db2.gz KGVQAJJDXNGWKB-UHFFFAOYSA-N 2 1 322.452 4.115 20 0 DIADMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)s1 ZINC000178706685 1054656919 /nfs/dbraw/zinc/65/69/19/1054656919.db2.gz JRKNYVDFNPALRG-YPMHNXCESA-N 2 1 311.882 4.283 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[NH+]2CCC3(CC[NH2+]3)CC2)CC1 ZINC001235106385 1054659925 /nfs/dbraw/zinc/65/99/25/1054659925.db2.gz MICFKSHCIQENMC-IBGZPJMESA-N 2 1 302.506 4.287 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC001235112384 1054660291 /nfs/dbraw/zinc/66/02/91/1054660291.db2.gz XGKXESVORKZGQU-HXUWFJFHSA-N 2 1 322.477 4.382 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CCC[C@]12CC[NH2+]C2 ZINC001235112384 1054660294 /nfs/dbraw/zinc/66/02/94/1054660294.db2.gz XGKXESVORKZGQU-HXUWFJFHSA-N 2 1 322.477 4.382 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CCCC34CC[NH2+]CC4)cc2)cc1 ZINC001235141724 1054664819 /nfs/dbraw/zinc/66/48/19/1054664819.db2.gz WYTYAWKQMOOTGT-UHFFFAOYSA-N 2 1 324.443 4.211 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCCC12CC[NH2+]CC2 ZINC001235144482 1054665340 /nfs/dbraw/zinc/66/53/40/1054665340.db2.gz LVINRQDBDUWIJI-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235155323 1054666745 /nfs/dbraw/zinc/66/67/45/1054666745.db2.gz OHSIONJVAFFITD-SFHVURJKSA-N 2 1 314.498 4.255 20 0 DIADMP Fc1ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1C1CC1 ZINC001235154645 1054666756 /nfs/dbraw/zinc/66/67/56/1054666756.db2.gz JKQQYNFZZRLXBL-HXUWFJFHSA-N 2 1 316.464 4.057 20 0 DIADMP Cc1csc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1Cl ZINC001235151726 1054666785 /nfs/dbraw/zinc/66/67/85/1054666785.db2.gz AQEVZUGDQYPHHJ-AWEZNQCLSA-N 2 1 312.910 4.064 20 0 DIADMP c1cc(-c2cccc(C[N@H+]3CCCC34CC[NH2+]CC4)c2)cs1 ZINC001235145855 1054666834 /nfs/dbraw/zinc/66/68/34/1054666834.db2.gz WUAGZEWQDZFIAS-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP CC(C)(CC[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1)c1ccccc1 ZINC001235155033 1054667552 /nfs/dbraw/zinc/66/75/52/1054667552.db2.gz XPPYTRLCPPMKSD-HXUWFJFHSA-N 2 1 314.517 4.208 20 0 DIADMP Clc1ccc(CCC[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001235153545 1054667781 /nfs/dbraw/zinc/66/77/81/1054667781.db2.gz SRBBGGLYHIVQKZ-LJQANCHMSA-N 2 1 320.908 4.127 20 0 DIADMP Cc1cccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1Cl ZINC001235159886 1054668928 /nfs/dbraw/zinc/66/89/28/1054668928.db2.gz XVCLHIDJCYBXJP-QGZVFWFLSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1cc(Cl)c(C[N@H+](C)CC2CC[NH+](C)CC2)c(Cl)c1 ZINC001235168017 1054669344 /nfs/dbraw/zinc/66/93/44/1054669344.db2.gz IODXXFFUDGVCLE-UHFFFAOYSA-N 2 1 315.288 4.075 20 0 DIADMP Cc1cc(Cl)c(C[N@@H+](C)CC2CC[NH+](C)CC2)c(Cl)c1 ZINC001235168017 1054669349 /nfs/dbraw/zinc/66/93/49/1054669349.db2.gz IODXXFFUDGVCLE-UHFFFAOYSA-N 2 1 315.288 4.075 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235174775 1054672428 /nfs/dbraw/zinc/67/24/28/1054672428.db2.gz VIVSLHPODDICBH-AZUAARDMSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235174778 1054672463 /nfs/dbraw/zinc/67/24/63/1054672463.db2.gz VIVSLHPODDICBH-UYAOXDASSA-N 2 1 324.553 4.216 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235190508 1054680049 /nfs/dbraw/zinc/68/00/49/1054680049.db2.gz KJICEGKHGNJHOC-UHFFFAOYSA-N 2 1 314.498 4.318 20 0 DIADMP Clc1ccc([C@@H]2C[C@H]2C[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235191803 1054681283 /nfs/dbraw/zinc/68/12/83/1054681283.db2.gz ZEBKPACNXSWCSZ-WMZOPIPTSA-N 2 1 318.892 4.052 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCCCC34CC[NH2+]CC4)c2)cc1 ZINC001235190635 1054681909 /nfs/dbraw/zinc/68/19/09/1054681909.db2.gz YFRYDNNFAPUGMY-UHFFFAOYSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(C2(C[N@H+]3CCCCC34CC[NH2+]CC4)CCCC2)cc1 ZINC001235189773 1054681956 /nfs/dbraw/zinc/68/19/56/1054681956.db2.gz BCAQYFUUCACERV-UHFFFAOYSA-N 2 1 312.501 4.107 20 0 DIADMP c1ccc(CCCCC[N@@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235191219 1054682218 /nfs/dbraw/zinc/68/22/18/1054682218.db2.gz QQEVIEBMZPQENA-UHFFFAOYSA-N 2 1 300.490 4.008 20 0 DIADMP c1ccc(CCCCC[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235191219 1054682229 /nfs/dbraw/zinc/68/22/29/1054682229.db2.gz QQEVIEBMZPQENA-UHFFFAOYSA-N 2 1 300.490 4.008 20 0 DIADMP Cc1cc(C)cc(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1 ZINC001235249710 1054691376 /nfs/dbraw/zinc/69/13/76/1054691376.db2.gz VIHUREQXENKGGL-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1cc(C)cc(C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1 ZINC001235249710 1054691383 /nfs/dbraw/zinc/69/13/83/1054691383.db2.gz VIHUREQXENKGGL-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)s1 ZINC001235266058 1054695084 /nfs/dbraw/zinc/69/50/84/1054695084.db2.gz XFIJKIOFTAORKY-CRAIPNDOSA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)s1 ZINC001235266058 1054695090 /nfs/dbraw/zinc/69/50/90/1054695090.db2.gz XFIJKIOFTAORKY-CRAIPNDOSA-N 2 1 306.519 4.055 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@H](C2C[NH2+]C2)C1 ZINC001235341501 1054702794 /nfs/dbraw/zinc/70/27/94/1054702794.db2.gz PUTLONXICGFQFS-AWEZNQCLSA-N 2 1 322.477 4.096 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235377118 1054713254 /nfs/dbraw/zinc/71/32/54/1054713254.db2.gz AAUQAUXURIWSEM-ZDFPQIBNSA-N 2 1 324.512 4.058 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c2ccccc12 ZINC001235424003 1054714382 /nfs/dbraw/zinc/71/43/82/1054714382.db2.gz ILRVSUVLHKNAEQ-RBUKOAKNSA-N 2 1 322.496 4.360 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235425380 1054714964 /nfs/dbraw/zinc/71/49/64/1054714964.db2.gz IXWSMVUQTRSKBO-HZPDHXFCSA-N 2 1 314.498 4.113 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c2ccccc12 ZINC001235424004 1054715235 /nfs/dbraw/zinc/71/52/35/1054715235.db2.gz ILRVSUVLHKNAEQ-RTBURBONSA-N 2 1 322.496 4.360 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)s1 ZINC001235425896 1054715465 /nfs/dbraw/zinc/71/54/65/1054715465.db2.gz JSQQIGIVFPCDIL-HZPDHXFCSA-N 2 1 314.498 4.113 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc1 ZINC001235429740 1054717763 /nfs/dbraw/zinc/71/77/63/1054717763.db2.gz ZHRLJJILMAKJHC-WOJBJXKFSA-N 2 1 300.490 4.022 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235428215 1054719353 /nfs/dbraw/zinc/71/93/53/1054719353.db2.gz ULAJZRQMSYZWDU-RBUKOAKNSA-N 2 1 308.469 4.051 20 0 DIADMP CCCCCCc1ccc(C[N@@H+](C)CC2CC[NH2+]CC2)s1 ZINC001235432596 1054719548 /nfs/dbraw/zinc/71/95/48/1054719548.db2.gz MTWVCNRKHZESBT-UHFFFAOYSA-N 2 1 308.535 4.302 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2Cl)cc1)C1CC[NH2+]CC1 ZINC001235466692 1054731149 /nfs/dbraw/zinc/73/11/49/1054731149.db2.gz SWLYUMSCARMQTD-UHFFFAOYSA-N 2 1 314.860 4.191 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](CCC[NH2+]C3CCCCC3)C2)cc1 ZINC001235665696 1054762898 /nfs/dbraw/zinc/76/28/98/1054762898.db2.gz QFOGUQXPIKYEIT-LJQANCHMSA-N 2 1 300.490 4.178 20 0 DIADMP C[N@@H+](Cc1ccc2c(c1)CC[NH2+]C2)Cc1cccc2ccccc21 ZINC001235663929 1054764294 /nfs/dbraw/zinc/76/42/94/1054764294.db2.gz YJIPUPNXIIQKAH-UHFFFAOYSA-N 2 1 316.448 4.118 20 0 DIADMP C[N@@H+](Cc1ccc2c(c1)C[NH2+]C2)Cc1cccc2ccccc21 ZINC001235662476 1054764592 /nfs/dbraw/zinc/76/45/92/1054764592.db2.gz IBYHJEHXUKRACE-UHFFFAOYSA-N 2 1 302.421 4.075 20 0 DIADMP CCCC[N@H+](Cc1ccccc1)CC1CC2(C1)CC[NH2+]CC2 ZINC001235663083 1054764953 /nfs/dbraw/zinc/76/49/53/1054764953.db2.gz IAKNZGOGZMSYMQ-UHFFFAOYSA-N 2 1 300.490 4.069 20 0 DIADMP Cc1ccc(Cl)c(O[C@H]2CCC[N@@H+](CCCCCC[NH3+])C2)c1 ZINC001235673692 1054766559 /nfs/dbraw/zinc/76/65/59/1054766559.db2.gz FJLBEGRBOLYZDC-INIZCTEOSA-N 2 1 324.896 4.011 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1CC1CC2(C1)CC[NH2+]CC2 ZINC001235680629 1054773259 /nfs/dbraw/zinc/77/32/59/1054773259.db2.gz UZVLZWNPEMEFFF-LJQANCHMSA-N 2 1 316.464 4.133 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)c2cccs2)CC[N@@H+]1C ZINC000180944918 1054782009 /nfs/dbraw/zinc/78/20/09/1054782009.db2.gz VZNIFLYHZMXPRX-NXHRZFHOSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2)c2cccs2)CC[N@H+]1C ZINC000180944918 1054782023 /nfs/dbraw/zinc/78/20/23/1054782023.db2.gz VZNIFLYHZMXPRX-NXHRZFHOSA-N 2 1 314.498 4.104 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001235717074 1054789106 /nfs/dbraw/zinc/78/91/06/1054789106.db2.gz CKMYNLAZOHIJES-UHFFFAOYSA-N 2 1 315.288 4.123 20 0 DIADMP CC1([NH3+])CC[NH+](Cc2ccccc2-c2ccccc2Cl)CC1 ZINC001235748700 1054796960 /nfs/dbraw/zinc/79/69/60/1054796960.db2.gz MMFYTVUOSOCSEV-UHFFFAOYSA-N 2 1 314.860 4.320 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc(C)sc1C ZINC000623854926 1054797649 /nfs/dbraw/zinc/79/76/49/1054797649.db2.gz MOQAMLBEMSBKKA-GOSISDBHSA-N 2 1 306.519 4.423 20 0 DIADMP Cc1csc([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)n1 ZINC000623877063 1054800210 /nfs/dbraw/zinc/80/02/10/1054800210.db2.gz PVJIXZWDYRINQR-HNNXBMFYSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1csc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)n1 ZINC000623877063 1054800221 /nfs/dbraw/zinc/80/02/21/1054800221.db2.gz PVJIXZWDYRINQR-HNNXBMFYSA-N 2 1 317.502 4.143 20 0 DIADMP CC[N@@H+](Cc1sc2scc(C)c2c1C)C1CC[NH2+]CC1 ZINC001235762297 1054800630 /nfs/dbraw/zinc/80/06/30/1054800630.db2.gz RRDLAXFCEADZQP-UHFFFAOYSA-N 2 1 308.516 4.154 20 0 DIADMP CC[N@@H+](Cc1cccc(-c2ccc(C)cc2)c1)C1CC[NH2+]CC1 ZINC001235760768 1054801926 /nfs/dbraw/zinc/80/19/26/1054801926.db2.gz KDQOLQXOOCHMEI-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP c1ccc([C@H]2c3ccccc3CC[N@@H+]2CC[C@H]2CCC[NH2+]C2)cc1 ZINC001235794181 1054806396 /nfs/dbraw/zinc/80/63/96/1054806396.db2.gz KAAYITHSFOYEBQ-GCJKJVERSA-N 2 1 320.480 4.024 20 0 DIADMP c1ccc([C@H]2c3ccccc3CC[N@@H+]2CC[C@@H]2CCC[NH2+]C2)cc1 ZINC001235794178 1054807057 /nfs/dbraw/zinc/80/70/57/1054807057.db2.gz KAAYITHSFOYEBQ-AVRDEDQJSA-N 2 1 320.480 4.024 20 0 DIADMP Cc1c(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)cccc1-c1ccccc1 ZINC001235812501 1054811801 /nfs/dbraw/zinc/81/18/01/1054811801.db2.gz YDABZXOSZROZTA-ACDBMABISA-N 2 1 306.453 4.116 20 0 DIADMP [NH3+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001235810894 1054813114 /nfs/dbraw/zinc/81/31/14/1054813114.db2.gz OYFXMCRVEGDNQC-IPJTVVJOSA-N 2 1 318.464 4.311 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902392 1054839945 /nfs/dbraw/zinc/83/99/45/1054839945.db2.gz FKWKJCBQICNOOW-KSSFIOAISA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902392 1054839961 /nfs/dbraw/zinc/83/99/61/1054839961.db2.gz FKWKJCBQICNOOW-KSSFIOAISA-N 2 1 314.860 4.319 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(C)sc1C ZINC000623995766 1054848160 /nfs/dbraw/zinc/84/81/60/1054848160.db2.gz ILVBBCQCADOVPF-MMNRESRNSA-N 2 1 306.519 4.421 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235925653 1054848394 /nfs/dbraw/zinc/84/83/94/1054848394.db2.gz NPIAFXWWVSCHTR-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)CC1 ZINC001235929571 1054852593 /nfs/dbraw/zinc/85/25/93/1054852593.db2.gz RODHHFMPAAPKQL-SLFFLAALSA-N 2 1 302.506 4.001 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)c1 ZINC001235943872 1054861724 /nfs/dbraw/zinc/86/17/24/1054861724.db2.gz ZONFUKXHMXWKDH-NHCUHLMSSA-N 2 1 320.480 4.012 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001235950892 1054866080 /nfs/dbraw/zinc/86/60/80/1054866080.db2.gz OSLPUFFKTKYRCF-CQSZACIVSA-N 2 1 314.860 4.179 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001235950876 1054867833 /nfs/dbraw/zinc/86/78/33/1054867833.db2.gz OAUGSZRJLOUHHM-SFHVURJKSA-N 2 1 318.505 4.077 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001235950876 1054867844 /nfs/dbraw/zinc/86/78/44/1054867844.db2.gz OAUGSZRJLOUHHM-SFHVURJKSA-N 2 1 318.505 4.077 20 0 DIADMP C[N@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C[C@@H]1CCC[NH2+]C1 ZINC001235957439 1054868916 /nfs/dbraw/zinc/86/89/16/1054868916.db2.gz NZHLHHUMBZVVJQ-DGSRBQDKSA-N 2 1 320.480 4.288 20 0 DIADMP C[N@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C[C@H]1CCC[NH2+]C1 ZINC001235957438 1054869339 /nfs/dbraw/zinc/86/93/39/1054869339.db2.gz NZHLHHUMBZVVJQ-CZQLGGELSA-N 2 1 320.480 4.288 20 0 DIADMP C[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@@H]1CCC[NH2+]C1 ZINC001235957041 1054869569 /nfs/dbraw/zinc/86/95/69/1054869569.db2.gz KAYGJLMOXJSBSB-SNVBAGLBSA-N 2 1 321.679 4.078 20 0 DIADMP C[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@@H]1CCC[NH2+]C1 ZINC001235957041 1054869581 /nfs/dbraw/zinc/86/95/81/1054869581.db2.gz KAYGJLMOXJSBSB-SNVBAGLBSA-N 2 1 321.679 4.078 20 0 DIADMP [NH3+][C@@H]1[C@@H]2CC[C@H]1C[N@H+](Cc1ccc3sc4ccccc4c3c1)C2 ZINC001235959229 1054870015 /nfs/dbraw/zinc/87/00/15/1054870015.db2.gz JCPKYOQPCYQTMW-YVWYUNDQSA-N 2 1 322.477 4.224 20 0 DIADMP C[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@H]1CCC[NH2+]C1 ZINC001235957040 1054870244 /nfs/dbraw/zinc/87/02/44/1054870244.db2.gz KAYGJLMOXJSBSB-JTQLQIEISA-N 2 1 321.679 4.078 20 0 DIADMP C[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@H]1CCC[NH2+]C1 ZINC001235957040 1054870254 /nfs/dbraw/zinc/87/02/54/1054870254.db2.gz KAYGJLMOXJSBSB-JTQLQIEISA-N 2 1 321.679 4.078 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000624119454 1054883882 /nfs/dbraw/zinc/88/38/82/1054883882.db2.gz BJZNUAUBXQAPEH-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624119454 1054883905 /nfs/dbraw/zinc/88/39/05/1054883905.db2.gz BJZNUAUBXQAPEH-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000624119455 1054885984 /nfs/dbraw/zinc/88/59/84/1054885984.db2.gz BJZNUAUBXQAPEH-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624119455 1054886002 /nfs/dbraw/zinc/88/60/02/1054886002.db2.gz BJZNUAUBXQAPEH-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+](Cc1cccc2c3ccccc3oc21)[C@H]1CCC[NH2+]C1 ZINC001236005815 1054890784 /nfs/dbraw/zinc/89/07/84/1054890784.db2.gz FPPVSDYSJJBGHS-INIZCTEOSA-N 2 1 308.425 4.160 20 0 DIADMP CC[N@@H+](Cc1cccc2c3ccccc3oc21)[C@H]1CCC[NH2+]C1 ZINC001236005815 1054890794 /nfs/dbraw/zinc/89/07/94/1054890794.db2.gz FPPVSDYSJJBGHS-INIZCTEOSA-N 2 1 308.425 4.160 20 0 DIADMP Fc1c(C[NH+]2CCCCC2)cccc1-c1c[nH+]cc2cc[nH]c21 ZINC001236012129 1054897287 /nfs/dbraw/zinc/89/72/87/1054897287.db2.gz KTCQFSBGAYBSDI-UHFFFAOYSA-N 2 1 309.388 4.355 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051694 1054915605 /nfs/dbraw/zinc/91/56/05/1054915605.db2.gz XZPALSMNFPPSFT-WMLDXEAASA-N 2 1 314.860 4.176 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051694 1054915615 /nfs/dbraw/zinc/91/56/15/1054915615.db2.gz XZPALSMNFPPSFT-WMLDXEAASA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481255 1054917187 /nfs/dbraw/zinc/91/71/87/1054917187.db2.gz VUPRAVWDMICOOR-OLZOCXBDSA-N 2 1 318.848 4.221 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481255 1054917200 /nfs/dbraw/zinc/91/72/00/1054917200.db2.gz VUPRAVWDMICOOR-OLZOCXBDSA-N 2 1 318.848 4.221 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236066293 1054922234 /nfs/dbraw/zinc/92/22/34/1054922234.db2.gz GYDDPNMTGDMLBR-AWEZNQCLSA-N 2 1 310.466 4.096 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236066438 1054922472 /nfs/dbraw/zinc/92/24/72/1054922472.db2.gz HBMSRWCQFVTCQZ-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236066438 1054922484 /nfs/dbraw/zinc/92/24/84/1054922484.db2.gz HBMSRWCQFVTCQZ-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236066842 1054924544 /nfs/dbraw/zinc/92/45/44/1054924544.db2.gz LRGMUTVAEGOMPA-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP Clc1ccccc1C1CC[NH+](CC[C@@H]2CCCC[NH2+]2)CC1 ZINC001236070956 1054927175 /nfs/dbraw/zinc/92/71/75/1054927175.db2.gz DFQHKIDSAZEKMJ-INIZCTEOSA-N 2 1 306.881 4.052 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)CC12CC([NH3+])(C1)C2 ZINC001236092138 1054938167 /nfs/dbraw/zinc/93/81/67/1054938167.db2.gz HJDAZMKBTQYNQW-UHFFFAOYSA-N 2 1 313.272 4.085 20 0 DIADMP C[N@@H+](CCC(c1ccccc1)c1ccccc1)C[C@H]1CCC[NH2+]C1 ZINC001236093136 1054940757 /nfs/dbraw/zinc/94/07/57/1054940757.db2.gz RBLIZQRLCSIYSJ-IBGZPJMESA-N 2 1 322.496 4.140 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1Cc1cccc(C[NH3+])c1 ZINC001236110107 1054954023 /nfs/dbraw/zinc/95/40/23/1054954023.db2.gz YOUBBSPGWZPFRR-GOSISDBHSA-N 2 1 312.482 4.204 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccc(-c2ccccc2)cc1Cl ZINC001236141560 1054968039 /nfs/dbraw/zinc/96/80/39/1054968039.db2.gz JEGYQWSTPFNFLI-UHFFFAOYSA-N 2 1 302.849 4.178 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccccc1-c1ccccc1Cl ZINC001236141597 1054968997 /nfs/dbraw/zinc/96/89/97/1054968997.db2.gz LAXXFJQETMOTQO-UHFFFAOYSA-N 2 1 302.849 4.178 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)cc1 ZINC001236151923 1054970169 /nfs/dbraw/zinc/97/01/69/1054970169.db2.gz KEDBDKAIUXZCSP-SFHVURJKSA-N 2 1 300.833 4.136 20 0 DIADMP CCC[N@@H+](Cc1c(C)c(C)c(C)c(C)c1C)C1CC[NH2+]CC1 ZINC001236182330 1054980366 /nfs/dbraw/zinc/98/03/66/1054980366.db2.gz KXLZEPGZLRQROL-UHFFFAOYSA-N 2 1 302.506 4.193 20 0 DIADMP CCC[N@@H+](Cc1cccc(Oc2ccccc2)c1)C1CC[NH2+]CC1 ZINC001236180728 1054981315 /nfs/dbraw/zinc/98/13/15/1054981315.db2.gz MVXSLOSZSNCMSG-UHFFFAOYSA-N 2 1 324.468 4.443 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](CCC)C2CC[NH2+]CC2)cc1 ZINC001236180257 1054981938 /nfs/dbraw/zinc/98/19/38/1054981938.db2.gz FILXGRZVHCKIGL-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CCC[N@@H+](Cc1cc(C)c(OC(C)C)c(C)c1)C1CC[NH2+]CC1 ZINC001236184707 1054985004 /nfs/dbraw/zinc/98/50/04/1054985004.db2.gz MGBDBEIGWMQRFI-UHFFFAOYSA-N 2 1 318.505 4.055 20 0 DIADMP CCC[N@@H+](Cc1ccc(Cc2ccccc2)cc1)C1CC[NH2+]CC1 ZINC001236184780 1054985394 /nfs/dbraw/zinc/98/53/94/1054985394.db2.gz OXVVZOKKCAAZMV-UHFFFAOYSA-N 2 1 322.496 4.241 20 0 DIADMP CCC[N@H+](Cc1cc(C)c(Cl)cc1Cl)C1CC[NH2+]CC1 ZINC001236184835 1054985904 /nfs/dbraw/zinc/98/59/04/1054985904.db2.gz QBYWXHCJIXKKMO-UHFFFAOYSA-N 2 1 315.288 4.266 20 0 DIADMP CCC[N@@H+](Cc1cc(C)c(Cl)cc1Cl)C1CC[NH2+]CC1 ZINC001236184835 1054985913 /nfs/dbraw/zinc/98/59/13/1054985913.db2.gz QBYWXHCJIXKKMO-UHFFFAOYSA-N 2 1 315.288 4.266 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCc2occc21 ZINC000360035434 1054994937 /nfs/dbraw/zinc/99/49/37/1054994937.db2.gz BBVXJTYSVYCADV-AHRSYUTCSA-N 2 1 324.468 4.157 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCc2occc21 ZINC000360035434 1054994943 /nfs/dbraw/zinc/99/49/43/1054994943.db2.gz BBVXJTYSVYCADV-AHRSYUTCSA-N 2 1 324.468 4.157 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2sc3ccccc3c2C)CC1 ZINC001236213729 1055001787 /nfs/dbraw/zinc/00/17/87/1055001787.db2.gz UAICEYSQCAJTQJ-UHFFFAOYSA-N 2 1 302.487 4.172 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236216579 1055003643 /nfs/dbraw/zinc/00/36/43/1055003643.db2.gz KLOKHJGJWXTOSC-PMACEKPBSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236216579 1055003655 /nfs/dbraw/zinc/00/36/55/1055003655.db2.gz KLOKHJGJWXTOSC-PMACEKPBSA-N 2 1 312.432 4.194 20 0 DIADMP COc1ccc(-c2cccc(C[N@H+](C)[C@H]3CCCC[C@H]3[NH3+])c2)cc1 ZINC001236216264 1055004497 /nfs/dbraw/zinc/00/44/97/1055004497.db2.gz JWOLOAXIADOPDH-RTWAWAEBSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2cccc(C[N@@H+](C)[C@H]3CCCC[C@H]3[NH3+])c2)cc1 ZINC001236216264 1055004509 /nfs/dbraw/zinc/00/45/09/1055004509.db2.gz JWOLOAXIADOPDH-RTWAWAEBSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2cccc(C[N@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])c2)cc1 ZINC001236216262 1055005748 /nfs/dbraw/zinc/00/57/48/1055005748.db2.gz JWOLOAXIADOPDH-LEWJYISDSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2cccc(C[N@@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])c2)cc1 ZINC001236216262 1055005763 /nfs/dbraw/zinc/00/57/63/1055005763.db2.gz JWOLOAXIADOPDH-LEWJYISDSA-N 2 1 324.468 4.064 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(C)c(Cl)cc2Cl)CC1 ZINC001236215866 1055006787 /nfs/dbraw/zinc/00/67/87/1055006787.db2.gz RXDUAUKDXPOCEB-UHFFFAOYSA-N 2 1 315.288 4.264 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236218490 1055009387 /nfs/dbraw/zinc/00/93/87/1055009387.db2.gz SGNDGOCHEXMAOC-SFTDATJTSA-N 2 1 308.469 4.364 20 0 DIADMP COc1ccc(-c2ccc(C[N@H+](C)[C@H]3CCCC[C@H]3[NH3+])cc2)cc1 ZINC001236218730 1055009821 /nfs/dbraw/zinc/00/98/21/1055009821.db2.gz SXSZYYZFUMBMQG-RTWAWAEBSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CCCC[C@H]3[NH3+])cc2)cc1 ZINC001236218730 1055009836 /nfs/dbraw/zinc/00/98/36/1055009836.db2.gz SXSZYYZFUMBMQG-RTWAWAEBSA-N 2 1 324.468 4.064 20 0 DIADMP Cc1c(C[N@@H+](C)[C@H]2CCCC[C@@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219389 1055009937 /nfs/dbraw/zinc/00/99/37/1055009937.db2.gz VOEHMPRZTZGJKZ-SFTDATJTSA-N 2 1 308.469 4.364 20 0 DIADMP Cc1c(C[N@H+](C)[C@H]2CCCC[C@@H]2[NH3+])cccc1-c1ccccc1 ZINC001236219389 1055009953 /nfs/dbraw/zinc/00/99/53/1055009953.db2.gz VOEHMPRZTZGJKZ-SFTDATJTSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)[C@H]1CCCC[C@H]1[NH3+] ZINC001236218765 1055010648 /nfs/dbraw/zinc/01/06/48/1055010648.db2.gz UBMUKUBMDRLYAO-MSOLQXFVSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1cccc(SC(F)(F)F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224004 1055014056 /nfs/dbraw/zinc/01/40/56/1055014056.db2.gz QDFUOBAUNFHSAL-JOCQHMNTSA-N 2 1 318.408 4.000 20 0 DIADMP C[N@@H+](Cc1ccccc1CCc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223338 1055014661 /nfs/dbraw/zinc/01/46/61/1055014661.db2.gz MXQLDNKDWARIBM-HZCBDIJESA-N 2 1 322.496 4.174 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+](C)[C@H]3CC[C@H]([NH3+])CC3)c2)cc1 ZINC001236225067 1055015357 /nfs/dbraw/zinc/01/53/57/1055015357.db2.gz YXOYXYWVIOXNFU-WGSAOQKQSA-N 2 1 324.468 4.489 20 0 DIADMP C[N@@H+](Cc1cc(-c2ccsc2)cs1)C1(C)CC[NH2+]CC1 ZINC001236226147 1055016079 /nfs/dbraw/zinc/01/60/79/1055016079.db2.gz KJMHFZJVNSCIFV-UHFFFAOYSA-N 2 1 306.500 4.051 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)C1(C)CC[NH2+]CC1 ZINC001236225665 1055016612 /nfs/dbraw/zinc/01/66/12/1055016612.db2.gz ARXZTVWZZXRJID-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)C1(C)CC[NH2+]CC1 ZINC001236225665 1055016627 /nfs/dbraw/zinc/01/66/27/1055016627.db2.gz ARXZTVWZZXRJID-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP C[N@@H+](Cc1ccc2oc3ccccc3c2c1)C1(C)CC[NH2+]CC1 ZINC001236226476 1055016652 /nfs/dbraw/zinc/01/66/52/1055016652.db2.gz MFMZKSJGBHNCAQ-UHFFFAOYSA-N 2 1 308.425 4.160 20 0 DIADMP C[N@@H+](Cc1ccccc1CCc1ccccc1)C1(C)CC[NH2+]CC1 ZINC001236226061 1055017474 /nfs/dbraw/zinc/01/74/74/1055017474.db2.gz GKCPMORELQKLHO-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP [NH3+]C1CCC([N@@H+](CCc2cccs2)Cc2ccccc2)CC1 ZINC001236227758 1055019020 /nfs/dbraw/zinc/01/90/20/1055019020.db2.gz LVHSCCFSUJAQHT-UHFFFAOYSA-N 2 1 314.498 4.063 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCCC[NH2+]1)Cc1ccc(C(F)(F)F)cc1 ZINC001236242213 1055027733 /nfs/dbraw/zinc/02/77/33/1055027733.db2.gz WTSJWFZTXYXJIH-INIZCTEOSA-N 2 1 314.395 4.060 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2CCC2CC[NH2+]CC2)cc1C ZINC001236246231 1055028667 /nfs/dbraw/zinc/02/86/67/1055028667.db2.gz ZXXHCNMWMQAIRV-FQEVSTJZSA-N 2 1 300.490 4.220 20 0 DIADMP CCc1ccc(C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)s1 ZINC001236300810 1055048918 /nfs/dbraw/zinc/04/89/18/1055048918.db2.gz MAXONBHWEAXZPL-UHFFFAOYSA-N 2 1 314.498 4.065 20 0 DIADMP CCc1ccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)s1 ZINC001236300810 1055048934 /nfs/dbraw/zinc/04/89/34/1055048934.db2.gz MAXONBHWEAXZPL-UHFFFAOYSA-N 2 1 314.498 4.065 20 0 DIADMP Fc1ccc(CCC[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236370381 1055077233 /nfs/dbraw/zinc/07/72/33/1055077233.db2.gz DXDXUETYFHOSBB-GOSISDBHSA-N 2 1 318.480 4.003 20 0 DIADMP Clc1ccsc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374021 1055078890 /nfs/dbraw/zinc/07/88/90/1055078890.db2.gz OCDNGTBKHWFGLF-ZDUSSCGKSA-N 2 1 312.910 4.146 20 0 DIADMP Clc1ccsc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374021 1055078898 /nfs/dbraw/zinc/07/88/98/1055078898.db2.gz OCDNGTBKHWFGLF-ZDUSSCGKSA-N 2 1 312.910 4.146 20 0 DIADMP Fc1ccc(Cl)c(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373785 1055079423 /nfs/dbraw/zinc/07/94/23/1055079423.db2.gz LCLBJQYRYSBRNS-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1ccc(Cl)c(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373785 1055079433 /nfs/dbraw/zinc/07/94/33/1055079433.db2.gz LCLBJQYRYSBRNS-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1ccc(Cl)cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375060 1055081855 /nfs/dbraw/zinc/08/18/55/1055081855.db2.gz VHSYTGBAIMOXHV-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1cc(Cl)ccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374393 1055081894 /nfs/dbraw/zinc/08/18/94/1055081894.db2.gz QJPRAYCWXOHCKJ-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375974 1055082931 /nfs/dbraw/zinc/08/29/31/1055082931.db2.gz OLGZTXHZZBMHKH-QGZVFWFLSA-N 2 1 318.480 4.187 20 0 DIADMP CSc1ccccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375973 1055083647 /nfs/dbraw/zinc/08/36/47/1055083647.db2.gz NUQOTXWVGBQMFW-INIZCTEOSA-N 2 1 318.530 4.153 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(Cl)s1)C1CC[NH2+]CC1 ZINC001236458615 1055126401 /nfs/dbraw/zinc/12/64/01/1055126401.db2.gz UHOXEIHJIHHHIL-UHFFFAOYSA-N 2 1 300.899 4.002 20 0 DIADMP Fc1cccc(C[N@@H+](CCCC2CCCC2)C2CC[NH2+]CC2)c1 ZINC001236402055 1055094446 /nfs/dbraw/zinc/09/44/46/1055094446.db2.gz URMNQPDQSAFPLB-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP C[C@H]([NH2+]CCc1ccccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185724214 1055096957 /nfs/dbraw/zinc/09/69/57/1055096957.db2.gz XFSVBNHXSGBQIZ-RDJZCZTQSA-N 2 1 320.908 4.125 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](CC)C[C@H]2CC[NH2+]C2)cc1 ZINC001236407791 1055098599 /nfs/dbraw/zinc/09/85/99/1055098599.db2.gz HKIPXJAYWUVIQK-IBGZPJMESA-N 2 1 318.505 4.077 20 0 DIADMP CC[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@@H]1CC[NH2+]C1 ZINC001236408839 1055100619 /nfs/dbraw/zinc/10/06/19/1055100619.db2.gz OXMIHWONVUWEDR-MRXNPFEDSA-N 2 1 308.425 4.017 20 0 DIADMP CC[N@@H+](C[C@H](C)Cc1ccc(C(C)(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236409180 1055100851 /nfs/dbraw/zinc/10/08/51/1055100851.db2.gz YGOFHOVYRFRADS-IEBWSBKVSA-N 2 1 316.533 4.094 20 0 DIADMP CC[N@H+](Cc1ccc(Oc2ccccc2)c(C)c1)C[C@@H]1CC[NH2+]C1 ZINC001236411031 1055102106 /nfs/dbraw/zinc/10/21/06/1055102106.db2.gz LTUMUSRJHQAAQI-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP CC[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@H]1CC[NH2+]C1 ZINC001236412790 1055103462 /nfs/dbraw/zinc/10/34/62/1055103462.db2.gz YKERXAJLHNFAGG-JTQLQIEISA-N 2 1 321.679 4.078 20 0 DIADMP CC[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C[C@H]1CC[NH2+]C1 ZINC001236412790 1055103468 /nfs/dbraw/zinc/10/34/68/1055103468.db2.gz YKERXAJLHNFAGG-JTQLQIEISA-N 2 1 321.679 4.078 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419165 1055105051 /nfs/dbraw/zinc/10/50/51/1055105051.db2.gz HBXFWYBPMLLPMA-BEFAXECRSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419165 1055105062 /nfs/dbraw/zinc/10/50/62/1055105062.db2.gz HBXFWYBPMLLPMA-BEFAXECRSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccc(C[NH+](C)C)c2)nc1 ZINC001236418611 1055105707 /nfs/dbraw/zinc/10/57/07/1055105707.db2.gz SSOBCPAAXDZWEF-KRWDZBQOSA-N 2 1 323.484 4.185 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)cc1 ZINC001236424938 1055107382 /nfs/dbraw/zinc/10/73/82/1055107382.db2.gz FDKSYZPFPCNDTG-UHFFFAOYSA-N 2 1 323.362 4.095 20 0 DIADMP CSC1(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000193808393 1055111122 /nfs/dbraw/zinc/11/11/22/1055111122.db2.gz VAGCNAJLLOBIII-AWEZNQCLSA-N 2 1 315.486 4.117 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(-c2ccc3c(c2)CC[N@H+](C)C3)cc1 ZINC001236436940 1055113634 /nfs/dbraw/zinc/11/36/34/1055113634.db2.gz SBUUHIIRCLLTKV-UHFFFAOYSA-N 2 1 308.469 4.087 20 0 DIADMP CC[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)CC(F)F ZINC000660307328 1055114723 /nfs/dbraw/zinc/11/47/23/1055114723.db2.gz WIIAXNVZSUUDOC-RYRKJORJSA-N 2 1 324.459 4.168 20 0 DIADMP Cc1cccc2c(C[N@@H+](CC(C)(C)C)C3CC[NH2+]CC3)c[nH]c21 ZINC001236457998 1055124555 /nfs/dbraw/zinc/12/45/55/1055124555.db2.gz PDGZCHKESBHUBG-UHFFFAOYSA-N 2 1 313.489 4.076 20 0 DIADMP CSc1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)s1 ZINC001236457075 1055125228 /nfs/dbraw/zinc/12/52/28/1055125228.db2.gz ICSBDWZWEKCTRJ-UHFFFAOYSA-N 2 1 312.548 4.070 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc2cccccc1-2)C1CC[NH2+]CC1 ZINC001236459463 1055126319 /nfs/dbraw/zinc/12/63/19/1055126319.db2.gz POKFBPMZVITPBE-UHFFFAOYSA-N 2 1 310.485 4.392 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc2ccoc21)C1CC[NH2+]CC1 ZINC001236459375 1055126659 /nfs/dbraw/zinc/12/66/59/1055126659.db2.gz KTBCPSMPFPXVSO-UHFFFAOYSA-N 2 1 300.446 4.033 20 0 DIADMP Cc1[nH]c2ccccc2c1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458785 1055126695 /nfs/dbraw/zinc/12/66/95/1055126695.db2.gz YDULMKNVIBNWQF-UHFFFAOYSA-N 2 1 313.489 4.076 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236459766 1055127862 /nfs/dbraw/zinc/12/78/62/1055127862.db2.gz YOCRYUKSYNGDHK-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1 ZINC001236459766 1055127867 /nfs/dbraw/zinc/12/78/67/1055127867.db2.gz YOCRYUKSYNGDHK-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP CCSc1ccccc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236459390 1055127987 /nfs/dbraw/zinc/12/79/87/1055127987.db2.gz LTAIJXAYGGTMNZ-UHFFFAOYSA-N 2 1 320.546 4.399 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@H+](C(C)C)[C@@H]1CCC[NH2+]C1 ZINC001236470969 1055129260 /nfs/dbraw/zinc/12/92/60/1055129260.db2.gz KDJTUCTUZTUDTI-GOSISDBHSA-N 2 1 318.505 4.053 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@@H+](C(C)C)[C@@H]1CCC[NH2+]C1 ZINC001236470969 1055129270 /nfs/dbraw/zinc/12/92/70/1055129270.db2.gz KDJTUCTUZTUDTI-GOSISDBHSA-N 2 1 318.505 4.053 20 0 DIADMP CC(C)C[N@H+](Cc1cc2ccccc2s1)[C@@H]1CCC[NH2+]C1 ZINC001236474335 1055133240 /nfs/dbraw/zinc/13/32/40/1055133240.db2.gz QUDKGUJTYCLYBP-MRXNPFEDSA-N 2 1 302.487 4.111 20 0 DIADMP CC(C)C[N@@H+](Cc1cc2ccccc2s1)[C@@H]1CCC[NH2+]C1 ZINC001236474335 1055133247 /nfs/dbraw/zinc/13/32/47/1055133247.db2.gz QUDKGUJTYCLYBP-MRXNPFEDSA-N 2 1 302.487 4.111 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380898083 1055134247 /nfs/dbraw/zinc/13/42/47/1055134247.db2.gz DNPLEMLHKAULLZ-RTBURBONSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H](C4CC4)C3)C2)cc1 ZINC000380958120 1055141201 /nfs/dbraw/zinc/14/12/01/1055141201.db2.gz VMQMTJIKALGLIG-HMXCVIKNSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1ccc(C[N@H+](CCC(C)(C)C)C2CC[NH2+]CC2)c(F)c1 ZINC001236491200 1055143563 /nfs/dbraw/zinc/14/35/63/1055143563.db2.gz BKNQIRCCJNQXJI-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1ccc(C[N@@H+](CCC(C)(C)C)C2CC[NH2+]CC2)c(F)c1 ZINC001236491200 1055143571 /nfs/dbraw/zinc/14/35/71/1055143571.db2.gz BKNQIRCCJNQXJI-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1ccc(C[N@@H+](CCCC(C)C)C2CC[NH2+]CC2)c(F)c1 ZINC001236491186 1055144228 /nfs/dbraw/zinc/14/42/28/1055144228.db2.gz AZRQYPCIVCYNGE-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1ccc(C[N@H+](CCCC(C)C)C2CC[NH2+]CC2)c(F)c1 ZINC001236491186 1055144230 /nfs/dbraw/zinc/14/42/30/1055144230.db2.gz AZRQYPCIVCYNGE-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1ccc(C[N@H+](CCC2CCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236493874 1055145944 /nfs/dbraw/zinc/14/59/44/1055145944.db2.gz ZFFHGERMPUQOGW-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP Cc1ccc(C[N@@H+](CCC2CCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236493874 1055145956 /nfs/dbraw/zinc/14/59/56/1055145956.db2.gz ZFFHGERMPUQOGW-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP CCCCCC[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001236499308 1055150818 /nfs/dbraw/zinc/15/08/18/1055150818.db2.gz LCRLVLIXFZBIQL-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000381406409 1055166237 /nfs/dbraw/zinc/16/62/37/1055166237.db2.gz WRQGVVLUBYAGQU-SJLPKXTDSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2ccc3c(c2)CC[NH2+]C3)C2CC2)c1C ZINC001236535058 1055166869 /nfs/dbraw/zinc/16/68/69/1055166869.db2.gz QHMSINTWFMCBHT-UHFFFAOYSA-N 2 1 320.480 4.114 20 0 DIADMP CCc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236539464 1055168639 /nfs/dbraw/zinc/16/86/39/1055168639.db2.gz FDPFNCRJZMICGC-WKILWMFISA-N 2 1 306.519 4.183 20 0 DIADMP Cc1c(F)cccc1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236541921 1055170492 /nfs/dbraw/zinc/17/04/92/1055170492.db2.gz PAQZWZMOJIZISZ-IYARVYRRSA-N 2 1 304.453 4.006 20 0 DIADMP Cc1c(F)cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1F ZINC001236540860 1055170909 /nfs/dbraw/zinc/17/09/09/1055170909.db2.gz LSFOYSUZOXSHEN-QAQDUYKDSA-N 2 1 322.443 4.145 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3ncccc3c2)CC2CCC2)CC1 ZINC001236540749 1055170980 /nfs/dbraw/zinc/17/09/80/1055170980.db2.gz ANKLQURWTNFWME-MXVIHJGJSA-N 2 1 323.484 4.107 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccccc2F)CC2CCC2)CC1 ZINC001236541956 1055171033 /nfs/dbraw/zinc/17/10/33/1055171033.db2.gz QWXWDGDGNIITMY-WGSAOQKQSA-N 2 1 318.480 4.130 20 0 DIADMP COc1ccc(C[N@@H+](CCC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236542974 1055173063 /nfs/dbraw/zinc/17/30/63/1055173063.db2.gz KQYBXURQIAXQRP-IYARVYRRSA-N 2 1 318.505 4.203 20 0 DIADMP CSc1cc(C)cc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236549925 1055177335 /nfs/dbraw/zinc/17/73/35/1055177335.db2.gz CTXYZJAFEAKBIP-IYARVYRRSA-N 2 1 318.530 4.199 20 0 DIADMP CCCOc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236550177 1055177894 /nfs/dbraw/zinc/17/78/94/1055177894.db2.gz IDSZXGACUIFYDY-WGSAOQKQSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(Cl)c(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550059 1055178200 /nfs/dbraw/zinc/17/82/00/1055178200.db2.gz GHQGXNACQJZKEW-SHTZXODSSA-N 2 1 312.860 4.207 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(OC(C)C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236549758 1055178449 /nfs/dbraw/zinc/17/84/49/1055178449.db2.gz BASDWRGBXJKWBZ-WGSAOQKQSA-N 2 1 318.505 4.202 20 0 DIADMP COc1cccc(Cl)c1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550977 1055179391 /nfs/dbraw/zinc/17/93/91/1055179391.db2.gz GJXBYKCPLDEPBO-SHTZXODSSA-N 2 1 324.896 4.077 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(O)c3ccccc23)CC2CC2)CC1 ZINC001236552190 1055179934 /nfs/dbraw/zinc/17/99/34/1055179934.db2.gz OESMVEAHTIEERJ-IYARVYRRSA-N 2 1 324.468 4.027 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2c3ccoc3ccc2F)CC2CC2)CC1 ZINC001236552923 1055180183 /nfs/dbraw/zinc/18/01/83/1055180183.db2.gz VCCABAKVOZMUJY-SHTZXODSSA-N 2 1 316.420 4.054 20 0 DIADMP CS[C@@H](C)CC[N@@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554676 1055181909 /nfs/dbraw/zinc/18/19/09/1055181909.db2.gz PWIIIYKJLMTJRA-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP Clc1ccsc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381764648 1055181966 /nfs/dbraw/zinc/18/19/66/1055181966.db2.gz MVKVUXFWAGAVFK-OAHLLOKOSA-N 2 1 320.889 4.013 20 0 DIADMP Clc1ccsc1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381764648 1055181971 /nfs/dbraw/zinc/18/19/71/1055181971.db2.gz MVKVUXFWAGAVFK-OAHLLOKOSA-N 2 1 320.889 4.013 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381791634 1055182216 /nfs/dbraw/zinc/18/22/16/1055182216.db2.gz LMDBSEMUXSPTMF-YTQUADARSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccccc1C[N@@H+](C[C@H]1C[C@H]2C=C[C@@H]1C2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554839 1055183366 /nfs/dbraw/zinc/18/33/66/1055183366.db2.gz XTHBNFGWHYYQIT-XWZZJKMASA-N 2 1 324.512 4.279 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236556495 1055183776 /nfs/dbraw/zinc/18/37/76/1055183776.db2.gz UWYGFAPQDUYRRM-MHCKVMFOSA-N 2 1 300.490 4.423 20 0 DIADMP CCCC[C@@H](CC)C[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236559154 1055183843 /nfs/dbraw/zinc/18/38/43/1055183843.db2.gz BUKSWSZZJMJEKR-MISYRCLQSA-N 2 1 317.521 4.370 20 0 DIADMP Cc1cccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236566511 1055186020 /nfs/dbraw/zinc/18/60/20/1055186020.db2.gz YJQDUWRIENJIKR-KESTWPANSA-N 2 1 300.490 4.400 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2cccc(F)c2)C2CCCC2)CC1 ZINC001236566436 1055186104 /nfs/dbraw/zinc/18/61/04/1055186104.db2.gz HKSVKHLONCSCST-KESTWPANSA-N 2 1 318.480 4.273 20 0 DIADMP Cc1sccc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236565412 1055186521 /nfs/dbraw/zinc/18/65/21/1055186521.db2.gz CYVROBFMLDQMFR-SAABIXHNSA-N 2 1 306.519 4.461 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(Cl)c2)C2CCCC2)CC1 ZINC001236566041 1055186794 /nfs/dbraw/zinc/18/67/94/1055186794.db2.gz AALBUNYWEKGXFL-SAABIXHNSA-N 2 1 306.881 4.355 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)oc1C ZINC001236565837 1055186821 /nfs/dbraw/zinc/18/68/21/1055186821.db2.gz ORVPBRKDJITHLC-SAABIXHNSA-N 2 1 304.478 4.301 20 0 DIADMP Cc1cc(C)c(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)[nH]1 ZINC001236565836 1055186896 /nfs/dbraw/zinc/18/68/96/1055186896.db2.gz ORFJHEWJWPYDPE-SAABIXHNSA-N 2 1 303.494 4.036 20 0 DIADMP Cc1cccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1C ZINC001236567381 1055188339 /nfs/dbraw/zinc/18/83/39/1055188339.db2.gz UPFUTFJKPSKVBS-KESTWPANSA-N 2 1 300.490 4.318 20 0 DIADMP CCc1cccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236570748 1055191689 /nfs/dbraw/zinc/19/16/89/1055191689.db2.gz AOJHCEIMFZDQFA-KESTWPANSA-N 2 1 300.490 4.264 20 0 DIADMP COc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1C ZINC001236572426 1055193510 /nfs/dbraw/zinc/19/35/10/1055193510.db2.gz YKWBWDAMVMJPGE-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2Cl)C2CCC2)CC1 ZINC001236571714 1055193692 /nfs/dbraw/zinc/19/36/92/1055193692.db2.gz AVPFGTZXCHMTJB-CTYIDZIISA-N 2 1 310.844 4.104 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2-n2cccc2)C2CCC2)CC1 ZINC001236572245 1055193934 /nfs/dbraw/zinc/19/39/34/1055193934.db2.gz KUZCHOIUJXSXCH-KESTWPANSA-N 2 1 323.484 4.102 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(O)c3ccccc23)C2CCC2)CC1 ZINC001236573236 1055195032 /nfs/dbraw/zinc/19/50/32/1055195032.db2.gz ZRNKSCPJKIBOAM-SAABIXHNSA-N 2 1 324.468 4.170 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3cc(O)ccc3c2)C2CCC2)CC1 ZINC001236572838 1055195201 /nfs/dbraw/zinc/19/52/01/1055195201.db2.gz VAWOJBURDUQYPV-KESTWPANSA-N 2 1 324.468 4.170 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c2ccccc12 ZINC001236598247 1055200244 /nfs/dbraw/zinc/20/02/44/1055200244.db2.gz JGJOXOZSFGZKFX-QGZVFWFLSA-N 2 1 308.469 4.112 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236599573 1055202264 /nfs/dbraw/zinc/20/22/64/1055202264.db2.gz STEYTFRPLXGKAU-HNNXBMFYSA-N 2 1 314.498 4.174 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236606002 1055203368 /nfs/dbraw/zinc/20/33/68/1055203368.db2.gz YJHALAHIMYJAMM-OAQYLSRUSA-N 2 1 319.452 4.006 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001236606004 1055203984 /nfs/dbraw/zinc/20/39/84/1055203984.db2.gz YKACNNWUDRRVAC-CQQBXOTJSA-N 2 1 306.453 4.028 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001236637716 1055208473 /nfs/dbraw/zinc/20/84/73/1055208473.db2.gz UBMSFAGTCJKMKY-UHFFFAOYSA-N 2 1 308.469 4.255 20 0 DIADMP CCCC[C@@H](CC)C[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236662268 1055216527 /nfs/dbraw/zinc/21/65/27/1055216527.db2.gz AYJSSXYSDCPEGK-QWFCFKBJSA-N 2 1 317.521 4.370 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc2cc(OC)ccc2s1 ZINC001236667264 1055220446 /nfs/dbraw/zinc/22/04/46/1055220446.db2.gz KTAWDHGLDANTLM-UHFFFAOYSA-N 2 1 320.502 4.074 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001236682529 1055228688 /nfs/dbraw/zinc/22/86/88/1055228688.db2.gz VCRLQMJWKWBPLE-MEMLXQNLSA-N 2 1 308.469 4.001 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)CC1 ZINC001236681862 1055228832 /nfs/dbraw/zinc/22/88/32/1055228832.db2.gz KNDIFKLSZZVAGE-MXVIHJGJSA-N 2 1 312.432 4.098 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cccc3occc32)CC1 ZINC001236744933 1055247667 /nfs/dbraw/zinc/24/76/67/1055247667.db2.gz FJUGBUGJWVIBNM-UHFFFAOYSA-N 2 1 300.446 4.129 20 0 DIADMP Cc1cnccc1C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236755377 1055250332 /nfs/dbraw/zinc/25/03/32/1055250332.db2.gz OVJCEKFKNMZOFZ-MXVIHJGJSA-N 2 1 315.505 4.042 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236755246 1055251189 /nfs/dbraw/zinc/25/11/89/1055251189.db2.gz MQELWFWWPNWBJG-IYARVYRRSA-N 2 1 304.478 4.240 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236767892 1055251377 /nfs/dbraw/zinc/25/13/77/1055251377.db2.gz QAUYGRYUDMPYEU-QAQDUYKDSA-N 2 1 306.469 4.252 20 0 DIADMP CC(C)(C)C[N@@H+](CCc1c(F)cccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767184 1055251628 /nfs/dbraw/zinc/25/16/28/1055251628.db2.gz FKYNIPXRRCSPMM-SHTZXODSSA-N 2 1 324.459 4.125 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1F ZINC001236767461 1055252113 /nfs/dbraw/zinc/25/21/13/1055252113.db2.gz MTCCPWYUZKOUKD-QAQDUYKDSA-N 2 1 306.469 4.252 20 0 DIADMP CS[C@H](C)CC[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236755213 1055252200 /nfs/dbraw/zinc/25/22/00/1055252200.db2.gz MGGVKIBEIWUXCZ-KBAYOESNSA-N 2 1 312.567 4.280 20 0 DIADMP Cc1cc(Cl)ncc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236766063 1055252461 /nfs/dbraw/zinc/25/24/61/1055252461.db2.gz CPYFATDZPNJSCY-WKILWMFISA-N 2 1 323.912 4.161 20 0 DIADMP C[C@H](C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C(F)(F)F ZINC001236756639 1055253011 /nfs/dbraw/zinc/25/30/11/1055253011.db2.gz ZAEQTFCKDFUVMD-FVQBIDKESA-N 2 1 320.443 4.337 20 0 DIADMP Cc1ccc(CCC[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236768902 1055253802 /nfs/dbraw/zinc/25/38/02/1055253802.db2.gz SHQUIXCMONSYBC-QAQDUYKDSA-N 2 1 306.494 4.139 20 0 DIADMP CC(C)(C)C[N@@H+](CCc1ccc(F)c(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236769400 1055254716 /nfs/dbraw/zinc/25/47/16/1055254716.db2.gz ULBBFHSXKPLGBK-WKILWMFISA-N 2 1 324.459 4.125 20 0 DIADMP CCc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236779201 1055255109 /nfs/dbraw/zinc/25/51/09/1055255109.db2.gz FYRJQFUBPPXSBP-SHTZXODSSA-N 2 1 308.535 4.429 20 0 DIADMP Cc1c(F)cccc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236769431 1055255425 /nfs/dbraw/zinc/25/54/25/1055255425.db2.gz VEXIHAYPBXIMDR-QAQDUYKDSA-N 2 1 306.469 4.252 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(O)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768863 1055255510 /nfs/dbraw/zinc/25/55/10/1055255510.db2.gz YAEKJNTWOVZTIN-SHTZXODSSA-N 2 1 324.896 4.164 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(F)ccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782139 1055258282 /nfs/dbraw/zinc/25/82/82/1055258282.db2.gz OGQNWEVQHDSYAL-UAPYVXQJSA-N 2 1 306.469 4.395 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc2c(c1)CCC2)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782342 1055259028 /nfs/dbraw/zinc/25/90/28/1055259028.db2.gz JOADOJGBEXALHN-XUTJKUGGSA-N 2 1 314.517 4.436 20 0 DIADMP COc1ccc(C)c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236782842 1055259363 /nfs/dbraw/zinc/25/93/63/1055259363.db2.gz KYWJRAGRDFYJSO-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP CCC(CC)[N@@H+](Cc1c[nH]c2ccccc12)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783235 1055259452 /nfs/dbraw/zinc/25/94/52/1055259452.db2.gz QXRNIAGMPQNHLF-SAABIXHNSA-N 2 1 313.489 4.428 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)c2ccccc21 ZINC000383287367 1055262811 /nfs/dbraw/zinc/26/28/11/1055262811.db2.gz MGYUYAQOQFQTQF-VGSWGCGISA-N 2 1 320.480 4.489 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+](C)C2CC[NH+](C)CC2)c1 ZINC001236822710 1055277580 /nfs/dbraw/zinc/27/75/80/1055277580.db2.gz JLBYVZULWCMHEC-UHFFFAOYSA-N 2 1 322.496 4.496 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+](C)C2CC[NH+](C)CC2)c1 ZINC001236822710 1055277595 /nfs/dbraw/zinc/27/75/95/1055277595.db2.gz JLBYVZULWCMHEC-UHFFFAOYSA-N 2 1 322.496 4.496 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3cccc4c5ccccc5sc43)C[C@@H]12 ZINC001236822104 1055277752 /nfs/dbraw/zinc/27/77/52/1055277752.db2.gz YGASEWOVONYHOP-FSPWUOQZSA-N 2 1 322.477 4.224 20 0 DIADMP C[C@@H]1C[C@H]1c1ccc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000383482387 1055280599 /nfs/dbraw/zinc/28/05/99/1055280599.db2.gz SQYUZFGHPIYEQI-YVWKXTFCSA-N 2 1 324.468 4.015 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2ccccc2)s1)C[C@H]1CC[NH2+]C1 ZINC001236833440 1055282410 /nfs/dbraw/zinc/28/24/10/1055282410.db2.gz BHUPLIOZUDJHNE-INIZCTEOSA-N 2 1 314.498 4.237 20 0 DIADMP c1cc2c(o1)CCC[C@H]2[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000764879420 1055284903 /nfs/dbraw/zinc/28/49/03/1055284903.db2.gz ILXHANGQKVFAJP-LJQANCHMSA-N 2 1 316.489 4.291 20 0 DIADMP CCC[N@H+](Cc1ccccc1-c1ccccc1C)C[C@H]1CC[NH2+]C1 ZINC001236844648 1055286689 /nfs/dbraw/zinc/28/66/89/1055286689.db2.gz XAWOWVDBOXKFDQ-IBGZPJMESA-N 2 1 322.496 4.484 20 0 DIADMP CCC[N@H+](Cc1cc(-c2ccsc2)cs1)C[C@H]1CC[NH2+]C1 ZINC001236843739 1055287625 /nfs/dbraw/zinc/28/76/25/1055287625.db2.gz QPPCQBNRILSZTL-AWEZNQCLSA-N 2 1 320.527 4.298 20 0 DIADMP CCC[N@H+](Cc1cccc(-c2ccccc2)c1)C[C@@H]1CC[NH2+]C1 ZINC001236843045 1055289462 /nfs/dbraw/zinc/28/94/62/1055289462.db2.gz KTDQZOJOKGXBCU-LJQANCHMSA-N 2 1 308.469 4.175 20 0 DIADMP CCC[N@H+](Cc1ccc(Cc2ccccc2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236844507 1055289668 /nfs/dbraw/zinc/28/96/68/1055289668.db2.gz VKOHGBKAUVDOTQ-JOCHJYFZSA-N 2 1 322.496 4.099 20 0 DIADMP C[C@@H]1CCCC[N@@H+](Cc2ccc(-n3ccnc3)c(Cl)c2)C1 ZINC001236901867 1055308529 /nfs/dbraw/zinc/30/85/29/1055308529.db2.gz BKRGWYPEXGFGRI-CQSZACIVSA-N 2 1 303.837 4.148 20 0 DIADMP Clc1cc(C[N@H+]2CC[C@@H]3CCC[C@H]3C2)ccc1-n1ccnc1 ZINC001236906740 1055312377 /nfs/dbraw/zinc/31/23/77/1055312377.db2.gz MNJOLOKDWMBBTD-HOTGVXAUSA-N 2 1 315.848 4.148 20 0 DIADMP Clc1cc(-n2ccnc2)ccc1C[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001236915060 1055317670 /nfs/dbraw/zinc/31/76/70/1055317670.db2.gz BDBKFMRCALFJSH-HUUCEWRRSA-N 2 1 315.848 4.148 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001237056864 1055356049 /nfs/dbraw/zinc/35/60/49/1055356049.db2.gz KKZOTZBYAWDDJJ-HXUWFJFHSA-N 2 1 310.441 4.040 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001237056864 1055356064 /nfs/dbraw/zinc/35/60/64/1055356064.db2.gz KKZOTZBYAWDDJJ-HXUWFJFHSA-N 2 1 310.441 4.040 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+](Cc2sccc2Oc2ccccc2)C1 ZINC001237059744 1055359259 /nfs/dbraw/zinc/35/92/59/1055359259.db2.gz VAXSCMGJONEVNA-SFHVURJKSA-N 2 1 316.470 4.101 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2sccc2Oc2ccccc2)C1 ZINC001237059744 1055359269 /nfs/dbraw/zinc/35/92/69/1055359269.db2.gz VAXSCMGJONEVNA-SFHVURJKSA-N 2 1 316.470 4.101 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+]1CCC[C@](C)(C[NH3+])C1 ZINC001237059382 1055360513 /nfs/dbraw/zinc/36/05/13/1055360513.db2.gz UBGISHIQUXHLSB-HXUWFJFHSA-N 2 1 318.505 4.207 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@](C)(C[NH3+])C1 ZINC001237059382 1055360530 /nfs/dbraw/zinc/36/05/30/1055360530.db2.gz UBGISHIQUXHLSB-HXUWFJFHSA-N 2 1 318.505 4.207 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)C1 ZINC001237079842 1055361962 /nfs/dbraw/zinc/36/19/62/1055361962.db2.gz CEBRXWQFJKKARS-INIZCTEOSA-N 2 1 306.500 4.037 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(-c2ccccc2)c1 ZINC001237081516 1055362009 /nfs/dbraw/zinc/36/20/09/1055362009.db2.gz JJFBLFXTRLSLDR-PRJVBOEPSA-N 2 1 306.453 4.055 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccccc2)s1 ZINC001237082635 1055364599 /nfs/dbraw/zinc/36/45/99/1055364599.db2.gz UEDNSTABMCRODZ-ZXFUBFMLSA-N 2 1 312.482 4.117 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@@](C)(C[NH3+])C3)cc2)c1 ZINC001237080660 1055365226 /nfs/dbraw/zinc/36/52/26/1055365226.db2.gz HNRDMZDAYQLEQR-NRFANRHFSA-N 2 1 308.469 4.223 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+](C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237156664 1055388059 /nfs/dbraw/zinc/38/80/59/1055388059.db2.gz QMKXDXPMHVCCBA-INIZCTEOSA-N 2 1 314.498 4.316 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237156664 1055388068 /nfs/dbraw/zinc/38/80/68/1055388068.db2.gz QMKXDXPMHVCCBA-INIZCTEOSA-N 2 1 314.498 4.316 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc3ccccc3c2)CC[N@H+]1C ZINC000624267315 1055398027 /nfs/dbraw/zinc/39/80/27/1055398027.db2.gz JYTCGNYBOVUVHE-JXFKEZNVSA-N 2 1 310.485 4.190 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc2nccc(Cl)c2c1 ZINC001237274946 1055412398 /nfs/dbraw/zinc/41/23/98/1055412398.db2.gz NDRLOKVRQSVNHG-UHFFFAOYSA-N 2 1 319.880 4.052 20 0 DIADMP CC(C)=CCC[C@@H](C)C[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001237358245 1055439603 /nfs/dbraw/zinc/43/96/03/1055439603.db2.gz DQWKOYKQJCNERP-GOSISDBHSA-N 2 1 312.501 4.463 20 0 DIADMP C[C@H](C[N@H+]1CC[C@H]2[NH2+]CCC[C@@H]2C1)c1cccc2ccccc21 ZINC001237380724 1055444177 /nfs/dbraw/zinc/44/41/77/1055444177.db2.gz HCVANNYESFRZEB-HGHGUNKESA-N 2 1 308.469 4.017 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237380813 1055444546 /nfs/dbraw/zinc/44/45/46/1055444546.db2.gz HOPGWVBPCUSUNT-DUXKGJEZSA-N 2 1 314.517 4.063 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237380818 1055444961 /nfs/dbraw/zinc/44/49/61/1055444961.db2.gz HOPGWVBPCUSUNT-QMMLZNLJSA-N 2 1 314.517 4.063 20 0 DIADMP Cc1csc2sc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)c(C)c12 ZINC001237407589 1055449509 /nfs/dbraw/zinc/44/95/09/1055449509.db2.gz YCDQNACTPDSCCK-UONOGXRCSA-N 2 1 320.527 4.154 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2cccc3ccccc32)C1 ZINC001620868499 1055495755 /nfs/dbraw/zinc/49/57/55/1055495755.db2.gz FJFPHAUGBAJRQN-GOSISDBHSA-N 2 1 310.485 4.297 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001620910970 1055536138 /nfs/dbraw/zinc/53/61/38/1055536138.db2.gz PCEMCDQOBVPXKF-AEFFLSMTSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001620910970 1055536148 /nfs/dbraw/zinc/53/61/48/1055536148.db2.gz PCEMCDQOBVPXKF-AEFFLSMTSA-N 2 1 314.517 4.311 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001620921242 1055543535 /nfs/dbraw/zinc/54/35/35/1055543535.db2.gz RPBDRMXVUJKFFM-JBACZVJFSA-N 2 1 312.501 4.091 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@@](C)(F)CC3)cc21 ZINC001237880707 1055546474 /nfs/dbraw/zinc/54/64/74/1055546474.db2.gz JDWZUZQDVXAKMM-HXUWFJFHSA-N 2 1 316.464 4.402 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+](C)Cc3cccc(O)c3)cc21 ZINC001237881889 1055548484 /nfs/dbraw/zinc/54/84/84/1055548484.db2.gz YVISPPXHFYWITO-UHFFFAOYSA-N 2 1 322.452 4.025 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCCC(F)(F)CC3)cc21 ZINC001237881000 1055548837 /nfs/dbraw/zinc/54/88/37/1055548837.db2.gz MPVUUKCPWCBQTN-UHFFFAOYSA-N 2 1 320.427 4.309 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@H+]1CCC[C@@H](CCc2ccccc2)C1 ZINC001238117007 1055608265 /nfs/dbraw/zinc/60/82/65/1055608265.db2.gz UDWJRZABALVCKV-IBGZPJMESA-N 2 1 319.452 4.179 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@@H+]1CCC[C@@H](CCc2ccccc2)C1 ZINC001238117007 1055608276 /nfs/dbraw/zinc/60/82/76/1055608276.db2.gz UDWJRZABALVCKV-IBGZPJMESA-N 2 1 319.452 4.179 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cccc3c[nH+]cn32)cc1 ZINC001238118287 1055609809 /nfs/dbraw/zinc/60/98/09/1055609809.db2.gz IVQUBTPOVQSRNT-HXUWFJFHSA-N 2 1 321.424 4.070 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2Cc2cccc3c[nH+]cn32)cc1 ZINC001238118287 1055609815 /nfs/dbraw/zinc/60/98/15/1055609815.db2.gz IVQUBTPOVQSRNT-HXUWFJFHSA-N 2 1 321.424 4.070 20 0 DIADMP CC(C)c1cc(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)ccc1Cl ZINC001238226752 1055624752 /nfs/dbraw/zinc/62/47/52/1055624752.db2.gz DPNFMQYQWJTIRN-UHFFFAOYSA-N 2 1 320.908 4.381 20 0 DIADMP CC[NH+]1CCC(N(C)Cc2ccc(Cl)c(C(C)C)c2)CC1 ZINC001238227638 1055625655 /nfs/dbraw/zinc/62/56/55/1055625655.db2.gz IJLNXDSTELHSSM-UHFFFAOYSA-N 2 1 308.897 4.380 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c(C(C)C)c2)CC1 ZINC001238227638 1055625669 /nfs/dbraw/zinc/62/56/69/1055625669.db2.gz IJLNXDSTELHSSM-UHFFFAOYSA-N 2 1 308.897 4.380 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c(C(C)C)c2)CC1 ZINC001238227638 1055625686 /nfs/dbraw/zinc/62/56/86/1055625686.db2.gz IJLNXDSTELHSSM-UHFFFAOYSA-N 2 1 308.897 4.380 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC[C@]2(C1)CCC[N@H+](CCCOC)C2 ZINC001278208097 1055629851 /nfs/dbraw/zinc/62/98/51/1055629851.db2.gz SOIUTCZBHCANTG-VQTJNVASSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCCOC)C2 ZINC001278208097 1055629856 /nfs/dbraw/zinc/62/98/56/1055629856.db2.gz SOIUTCZBHCANTG-VQTJNVASSA-N 2 1 324.553 4.027 20 0 DIADMP CC[N@@H+](CCn1ccnc1)Cc1cc(Cl)c(Cl)cc1C ZINC001238269195 1055633313 /nfs/dbraw/zinc/63/33/13/1055633313.db2.gz VBDMFRCNAXWYJF-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP CC(C)(C)[C@H]1CCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001620966793 1055700162 /nfs/dbraw/zinc/70/01/62/1055700162.db2.gz KMEGOJTYJAZGPQ-VQTJNVASSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@@H+]2CCCC2(C)C)C[C@H](c2ccccc2)C1 ZINC001620967786 1055716241 /nfs/dbraw/zinc/71/62/41/1055716241.db2.gz ZQSGCTAXAJSPFX-DFQSSKMNSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@H+]2CCCC2(C)C)C[C@H](c2ccccc2)C1 ZINC001620967786 1055716251 /nfs/dbraw/zinc/71/62/51/1055716251.db2.gz ZQSGCTAXAJSPFX-DFQSSKMNSA-N 2 1 314.517 4.423 20 0 DIADMP CC[C@@H](c1ccccc1OC)[N@H+](C)CCCCn1cc[nH+]c1C ZINC000347537228 1055786546 /nfs/dbraw/zinc/78/65/46/1055786546.db2.gz JMLOHNOSXWANSO-SFHVURJKSA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@@H](c1ccccc1OC)[N@@H+](C)CCCCn1cc[nH+]c1C ZINC000347537228 1055786558 /nfs/dbraw/zinc/78/65/58/1055786558.db2.gz JMLOHNOSXWANSO-SFHVURJKSA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1CC[NH2+]C[C@@H](c1ccccc1)C(C)C ZINC001620785882 1055960085 /nfs/dbraw/zinc/96/00/85/1055960085.db2.gz QLQUQKCFPFPXFU-WOJBJXKFSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1CC[NH2+]C[C@@H](c1ccccc1)C(C)C ZINC001620785882 1055960097 /nfs/dbraw/zinc/96/00/97/1055960097.db2.gz QLQUQKCFPFPXFU-WOJBJXKFSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1CC[NH2+]C[C@@H](c1ccccc1)C(C)C ZINC001620785881 1055960568 /nfs/dbraw/zinc/96/05/68/1055960568.db2.gz QLQUQKCFPFPXFU-VQTJNVASSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@H]1CCCC[N@H+]1CC[NH2+]C[C@@H](c1ccccc1)C(C)C ZINC001620785881 1055960578 /nfs/dbraw/zinc/96/05/78/1055960578.db2.gz QLQUQKCFPFPXFU-VQTJNVASSA-N 2 1 302.506 4.280 20 0 DIADMP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506606 1055962364 /nfs/dbraw/zinc/96/23/64/1055962364.db2.gz JMUZBJVNPQAWMB-RTWAWAEBSA-N 2 1 312.501 4.260 20 0 DIADMP C[N@H+]1CC[C@@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506606 1055962375 /nfs/dbraw/zinc/96/23/75/1055962375.db2.gz JMUZBJVNPQAWMB-RTWAWAEBSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506606 1055962382 /nfs/dbraw/zinc/96/23/82/1055962382.db2.gz JMUZBJVNPQAWMB-RTWAWAEBSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506606 1055962389 /nfs/dbraw/zinc/96/23/89/1055962389.db2.gz JMUZBJVNPQAWMB-RTWAWAEBSA-N 2 1 312.501 4.260 20 0 DIADMP C[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506607 1055962460 /nfs/dbraw/zinc/96/24/60/1055962460.db2.gz JMUZBJVNPQAWMB-SFTDATJTSA-N 2 1 312.501 4.260 20 0 DIADMP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506607 1055962467 /nfs/dbraw/zinc/96/24/67/1055962467.db2.gz JMUZBJVNPQAWMB-SFTDATJTSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2C[N@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506607 1055962473 /nfs/dbraw/zinc/96/24/73/1055962473.db2.gz JMUZBJVNPQAWMB-SFTDATJTSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@@H]21 ZINC001620506607 1055962477 /nfs/dbraw/zinc/96/24/77/1055962477.db2.gz JMUZBJVNPQAWMB-SFTDATJTSA-N 2 1 312.501 4.260 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@H]3[C@H](CC[NH+]3C)C2)c(C(C)C)c1 ZINC001620506727 1055962643 /nfs/dbraw/zinc/96/26/43/1055962643.db2.gz MPGOIKMXGXJCDL-CTNGQTDRSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c(C(C)C)c1 ZINC001620506727 1055962651 /nfs/dbraw/zinc/96/26/51/1055962651.db2.gz MPGOIKMXGXJCDL-CTNGQTDRSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CC[N@H+]3C)C2)c(C(C)C)c1 ZINC001620506727 1055962656 /nfs/dbraw/zinc/96/26/56/1055962656.db2.gz MPGOIKMXGXJCDL-CTNGQTDRSA-N 2 1 314.517 4.459 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001621006517 1055974265 /nfs/dbraw/zinc/97/42/65/1055974265.db2.gz LEHBPGDEMNBUOE-QGZVFWFLSA-N 2 1 312.501 4.263 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC001621006696 1055975078 /nfs/dbraw/zinc/97/50/78/1055975078.db2.gz RAJOKERRPKJCBX-SFHVURJKSA-N 2 1 300.490 4.166 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]CC(C)(C)c2ccccc2)C1 ZINC001620724634 1055987082 /nfs/dbraw/zinc/98/70/82/1055987082.db2.gz FZZAPVQTTSQUIP-SFHVURJKSA-N 2 1 302.506 4.066 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000069754303 1056025668 /nfs/dbraw/zinc/02/56/68/1056025668.db2.gz UKLRGMZSZPSZAP-UHFFFAOYSA-N 2 1 311.454 4.100 20 0 DIADMP C[NH+](C)Cc1ccccc1-c1ccc2c(c1)[nH]c1cc[nH+]cc12 ZINC001239683895 1056026959 /nfs/dbraw/zinc/02/69/59/1056026959.db2.gz MINZKGIOSRQJKA-UHFFFAOYSA-N 2 1 301.393 4.445 20 0 DIADMP Clc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)o1 ZINC000071007458 1056027265 /nfs/dbraw/zinc/02/72/65/1056027265.db2.gz ZEEOSAYOXAKDCX-UHFFFAOYSA-N 2 1 318.848 4.209 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000166387374 1056184754 /nfs/dbraw/zinc/18/47/54/1056184754.db2.gz FUXXEUVFRXXHAN-RBUKOAKNSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166387374 1056184761 /nfs/dbraw/zinc/18/47/61/1056184761.db2.gz FUXXEUVFRXXHAN-RBUKOAKNSA-N 2 1 322.452 4.195 20 0 DIADMP CC[C@@H](C)[N@H+](C)CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614453 1056329814 /nfs/dbraw/zinc/32/98/14/1056329814.db2.gz SJOKGMKAWPRXGJ-DNDYEEKYSA-N 2 1 308.432 4.064 20 0 DIADMP CC[C@@H](C)[N@@H+](C)CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614453 1056329826 /nfs/dbraw/zinc/32/98/26/1056329826.db2.gz SJOKGMKAWPRXGJ-DNDYEEKYSA-N 2 1 308.432 4.064 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474727505 1056344525 /nfs/dbraw/zinc/34/45/25/1056344525.db2.gz REZWACPMZOUWQQ-XDQVBPFNSA-N 2 1 314.926 4.213 20 0 DIADMP CCOC(=[NH2+])c1ccc(C2=CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC001240387433 1056468839 /nfs/dbraw/zinc/46/88/39/1056468839.db2.gz PQSDDDSONIWMNP-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP CCOC(=[NH2+])c1ccc(C2=CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001240387433 1056468848 /nfs/dbraw/zinc/46/88/48/1056468848.db2.gz PQSDDDSONIWMNP-UHFFFAOYSA-N 2 1 320.436 4.338 20 0 DIADMP c1ccc(-c2cccc(C[NH2+]C3CC([NH+]4CCCCC4)C3)c2)cc1 ZINC000475572024 1056471125 /nfs/dbraw/zinc/47/11/25/1056471125.db2.gz WZZCIUXXBRWVEC-UHFFFAOYSA-N 2 1 320.480 4.460 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H]1c1cccc2ccccc21 ZINC001615252270 1056485077 /nfs/dbraw/zinc/48/50/77/1056485077.db2.gz XRTPIEZEUMIMCG-GHTZIAJQSA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC001615252270 1056485080 /nfs/dbraw/zinc/48/50/80/1056485080.db2.gz XRTPIEZEUMIMCG-GHTZIAJQSA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC001615252270 1056485082 /nfs/dbraw/zinc/48/50/82/1056485082.db2.gz XRTPIEZEUMIMCG-GHTZIAJQSA-N 2 1 308.469 4.461 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC3CCC4(CC4)CC3)C2)CC1 ZINC001615342508 1056497311 /nfs/dbraw/zinc/49/73/11/1056497311.db2.gz BKCSJLJTSPTNMN-HXUWFJFHSA-N 2 1 318.549 4.401 20 0 DIADMP Cc1sccc1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310019906 1056531198 /nfs/dbraw/zinc/53/11/98/1056531198.db2.gz QTIVNJQDACGGKF-GOSISDBHSA-N 2 1 314.498 4.058 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001615540638 1056534176 /nfs/dbraw/zinc/53/41/76/1056534176.db2.gz ZLKJFJZWCAREST-QZTJIDSGSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001615540638 1056534190 /nfs/dbraw/zinc/53/41/90/1056534190.db2.gz ZLKJFJZWCAREST-QZTJIDSGSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001615540638 1056534203 /nfs/dbraw/zinc/53/42/03/1056534203.db2.gz ZLKJFJZWCAREST-QZTJIDSGSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001615540638 1056534217 /nfs/dbraw/zinc/53/42/17/1056534217.db2.gz ZLKJFJZWCAREST-QZTJIDSGSA-N 2 1 318.480 4.221 20 0 DIADMP CC(C)[NH+](CCC[NH2+]C/C=C/c1ccc(F)cc1F)C(C)C ZINC001620828401 1056537937 /nfs/dbraw/zinc/53/79/37/1056537937.db2.gz REQRWNCRVJHGRL-FNORWQNLSA-N 2 1 310.432 4.077 20 0 DIADMP C[N@H+](C[C@@H]1CCC[NH+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634866 1056550835 /nfs/dbraw/zinc/55/08/35/1056550835.db2.gz KEFNPXIKWADEQY-MRXNPFEDSA-N 2 1 306.453 4.030 20 0 DIADMP C[N@@H+](C[C@@H]1CCC[NH+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634866 1056550844 /nfs/dbraw/zinc/55/08/44/1056550844.db2.gz KEFNPXIKWADEQY-MRXNPFEDSA-N 2 1 306.453 4.030 20 0 DIADMP C[NH+](C[C@@H]1CCC[N@H+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634866 1056550856 /nfs/dbraw/zinc/55/08/56/1056550856.db2.gz KEFNPXIKWADEQY-MRXNPFEDSA-N 2 1 306.453 4.030 20 0 DIADMP C[NH+](C[C@@H]1CCC[N@@H+](C)C1)C1c2ccccc2-c2ccccc21 ZINC001615634866 1056550867 /nfs/dbraw/zinc/55/08/67/1056550867.db2.gz KEFNPXIKWADEQY-MRXNPFEDSA-N 2 1 306.453 4.030 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001615789549 1056575916 /nfs/dbraw/zinc/57/59/16/1056575916.db2.gz NRUZKQRPLQUPOR-UYAOXDASSA-N 2 1 314.517 4.377 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)c(C)c1C ZINC001615791575 1056576000 /nfs/dbraw/zinc/57/60/00/1056576000.db2.gz JFCSUTMFWCBZJX-YJYMSZOUSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c(C)c1C ZINC001615791575 1056576013 /nfs/dbraw/zinc/57/60/13/1056576013.db2.gz JFCSUTMFWCBZJX-YJYMSZOUSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c(C)c1C ZINC001615791575 1056576029 /nfs/dbraw/zinc/57/60/29/1056576029.db2.gz JFCSUTMFWCBZJX-YJYMSZOUSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c(C)c1C ZINC001615791575 1056576040 /nfs/dbraw/zinc/57/60/40/1056576040.db2.gz JFCSUTMFWCBZJX-YJYMSZOUSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615845999 1056584660 /nfs/dbraw/zinc/58/46/60/1056584660.db2.gz FJIZRWZKYBJNSI-TYPHKJRUSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615845999 1056584669 /nfs/dbraw/zinc/58/46/69/1056584669.db2.gz FJIZRWZKYBJNSI-TYPHKJRUSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615845999 1056584673 /nfs/dbraw/zinc/58/46/73/1056584673.db2.gz FJIZRWZKYBJNSI-TYPHKJRUSA-N 2 1 314.517 4.408 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001615867206 1056586909 /nfs/dbraw/zinc/58/69/09/1056586909.db2.gz FECUXNNARNYJDQ-KRWDZBQOSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCc2ccccc2)CC1 ZINC001615868057 1056588593 /nfs/dbraw/zinc/58/85/93/1056588593.db2.gz MNLSKAKBHCZIKD-LJQANCHMSA-N 2 1 314.517 4.206 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2CC(C)C)[C@@H](C)C1 ZINC001615896639 1056593922 /nfs/dbraw/zinc/59/39/22/1056593922.db2.gz YZEJGEMLSDCJND-PXNSSMCTSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2CC(C)C)[C@@H](C)C1 ZINC001615896639 1056593930 /nfs/dbraw/zinc/59/39/30/1056593930.db2.gz YZEJGEMLSDCJND-PXNSSMCTSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2CC(C)C)[C@@H](C)C1 ZINC001615896639 1056593944 /nfs/dbraw/zinc/59/39/44/1056593944.db2.gz YZEJGEMLSDCJND-PXNSSMCTSA-N 2 1 302.506 4.047 20 0 DIADMP COC(=[NH2+])c1cccc(-c2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC001241389203 1057035533 /nfs/dbraw/zinc/03/55/33/1057035533.db2.gz ODGWBSQFGGPALE-UHFFFAOYSA-N 2 1 308.425 4.311 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000390791448 1057050213 /nfs/dbraw/zinc/05/02/13/1057050213.db2.gz WTJYVYOLBYSZJC-QUCCMNQESA-N 2 1 308.469 4.249 20 0 DIADMP Cc1cccc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCCC2)c1 ZINC000166460416 1057058775 /nfs/dbraw/zinc/05/87/75/1057058775.db2.gz GTVRKZSDTBSOEU-VQTJNVASSA-N 2 1 312.501 4.023 20 0 DIADMP C[C@@H](C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C(C)(C)C ZINC000766003509 1057070752 /nfs/dbraw/zinc/07/07/52/1057070752.db2.gz ARMPHNGGVOXXHN-INIZCTEOSA-N 2 1 320.496 4.104 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)Cc2cccs2)c1 ZINC000675779822 1057410601 /nfs/dbraw/zinc/41/06/01/1057410601.db2.gz IZCFKSSIZKMHAZ-MRXNPFEDSA-N 2 1 316.514 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166464 1057533544 /nfs/dbraw/zinc/53/35/44/1057533544.db2.gz SDGHZGBKDONIHY-SGMGOOAPSA-N 2 1 314.445 4.135 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166464 1057533553 /nfs/dbraw/zinc/53/35/53/1057533553.db2.gz SDGHZGBKDONIHY-SGMGOOAPSA-N 2 1 314.445 4.135 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc(C[NH2+]C)cc2)nc1 ZINC001242991444 1057538239 /nfs/dbraw/zinc/53/82/39/1057538239.db2.gz OLWHOHDNEKVWLG-HXUWFJFHSA-N 2 1 309.457 4.015 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(-c2ccc(C[NH2+]C)cc2)nc1 ZINC001242991443 1057538542 /nfs/dbraw/zinc/53/85/42/1057538542.db2.gz OLWHOHDNEKVWLG-FQEVSTJZSA-N 2 1 309.457 4.015 20 0 DIADMP CC[C@@H](CC(F)F)C[N@@H+](CC)Cc1ccc(C[NH+](C)C)cc1 ZINC000626063559 1057555252 /nfs/dbraw/zinc/55/52/52/1057555252.db2.gz IHHCLBCPNKXSNS-HNNXBMFYSA-N 2 1 312.448 4.252 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1scnc1C1CC1 ZINC000487269949 1057572260 /nfs/dbraw/zinc/57/22/60/1057572260.db2.gz IYWWITIWCNAOSL-JKSUJKDBSA-N 2 1 321.534 4.011 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000161615127 1057598217 /nfs/dbraw/zinc/59/82/17/1057598217.db2.gz LFMTVCUPJWKPDI-HSALFYBXSA-N 2 1 300.490 4.004 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC000513074232 1057620716 /nfs/dbraw/zinc/62/07/16/1057620716.db2.gz GARUSCDOHWAQSG-UHFFFAOYSA-N 2 1 308.469 4.316 20 0 DIADMP C1=CC[C@@H](C[N@H+]2CCC[C@@]3(CC[NH+](C4CCCC4)C3)C2)CC1 ZINC001278386358 1058023263 /nfs/dbraw/zinc/02/32/63/1058023263.db2.gz PBXCJVYODMPJPZ-UYAOXDASSA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@@H](C[NH+]2CCC[C@@]3(CC[N@@H+](C4CCCC4)C3)C2)CC1 ZINC001278386358 1058023267 /nfs/dbraw/zinc/02/32/67/1058023267.db2.gz PBXCJVYODMPJPZ-UYAOXDASSA-N 2 1 302.506 4.073 20 0 DIADMP C1=CC[C@@H](C[NH+]2CCC[C@@]3(CC[N@H+](C4CCCC4)C3)C2)CC1 ZINC001278386358 1058023272 /nfs/dbraw/zinc/02/32/72/1058023272.db2.gz PBXCJVYODMPJPZ-UYAOXDASSA-N 2 1 302.506 4.073 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001550520142 1058341361 /nfs/dbraw/zinc/34/13/61/1058341361.db2.gz IKCXNYUWLDZMNZ-FPQWYMTMSA-N 2 1 301.478 4.005 20 0 DIADMP Cc1cccc2c1CCC[C@@H]2[NH2+][C@H]1CC[C@H](c2[nH+]ccn2C)C1 ZINC001550520306 1058341774 /nfs/dbraw/zinc/34/17/74/1058341774.db2.gz NJGZAPAZUUDBDO-BXWFABGCSA-N 2 1 309.457 4.032 20 0 DIADMP Cn1cc[nH+]c1[C@H]1CC[C@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001550520144 1058342606 /nfs/dbraw/zinc/34/26/06/1058342606.db2.gz IKCXNYUWLDZMNZ-IKJBURDNSA-N 2 1 301.478 4.005 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC001552080697 1058428987 /nfs/dbraw/zinc/42/89/87/1058428987.db2.gz IULZQYVYEHEUDG-WDQDQHCCSA-N 2 1 324.443 4.155 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc(C(C)(C)[NH3+])cc2)nc1 ZINC001245906675 1058610373 /nfs/dbraw/zinc/61/03/73/1058610373.db2.gz JBESLBBEABJNMU-HXUWFJFHSA-N 2 1 323.484 4.489 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC001246065841 1058659754 /nfs/dbraw/zinc/65/97/54/1058659754.db2.gz NGKXNBIPTDQBRT-IEBWSBKVSA-N 2 1 304.453 4.097 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)cc1 ZINC001246073492 1058662502 /nfs/dbraw/zinc/66/25/02/1058662502.db2.gz ZISXJXQZPKZISZ-ICSRJNTNSA-N 2 1 312.432 4.025 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC001246074972 1058666713 /nfs/dbraw/zinc/66/67/13/1058666713.db2.gz HNNVQOJNLSNCBI-LSCVPOLPSA-N 2 1 301.261 4.173 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076786 1058667164 /nfs/dbraw/zinc/66/71/64/1058667164.db2.gz PNGJRPJSAWGDAT-IAGOWNOFSA-N 2 1 306.881 4.230 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1CC[C@H](C)[NH2+]C1 ZINC001246078010 1058667763 /nfs/dbraw/zinc/66/77/63/1058667763.db2.gz APGDPCYQLWLGLZ-WFXMLNOXSA-N 2 1 322.496 4.327 20 0 DIADMP Cc1csc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)c1 ZINC001246078295 1058669844 /nfs/dbraw/zinc/66/98/44/1058669844.db2.gz CGMIVFSLVAMBIV-MAUKXSAKSA-N 2 1 318.461 4.087 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC001246081306 1058669912 /nfs/dbraw/zinc/66/99/12/1058669912.db2.gz MSMNFXKEQDIARA-AEFFLSMTSA-N 2 1 304.453 4.097 20 0 DIADMP Cc1ccsc1C[NH2+][C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246083725 1058671560 /nfs/dbraw/zinc/67/15/60/1058671560.db2.gz IUPDYIMDDCDFJD-RDJZCZTQSA-N 2 1 318.461 4.087 20 0 DIADMP Cc1csc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)c1 ZINC001246078297 1058672012 /nfs/dbraw/zinc/67/20/12/1058672012.db2.gz CGMIVFSLVAMBIV-QAPCUYQASA-N 2 1 318.461 4.087 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246092052 1058674788 /nfs/dbraw/zinc/67/47/88/1058674788.db2.gz BXOGOUVNEFTTNZ-UQWBFEFOSA-N 2 1 318.480 4.343 20 0 DIADMP C[C@@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1cc(Cl)ccc1Cl ZINC001246113440 1058684600 /nfs/dbraw/zinc/68/46/00/1058684600.db2.gz AUFNMFHQEXBYHQ-GMTAPVOTSA-N 2 1 301.261 4.173 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](C)C2)CC[NH2+]1 ZINC001246115308 1058684385 /nfs/dbraw/zinc/68/43/85/1058684385.db2.gz HGWZQDNFEAWLSK-QUIPCFFLSA-N 2 1 304.453 4.096 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)ccc1Cl ZINC001246113483 1058684622 /nfs/dbraw/zinc/68/46/22/1058684622.db2.gz BJMNWQDLIHZRFP-DEQVHRJGSA-N 2 1 313.272 4.317 20 0 DIADMP C[C@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1cc(Cl)ccc1Cl ZINC001246113445 1058684702 /nfs/dbraw/zinc/68/47/02/1058684702.db2.gz AUFNMFHQEXBYHQ-MXWKQRLJSA-N 2 1 301.261 4.173 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)ccc1Cl ZINC001246115968 1058684821 /nfs/dbraw/zinc/68/48/21/1058684821.db2.gz LWFKTTZZQGDIOD-PWSUYJOCSA-N 2 1 301.261 4.175 20 0 DIADMP Cc1ccc(CCC[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC001246127706 1058689875 /nfs/dbraw/zinc/68/98/75/1058689875.db2.gz MMVIIVPYLFQFDM-PKOBYXMFSA-N 2 1 314.498 4.072 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246154791 1058700074 /nfs/dbraw/zinc/70/00/74/1058700074.db2.gz RBPWAALAXZEVHZ-MUJYYYPQSA-N 2 1 315.288 4.392 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1Cl ZINC001246162851 1058705081 /nfs/dbraw/zinc/70/50/81/1058705081.db2.gz GRJZWFJYDREPSY-HUUCEWRRSA-N 2 1 306.881 4.446 20 0 DIADMP Fc1c(Cl)cccc1C[NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246165040 1058709627 /nfs/dbraw/zinc/70/96/27/1058709627.db2.gz ZEBBOFZNQSBEHL-CQSZACIVSA-N 2 1 310.844 4.024 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@H]1CCCC[NH2+]1 ZINC001246175580 1058718367 /nfs/dbraw/zinc/71/83/67/1058718367.db2.gz FOLAFDYFDDTCBJ-TZMCWYRMSA-N 2 1 315.288 4.046 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC001246177761 1058723763 /nfs/dbraw/zinc/72/37/63/1058723763.db2.gz UASZMBPOKCGTSA-PKOBYXMFSA-N 2 1 304.453 4.097 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@H]1CCCC[NH2+]1 ZINC001246182260 1058727641 /nfs/dbraw/zinc/72/76/41/1058727641.db2.gz ZLEVECZKQQUFCR-GHTZIAJQSA-N 2 1 322.496 4.329 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246189335 1058731534 /nfs/dbraw/zinc/73/15/34/1058731534.db2.gz CCSMZLNHMPTWGW-AZUAARDMSA-N 2 1 324.468 4.345 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246190348 1058733573 /nfs/dbraw/zinc/73/35/73/1058733573.db2.gz IFHOBNVLOYUPDC-SFHVURJKSA-N 2 1 322.452 4.243 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246190814 1058733700 /nfs/dbraw/zinc/73/37/00/1058733700.db2.gz JAUOCIOWROSPRD-BWTSREIZSA-N 2 1 322.452 4.242 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@]1(C)CCC[NH2+]C1 ZINC001246190761 1058734617 /nfs/dbraw/zinc/73/46/17/1058734617.db2.gz SEWUUSPNKPRLEO-PGRDOPGGSA-N 2 1 322.496 4.329 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246196204 1058736766 /nfs/dbraw/zinc/73/67/66/1058736766.db2.gz RMDDIWDTCIGZKG-BTTYYORXSA-N 2 1 315.288 4.392 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccc(F)c(Cl)c1 ZINC001246212859 1058744471 /nfs/dbraw/zinc/74/44/71/1058744471.db2.gz OLNFOYFYMXCYKS-FFSVYQOJSA-N 2 1 312.860 4.296 20 0 DIADMP CC[C@H]1CC([NH2+][C@H](C)c2ccc(Cl)c(F)c2)C[C@H](CC)[NH2+]1 ZINC001246211465 1058744948 /nfs/dbraw/zinc/74/49/48/1058744948.db2.gz JXVXOCUFAOMRAE-XBFCOCLRSA-N 2 1 312.860 4.439 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C[C@@]1(C)CC[NH2+]CC1(F)F ZINC001246223380 1058747994 /nfs/dbraw/zinc/74/79/94/1058747994.db2.gz VPARPBNKOAYOOZ-QZTJIDSGSA-N 2 1 324.459 4.012 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C[C@@]1(C)CC[NH2+]CC1(F)F ZINC001246223382 1058750922 /nfs/dbraw/zinc/75/09/22/1058750922.db2.gz VPARPBNKOAYOOZ-ZWKOTPCHSA-N 2 1 324.459 4.012 20 0 DIADMP COc1ccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246230510 1058752476 /nfs/dbraw/zinc/75/24/76/1058752476.db2.gz BUCKFALNRAHUKJ-AZUAARDMSA-N 2 1 324.468 4.013 20 0 DIADMP COc1ccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246230515 1058752661 /nfs/dbraw/zinc/75/26/61/1058752661.db2.gz BUCKFALNRAHUKJ-UYAOXDASSA-N 2 1 324.468 4.013 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246230904 1058753129 /nfs/dbraw/zinc/75/31/29/1058753129.db2.gz ASERINBTSDFOBV-WDYCEAGBSA-N 2 1 306.469 4.486 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246235099 1058758330 /nfs/dbraw/zinc/75/83/30/1058758330.db2.gz XTTBGAYMSMXGMM-YMFLFHJQSA-N 2 1 306.469 4.342 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246235529 1058758605 /nfs/dbraw/zinc/75/86/05/1058758605.db2.gz HTIKGSQYXWFMOF-IRXDYDNUSA-N 2 1 306.881 4.230 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC001246237901 1058761448 /nfs/dbraw/zinc/76/14/48/1058761448.db2.gz JTOCCTFXORDORW-PCCBWWKXSA-N 2 1 308.469 4.467 20 0 DIADMP CCCC[C@H]1CC[C@H](C2CCC([NH2+]C[C@H]([NH3+])COC)CC2)CC1 ZINC001246242028 1058763719 /nfs/dbraw/zinc/76/37/19/1058763719.db2.gz WILKFASOHPPPNL-WKKAHXHTSA-N 2 1 324.553 4.105 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C(C(C)C)C(C)C)CC[NH2+]1 ZINC001246241285 1058764765 /nfs/dbraw/zinc/76/47/65/1058764765.db2.gz YTRXONFJXVPUKY-WMZOPIPTSA-N 2 1 306.469 4.197 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C(C(C)C)C(C)C)CC[NH2+]1 ZINC001246241281 1058765253 /nfs/dbraw/zinc/76/52/53/1058765253.db2.gz YTRXONFJXVPUKY-FUHWJXTLSA-N 2 1 306.469 4.197 20 0 DIADMP CCCOc1cccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246243807 1058765477 /nfs/dbraw/zinc/76/54/77/1058765477.db2.gz NABBEBHYTGMYED-CTNGQTDRSA-N 2 1 324.468 4.058 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246253440 1058770101 /nfs/dbraw/zinc/77/01/01/1058770101.db2.gz MAOLCMVSYQDLMG-KMUNFCNLSA-N 2 1 301.261 4.175 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]4CCCC[C@H]34)CC[NH2+]2)cc1 ZINC001246254214 1058774336 /nfs/dbraw/zinc/77/43/36/1058774336.db2.gz GAAKMZDNTVRYJM-OSTWSGHESA-N 2 1 312.501 4.428 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]4CCCC[C@H]43)CC[NH2+]2)cc1 ZINC001246254212 1058774431 /nfs/dbraw/zinc/77/44/31/1058774431.db2.gz GAAKMZDNTVRYJM-MLZLACJZSA-N 2 1 312.501 4.428 20 0 DIADMP CCC(C)(C)C1CCC([NH2+][C@@H](C[NH3+])Cc2ccccc2)CC1 ZINC001246266651 1058780603 /nfs/dbraw/zinc/78/06/03/1058780603.db2.gz LUMJSXYCESTXOZ-CTWPCTMYSA-N 2 1 302.506 4.141 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)c(Cl)c1 ZINC001246265741 1058782304 /nfs/dbraw/zinc/78/23/04/1058782304.db2.gz QOZLXSXTWHNSLS-MRXNPFEDSA-N 2 1 306.881 4.193 20 0 DIADMP CC[C@H]([NH2+]C1C[C@@H](CC)[NH2+][C@H](CC)C1)c1cc(F)ccc1F ZINC001246270057 1058782702 /nfs/dbraw/zinc/78/27/02/1058782702.db2.gz SSYKCGIWMWSHBE-LBTNJELSSA-N 2 1 310.432 4.315 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccccc1F ZINC001246270295 1058783908 /nfs/dbraw/zinc/78/39/08/1058783908.db2.gz AHFXIDCIBYTLJQ-QGTPRVQTSA-N 2 1 306.469 4.279 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](CC)c2cc(F)ccc2F)CC[NH2+]1 ZINC001246272287 1058786403 /nfs/dbraw/zinc/78/64/03/1058786403.db2.gz YGHNPOQEYMMTLC-VKJFTORMSA-N 2 1 310.432 4.316 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](CC)c2cc(F)ccc2F)CC[NH2+]1 ZINC001246272286 1058786440 /nfs/dbraw/zinc/78/64/40/1058786440.db2.gz YGHNPOQEYMMTLC-RKVPGOIHSA-N 2 1 310.432 4.316 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1F ZINC001246272150 1058786872 /nfs/dbraw/zinc/78/68/72/1058786872.db2.gz LEBIVDGWHQAQCT-MAUKXSAKSA-N 2 1 304.453 4.177 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@@H](CC)c2cc(F)ccc2F)CC[NH2+]1 ZINC001246272282 1058787179 /nfs/dbraw/zinc/78/71/79/1058787179.db2.gz YGHNPOQEYMMTLC-DAYGRLMNSA-N 2 1 310.432 4.316 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cc(F)ccc1F ZINC001246271670 1058788090 /nfs/dbraw/zinc/78/80/90/1058788090.db2.gz WTMCIEVZLOYKRH-XOKHGSTOSA-N 2 1 310.432 4.172 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)C)C1)c1ccccc1F ZINC001246274326 1058788960 /nfs/dbraw/zinc/78/89/60/1058788960.db2.gz WBDDZQZTYPYZAA-LZQZEXGQSA-N 2 1 306.469 4.279 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C(C)C)C[C@H](CC)[NH2+]1 ZINC001246275457 1058791532 /nfs/dbraw/zinc/79/15/32/1058791532.db2.gz UPJQWSBPVLUMEI-YYAJDYIMSA-N 2 1 306.469 4.422 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C1(C[NH3+])CCCC1 ZINC001246285623 1058799817 /nfs/dbraw/zinc/79/98/17/1058799817.db2.gz IHLSAFVHFRUIRS-GFCCVEGCSA-N 2 1 315.288 4.176 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246290994 1058806734 /nfs/dbraw/zinc/80/67/34/1058806734.db2.gz PTRMZUBPWMEJFK-SLFFLAALSA-N 2 1 312.432 4.360 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246290991 1058808636 /nfs/dbraw/zinc/80/86/36/1058808636.db2.gz PTRMZUBPWMEJFK-AABGKKOBSA-N 2 1 312.432 4.360 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246307663 1058815159 /nfs/dbraw/zinc/81/51/59/1058815159.db2.gz NADLNIPUCIXZQF-ZTFGCOKTSA-N 2 1 304.453 4.033 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](c2ccccc2F)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246308383 1058815722 /nfs/dbraw/zinc/81/57/22/1058815722.db2.gz QTBQMXYUXBETKO-SPYBWZPUSA-N 2 1 304.453 4.176 20 0 DIADMP Fc1ccccc1[C@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)C1CC1 ZINC001246305195 1058815818 /nfs/dbraw/zinc/81/58/18/1058815818.db2.gz HEXAWMODYWACEJ-QFBILLFUSA-N 2 1 316.464 4.321 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246305244 1058816703 /nfs/dbraw/zinc/81/67/03/1058816703.db2.gz HKHNBVQWUYCDKB-JTDSTZFVSA-N 2 1 304.453 4.177 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246309841 1058816880 /nfs/dbraw/zinc/81/68/80/1058816880.db2.gz OOYXGRDSBRBGKM-MJGOQNOKSA-N 2 1 318.480 4.486 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@@H](CC)c2ccccc2OC)CC[NH2+]1 ZINC001246312225 1058818536 /nfs/dbraw/zinc/81/85/36/1058818536.db2.gz CCJFRWXVGOVGHM-BQFCYCMXSA-N 2 1 304.478 4.047 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(OC)c1 ZINC001246310949 1058821665 /nfs/dbraw/zinc/82/16/65/1058821665.db2.gz AQANMXPWTUPQGX-NRSPTQNISA-N 2 1 324.468 4.229 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(OC)c1 ZINC001246310948 1058822514 /nfs/dbraw/zinc/82/25/14/1058822514.db2.gz AQANMXPWTUPQGX-HMXCVIKNSA-N 2 1 324.468 4.229 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1OC ZINC001246317172 1058828647 /nfs/dbraw/zinc/82/86/47/1058828647.db2.gz LRWUEHVSEIPSGB-WMZOPIPTSA-N 2 1 316.489 4.191 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]CCCC3CCCCC3)CC[NH2+]2)cc1 ZINC001246329092 1058838752 /nfs/dbraw/zinc/83/87/52/1058838752.db2.gz OMEMHPCHFBHFFB-PMACEKPBSA-N 2 1 300.490 4.430 20 0 DIADMP C[NH2+]CC[C@H](C)[NH2+]Cc1ccccc1Oc1ccc(Cl)cc1 ZINC001246332550 1058841892 /nfs/dbraw/zinc/84/18/92/1058841892.db2.gz HITDLGDIBSWFHB-AWEZNQCLSA-N 2 1 318.848 4.220 20 0 DIADMP CCCC1CCC([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246331781 1058841940 /nfs/dbraw/zinc/84/19/40/1058841940.db2.gz CGNVCSBBGWSWLK-QUDVFMAMSA-N 2 1 300.490 4.428 20 0 DIADMP CCCCCC1CCC([NH2+][C@@H]2CC[NH2+]C[C@H]2C(F)(F)F)CC1 ZINC001246341262 1058853188 /nfs/dbraw/zinc/85/31/88/1058853188.db2.gz OMNLIRJGTNGXCD-QDIHITRGSA-N 2 1 320.443 4.256 20 0 DIADMP COc1cccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246363685 1058868426 /nfs/dbraw/zinc/86/84/26/1058868426.db2.gz SNOJEIMCFPOXFR-QUCCMNQESA-N 2 1 324.468 4.013 20 0 DIADMP CC(C)CC[C@@H](C)[NH2+]C1(c2ccccc2Cl)CC[NH2+]CC1 ZINC001246375304 1058877102 /nfs/dbraw/zinc/87/71/02/1058877102.db2.gz OCBJVIBGOOJLCN-OAHLLOKOSA-N 2 1 308.897 4.333 20 0 DIADMP Cc1ccccc1CC(C)(C)[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246373931 1058881000 /nfs/dbraw/zinc/88/10/00/1058881000.db2.gz RXQUKUDVVFSPKJ-LEWJYISDSA-N 2 1 322.496 4.399 20 0 DIADMP CC[C@H]1CC[C@@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C1 ZINC001246379621 1058884427 /nfs/dbraw/zinc/88/44/27/1058884427.db2.gz ZRAJXNCKODDBHV-LSDHHAIUSA-N 2 1 306.881 4.087 20 0 DIADMP Cc1cccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246384134 1058887641 /nfs/dbraw/zinc/88/76/41/1058887641.db2.gz ADQOOGKGRYHYAV-VQTJNVASSA-N 2 1 308.469 4.313 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](c2cncc(Cl)c2)C2CC2)CC[NH2+]1 ZINC001246396572 1058901325 /nfs/dbraw/zinc/90/13/25/1058901325.db2.gz CDRCDYXLVVGVHH-SQNIBIBYSA-N 2 1 321.896 4.087 20 0 DIADMP Fc1ccccc1[C@H](CC1CCC1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246405204 1058907498 /nfs/dbraw/zinc/90/74/98/1058907498.db2.gz OPZFPBBCKBRPIL-CLWJZODNSA-N 2 1 316.464 4.320 20 0 DIADMP Cc1cccc(C2([NH2+][C@H]3CCCC[NH2+]C3)CCC(F)(F)CC2)c1 ZINC001246405285 1058908408 /nfs/dbraw/zinc/90/84/08/1058908408.db2.gz LSJLYHCVJHYVCX-KRWDZBQOSA-N 2 1 322.443 4.131 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246406682 1058909134 /nfs/dbraw/zinc/90/91/34/1058909134.db2.gz RGJPTULNZAYMQP-GPMSIDNRSA-N 2 1 304.453 4.177 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C(C)(C)CC2CCC2)CC[NH2+]1 ZINC001246411802 1058915886 /nfs/dbraw/zinc/91/58/86/1058915886.db2.gz VZDSKHQBFSDIHO-PKOBYXMFSA-N 2 1 318.480 4.486 20 0 DIADMP CCC1([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246417944 1058917935 /nfs/dbraw/zinc/91/79/35/1058917935.db2.gz WXNRBOGFHRQAIL-IAGOWNOFSA-N 2 1 322.443 4.427 20 0 DIADMP Cc1ccc(C)c([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246416641 1058919028 /nfs/dbraw/zinc/91/90/28/1058919028.db2.gz SKJKPBBLUXAZFA-FBBABVLZSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CC(C)(C)CC2CC2)CC[NH2+]1 ZINC001246430070 1058921282 /nfs/dbraw/zinc/92/12/82/1058921282.db2.gz FMCDXEMECSWTCG-PKOBYXMFSA-N 2 1 318.480 4.343 20 0 DIADMP CC(C)C1CCC([NH2+]C2(c3ccccc3F)CC[NH2+]CC2)CC1 ZINC001246430723 1058925597 /nfs/dbraw/zinc/92/55/97/1058925597.db2.gz QNSXOFFGWKRUBN-UHFFFAOYSA-N 2 1 318.480 4.209 20 0 DIADMP CCCC1CCC([NH2+]C2(c3ccccc3F)CC[NH2+]CC2)CC1 ZINC001246430770 1058927887 /nfs/dbraw/zinc/92/78/87/1058927887.db2.gz RUNRZABUKIMPEZ-UHFFFAOYSA-N 2 1 318.480 4.353 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246437855 1058928905 /nfs/dbraw/zinc/92/89/05/1058928905.db2.gz WFDVKGNMUQVNKZ-WDYCEAGBSA-N 2 1 318.480 4.343 20 0 DIADMP C[C@H]1[C@H]2C[C@@H](C[C@H]1[NH2+][C@H]1CC[NH2+][C@@H](c3ccccc3)C1)C2(C)C ZINC001246443635 1058934580 /nfs/dbraw/zinc/93/45/80/1058934580.db2.gz NUGTXWOEZSRGAR-DAJYORATSA-N 2 1 312.501 4.140 20 0 DIADMP Cc1ccc(C2([NH2+][C@@H]3CC[C@H](C)[NH2+]C3)CCC(F)(F)CC2)cc1 ZINC001246454138 1058939965 /nfs/dbraw/zinc/93/99/65/1058939965.db2.gz DBOWZOHIYXHBRG-DOTOQJQBSA-N 2 1 322.443 4.130 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2OCC)CC[NH2+]1 ZINC001246453264 1058942109 /nfs/dbraw/zinc/94/21/09/1058942109.db2.gz BGAIZYMGFKNDQX-ULQDDVLXSA-N 2 1 304.478 4.047 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1cc(F)cc(F)c1 ZINC001246459473 1058944610 /nfs/dbraw/zinc/94/46/10/1058944610.db2.gz AKKPOSLUTCVMAH-VSZNYVQBSA-N 2 1 310.432 4.315 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@H](CC)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246463423 1058949414 /nfs/dbraw/zinc/94/94/14/1058949414.db2.gz RTLZXYYCMZXLTN-RCCFBDPRSA-N 2 1 310.432 4.316 20 0 DIADMP Cc1ccccc1C1([NH2+][C@H]2CC[C@@H](C)[NH2+]C2)CCC(F)(F)CC1 ZINC001246462469 1058950408 /nfs/dbraw/zinc/95/04/08/1058950408.db2.gz ZHVDFDTVOIVPTP-CVEARBPZSA-N 2 1 322.443 4.130 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2OC)C2CC2)CC[NH2+]1 ZINC001246469827 1058955480 /nfs/dbraw/zinc/95/54/80/1058955480.db2.gz TUAFXRLBALPBJS-UWVAXJGDSA-N 2 1 316.489 4.047 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cc(F)cc(Cl)c1 ZINC001246490225 1058965828 /nfs/dbraw/zinc/96/58/28/1058965828.db2.gz OCQVDQRBMKIVBH-LYRGGWFBSA-N 2 1 312.860 4.296 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246491018 1058966619 /nfs/dbraw/zinc/96/66/19/1058966619.db2.gz RLYWEBNSIMGIQY-JBACZVJFSA-N 2 1 306.453 4.065 20 0 DIADMP FC1(F)C[NH2+]CC[C@@H]1CC[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001246490128 1058966721 /nfs/dbraw/zinc/96/67/21/1058966721.db2.gz QFLIYLGJVQNQNM-HZPDHXFCSA-N 2 1 314.464 4.104 20 0 DIADMP FC1(F)C[NH2+]CC[C@@H]1CC[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001246490115 1058967803 /nfs/dbraw/zinc/96/78/03/1058967803.db2.gz QFLIYLGJVQNQNM-CVEARBPZSA-N 2 1 314.464 4.104 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246497080 1058968748 /nfs/dbraw/zinc/96/87/48/1058968748.db2.gz GACAOJKQXCQWHF-XWIAVFTESA-N 2 1 322.443 4.099 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246497077 1058970996 /nfs/dbraw/zinc/97/09/96/1058970996.db2.gz GACAOJKQXCQWHF-VHSSKADRSA-N 2 1 322.443 4.099 20 0 DIADMP CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)CC(C)(C)SCc1ccco1 ZINC001246503889 1058974752 /nfs/dbraw/zinc/97/47/52/1058974752.db2.gz MPSBYFRDGUZMEB-GJZGRUSLSA-N 2 1 312.523 4.033 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001246506052 1058979001 /nfs/dbraw/zinc/97/90/01/1058979001.db2.gz UCXYBSWIWDASAB-UHFFFAOYSA-N 2 1 318.505 4.264 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCCC23CCC3)CC[NH2+]1 ZINC001246521527 1058980344 /nfs/dbraw/zinc/98/03/44/1058980344.db2.gz BPDJNVWRMGQIFJ-NEWSRXKRSA-N 2 1 316.464 4.240 20 0 DIADMP CC[N@@H+](C1CCCCC1)[C@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246533148 1058985457 /nfs/dbraw/zinc/98/54/57/1058985457.db2.gz TTYWYYFIABNKJG-ICSRJNTNSA-N 2 1 300.490 4.004 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246537648 1058986095 /nfs/dbraw/zinc/98/60/95/1058986095.db2.gz XFXLUJQUCGKPQM-MOPGFXCFSA-N 2 1 318.892 4.206 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@@H]([NH3+])C2(CC2)C1 ZINC001246535309 1058987130 /nfs/dbraw/zinc/98/71/30/1058987130.db2.gz XCZAFVXBIHUXPJ-DYESRHJHSA-N 2 1 320.480 4.020 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]([NH3+])C2(CC2)C1 ZINC001246535309 1058987150 /nfs/dbraw/zinc/98/71/50/1058987150.db2.gz XCZAFVXBIHUXPJ-DYESRHJHSA-N 2 1 320.480 4.020 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534847 1058987810 /nfs/dbraw/zinc/98/78/10/1058987810.db2.gz ZPKXMRJJRHDMDN-MJGOQNOKSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534847 1058987832 /nfs/dbraw/zinc/98/78/32/1058987832.db2.gz ZPKXMRJJRHDMDN-MJGOQNOKSA-N 2 1 304.453 4.192 20 0 DIADMP c1ccc([C@H]2CCC[C@H]([N@H+]3CCCC4(CC[NH2+]CC4)C3)C2)cc1 ZINC001246524887 1058988315 /nfs/dbraw/zinc/98/83/15/1058988315.db2.gz UQWBLPMMJZZKPA-PMACEKPBSA-N 2 1 312.501 4.178 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@](C)([NH3+])C1 ZINC001246540171 1058991408 /nfs/dbraw/zinc/99/14/08/1058991408.db2.gz LGYMPQCFYLWNAE-WBMJQRKESA-N 2 1 315.288 4.128 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@](C)([NH3+])C1 ZINC001246540171 1058991432 /nfs/dbraw/zinc/99/14/32/1058991432.db2.gz LGYMPQCFYLWNAE-WBMJQRKESA-N 2 1 315.288 4.128 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246547332 1058997278 /nfs/dbraw/zinc/99/72/78/1058997278.db2.gz CKVQAABPRCCTQN-QAPCUYQASA-N 2 1 324.534 4.273 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CCN[C@@H](c2ccccc2)C1 ZINC001246551538 1058999837 /nfs/dbraw/zinc/99/98/37/1058999837.db2.gz ZOLGGBYPYHCFBW-OZOXKJRCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246551538 1058999853 /nfs/dbraw/zinc/99/98/53/1058999853.db2.gz ZOLGGBYPYHCFBW-OZOXKJRCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246551538 1058999866 /nfs/dbraw/zinc/99/98/66/1058999866.db2.gz ZOLGGBYPYHCFBW-OZOXKJRCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1C[N@@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546488 1059000531 /nfs/dbraw/zinc/00/05/31/1059000531.db2.gz KKNPDDGZTFHTFF-BSIFCXSSSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546488 1059000552 /nfs/dbraw/zinc/00/05/52/1059000552.db2.gz KKNPDDGZTFHTFF-BSIFCXSSSA-N 2 1 306.453 4.099 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@@H]1CC[NH2+][C@H](c3ccc(F)cc3C)C1)C2 ZINC001246568875 1059001900 /nfs/dbraw/zinc/00/19/00/1059001900.db2.gz SLZUPTNMQGKYQT-NQIIRXRSSA-N 2 1 324.443 4.251 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@@H]1CC[NH2+][C@H](c3ccc(F)cc3C)C1)C2 ZINC001246568875 1059001924 /nfs/dbraw/zinc/00/19/24/1059001924.db2.gz SLZUPTNMQGKYQT-NQIIRXRSSA-N 2 1 324.443 4.251 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246564505 1059005628 /nfs/dbraw/zinc/00/56/28/1059005628.db2.gz XOIGMZCMAXRNQW-ACRUOGEOSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246564505 1059005652 /nfs/dbraw/zinc/00/56/52/1059005652.db2.gz XOIGMZCMAXRNQW-ACRUOGEOSA-N 2 1 324.443 4.456 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246573532 1059008154 /nfs/dbraw/zinc/00/81/54/1059008154.db2.gz RSYWSAIAWIDVRJ-WQDJSCAQSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246573532 1059008176 /nfs/dbraw/zinc/00/81/76/1059008176.db2.gz RSYWSAIAWIDVRJ-WQDJSCAQSA-N 2 1 316.464 4.049 20 0 DIADMP [NH3+][C@@H]1CC[N@@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@H]1F ZINC001246588335 1059010075 /nfs/dbraw/zinc/01/00/75/1059010075.db2.gz PVGWEWVLUIFPLS-XAWIXRBMSA-N 2 1 324.871 4.127 20 0 DIADMP [NH3+][C@@H]1CC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@H]1F ZINC001246588335 1059010094 /nfs/dbraw/zinc/01/00/94/1059010094.db2.gz PVGWEWVLUIFPLS-XAWIXRBMSA-N 2 1 324.871 4.127 20 0 DIADMP CCC1CC[NH+]([C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CC1 ZINC001246587023 1059011563 /nfs/dbraw/zinc/01/15/63/1059011563.db2.gz DGRPJCXRMGSVBQ-PKOBYXMFSA-N 2 1 304.453 4.049 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001246581771 1059012295 /nfs/dbraw/zinc/01/22/95/1059012295.db2.gz AMEAVHPKDGXVOO-PXNSSMCTSA-N 2 1 302.506 4.033 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001246581808 1059012699 /nfs/dbraw/zinc/01/26/99/1059012699.db2.gz AWEMXCGDUDCYMX-UYAOXDASSA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001246579527 1059014081 /nfs/dbraw/zinc/01/40/81/1059014081.db2.gz FJGJJKDKZFCRIX-VQTJNVASSA-N 2 1 302.506 4.095 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@@H](c2ccccc2)C1)[C@H]1CCC[NH2+]CC1 ZINC001246590733 1059014633 /nfs/dbraw/zinc/01/46/33/1059014633.db2.gz HVFDOLAQNVNRJG-AABGKKOBSA-N 2 1 300.490 4.175 20 0 DIADMP c1ccc(C[N@@H+](C2CCCCC2)[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246595791 1059017250 /nfs/dbraw/zinc/01/72/50/1059017250.db2.gz IOYUJECUDFPTFC-HXUWFJFHSA-N 2 1 312.501 4.496 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1cccc(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC001246595981 1059019001 /nfs/dbraw/zinc/01/90/01/1059019001.db2.gz UNZYRWOOTAXHJI-MAUKXSAKSA-N 2 1 308.897 4.124 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)CSc1ccc(F)cc1)[C@H]1CCC[NH2+]CC1 ZINC001246595963 1059019405 /nfs/dbraw/zinc/01/94/05/1059019405.db2.gz UJEIBBKIJOPVRH-RDJZCZTQSA-N 2 1 324.509 4.159 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1C[C@@H](C[NH3+])CC[C@H]1C ZINC001246593660 1059019447 /nfs/dbraw/zinc/01/94/47/1059019447.db2.gz SINXNHIFWRBTPP-BZUAXINKSA-N 2 1 324.534 4.129 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246605468 1059021721 /nfs/dbraw/zinc/02/17/21/1059021721.db2.gz JWBMRATZCLOYRN-NHCUHLMSSA-N 2 1 314.517 4.252 20 0 DIADMP C1C[N@@H+](C2CCC3(CCCCC3)CC2)[C@]2(C1)CCC[NH2+]CC2 ZINC001246606637 1059022735 /nfs/dbraw/zinc/02/27/35/1059022735.db2.gz NLVADTBAZKFWGG-FQEVSTJZSA-N 2 1 304.522 4.488 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001246597036 1059022894 /nfs/dbraw/zinc/02/28/94/1059022894.db2.gz WFCUOSFHZJNJOV-NHCUHLMSSA-N 2 1 316.533 4.496 20 0 DIADMP CC(C)[N@@H+]([C@H]1CCc2cccc(Cl)c2C1)[C@@H]1CCC[NH2+]CC1 ZINC001246597947 1059023548 /nfs/dbraw/zinc/02/35/48/1059023548.db2.gz YYHJKUCYZAUMNO-SJORKVTESA-N 2 1 320.908 4.050 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@H+]3CCC[C@]4(CCC[NH2+]C4)C3)C2)cc1 ZINC001246610642 1059026989 /nfs/dbraw/zinc/02/69/89/1059026989.db2.gz QSMTZDDAIMYWJT-NJYVYQBISA-N 2 1 312.501 4.178 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH+]2CCC3(CCCC[NH2+]3)CC2)cc1 ZINC001246612072 1059029026 /nfs/dbraw/zinc/02/90/26/1059029026.db2.gz QGCDXOIHNQVKAV-KRWDZBQOSA-N 2 1 318.530 4.084 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614382 1059029525 /nfs/dbraw/zinc/02/95/25/1059029525.db2.gz NYYCFXTYBDWNKZ-IEBWSBKVSA-N 2 1 316.464 4.336 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614382 1059029547 /nfs/dbraw/zinc/02/95/47/1059029547.db2.gz NYYCFXTYBDWNKZ-IEBWSBKVSA-N 2 1 316.464 4.336 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001246619364 1059033644 /nfs/dbraw/zinc/03/36/44/1059033644.db2.gz LWLCUPAERRXSPC-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP FC(F)(F)CC[NH+]1CCC2(CCC[N@H+](C3CCCC3)C2)CC1 ZINC001278458381 1059034738 /nfs/dbraw/zinc/03/47/38/1059034738.db2.gz GKIWYNLORXXSOK-UHFFFAOYSA-N 2 1 318.427 4.059 20 0 DIADMP CCCC[C@H](CCC)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625079 1059040809 /nfs/dbraw/zinc/04/08/09/1059040809.db2.gz QYCGWQWCHHRCOB-RBUKOAKNSA-N 2 1 300.490 4.034 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)C2)cc1 ZINC001246636672 1059042602 /nfs/dbraw/zinc/04/26/02/1059042602.db2.gz VYHAOHGAUAPMBY-QHAWAJNXSA-N 2 1 312.501 4.321 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001246649116 1059050742 /nfs/dbraw/zinc/05/07/42/1059050742.db2.gz VIYBJOWXTBEOIF-AWEZNQCLSA-N 2 1 324.871 4.018 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001246649116 1059050762 /nfs/dbraw/zinc/05/07/62/1059050762.db2.gz VIYBJOWXTBEOIF-AWEZNQCLSA-N 2 1 324.871 4.018 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001246657480 1059052714 /nfs/dbraw/zinc/05/27/14/1059052714.db2.gz NYZIZHQJYYETEM-QHAWAJNXSA-N 2 1 312.501 4.177 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3C[C@H]4CCC[NH2+][C@H]4C3)CC2)cc1 ZINC001246656277 1059054169 /nfs/dbraw/zinc/05/41/69/1059054169.db2.gz JEQCUHVZWBHBMU-KXWSQRDISA-N 2 1 318.892 4.050 20 0 DIADMP CCCCCC[C@H](CCC)[N@H+]1C[C@@H]2C[NH2+]C[C@]2(C(F)(F)F)C1 ZINC001246658049 1059054497 /nfs/dbraw/zinc/05/44/97/1059054497.db2.gz SUQDPTSUJSTWAN-JYJNAYRXSA-N 2 1 320.443 4.209 20 0 DIADMP CC1(C)CCC[C@@H]([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C1 ZINC001246674954 1059058441 /nfs/dbraw/zinc/05/84/41/1059058441.db2.gz PHDWJWRGUOUUHC-SFHLNBCPSA-N 2 1 312.501 4.177 20 0 DIADMP CCCC[C@@H](CC)[N@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1 ZINC001246669864 1059060291 /nfs/dbraw/zinc/06/02/91/1059060291.db2.gz CCQXVUIOJKPTIE-VAMGGRTRSA-N 2 1 300.490 4.177 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cc1 ZINC001246677527 1059063529 /nfs/dbraw/zinc/06/35/29/1059063529.db2.gz IMWNWGLLUNIYEW-CEWLAPEOSA-N 2 1 314.517 4.028 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2C)CC[NH2+]1 ZINC001246681392 1059064117 /nfs/dbraw/zinc/06/41/17/1059064117.db2.gz OBQOWYHEGKSHHT-QWFCFKBJSA-N 2 1 300.490 4.443 20 0 DIADMP CC(C)CCC[C@H](C)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246686252 1059067067 /nfs/dbraw/zinc/06/70/67/1059067067.db2.gz QGAHRLQHFKGAMU-TYPHKJRUSA-N 2 1 314.517 4.280 20 0 DIADMP CCCCCC1CCC([N@H+]2C[C@H](CF)[C@H](C3([NH3+])CC3)C2)CC1 ZINC001246698369 1059068329 /nfs/dbraw/zinc/06/83/29/1059068329.db2.gz XTAMOQGKCYPVFO-JYSRZZCRSA-N 2 1 310.501 4.134 20 0 DIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246688824 1059068600 /nfs/dbraw/zinc/06/86/00/1059068600.db2.gz HSQHJEXNXGIWKC-CYBMUJFWSA-N 2 1 313.272 4.100 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246688824 1059068617 /nfs/dbraw/zinc/06/86/17/1059068617.db2.gz HSQHJEXNXGIWKC-CYBMUJFWSA-N 2 1 313.272 4.100 20 0 DIADMP c1ccc(C2CC[NH+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)cc1 ZINC001246688867 1059070056 /nfs/dbraw/zinc/07/00/56/1059070056.db2.gz ICBZQGQCYJAZNT-YADHBBJMSA-N 2 1 320.480 4.359 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246773358 1059071401 /nfs/dbraw/zinc/07/14/01/1059071401.db2.gz BKVQKBWLCZPXQP-LJQANCHMSA-N 2 1 308.469 4.194 20 0 DIADMP C[N@H+](CCCc1ccccc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246773653 1059072261 /nfs/dbraw/zinc/07/22/61/1059072261.db2.gz CBILMWRGLKMILF-SFTDATJTSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@@H+](CCCc1ccccc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246773653 1059072282 /nfs/dbraw/zinc/07/22/82/1059072282.db2.gz CBILMWRGLKMILF-SFTDATJTSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@@H+](Cc1ccccc1Cl)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246771232 1059072461 /nfs/dbraw/zinc/07/24/61/1059072461.db2.gz XASZSRLPPIXQSP-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246775518 1059073321 /nfs/dbraw/zinc/07/33/21/1059073321.db2.gz IXRVZEILBJHBDC-AZUAARDMSA-N 2 1 310.485 4.438 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246774070 1059073401 /nfs/dbraw/zinc/07/34/01/1059073401.db2.gz FVYVSTGZVKECPT-YADHBBJMSA-N 2 1 322.496 4.262 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@H+]3CCC[C@@H](c4ccccc4)C3)CC[NH2+]2)cc1 ZINC001246773335 1059074341 /nfs/dbraw/zinc/07/43/41/1059074341.db2.gz AVFPPWWSSZDIEM-YPAWHYETSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@@H+]3CCC[C@@H](c4ccccc4)C3)CC[NH2+]2)cc1 ZINC001246773335 1059074370 /nfs/dbraw/zinc/07/43/70/1059074370.db2.gz AVFPPWWSSZDIEM-YPAWHYETSA-N 2 1 320.480 4.359 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246768966 1059076304 /nfs/dbraw/zinc/07/63/04/1059076304.db2.gz HKJZTIXBUXQHEJ-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246776542 1059078633 /nfs/dbraw/zinc/07/86/33/1059078633.db2.gz OBQCPAYPOHZMAV-AQNXPRMDSA-N 2 1 314.517 4.108 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246778544 1059081468 /nfs/dbraw/zinc/08/14/68/1059081468.db2.gz QKKPNRCXFVWAJV-CTNGQTDRSA-N 2 1 308.469 4.194 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246784990 1059083803 /nfs/dbraw/zinc/08/38/03/1059083803.db2.gz ITNIEJJIRDVMLW-IRXDYDNUSA-N 2 1 304.865 4.152 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246783920 1059084497 /nfs/dbraw/zinc/08/44/97/1059084497.db2.gz RAVYYLTYRJJZPX-SJLPKXTDSA-N 2 1 304.453 4.049 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246784992 1059084549 /nfs/dbraw/zinc/08/45/49/1059084549.db2.gz ITNIEJJIRDVMLW-SJORKVTESA-N 2 1 304.865 4.152 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246784696 1059085967 /nfs/dbraw/zinc/08/59/67/1059085967.db2.gz IKGAKRLWTSTPLT-FFZOFVMBSA-N 2 1 316.464 4.275 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246787536 1059087221 /nfs/dbraw/zinc/08/72/21/1059087221.db2.gz DEJZTISHVDMQOJ-OBONGRFPSA-N 2 1 318.892 4.399 20 0 DIADMP c1csc([C@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)c1 ZINC001246784192 1059087948 /nfs/dbraw/zinc/08/79/48/1059087948.db2.gz FKVAIHIHTWYVQQ-UPTPFMHGSA-N 2 1 304.503 4.197 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793664 1059094811 /nfs/dbraw/zinc/09/48/11/1059094811.db2.gz WAILJPZQLDHZQL-WBAXXEDZSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793664 1059094823 /nfs/dbraw/zinc/09/48/23/1059094823.db2.gz WAILJPZQLDHZQL-WBAXXEDZSA-N 2 1 322.443 4.268 20 0 DIADMP Fc1ccc(F)c([C@@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246792218 1059095375 /nfs/dbraw/zinc/09/53/75/1059095375.db2.gz OMLOESRTDQSSKW-ZYSHUDEJSA-N 2 1 320.427 4.024 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)C1CCC(c2ccccc2)CC1 ZINC001246794912 1059096117 /nfs/dbraw/zinc/09/61/17/1059096117.db2.gz HSZCZAUOGMSXHC-UHFFFAOYSA-N 2 1 300.490 4.034 20 0 DIADMP Fc1ccc(F)c([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c1 ZINC001246792506 1059097200 /nfs/dbraw/zinc/09/72/00/1059097200.db2.gz PRPBHTCGTNDWLX-ZCDLSOSASA-N 2 1 320.427 4.024 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001246807738 1059101308 /nfs/dbraw/zinc/10/13/08/1059101308.db2.gz QUBGTKRHNLEREN-LVCYWYKZSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001246807738 1059101314 /nfs/dbraw/zinc/10/13/14/1059101314.db2.gz QUBGTKRHNLEREN-LVCYWYKZSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246801065 1059101424 /nfs/dbraw/zinc/10/14/24/1059101424.db2.gz YLRZPJXTZFRXFA-WMQCIHAUSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246801065 1059101427 /nfs/dbraw/zinc/10/14/27/1059101427.db2.gz YLRZPJXTZFRXFA-WMQCIHAUSA-N 2 1 324.443 4.456 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246798234 1059102167 /nfs/dbraw/zinc/10/21/67/1059102167.db2.gz MTKRCIWLFINNLG-QYZOEREBSA-N 2 1 304.453 4.273 20 0 DIADMP C[C@H]1CC([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)C[C@H](C)[NH2+]1 ZINC001246807599 1059102634 /nfs/dbraw/zinc/10/26/34/1059102634.db2.gz SLJQWJOHIJVMRZ-HOIFWPIMSA-N 2 1 320.480 4.163 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCSC[C@@H]2c2ccccc2)C[C@@H](CC)[NH2+]1 ZINC001246806685 1059102916 /nfs/dbraw/zinc/10/29/16/1059102916.db2.gz HREACBCWCHGTCT-ZHALLVOQSA-N 2 1 318.530 4.086 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809600 1059104848 /nfs/dbraw/zinc/10/48/48/1059104848.db2.gz KKRNLOWHHNQBOT-BBWFWOEESA-N 2 1 320.908 4.440 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809603 1059106041 /nfs/dbraw/zinc/10/60/41/1059106041.db2.gz KKRNLOWHHNQBOT-GVDBMIGSSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@@H+](CCc1ccc(Cl)cc1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246814751 1059106284 /nfs/dbraw/zinc/10/62/84/1059106284.db2.gz RRXNGIFMWXGXPE-UHFFFAOYSA-N 2 1 320.908 4.127 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809215 1059106315 /nfs/dbraw/zinc/10/63/15/1059106315.db2.gz FYLQISZYYDWTGL-VKJFTORMSA-N 2 1 320.908 4.296 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+](C)CCc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246815350 1059106613 /nfs/dbraw/zinc/10/66/13/1059106613.db2.gz YECJMANULPPJBM-QZTJIDSGSA-N 2 1 308.897 4.125 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@H+]([C@@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246809473 1059106959 /nfs/dbraw/zinc/10/69/59/1059106959.db2.gz WRLYTOJCAZYCRV-IAGOWNOFSA-N 2 1 316.464 4.070 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)C[C@@H]1CC[NH2+]C1 ZINC001246815631 1059110256 /nfs/dbraw/zinc/11/02/56/1059110256.db2.gz ZSLKTKWIYKDCHU-RBUKOAKNSA-N 2 1 322.496 4.138 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2C2CCC3(C[NH2+]C3)CC2)s1 ZINC001246825316 1059110273 /nfs/dbraw/zinc/11/02/73/1059110273.db2.gz URNHWHBZVFZJBY-ZDUSSCGKSA-N 2 1 310.894 4.071 20 0 DIADMP CC[C@H]1CC([N@@H+](C)CCc2cccc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246822377 1059110366 /nfs/dbraw/zinc/11/03/66/1059110366.db2.gz KPDFZRJWUQHENC-IRXDYDNUSA-N 2 1 308.897 4.124 20 0 DIADMP C[NH2+]CC[C@H](C)[N@H+]1CCC[C@@H]1C(c1ccccc1)c1ccccc1 ZINC001246819574 1059110424 /nfs/dbraw/zinc/11/04/24/1059110424.db2.gz CREJECIEOTVSTE-GHTZIAJQSA-N 2 1 322.496 4.281 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]([NH3+])CC[C@H]1C ZINC001246818426 1059110554 /nfs/dbraw/zinc/11/05/54/1059110554.db2.gz BYJCSQSGOBORTL-YRGRVCCFSA-N 2 1 315.288 4.126 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](CC)Cc2ccc(Cl)cc2)C[C@H](CC)[NH2+]1 ZINC001246842898 1059118656 /nfs/dbraw/zinc/11/86/56/1059118656.db2.gz CSYAQOLRDAWTNC-PIIMJCKOSA-N 2 1 308.897 4.471 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)CC[NH2+]1 ZINC001246838898 1059119924 /nfs/dbraw/zinc/11/99/24/1059119924.db2.gz KDIGYYMCLXMUHC-VXKWHMMOSA-N 2 1 322.496 4.262 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246844606 1059122119 /nfs/dbraw/zinc/12/21/19/1059122119.db2.gz JUVGNERSPHMZJQ-IAGOWNOFSA-N 2 1 308.897 4.329 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(OC)c2)CC[NH2+]1 ZINC001246846408 1059123523 /nfs/dbraw/zinc/12/35/23/1059123523.db2.gz GWDQRSMPOKSTDU-HBFSDRIKSA-N 2 1 316.489 4.143 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843326 1059123602 /nfs/dbraw/zinc/12/36/02/1059123602.db2.gz JKCBPCUVFRYXLQ-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246843326 1059123609 /nfs/dbraw/zinc/12/36/09/1059123609.db2.gz JKCBPCUVFRYXLQ-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](C)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246843922 1059124155 /nfs/dbraw/zinc/12/41/55/1059124155.db2.gz GQAWDRDWDDNEKH-IBGZPJMESA-N 2 1 300.490 4.382 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246843043 1059124465 /nfs/dbraw/zinc/12/44/65/1059124465.db2.gz DKZJPKFXMSKNRV-ZCNNSNEGSA-N 2 1 300.490 4.033 20 0 DIADMP Fc1ccc([C@@H]2CC[N@@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246846406 1059124599 /nfs/dbraw/zinc/12/45/99/1059124599.db2.gz GWBXFOXKAYNJNY-NRSPTQNISA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccc([C@@H]2CC[N@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246846406 1059124603 /nfs/dbraw/zinc/12/46/03/1059124603.db2.gz GWBXFOXKAYNJNY-NRSPTQNISA-N 2 1 324.443 4.108 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246845652 1059125369 /nfs/dbraw/zinc/12/53/69/1059125369.db2.gz QAZDBSAIZFTEHA-IZZQQSIFSA-N 2 1 324.468 4.440 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246845652 1059125385 /nfs/dbraw/zinc/12/53/85/1059125385.db2.gz QAZDBSAIZFTEHA-IZZQQSIFSA-N 2 1 324.468 4.440 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(OC)c2)C[C@H](CC)[NH2+]1 ZINC001246849090 1059128369 /nfs/dbraw/zinc/12/83/69/1059128369.db2.gz PWPZPQYHOTWWDS-XFKSJGNHSA-N 2 1 316.489 4.141 20 0 DIADMP Fc1ccc([C@@H]2CC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246848190 1059129385 /nfs/dbraw/zinc/12/93/85/1059129385.db2.gz MOWIVDNPIKGPMC-IEBWSBKVSA-N 2 1 316.464 4.070 20 0 DIADMP Clc1cccc([C@H]2CC[N@H+]([C@H]3CCC4(C3)CC[NH2+]CC4)C2)c1 ZINC001246854402 1059131320 /nfs/dbraw/zinc/13/13/20/1059131320.db2.gz SZZQPLSZSAHDLF-WMZOPIPTSA-N 2 1 318.892 4.052 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246856427 1059131418 /nfs/dbraw/zinc/13/14/18/1059131418.db2.gz ZEVKVFILBFHPNS-UHOSZYNNSA-N 2 1 320.908 4.440 20 0 DIADMP c1ccc(C2=CC[N@@H+](C3CCC4(CC[NH2+]CC4)CC3)CC2)cc1 ZINC001246857245 1059131522 /nfs/dbraw/zinc/13/15/22/1059131522.db2.gz GSBGFIYLVHKRTR-UHFFFAOYSA-N 2 1 310.485 4.088 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246852343 1059131750 /nfs/dbraw/zinc/13/17/50/1059131750.db2.gz OUSSKJXVLWGLPT-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP FC1CC2(C1)CCC[N@@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246853462 1059131930 /nfs/dbraw/zinc/13/19/30/1059131930.db2.gz MAIBGPYZZCSCSO-ADKAHSJRSA-N 2 1 308.485 4.046 20 0 DIADMP FC1CC2(C1)CCC[N@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246853462 1059131944 /nfs/dbraw/zinc/13/19/44/1059131944.db2.gz MAIBGPYZZCSCSO-ADKAHSJRSA-N 2 1 308.485 4.046 20 0 DIADMP Clc1cccc([C@H]2CC[N@H+]([C@@H]3CCC4(C3)CC[NH2+]CC4)C2)c1 ZINC001246854399 1059133399 /nfs/dbraw/zinc/13/33/99/1059133399.db2.gz SZZQPLSZSAHDLF-FUHWJXTLSA-N 2 1 318.892 4.052 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246855358 1059133536 /nfs/dbraw/zinc/13/35/36/1059133536.db2.gz XLJVKAUSEIAWPA-NXHRZFHOSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246851626 1059133765 /nfs/dbraw/zinc/13/37/65/1059133765.db2.gz ZAJYEOCZWAKIKJ-XYPHTWIQSA-N 2 1 308.897 4.500 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246851623 1059133907 /nfs/dbraw/zinc/13/39/07/1059133907.db2.gz ZAJYEOCZWAKIKJ-COXVUDFISA-N 2 1 308.897 4.500 20 0 DIADMP FC1CC2(C1)CCC[N@@H+]([C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246853229 1059133993 /nfs/dbraw/zinc/13/39/93/1059133993.db2.gz LCWOKIDHOYTKPG-WBFXSEPVSA-N 2 1 316.464 4.084 20 0 DIADMP FC1CC2(C1)CCC[N@H+]([C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246853229 1059134014 /nfs/dbraw/zinc/13/40/14/1059134014.db2.gz LCWOKIDHOYTKPG-WBFXSEPVSA-N 2 1 316.464 4.084 20 0 DIADMP CC(C)CCC[C@H](C)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246864561 1059137157 /nfs/dbraw/zinc/13/71/57/1059137157.db2.gz WIOCDAJGDUWGRZ-SFHVURJKSA-N 2 1 314.517 4.338 20 0 DIADMP CC[C@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246863795 1059138347 /nfs/dbraw/zinc/13/83/47/1059138347.db2.gz GIUMMILGSHYJNG-ICSRJNTNSA-N 2 1 312.501 4.451 20 0 DIADMP CC[C@H]1C[C@H]([NH+]2CCC(c3ccccc3Cl)CC2)CC[NH2+]1 ZINC001246867780 1059141869 /nfs/dbraw/zinc/14/18/69/1059141869.db2.gz JEAQJMLIBSXQSK-JKSUJKDBSA-N 2 1 306.881 4.050 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)CC[NH2+]1 ZINC001246876885 1059145598 /nfs/dbraw/zinc/14/55/98/1059145598.db2.gz DBJDDGGAXTXZSC-HKHXBQBMSA-N 2 1 318.464 4.003 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCc3cccc(Cl)c3C2)C[C@H](CC)[NH2+]1 ZINC001246876113 1059145695 /nfs/dbraw/zinc/14/56/95/1059145695.db2.gz YQOACUSXYZXVGW-MUJYYYPQSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCc3cccc(Cl)c3C2)C[C@H](CC)[NH2+]1 ZINC001246876113 1059145700 /nfs/dbraw/zinc/14/57/00/1059145700.db2.gz YQOACUSXYZXVGW-MUJYYYPQSA-N 2 1 306.881 4.007 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCC(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246884074 1059149494 /nfs/dbraw/zinc/14/94/94/1059149494.db2.gz SLJHJWPJQCGICY-GHTZIAJQSA-N 2 1 322.496 4.281 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2CC3CCC(CC3)C2)CC[NH2+]1 ZINC001246882874 1059149924 /nfs/dbraw/zinc/14/99/24/1059149924.db2.gz OWDZYXSGUYQWCE-CCJHYTBNSA-N 2 1 316.464 4.049 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1C[C@H](C)[NH2+][C@@H](C)C1 ZINC001246889639 1059154866 /nfs/dbraw/zinc/15/48/66/1059154866.db2.gz RJEGRFJFJZFKKR-ZQIUZPCESA-N 2 1 304.503 4.074 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c(F)c1 ZINC001246889726 1059155989 /nfs/dbraw/zinc/15/59/89/1059155989.db2.gz YWNPOSZNUKNPHH-QAPCUYQASA-N 2 1 320.427 4.024 20 0 DIADMP CCCC[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246892575 1059156634 /nfs/dbraw/zinc/15/66/34/1059156634.db2.gz FSXVOHQSZMQAHF-IPMKNSEASA-N 2 1 304.453 4.273 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)c1 ZINC001246888029 1059156874 /nfs/dbraw/zinc/15/68/74/1059156874.db2.gz QFQDCSWGSFEUDW-XMTFNYHQSA-N 2 1 304.865 4.150 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCC[C@@H]2c2c(F)cccc2F)C[C@@H](CC)[NH2+]1 ZINC001246899739 1059158544 /nfs/dbraw/zinc/15/85/44/1059158544.db2.gz FYWITXUYHOGEEH-HBUWYVDXSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2c(F)cccc2F)C[C@@H](CC)[NH2+]1 ZINC001246899739 1059158556 /nfs/dbraw/zinc/15/85/56/1059158556.db2.gz FYWITXUYHOGEEH-HBUWYVDXSA-N 2 1 322.443 4.411 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2c[nH]c3ccccc32)CC[NH2+]1 ZINC001246898997 1059158694 /nfs/dbraw/zinc/15/86/94/1059158694.db2.gz BUNSYOPGKFYJTI-RYGJVYDSSA-N 2 1 311.473 4.081 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+](C)C(C)(C)Cc2ccccc2)CC[NH2+]1 ZINC001246894425 1059159555 /nfs/dbraw/zinc/15/95/55/1059159555.db2.gz TYEUWUFXSCETNB-RBUKOAKNSA-N 2 1 302.506 4.250 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246893108 1059160074 /nfs/dbraw/zinc/16/00/74/1059160074.db2.gz HNNLYHMXCKQRBI-UXHICEINSA-N 2 1 310.485 4.438 20 0 DIADMP Fc1ccc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246896365 1059160299 /nfs/dbraw/zinc/16/02/99/1059160299.db2.gz XOIGMZCMAXRNQW-PWRODBHTSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246896365 1059160305 /nfs/dbraw/zinc/16/03/05/1059160305.db2.gz XOIGMZCMAXRNQW-PWRODBHTSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246896363 1059160626 /nfs/dbraw/zinc/16/06/26/1059160626.db2.gz XOIGMZCMAXRNQW-NJDAHSKKSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246896363 1059160629 /nfs/dbraw/zinc/16/06/29/1059160629.db2.gz XOIGMZCMAXRNQW-NJDAHSKKSA-N 2 1 324.443 4.456 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)C(C)(C)Cc1ccccc1 ZINC001246895770 1059160650 /nfs/dbraw/zinc/16/06/50/1059160650.db2.gz YANVJHZBEJENOJ-QZTJIDSGSA-N 2 1 302.506 4.106 20 0 DIADMP C[C@H]1CC([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)C[C@H](C)[NH2+]1 ZINC001246904899 1059162688 /nfs/dbraw/zinc/16/26/88/1059162688.db2.gz JORGWPACZMHGDO-IRXDYDNUSA-N 2 1 324.468 4.440 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+](CC)Cc2cccc(Cl)c2)CC[NH2+]1 ZINC001246903881 1059164595 /nfs/dbraw/zinc/16/45/95/1059164595.db2.gz LVBZTCHKEMPHQY-MSOLQXFVSA-N 2 1 308.897 4.473 20 0 DIADMP Fc1cccc(F)c1[C@H]1CCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246903454 1059164808 /nfs/dbraw/zinc/16/48/08/1059164808.db2.gz XWYFPXRZRQACCA-LTCLLZNKSA-N 2 1 320.427 4.024 20 0 DIADMP Fc1cccc(F)c1[C@H]1CCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246901337 1059164844 /nfs/dbraw/zinc/16/48/44/1059164844.db2.gz MCQQWPCDWLMAST-WMLDXEAASA-N 2 1 320.427 4.024 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2C3CCCC2CCC3)CC[NH2+]1 ZINC001246905484 1059167797 /nfs/dbraw/zinc/16/77/97/1059167797.db2.gz MRLDDMUOWXVYRX-QQGUTBHFSA-N 2 1 316.464 4.334 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905955 1059168930 /nfs/dbraw/zinc/16/89/30/1059168930.db2.gz PCMOJTXDMHVNGQ-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905955 1059168945 /nfs/dbraw/zinc/16/89/45/1059168945.db2.gz PCMOJTXDMHVNGQ-AEFFLSMTSA-N 2 1 310.441 4.051 20 0 DIADMP CC1CCC([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)CC1 ZINC001246909761 1059171163 /nfs/dbraw/zinc/17/11/63/1059171163.db2.gz KMUSAZUTNOIPJX-UHFFFAOYSA-N 2 1 300.490 4.337 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246911472 1059171633 /nfs/dbraw/zinc/17/16/33/1059171633.db2.gz PMOSLYSWFKTWFQ-QEJZJMRPSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246910464 1059171824 /nfs/dbraw/zinc/17/18/24/1059171824.db2.gz UBSONXRETLPHIS-GJZGRUSLSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246908824 1059172388 /nfs/dbraw/zinc/17/23/88/1059172388.db2.gz NKGSRAPJMGNTAB-IIDMSEBBSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C[C@@H]1C ZINC001246912093 1059172586 /nfs/dbraw/zinc/17/25/86/1059172586.db2.gz DFNCJBTXGBSGAP-FUHIMQAGSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246908760 1059172691 /nfs/dbraw/zinc/17/26/91/1059172691.db2.gz MJAISLJXUCYRJA-UHFFFAOYSA-N 2 1 300.490 4.129 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1 ZINC001246914458 1059176901 /nfs/dbraw/zinc/17/69/01/1059176901.db2.gz LDOWNLNCSXQDHB-LJQANCHMSA-N 2 1 322.496 4.180 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](C)C1CCC([NH2+]C)CC1 ZINC001246924162 1059180522 /nfs/dbraw/zinc/18/05/22/1059180522.db2.gz ZIBMLFTVXRMENS-IOJLRTSASA-N 2 1 302.506 4.250 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C[C@H]1C ZINC001246936337 1059183001 /nfs/dbraw/zinc/18/30/01/1059183001.db2.gz IZZQHCLQCDLVEG-JXXFODFXSA-N 2 1 318.480 4.204 20 0 DIADMP CC[N@@H+](C[C@H]1CC[NH2+]C1)[C@H](C)CC(C)(C)SCc1ccco1 ZINC001246934360 1059183935 /nfs/dbraw/zinc/18/39/35/1059183935.db2.gz CPSBWNRPZGVDKD-CVEARBPZSA-N 2 1 324.534 4.001 20 0 DIADMP CC(C)CC[C@@H](C)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246934709 1059185031 /nfs/dbraw/zinc/18/50/31/1059185031.db2.gz PAQJFXFMVHAUKS-MRXNPFEDSA-N 2 1 306.469 4.204 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C[C@@H]1C ZINC001246936335 1059185962 /nfs/dbraw/zinc/18/59/62/1059185962.db2.gz IZZQHCLQCDLVEG-GUXCAODWSA-N 2 1 318.480 4.204 20 0 DIADMP CC1(C)CC[C@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246943352 1059188572 /nfs/dbraw/zinc/18/85/72/1059188572.db2.gz RFCYEUSNDYNDPM-IBGZPJMESA-N 2 1 318.480 4.206 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246943703 1059188623 /nfs/dbraw/zinc/18/86/23/1059188623.db2.gz SDBUWHLWFSGZGN-MRXNPFEDSA-N 2 1 306.469 4.349 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246944450 1059189453 /nfs/dbraw/zinc/18/94/53/1059189453.db2.gz CDOHABAVAYOCPA-MAUKXSAKSA-N 2 1 320.908 4.473 20 0 DIADMP C[C@@H]1CC([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC001246944218 1059190625 /nfs/dbraw/zinc/19/06/25/1059190625.db2.gz VIJKYGCAJIGFID-HOTGVXAUSA-N 2 1 318.480 4.204 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CC[NH2+]CC2)C2CCC(C)CC2)c1 ZINC001246951517 1059193393 /nfs/dbraw/zinc/19/33/93/1059193393.db2.gz KUTZSHBFKNSYGZ-UHFFFAOYSA-N 2 1 318.480 4.267 20 0 DIADMP CC1CCC([N@@H+](Cc2ccc(Cl)cc2)C2CC[NH2+]CC2)CC1 ZINC001246948038 1059193568 /nfs/dbraw/zinc/19/35/68/1059193568.db2.gz ZWIRNBBRHYBMNW-UHFFFAOYSA-N 2 1 320.908 4.473 20 0 DIADMP CCC[C@H](C)CC[C@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246950257 1059195330 /nfs/dbraw/zinc/19/53/30/1059195330.db2.gz FPFUURZXLRRBNC-ROUUACIJSA-N 2 1 317.521 4.241 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246946416 1059195730 /nfs/dbraw/zinc/19/57/30/1059195730.db2.gz MEHSDSMAYYMZLY-OAHLLOKOSA-N 2 1 322.924 4.371 20 0 DIADMP CCC[C@@H](C)CC[C@@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246950256 1059196791 /nfs/dbraw/zinc/19/67/91/1059196791.db2.gz FPFUURZXLRRBNC-QZTJIDSGSA-N 2 1 317.521 4.241 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccc(C)cc2F)C2CC[NH2+]CC2)C1 ZINC001246954226 1059198662 /nfs/dbraw/zinc/19/86/62/1059198662.db2.gz FPNMMNJIQLEVAH-VQIMIIECSA-N 2 1 318.480 4.267 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246955883 1059199333 /nfs/dbraw/zinc/19/93/33/1059199333.db2.gz UXQPPYGMQJNEBW-MRXNPFEDSA-N 2 1 308.897 4.473 20 0 DIADMP Clc1ccccc1C[N@@H+](C1CCCCC1)C1CC[NH2+]CC1 ZINC001246953069 1059199799 /nfs/dbraw/zinc/19/97/99/1059199799.db2.gz LORCRTHTJNTARF-UHFFFAOYSA-N 2 1 306.881 4.227 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246956016 1059201382 /nfs/dbraw/zinc/20/13/82/1059201382.db2.gz PJSYZLJOQHXAAX-QGZVFWFLSA-N 2 1 324.459 4.344 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001246961959 1059204399 /nfs/dbraw/zinc/20/43/99/1059204399.db2.gz RSIPAMPHGAYPCB-SFHVURJKSA-N 2 1 306.469 4.267 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+]([C@@H]1CCC(C)(C)C1)C1CC[NH2+]CC1 ZINC001246961344 1059205150 /nfs/dbraw/zinc/20/51/50/1059205150.db2.gz QWAUUTCBWHYMSC-LJQANCHMSA-N 2 1 318.480 4.267 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246956959 1059206864 /nfs/dbraw/zinc/20/68/64/1059206864.db2.gz BKVGGMHNTLGCDC-ICSRJNTNSA-N 2 1 300.490 4.352 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2C)C2CC[NH2+]CC2)C1 ZINC001246963878 1059207394 /nfs/dbraw/zinc/20/73/94/1059207394.db2.gz ZUQUPPFBABLZIX-OXQOHEQNSA-N 2 1 318.480 4.267 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@@](C)(C[NH3+])C1 ZINC001246965632 1059210281 /nfs/dbraw/zinc/21/02/81/1059210281.db2.gz HLNUOCVKLPYUGO-GCJKJVERSA-N 2 1 322.496 4.268 20 0 DIADMP Cc1ccc(C[C@H](C)[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001246969044 1059210944 /nfs/dbraw/zinc/21/09/44/1059210944.db2.gz JCCYGSJSVYPENG-YYWHXJBOSA-N 2 1 314.517 4.298 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CC[NH2+][C@@H](C(C)C)C2)c1C ZINC001246966618 1059212538 /nfs/dbraw/zinc/21/25/38/1059212538.db2.gz LBUUGFUBVWWHEI-WOJBJXKFSA-N 2 1 300.490 4.044 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246970034 1059213215 /nfs/dbraw/zinc/21/32/15/1059213215.db2.gz NKRSMPCMRQBBSG-CDHQVMDDSA-N 2 1 318.480 4.129 20 0 DIADMP C1CC([N@@H+](C2CC[NH2+]CC2)[C@H]2CCCC3(CCCCC3)C2)C1 ZINC001246973679 1059215473 /nfs/dbraw/zinc/21/54/73/1059215473.db2.gz HUINAVRSOMLGSA-IBGZPJMESA-N 2 1 304.522 4.486 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246975277 1059215637 /nfs/dbraw/zinc/21/56/37/1059215637.db2.gz BNSDPRXJMGOJIA-YSIASYRMSA-N 2 1 302.506 4.250 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246974780 1059216627 /nfs/dbraw/zinc/21/66/27/1059216627.db2.gz QYPYJGLWWQZVON-SXLOBPIMSA-N 2 1 300.490 4.380 20 0 DIADMP C([C@H]1CCC[NH2+]C1)[N@@H+](C1CC1)[C@@H]1CCCC2(CCCCC2)C1 ZINC001246971894 1059219425 /nfs/dbraw/zinc/21/94/25/1059219425.db2.gz ISVVNHHDBLVTLV-PKOBYXMFSA-N 2 1 304.522 4.344 20 0 DIADMP Cc1cccc(C[N@H+]([C@@H](C)CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001246976215 1059221147 /nfs/dbraw/zinc/22/11/47/1059221147.db2.gz WJBYJCKFUNEMCQ-VDGAXYAQSA-N 2 1 300.490 4.256 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246976955 1059221294 /nfs/dbraw/zinc/22/12/94/1059221294.db2.gz GREWROPBYJSKLZ-WOZUAGRISA-N 2 1 314.517 4.108 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246977930 1059224434 /nfs/dbraw/zinc/22/44/34/1059224434.db2.gz RQFLSNWROUYTIU-HXUWFJFHSA-N 2 1 300.490 4.004 20 0 DIADMP c1ccc(CC[C@@H]2CCC[N@H+]([C@@H]3CC[NH2+]C4(CCC4)C3)C2)cc1 ZINC001246980207 1059225398 /nfs/dbraw/zinc/22/53/98/1059225398.db2.gz QFVVEIHJJBNYOW-VQTJNVASSA-N 2 1 312.501 4.006 20 0 DIADMP C[N@H+]([C@@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246998853 1059227592 /nfs/dbraw/zinc/22/75/92/1059227592.db2.gz HDZNYLKDHMLLQE-HLAWJBBLSA-N 2 1 306.453 4.099 20 0 DIADMP C[N@@H+]([C@@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246998853 1059227611 /nfs/dbraw/zinc/22/76/11/1059227611.db2.gz HDZNYLKDHMLLQE-HLAWJBBLSA-N 2 1 306.453 4.099 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC001246993542 1059228892 /nfs/dbraw/zinc/22/88/92/1059228892.db2.gz TZMTUFUOZHUNNA-CJNGLKHVSA-N 2 1 314.395 4.230 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@H+]1CCCC[C@H]1c1ccccc1C(F)(F)F ZINC001246993542 1059228910 /nfs/dbraw/zinc/22/89/10/1059228910.db2.gz TZMTUFUOZHUNNA-CJNGLKHVSA-N 2 1 314.395 4.230 20 0 DIADMP CC1(C)CCC[C@@H]([NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)C1 ZINC001246999940 1059228950 /nfs/dbraw/zinc/22/89/50/1059228950.db2.gz CSNPPJWEMCMDDP-GOSISDBHSA-N 2 1 312.501 4.092 20 0 DIADMP c1ccc(C[C@@H]2C[C@H]([N@H+]3CCC4(C3)CCCCC4)CC[NH2+]2)cc1 ZINC001246999562 1059230297 /nfs/dbraw/zinc/23/02/97/1059230297.db2.gz QXDAMULSRIXNGY-WOJBJXKFSA-N 2 1 312.501 4.006 20 0 DIADMP CCCCC[C@@H](C)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247004790 1059233189 /nfs/dbraw/zinc/23/31/89/1059233189.db2.gz OKYPYYMXQZBLRB-QGZVFWFLSA-N 2 1 300.490 4.092 20 0 DIADMP CCCCC[C@H](C)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247004785 1059233465 /nfs/dbraw/zinc/23/34/65/1059233465.db2.gz OKYPYYMXQZBLRB-KRWDZBQOSA-N 2 1 300.490 4.092 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2Cc2ccc(F)cc2)CC[NH2+]1 ZINC001247006237 1059234842 /nfs/dbraw/zinc/23/48/42/1059234842.db2.gz UTIDLTSYUKHMNV-HSALFYBXSA-N 2 1 318.480 4.143 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004567 1059234945 /nfs/dbraw/zinc/23/49/45/1059234945.db2.gz RWHDLLSHABLOMY-KURKYZTESA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004567 1059234963 /nfs/dbraw/zinc/23/49/63/1059234963.db2.gz RWHDLLSHABLOMY-KURKYZTESA-N 2 1 322.443 4.268 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001247001760 1059235490 /nfs/dbraw/zinc/23/54/90/1059235490.db2.gz KZIDPIJCQCPCJL-QRQLOZEOSA-N 2 1 300.490 4.299 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC34CCC(CC3)C4)C2)CC1 ZINC001559508186 1059303943 /nfs/dbraw/zinc/30/39/43/1059303943.db2.gz AKODTXVKMINBEB-GPJFCIFZSA-N 2 1 304.522 4.011 20 0 DIADMP CCc1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001559546523 1059348363 /nfs/dbraw/zinc/34/83/63/1059348363.db2.gz YLFVJEMTHBWLTD-RTBURBONSA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001559546523 1059348384 /nfs/dbraw/zinc/34/83/84/1059348384.db2.gz YLFVJEMTHBWLTD-RTBURBONSA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001559546523 1059348404 /nfs/dbraw/zinc/34/84/04/1059348404.db2.gz YLFVJEMTHBWLTD-RTBURBONSA-N 2 1 314.517 4.335 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC001559545855 1059350010 /nfs/dbraw/zinc/35/00/10/1059350010.db2.gz ICBHBCBBZJJBMR-FYQPLNBISA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)C1 ZINC001559545855 1059350031 /nfs/dbraw/zinc/35/00/31/1059350031.db2.gz ICBHBCBBZJJBMR-FYQPLNBISA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC001559545855 1059350052 /nfs/dbraw/zinc/35/00/52/1059350052.db2.gz ICBHBCBBZJJBMR-FYQPLNBISA-N 2 1 306.538 4.399 20 0 DIADMP CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568201 1059399293 /nfs/dbraw/zinc/39/92/93/1059399293.db2.gz RXRCPWMVKVFXCN-IEBWSBKVSA-N 2 1 318.505 4.491 20 0 DIADMP CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568201 1059399314 /nfs/dbraw/zinc/39/93/14/1059399314.db2.gz RXRCPWMVKVFXCN-IEBWSBKVSA-N 2 1 318.505 4.491 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@H]1CCN(C)[C@H](C)C1 ZINC001559584264 1059415254 /nfs/dbraw/zinc/41/52/54/1059415254.db2.gz GTZHKZWJPCZCEG-NXHRZFHOSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1 ZINC001559584264 1059415262 /nfs/dbraw/zinc/41/52/62/1059415262.db2.gz GTZHKZWJPCZCEG-NXHRZFHOSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[N@@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1 ZINC001559584264 1059415264 /nfs/dbraw/zinc/41/52/64/1059415264.db2.gz GTZHKZWJPCZCEG-NXHRZFHOSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC001559584264 1059415271 /nfs/dbraw/zinc/41/52/71/1059415271.db2.gz GTZHKZWJPCZCEG-NXHRZFHOSA-N 2 1 320.546 4.138 20 0 DIADMP Cc1ccccc1SC[C@H](C)C[NH+](C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC001559584264 1059415275 /nfs/dbraw/zinc/41/52/75/1059415275.db2.gz GTZHKZWJPCZCEG-NXHRZFHOSA-N 2 1 320.546 4.138 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(C3CCCC3)cc2)CC1 ZINC001559583668 1059416168 /nfs/dbraw/zinc/41/61/68/1059416168.db2.gz NLYSXNQINPGEOB-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(C3CCCC3)cc2)CC1 ZINC001559583668 1059416181 /nfs/dbraw/zinc/41/61/81/1059416181.db2.gz NLYSXNQINPGEOB-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H]2CCC3(CCCCCC3)O2)C[C@@H]1C ZINC001559584683 1059417809 /nfs/dbraw/zinc/41/78/09/1059417809.db2.gz UMVOPAMFQWGWRI-FHWLQOOXSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)C[C@@H]1C ZINC001559584683 1059417825 /nfs/dbraw/zinc/41/78/25/1059417825.db2.gz UMVOPAMFQWGWRI-FHWLQOOXSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)C[C@@H]1C ZINC001559584683 1059417834 /nfs/dbraw/zinc/41/78/34/1059417834.db2.gz UMVOPAMFQWGWRI-FHWLQOOXSA-N 2 1 322.537 4.063 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H]2CCC3(CCCCCC3)O2)C[C@@H]1C ZINC001559584684 1059419410 /nfs/dbraw/zinc/41/94/10/1059419410.db2.gz UMVOPAMFQWGWRI-GBESFXJTSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@H]2CCC3(CCCCCC3)O2)C[C@@H]1C ZINC001559584684 1059419413 /nfs/dbraw/zinc/41/94/13/1059419413.db2.gz UMVOPAMFQWGWRI-GBESFXJTSA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@H]2CCC3(CCCCCC3)O2)C[C@@H]1C ZINC001559584684 1059419420 /nfs/dbraw/zinc/41/94/20/1059419420.db2.gz UMVOPAMFQWGWRI-GBESFXJTSA-N 2 1 322.537 4.063 20 0 DIADMP CC(C)=CCC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001559718056 1059547082 /nfs/dbraw/zinc/54/70/82/1059547082.db2.gz HGOGRXUIKYYJLE-UHFFFAOYSA-N 2 1 312.501 4.331 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CCC(C)(C)C)C2)s1 ZINC001559819243 1059652638 /nfs/dbraw/zinc/65/26/38/1059652638.db2.gz SHAXIOMISFVFNX-MRXNPFEDSA-N 2 1 308.535 4.246 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CCC(C)(C)C)C2)s1 ZINC001559819243 1059652647 /nfs/dbraw/zinc/65/26/47/1059652647.db2.gz SHAXIOMISFVFNX-MRXNPFEDSA-N 2 1 308.535 4.246 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCC(C)(C)C)C2)s1 ZINC001559819243 1059652655 /nfs/dbraw/zinc/65/26/55/1059652655.db2.gz SHAXIOMISFVFNX-MRXNPFEDSA-N 2 1 308.535 4.246 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+](CC4CCCCC4)C3)C2)cc1 ZINC001559829570 1059661382 /nfs/dbraw/zinc/66/13/82/1059661382.db2.gz WZIXSRJCJJRTGB-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+](CC4CCCCC4)C3)C2)cc1 ZINC001559829570 1059661393 /nfs/dbraw/zinc/66/13/93/1059661393.db2.gz WZIXSRJCJJRTGB-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](CC4CCCCC4)C3)C2)cc1 ZINC001559829570 1059661408 /nfs/dbraw/zinc/66/14/08/1059661408.db2.gz WZIXSRJCJJRTGB-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP CCC(CC)C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001559829370 1059662176 /nfs/dbraw/zinc/66/21/76/1059662176.db2.gz RMSPZQMFYWMFSL-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CCC(CC)C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001559829370 1059662182 /nfs/dbraw/zinc/66/21/82/1059662182.db2.gz RMSPZQMFYWMFSL-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CCC(CC)C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001559829370 1059662189 /nfs/dbraw/zinc/66/21/89/1059662189.db2.gz RMSPZQMFYWMFSL-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1oc2c(cccc2C)c1C ZINC001559967923 1059776696 /nfs/dbraw/zinc/77/66/96/1059776696.db2.gz OOJAHNMJEVDQFT-UHFFFAOYSA-N 2 1 311.429 4.077 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1oc2c(cccc2C)c1C ZINC001559967923 1059776714 /nfs/dbraw/zinc/77/67/14/1059776714.db2.gz OOJAHNMJEVDQFT-UHFFFAOYSA-N 2 1 311.429 4.077 20 0 DIADMP C[NH+]1C[C@]2(C)C[NH+](Cc3ccc(C4CCCC4)cc3)C[C@@]2(C)C1 ZINC001560044081 1059857199 /nfs/dbraw/zinc/85/71/99/1059857199.db2.gz SZFHEEZEIJAQGI-NHCUHLMSSA-N 2 1 312.501 4.118 20 0 DIADMP CCCc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)cc1 ZINC001560100564 1059905307 /nfs/dbraw/zinc/90/53/07/1059905307.db2.gz OXQBJGRNJROFNK-UHFFFAOYSA-N 2 1 302.506 4.337 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@H](C)[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266642 1060037415 /nfs/dbraw/zinc/03/74/15/1060037415.db2.gz LAQRBNBDFWJMEJ-HBFSDRIKSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@H](C)[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001560266642 1060037429 /nfs/dbraw/zinc/03/74/29/1060037429.db2.gz LAQRBNBDFWJMEJ-HBFSDRIKSA-N 2 1 302.506 4.136 20 0 DIADMP CSCc1ccc(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001560270128 1060042598 /nfs/dbraw/zinc/04/25/98/1060042598.db2.gz HQRGZSHBJBICLO-CALCHBBNSA-N 2 1 320.546 4.007 20 0 DIADMP c1csc(-c2ccc(CN[C@@H]3CC[N@H+]4CCCC[C@H]34)cc2)c1 ZINC001560271557 1060046247 /nfs/dbraw/zinc/04/62/47/1060046247.db2.gz PHHYBHKDZUUYOK-QZTJIDSGSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CCN4CCCC[C@H]34)cc2)c1 ZINC001560271557 1060046266 /nfs/dbraw/zinc/04/62/66/1060046266.db2.gz PHHYBHKDZUUYOK-QZTJIDSGSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCCC[C@H]34)cc2)c1 ZINC001560271557 1060046288 /nfs/dbraw/zinc/04/62/88/1060046288.db2.gz PHHYBHKDZUUYOK-QZTJIDSGSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@@H]3CC[N@H+]4CCCC[C@H]34)cc2)c1 ZINC001560271557 1060046322 /nfs/dbraw/zinc/04/63/22/1060046322.db2.gz PHHYBHKDZUUYOK-QZTJIDSGSA-N 2 1 312.482 4.132 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560270417 1060047382 /nfs/dbraw/zinc/04/73/82/1060047382.db2.gz SSJYSAZUQFNVJM-SLFFLAALSA-N 2 1 316.533 4.213 20 0 DIADMP CC[N@H+](CC[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1)C(C)C ZINC001560306312 1060092005 /nfs/dbraw/zinc/09/20/05/1060092005.db2.gz BFIHVDLMPMITNW-PMACEKPBSA-N 2 1 302.506 4.423 20 0 DIADMP CC[N@@H+](CC[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1)C(C)C ZINC001560306312 1060092027 /nfs/dbraw/zinc/09/20/27/1060092027.db2.gz BFIHVDLMPMITNW-PMACEKPBSA-N 2 1 302.506 4.423 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC001560314496 1060102231 /nfs/dbraw/zinc/10/22/31/1060102231.db2.gz FRUSOJWBTRGXAX-BNOWGMLFSA-N 2 1 313.272 4.271 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC001560321015 1060108011 /nfs/dbraw/zinc/10/80/11/1060108011.db2.gz XRERKAFUJAJNAG-AQDCRGGLSA-N 2 1 314.517 4.335 20 0 DIADMP C[N@H+](Cc1sc(Cl)c2ccccc21)CC1CC[NH+](C)CC1 ZINC001249066488 1060140041 /nfs/dbraw/zinc/14/00/41/1060140041.db2.gz AHWJYWKIOXNZLJ-UHFFFAOYSA-N 2 1 322.905 4.328 20 0 DIADMP CCN1CCC([N@@H+](C)Cc2sc(Cl)c3ccccc32)CC1 ZINC001249068727 1060143582 /nfs/dbraw/zinc/14/35/82/1060143582.db2.gz YEXQWACSDFJXRF-UHFFFAOYSA-N 2 1 322.905 4.471 20 0 DIADMP CC[NH+]1CCC(N(C)Cc2sc(Cl)c3ccccc32)CC1 ZINC001249068727 1060143597 /nfs/dbraw/zinc/14/35/97/1060143597.db2.gz YEXQWACSDFJXRF-UHFFFAOYSA-N 2 1 322.905 4.471 20 0 DIADMP CC(C)CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](CC3CCCC3)C2)C1 ZINC001560360236 1060146519 /nfs/dbraw/zinc/14/65/19/1060146519.db2.gz GVLXFCJKSKTTBI-HOJAQTOUSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](CC3CCCC3)C2)C1 ZINC001560360236 1060146531 /nfs/dbraw/zinc/14/65/31/1060146531.db2.gz GVLXFCJKSKTTBI-HOJAQTOUSA-N 2 1 306.538 4.445 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1sc(Cl)c2ccccc21 ZINC001249075754 1060149039 /nfs/dbraw/zinc/14/90/39/1060149039.db2.gz QXJZCZCROBPBHK-UHFFFAOYSA-N 2 1 310.894 4.328 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1sc(Cl)c2ccccc21 ZINC001249075754 1060149051 /nfs/dbraw/zinc/14/90/51/1060149051.db2.gz QXJZCZCROBPBHK-UHFFFAOYSA-N 2 1 310.894 4.328 20 0 DIADMP CC(C)CSCCC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001560400612 1060185237 /nfs/dbraw/zinc/18/52/37/1060185237.db2.gz TVAGJXSDPDWQSI-UHFFFAOYSA-N 2 1 320.546 4.020 20 0 DIADMP C[C@H](CC[NH2+]Cc1cccc(C(F)(F)F)c1)[NH+]1CCCCC1 ZINC001560436539 1060222430 /nfs/dbraw/zinc/22/24/30/1060222430.db2.gz IXXRYHQLZDXPDH-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560482747 1060272047 /nfs/dbraw/zinc/27/20/47/1060272047.db2.gz ADCLJYSZLLRKCB-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560482747 1060272064 /nfs/dbraw/zinc/27/20/64/1060272064.db2.gz ADCLJYSZLLRKCB-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560482748 1060272953 /nfs/dbraw/zinc/27/29/53/1060272953.db2.gz ADCLJYSZLLRKCB-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560482748 1060272972 /nfs/dbraw/zinc/27/29/72/1060272972.db2.gz ADCLJYSZLLRKCB-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cc(-c3ccccc3)cs2)C1 ZINC001560500089 1060292992 /nfs/dbraw/zinc/29/29/92/1060292992.db2.gz CWKPIWPHCHHXOP-INIZCTEOSA-N 2 1 314.498 4.237 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)s2)C1 ZINC001560534423 1060338789 /nfs/dbraw/zinc/33/87/89/1060338789.db2.gz ZZWJXGYIKIGGGK-INIZCTEOSA-N 2 1 314.498 4.237 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3)s2)CC1(C)C ZINC001560542659 1060350453 /nfs/dbraw/zinc/35/04/53/1060350453.db2.gz NKVVCPZPVJVERP-MRXNPFEDSA-N 2 1 314.498 4.378 20 0 DIADMP c1ccc2cc(C[NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)ccc2c1 ZINC001560547189 1060355928 /nfs/dbraw/zinc/35/59/28/1060355928.db2.gz YBULRRHPQFVYQA-LJQANCHMSA-N 2 1 308.469 4.051 20 0 DIADMP CCC(CC)C[NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001560616322 1060430103 /nfs/dbraw/zinc/43/01/03/1060430103.db2.gz YUPRSVUZHADNRI-HKBOAZHASA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632821 1060445044 /nfs/dbraw/zinc/44/50/44/1060445044.db2.gz ZTBVUOFTOPNSBN-ROUKRRSUSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1C ZINC001560632821 1060445052 /nfs/dbraw/zinc/44/50/52/1060445052.db2.gz ZTBVUOFTOPNSBN-ROUKRRSUSA-N 2 1 312.501 4.043 20 0 DIADMP CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560644098 1060464400 /nfs/dbraw/zinc/46/44/00/1060464400.db2.gz HTCKFMRCHZILTO-MXEMCNAFSA-N 2 1 312.501 4.055 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)CC1 ZINC001560648421 1060469518 /nfs/dbraw/zinc/46/95/18/1060469518.db2.gz OYSOBRGVFPBWJI-AXUYNXDZSA-N 2 1 312.501 4.286 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2CCc3ccccc32)CC1 ZINC001560673298 1060505423 /nfs/dbraw/zinc/50/54/23/1060505423.db2.gz LICGXUWDJBYEPD-HXUWFJFHSA-N 2 1 314.517 4.160 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC001560680999 1060520043 /nfs/dbraw/zinc/52/00/43/1060520043.db2.gz RVIYDHBXUWTFHX-NHCUHLMSSA-N 2 1 314.517 4.303 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC001560680999 1060520063 /nfs/dbraw/zinc/52/00/63/1060520063.db2.gz RVIYDHBXUWTFHX-NHCUHLMSSA-N 2 1 314.517 4.303 20 0 DIADMP C[C@@H]([NH2+]C1CC2(C1)CCCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001560711940 1060569836 /nfs/dbraw/zinc/56/98/36/1060569836.db2.gz XNTSTYZSLGPWKG-IEBWSBKVSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001560749502 1060616346 /nfs/dbraw/zinc/61/63/46/1060616346.db2.gz HRKOZYBALRDYBT-CMKODMSKSA-N 2 1 314.517 4.169 20 0 DIADMP C([NH2+][C@@H]1CCCC[C@H]1C1CC1)[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791759 1060651283 /nfs/dbraw/zinc/65/12/83/1060651283.db2.gz QEBHZLVHEFEFKT-HSALFYBXSA-N 2 1 304.522 4.342 20 0 DIADMP C[C@@H]1CC[C@H]1[NH2+]C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001560820955 1060678542 /nfs/dbraw/zinc/67/85/42/1060678542.db2.gz ZWRAMUBINMOPLK-QFUCXCTJSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@@H]1CC[C@H]1[NH2+]C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001560820957 1060679946 /nfs/dbraw/zinc/67/99/46/1060679946.db2.gz ZWRAMUBINMOPLK-YFVAEKQCSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)cc1 ZINC001560845922 1060702295 /nfs/dbraw/zinc/70/22/95/1060702295.db2.gz UWOUARWEKQPCQE-ICSRJNTNSA-N 2 1 302.506 4.199 20 0 DIADMP Cc1ccc(C2CC([NH2+][C@@H](CC(C)C)C[NH+]3CCCC3)C2)cc1 ZINC001560845547 1060702623 /nfs/dbraw/zinc/70/26/23/1060702623.db2.gz NCKZTXYXTYDMGL-CBNMVNINSA-N 2 1 314.517 4.341 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+]C1CCC(c2ccccc2)CC1 ZINC001560861230 1060719738 /nfs/dbraw/zinc/71/97/38/1060719738.db2.gz HWTVMOWJAQNDNR-QHGAOEGBSA-N 2 1 302.506 4.423 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+]C1CCC(c2ccccc2)CC1 ZINC001560861230 1060719750 /nfs/dbraw/zinc/71/97/50/1060719750.db2.gz HWTVMOWJAQNDNR-QHGAOEGBSA-N 2 1 302.506 4.423 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001560870758 1060731405 /nfs/dbraw/zinc/73/14/05/1060731405.db2.gz PDUBCOCHTQCGNV-HFTRVMKXSA-N 2 1 308.897 4.294 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001560870758 1060731420 /nfs/dbraw/zinc/73/14/20/1060731420.db2.gz PDUBCOCHTQCGNV-HFTRVMKXSA-N 2 1 308.897 4.294 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001560871865 1060732819 /nfs/dbraw/zinc/73/28/19/1060732819.db2.gz UNXJRDZMMCGHNW-SFTDATJTSA-N 2 1 312.501 4.377 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC001560916093 1060776766 /nfs/dbraw/zinc/77/67/66/1060776766.db2.gz DSPHSTZCCFDJKF-UHFFFAOYSA-N 2 1 317.304 4.103 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938197 1060801766 /nfs/dbraw/zinc/80/17/66/1060801766.db2.gz YBIUIGIQNUKQSC-HOCLYGCPSA-N 2 1 314.464 4.197 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938197 1060801780 /nfs/dbraw/zinc/80/17/80/1060801780.db2.gz YBIUIGIQNUKQSC-HOCLYGCPSA-N 2 1 314.464 4.197 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CC[C@H]2[C@H](CC[N@@H+]2C)C1 ZINC001560972100 1060835753 /nfs/dbraw/zinc/83/57/53/1060835753.db2.gz CUGPDBFQINBTMI-KNQAVFIVSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H]2[C@H](CC[NH+]2C)C1 ZINC001560972100 1060835759 /nfs/dbraw/zinc/83/57/59/1060835759.db2.gz CUGPDBFQINBTMI-KNQAVFIVSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@H]2[C@H](CC[NH+]2C)C1 ZINC001560972100 1060835767 /nfs/dbraw/zinc/83/57/67/1060835767.db2.gz CUGPDBFQINBTMI-KNQAVFIVSA-N 2 1 320.480 4.188 20 0 DIADMP C([NH2+][C@@H]1CCC[C@H](C2CC2)C1)[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001560973520 1060837807 /nfs/dbraw/zinc/83/78/07/1060837807.db2.gz WSWTUDMNDWSASX-NLWGTHIKSA-N 2 1 304.522 4.342 20 0 DIADMP C([NH2+][C@@H]1CCC[C@H](C2CC2)C1)[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001560973520 1060837820 /nfs/dbraw/zinc/83/78/20/1060837820.db2.gz WSWTUDMNDWSASX-NLWGTHIKSA-N 2 1 304.522 4.342 20 0 DIADMP Clc1ccc(CC[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)cc1 ZINC001560973051 1060838783 /nfs/dbraw/zinc/83/87/83/1060838783.db2.gz HTECNLSWKKVCIX-IBGZPJMESA-N 2 1 320.908 4.269 20 0 DIADMP Clc1ccc(CC[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)cc1 ZINC001560973051 1060838787 /nfs/dbraw/zinc/83/87/87/1060838787.db2.gz HTECNLSWKKVCIX-IBGZPJMESA-N 2 1 320.908 4.269 20 0 DIADMP C[N@H+](C/C=C/c1cccc(F)c1)CCCC[NH+]1CCCCC1 ZINC001560982946 1060846762 /nfs/dbraw/zinc/84/67/62/1060846762.db2.gz LTJYIIAKICJGFD-CSKARUKUSA-N 2 1 304.453 4.037 20 0 DIADMP C[C@@H]([NH2+]CC1CCC=CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001561017718 1060874720 /nfs/dbraw/zinc/87/47/20/1060874720.db2.gz FUTOZKINHHOLMJ-WIYYLYMNSA-N 2 1 312.501 4.233 20 0 DIADMP CC(C)C1CCC(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)CC1 ZINC001561045038 1060895619 /nfs/dbraw/zinc/89/56/19/1060895619.db2.gz CGJWUDBRZRAAPN-VWAQSERHSA-N 2 1 306.538 4.111 20 0 DIADMP CC[C@@H](C)C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473204020 1060966996 /nfs/dbraw/zinc/96/69/96/1060966996.db2.gz WYKLMEUGDTVMLG-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H](C)C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473204020 1060967007 /nfs/dbraw/zinc/96/70/07/1060967007.db2.gz WYKLMEUGDTVMLG-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H](C)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473204020 1060967020 /nfs/dbraw/zinc/96/70/20/1060967020.db2.gz WYKLMEUGDTVMLG-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H](C)C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473204018 1060971686 /nfs/dbraw/zinc/97/16/86/1060971686.db2.gz WYKLMEUGDTVMLG-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473204018 1060971710 /nfs/dbraw/zinc/97/17/10/1060971710.db2.gz WYKLMEUGDTVMLG-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473204018 1060971732 /nfs/dbraw/zinc/97/17/32/1060971732.db2.gz WYKLMEUGDTVMLG-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCC2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001473206210 1060974062 /nfs/dbraw/zinc/97/40/62/1060974062.db2.gz PZPZGRROXXBZOM-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCC2CCC2)CC[N@H+]1Cc1ccccc1 ZINC001473206210 1060974080 /nfs/dbraw/zinc/97/40/80/1060974080.db2.gz PZPZGRROXXBZOM-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206210 1060974097 /nfs/dbraw/zinc/97/40/97/1060974097.db2.gz PZPZGRROXXBZOM-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206210 1060974117 /nfs/dbraw/zinc/97/41/17/1060974117.db2.gz PZPZGRROXXBZOM-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](CC3CCC(C(C)(C)C)CC3)CC[C@H]21 ZINC001473219453 1060994108 /nfs/dbraw/zinc/99/41/08/1060994108.db2.gz HRMITUMOAZZBFC-JWHDQAAXSA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](CC3CCC(C(C)(C)C)CC3)CC[C@H]21 ZINC001473219453 1060994127 /nfs/dbraw/zinc/99/41/27/1060994127.db2.gz HRMITUMOAZZBFC-JWHDQAAXSA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](CC3CCC(C(C)(C)C)CC3)CC[C@H]21 ZINC001473219453 1060994148 /nfs/dbraw/zinc/99/41/48/1060994148.db2.gz HRMITUMOAZZBFC-JWHDQAAXSA-N 2 1 306.538 4.255 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001462271641 1061066736 /nfs/dbraw/zinc/06/67/36/1061066736.db2.gz YCJAFAYUZJAVNG-NMLBUPMWSA-N 2 1 306.538 4.445 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(F)cc2)CC1)CC1CC1 ZINC001473304159 1061066867 /nfs/dbraw/zinc/06/68/67/1061066867.db2.gz IPNHCSVUJDRPKL-UHFFFAOYSA-N 2 1 318.480 4.160 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462306532 1061093524 /nfs/dbraw/zinc/09/35/24/1061093524.db2.gz PIACNGRPOBCMED-DFQSSKMNSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462306532 1061093544 /nfs/dbraw/zinc/09/35/44/1061093544.db2.gz PIACNGRPOBCMED-DFQSSKMNSA-N 2 1 302.506 4.108 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCCC[C@@H]1c1ccccc1)C1CC1 ZINC001462310011 1061096086 /nfs/dbraw/zinc/09/60/86/1061096086.db2.gz MEDKQQVMXCZKJD-UXHICEINSA-N 2 1 300.490 4.177 20 0 DIADMP Cc1ccccc1CCC[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001473342316 1061100503 /nfs/dbraw/zinc/10/05/03/1061100503.db2.gz NIIGJCQMFVBUDJ-UHFFFAOYSA-N 2 1 310.485 4.121 20 0 DIADMP Cc1cccc(CCC[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC001473342825 1061102352 /nfs/dbraw/zinc/10/23/52/1061102352.db2.gz RLXZULXXQYTFDH-UHFFFAOYSA-N 2 1 310.485 4.121 20 0 DIADMP CC(C)CC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001473348911 1061105194 /nfs/dbraw/zinc/10/51/94/1061105194.db2.gz IDJUGQQMJLVOCI-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001473349190 1061105632 /nfs/dbraw/zinc/10/56/32/1061105632.db2.gz RVWSKOXNBPSQBA-IBGZPJMESA-N 2 1 314.517 4.409 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c(C)c1C ZINC001473380002 1061122736 /nfs/dbraw/zinc/12/27/36/1061122736.db2.gz OEBBURSNSWQIMU-LJQANCHMSA-N 2 1 302.506 4.145 20 0 DIADMP CC[C@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)[C@H]1C ZINC001473403186 1061138628 /nfs/dbraw/zinc/13/86/28/1061138628.db2.gz SBVHMIWWFKIAJA-PXNSSMCTSA-N 2 1 300.490 4.293 20 0 DIADMP CC[C@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)[C@@H]1C ZINC001473403187 1061139522 /nfs/dbraw/zinc/13/95/22/1061139522.db2.gz SBVHMIWWFKIAJA-XLIONFOSSA-N 2 1 300.490 4.293 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H]1CC(C)(C)CCc2ccccc21 ZINC001473416775 1061147620 /nfs/dbraw/zinc/14/76/20/1061147620.db2.gz UONHLYFSCLCZMW-IBGZPJMESA-N 2 1 311.473 4.046 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H]1C[C@@H](OC(C)C)C1(C)C)C1CCCCC1 ZINC001462408117 1061154603 /nfs/dbraw/zinc/15/46/03/1061154603.db2.gz MHAXTOCVKUHMMM-RBUKOAKNSA-N 2 1 324.553 4.213 20 0 DIADMP CC(C)(CC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)C1CC1 ZINC001473427993 1061156255 /nfs/dbraw/zinc/15/62/55/1061156255.db2.gz RTVUIJGZSMARFK-UHFFFAOYSA-N 2 1 315.505 4.225 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCC3CCCC3)C2)s1 ZINC001473456259 1061170007 /nfs/dbraw/zinc/17/00/07/1061170007.db2.gz YSRSBXKNTWANIL-GOSISDBHSA-N 2 1 320.546 4.391 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC001473501646 1061196558 /nfs/dbraw/zinc/19/65/58/1061196558.db2.gz FHWPMRZIMXROQB-IFMALSPDSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC001473501646 1061196571 /nfs/dbraw/zinc/19/65/71/1061196571.db2.gz FHWPMRZIMXROQB-IFMALSPDSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC001473501646 1061196585 /nfs/dbraw/zinc/19/65/85/1061196585.db2.gz FHWPMRZIMXROQB-IFMALSPDSA-N 2 1 320.480 4.118 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC001462484420 1061203753 /nfs/dbraw/zinc/20/37/53/1061203753.db2.gz XBEDDEKBVUCDLN-NHCUHLMSSA-N 2 1 324.512 4.377 20 0 DIADMP Cc1cccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001462516740 1061226317 /nfs/dbraw/zinc/22/63/17/1061226317.db2.gz FGJNILWGZBJEAW-WIYYLYMNSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001462516740 1061226336 /nfs/dbraw/zinc/22/63/36/1061226336.db2.gz FGJNILWGZBJEAW-WIYYLYMNSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)cc1 ZINC001462520453 1061228447 /nfs/dbraw/zinc/22/84/47/1061228447.db2.gz WCNXAGSAMVCIDP-NQIIRXRSSA-N 2 1 314.517 4.485 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)cc1 ZINC001462520453 1061228468 /nfs/dbraw/zinc/22/84/68/1061228468.db2.gz WCNXAGSAMVCIDP-NQIIRXRSSA-N 2 1 314.517 4.485 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c1 ZINC001473586383 1061276492 /nfs/dbraw/zinc/27/64/92/1061276492.db2.gz IORARQDVCRYXPG-UHFFFAOYSA-N 2 1 323.484 4.091 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+](C[C@H](C)c2cccc(Cl)c2)CC1 ZINC001462586252 1061279167 /nfs/dbraw/zinc/27/91/67/1061279167.db2.gz PAMBPPBXRBMLMP-INIZCTEOSA-N 2 1 320.908 4.394 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001462627418 1061306904 /nfs/dbraw/zinc/30/69/04/1061306904.db2.gz JSQBUQDJSNOJJL-AZUAARDMSA-N 2 1 312.501 4.380 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001462627418 1061306918 /nfs/dbraw/zinc/30/69/18/1061306918.db2.gz JSQBUQDJSNOJJL-AZUAARDMSA-N 2 1 312.501 4.380 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001462661020 1061322032 /nfs/dbraw/zinc/32/20/32/1061322032.db2.gz AETKYVARLRGETA-UHFFFAOYSA-N 2 1 308.897 4.309 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001462661020 1061322046 /nfs/dbraw/zinc/32/20/46/1061322046.db2.gz AETKYVARLRGETA-UHFFFAOYSA-N 2 1 308.897 4.309 20 0 DIADMP CCc1ccccc1C[N@@H+](CC)Cc1ccc(C[NH+](C)C)cc1 ZINC001473691434 1061350314 /nfs/dbraw/zinc/35/03/14/1061350314.db2.gz UVHHUWWTSTZACE-UHFFFAOYSA-N 2 1 310.485 4.333 20 0 DIADMP C[C@@H]1CC(F)(F)CC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001473695291 1061355656 /nfs/dbraw/zinc/35/56/56/1061355656.db2.gz KMBAOQFOLBMMAZ-MRXNPFEDSA-N 2 1 322.443 4.292 20 0 DIADMP c1cc(C[N@@H+]2C[C@@H]3CC=CC[C@@H]3C2)cc(C[NH+]2CCCCC2)c1 ZINC001473724446 1061369997 /nfs/dbraw/zinc/36/99/97/1061369997.db2.gz UBRLTTKMILCAJI-OYRHEFFESA-N 2 1 310.485 4.071 20 0 DIADMP CC(C)C[C@H](C)[NH+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001473719605 1061372905 /nfs/dbraw/zinc/37/29/05/1061372905.db2.gz YCYYNTDQPOHCDO-CEWLAPEOSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[N@H+](CCCC(C)C)CCn2cc[nH+]c2C)o1 ZINC001473798122 1061411906 /nfs/dbraw/zinc/41/19/06/1061411906.db2.gz VVYRICFOWBHMON-UHFFFAOYSA-N 2 1 303.450 4.031 20 0 DIADMP Cc1ccc(C[N@@H+](CCCC(C)C)CCn2cc[nH+]c2C)o1 ZINC001473798122 1061411907 /nfs/dbraw/zinc/41/19/07/1061411907.db2.gz VVYRICFOWBHMON-UHFFFAOYSA-N 2 1 303.450 4.031 20 0 DIADMP C[N@H+]1C[C@]23C[NH+](CC4CCC(C)(C)CC4)C[C@@]2(C1)CCCC3 ZINC001473901039 1061452262 /nfs/dbraw/zinc/45/22/62/1061452262.db2.gz IVNRNWJCLKSBLV-BGYRXZFFSA-N 2 1 304.522 4.011 20 0 DIADMP C[NH+]1C[C@]23C[N@H+](CC4CCC(C)(C)CC4)C[C@@]2(C1)CCCC3 ZINC001473901039 1061452270 /nfs/dbraw/zinc/45/22/70/1061452270.db2.gz IVNRNWJCLKSBLV-BGYRXZFFSA-N 2 1 304.522 4.011 20 0 DIADMP C[NH+]1C[C@]23C[N@@H+](CC4CCC(C)(C)CC4)C[C@@]2(C1)CCCC3 ZINC001473901039 1061452272 /nfs/dbraw/zinc/45/22/72/1061452272.db2.gz IVNRNWJCLKSBLV-BGYRXZFFSA-N 2 1 304.522 4.011 20 0 DIADMP Cc1cc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)ccc1Cl ZINC001473910433 1061458201 /nfs/dbraw/zinc/45/82/01/1061458201.db2.gz NSFYPRQKIJZHFU-UHFFFAOYSA-N 2 1 308.897 4.393 20 0 DIADMP Cc1cc(C[NH2+]CCC[N@H+](C)C2CCCCC2)ccc1Cl ZINC001473910433 1061458209 /nfs/dbraw/zinc/45/82/09/1061458209.db2.gz NSFYPRQKIJZHFU-UHFFFAOYSA-N 2 1 308.897 4.393 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC1(C)C ZINC001473921465 1061469988 /nfs/dbraw/zinc/46/99/88/1061469988.db2.gz MRCDLQQFXVQKDS-LEWJYISDSA-N 2 1 322.496 4.433 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)cc1F ZINC001473954839 1061496405 /nfs/dbraw/zinc/49/64/05/1061496405.db2.gz IBLVQNKGWGITHC-HALDLXJZSA-N 2 1 315.436 4.234 20 0 DIADMP CCC[C@H](C[NH2+]CC[N@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962530 1061504838 /nfs/dbraw/zinc/50/48/38/1061504838.db2.gz LBRLHCIEJJZSKO-LJQANCHMSA-N 2 1 302.506 4.424 20 0 DIADMP CCC[C@H](C[NH2+]CC[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962530 1061504852 /nfs/dbraw/zinc/50/48/52/1061504852.db2.gz LBRLHCIEJJZSKO-LJQANCHMSA-N 2 1 302.506 4.424 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC12CCC(CC1)C2 ZINC001474096129 1061641463 /nfs/dbraw/zinc/64/14/63/1061641463.db2.gz AMIVOEGIPWJAPO-UHFFFAOYSA-N 2 1 314.517 4.315 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)C1(c2ccccc2)CCCC1 ZINC001474116444 1061666828 /nfs/dbraw/zinc/66/68/28/1061666828.db2.gz UJOPPKMMLOEJJJ-PKOBYXMFSA-N 2 1 314.517 4.349 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cccc(Oc3ccccc3)c2)C1 ZINC001474174063 1061718640 /nfs/dbraw/zinc/71/86/40/1061718640.db2.gz KGOZTJGHOGPJGV-SFHVURJKSA-N 2 1 324.468 4.300 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2cccc(C)c2C)CC1 ZINC001474317473 1061893194 /nfs/dbraw/zinc/89/31/94/1061893194.db2.gz GVRKJJADQBNYBS-HXUWFJFHSA-N 2 1 300.490 4.172 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@H]32)cc1 ZINC001474320312 1061896548 /nfs/dbraw/zinc/89/65/48/1061896548.db2.gz CFMDCTZEHWNPPJ-KSEOMHKRSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]32)cc1 ZINC001474320312 1061896564 /nfs/dbraw/zinc/89/65/64/1061896564.db2.gz CFMDCTZEHWNPPJ-KSEOMHKRSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]32)cc1 ZINC001474320312 1061896578 /nfs/dbraw/zinc/89/65/78/1061896578.db2.gz CFMDCTZEHWNPPJ-KSEOMHKRSA-N 2 1 324.512 4.329 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](CC)CC1CC[NH+](CC)CC1 ZINC001474344471 1061948676 /nfs/dbraw/zinc/94/86/76/1061948676.db2.gz LVGJGRAZOIKGRQ-FQEVSTJZSA-N 2 1 302.506 4.062 20 0 DIADMP c1ccc(C[N@@H+]2C[C@@H]3C[NH+](C4CCC5(CC5)CC4)CC[C@@H]3C2)cc1 ZINC001254449370 1062109288 /nfs/dbraw/zinc/10/92/88/1062109288.db2.gz MMWYWRYJKWQUBS-WOJBJXKFSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3C[N@H+](C4CCC5(CC5)CC4)CC[C@@H]3C2)cc1 ZINC001254449370 1062109302 /nfs/dbraw/zinc/10/93/02/1062109302.db2.gz MMWYWRYJKWQUBS-WOJBJXKFSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3C[N@@H+](C4CCC5(CC5)CC4)CC[C@@H]3C2)cc1 ZINC001254449370 1062109312 /nfs/dbraw/zinc/10/93/12/1062109312.db2.gz MMWYWRYJKWQUBS-WOJBJXKFSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254449367 1062110560 /nfs/dbraw/zinc/11/05/60/1062110560.db2.gz MMWYWRYJKWQUBS-PMACEKPBSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@@H+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254449367 1062110563 /nfs/dbraw/zinc/11/05/63/1062110563.db2.gz MMWYWRYJKWQUBS-PMACEKPBSA-N 2 1 324.512 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@H+](C4CCC5(CC5)CC4)C[C@@H]3C2)cc1 ZINC001254449367 1062110567 /nfs/dbraw/zinc/11/05/67/1062110567.db2.gz MMWYWRYJKWQUBS-PMACEKPBSA-N 2 1 324.512 4.163 20 0 DIADMP CC[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC001474436104 1062112487 /nfs/dbraw/zinc/11/24/87/1062112487.db2.gz WCCKPJKMGVDPNZ-NSHGMRRFSA-N 2 1 314.517 4.423 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001474439998 1062117066 /nfs/dbraw/zinc/11/70/66/1062117066.db2.gz DAYMVCAGMHGVIJ-IEBWSBKVSA-N 2 1 300.490 4.380 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001474439998 1062117081 /nfs/dbraw/zinc/11/70/81/1062117081.db2.gz DAYMVCAGMHGVIJ-IEBWSBKVSA-N 2 1 300.490 4.380 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001474451798 1062129014 /nfs/dbraw/zinc/12/90/14/1062129014.db2.gz LDVAUYMZTZOOSJ-QUCCMNQESA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001474451798 1062129020 /nfs/dbraw/zinc/12/90/20/1062129020.db2.gz LDVAUYMZTZOOSJ-QUCCMNQESA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CCC[C@H](NCc2ccccc2Oc2ccccc2)CC1 ZINC001254500529 1062141838 /nfs/dbraw/zinc/14/18/38/1062141838.db2.gz JHIQZFWWFKMIGB-SFHVURJKSA-N 2 1 310.441 4.053 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC1 ZINC001254500529 1062141856 /nfs/dbraw/zinc/14/18/56/1062141856.db2.gz JHIQZFWWFKMIGB-SFHVURJKSA-N 2 1 310.441 4.053 20 0 DIADMP C([C@@H]1CC[C@H]2C[C@H]2C1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001459442004 1062143736 /nfs/dbraw/zinc/14/37/36/1062143736.db2.gz ZFMMVHCQCVLSMO-FUMNGEBKSA-N 2 1 304.522 4.011 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C2(c3ccccc3)CCCCCC2)CC1 ZINC001254501358 1062146053 /nfs/dbraw/zinc/14/60/53/1062146053.db2.gz SZYUEQBIFCAEFA-IBGZPJMESA-N 2 1 300.490 4.310 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C(C)(C)c2ccc(C(F)(F)F)cc2)CC1 ZINC001254501299 1062146372 /nfs/dbraw/zinc/14/63/72/1062146372.db2.gz RJVKLMKELLBIAL-HNNXBMFYSA-N 2 1 314.395 4.014 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CCC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC001254510125 1062150471 /nfs/dbraw/zinc/15/04/71/1062150471.db2.gz RXPGPUMDVMCHOW-JKSUJKDBSA-N 2 1 314.395 4.230 20 0 DIADMP C[N@@H+]1CCC[C@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC1 ZINC001254506233 1062150619 /nfs/dbraw/zinc/15/06/19/1062150619.db2.gz PSTDFTYTEVEBKX-ZDUSSCGKSA-N 2 1 315.288 4.302 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC1 ZINC001254506233 1062150633 /nfs/dbraw/zinc/15/06/33/1062150633.db2.gz PSTDFTYTEVEBKX-ZDUSSCGKSA-N 2 1 315.288 4.302 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)CC1 ZINC001254505911 1062150733 /nfs/dbraw/zinc/15/07/33/1062150733.db2.gz LOQLLYOXATUZDI-OAHLLOKOSA-N 2 1 314.395 4.014 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+]2CCC(Cc3cccc(Cl)c3)CC2)CC1 ZINC001254517599 1062157404 /nfs/dbraw/zinc/15/74/04/1062157404.db2.gz WSEKCVFRXCZDJX-LJQANCHMSA-N 2 1 320.908 4.079 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CCC[NH+](C)CC1 ZINC001254529146 1062161557 /nfs/dbraw/zinc/16/15/57/1062161557.db2.gz KILIHRSFDJFWJB-WBVHZDCISA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@@H]1CCC[N@H+](C)CC1 ZINC001254529146 1062161571 /nfs/dbraw/zinc/16/15/71/1062161571.db2.gz KILIHRSFDJFWJB-WBVHZDCISA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@@H]1CCC[N@@H+](C)CC1 ZINC001254529146 1062161583 /nfs/dbraw/zinc/16/15/83/1062161583.db2.gz KILIHRSFDJFWJB-WBVHZDCISA-N 2 1 304.503 4.030 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)CC1 ZINC001474503678 1062183981 /nfs/dbraw/zinc/18/39/81/1062183981.db2.gz NCNHBZSPOKHMCI-AFMYVXGZSA-N 2 1 306.538 4.113 20 0 DIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC001459527057 1062185341 /nfs/dbraw/zinc/18/53/41/1062185341.db2.gz RFBKYNCQWFWMFL-RTWAWAEBSA-N 2 1 312.501 4.437 20 0 DIADMP C[NH+]1CCC([N@@H+](Cc2ccccc2)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001474504661 1062187219 /nfs/dbraw/zinc/18/72/19/1062187219.db2.gz IMCZMRBZQJAYSE-AQNXPRMDSA-N 2 1 312.501 4.019 20 0 DIADMP C[NH+]1CCC([N@H+](Cc2ccccc2)C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1 ZINC001474504661 1062187228 /nfs/dbraw/zinc/18/72/28/1062187228.db2.gz IMCZMRBZQJAYSE-AQNXPRMDSA-N 2 1 312.501 4.019 20 0 DIADMP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC001459541078 1062197100 /nfs/dbraw/zinc/19/71/00/1062197100.db2.gz ZIZRYDAPLKYJFZ-HXUWFJFHSA-N 2 1 314.517 4.434 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC001459541078 1062197106 /nfs/dbraw/zinc/19/71/06/1062197106.db2.gz ZIZRYDAPLKYJFZ-HXUWFJFHSA-N 2 1 314.517 4.434 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001459552412 1062205002 /nfs/dbraw/zinc/20/50/02/1062205002.db2.gz VKELHOGYPCUCNB-HXUWFJFHSA-N 2 1 300.490 4.293 20 0 DIADMP Cc1cccc([C@@H]2CCCC[NH+]2CC[C@H]2CCC[N@@H+]2C)c1C ZINC001459565683 1062213661 /nfs/dbraw/zinc/21/36/61/1062213661.db2.gz RYNORGDGACTJSQ-QUCCMNQESA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@@H]2CCCC[N@H+]2CC[C@H]2CCC[NH+]2C)c1C ZINC001459565683 1062213679 /nfs/dbraw/zinc/21/36/79/1062213679.db2.gz RYNORGDGACTJSQ-QUCCMNQESA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@@H]2CCCC[N@@H+]2CC[C@H]2CCC[NH+]2C)c1C ZINC001459565683 1062213695 /nfs/dbraw/zinc/21/36/95/1062213695.db2.gz RYNORGDGACTJSQ-QUCCMNQESA-N 2 1 300.490 4.315 20 0 DIADMP CC[C@@H](CCC(F)(F)F)[NH2+][C@@H](CC(C)C)C[NH+]1CCCC1 ZINC001474536842 1062226483 /nfs/dbraw/zinc/22/64/83/1062226483.db2.gz FWJRMRBGTSRNMT-GJZGRUSLSA-N 2 1 308.432 4.208 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474559913 1062262250 /nfs/dbraw/zinc/26/22/50/1062262250.db2.gz FUMRCGFUNCSZKI-UONOGXRCSA-N 2 1 316.411 4.127 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474559913 1062262258 /nfs/dbraw/zinc/26/22/58/1062262258.db2.gz FUMRCGFUNCSZKI-UONOGXRCSA-N 2 1 316.411 4.127 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@H]3C[C@@H]4CCC[C@@H]43)C2)cc1 ZINC001474565020 1062267367 /nfs/dbraw/zinc/26/73/67/1062267367.db2.gz PHTJEFQBNCLJPU-ANULTFPQSA-N 2 1 312.501 4.067 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCC[C@@H]2C2CCCCC2)C1 ZINC001474573470 1062283288 /nfs/dbraw/zinc/28/32/88/1062283288.db2.gz ZPXLVVPHCDSWBC-MISYRCLQSA-N 2 1 306.538 4.447 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCSc2ccc(C)c(C)c2)[C@@H](C)C1 ZINC001459665709 1062284467 /nfs/dbraw/zinc/28/44/67/1062284467.db2.gz FIZDRKBSOGZZDV-PKOBYXMFSA-N 2 1 320.546 4.058 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC001459669989 1062287333 /nfs/dbraw/zinc/28/73/33/1062287333.db2.gz QGAIFHQPCHDXMT-AVRDEDQJSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC001459669989 1062287358 /nfs/dbraw/zinc/28/73/58/1062287358.db2.gz QGAIFHQPCHDXMT-AVRDEDQJSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC001459669989 1062287363 /nfs/dbraw/zinc/28/73/63/1062287363.db2.gz QGAIFHQPCHDXMT-AVRDEDQJSA-N 2 1 324.512 4.435 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2cccc3ccccc32)[C@H](C)C1 ZINC001459669992 1062289019 /nfs/dbraw/zinc/28/90/19/1062289019.db2.gz QGAIFHQPCHDXMT-GCJKJVERSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2cccc3ccccc32)[C@H](C)C1 ZINC001459669992 1062289041 /nfs/dbraw/zinc/28/90/41/1062289041.db2.gz QGAIFHQPCHDXMT-GCJKJVERSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2cccc3ccccc32)[C@H](C)C1 ZINC001459669992 1062289063 /nfs/dbraw/zinc/28/90/63/1062289063.db2.gz QGAIFHQPCHDXMT-GCJKJVERSA-N 2 1 324.512 4.435 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2cccc3ccccc32)[C@H](C)C1 ZINC001459669997 1062291670 /nfs/dbraw/zinc/29/16/70/1062291670.db2.gz QGAIFHQPCHDXMT-XMSQKQJNSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2cccc3ccccc32)[C@H](C)C1 ZINC001459669997 1062291688 /nfs/dbraw/zinc/29/16/88/1062291688.db2.gz QGAIFHQPCHDXMT-XMSQKQJNSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2cccc3ccccc32)[C@H](C)C1 ZINC001459669997 1062291716 /nfs/dbraw/zinc/29/17/16/1062291716.db2.gz QGAIFHQPCHDXMT-XMSQKQJNSA-N 2 1 324.512 4.435 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2Cc3ccccc3C2)C2CCCCC2)CC1 ZINC001255016974 1062299861 /nfs/dbraw/zinc/29/98/61/1062299861.db2.gz ZPUPMLUZFAFSEQ-KESTWPANSA-N 2 1 312.501 4.058 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001255099712 1062313321 /nfs/dbraw/zinc/31/33/21/1062313321.db2.gz RQZHWLDTCKDNRQ-UZLBHIALSA-N 2 1 319.452 4.108 20 0 DIADMP C[C@@H]([NH3+])c1cn([C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001255109307 1062316898 /nfs/dbraw/zinc/31/68/98/1062316898.db2.gz QMPLAOITDBNEKD-AEFFLSMTSA-N 2 1 319.452 4.108 20 0 DIADMP CC1([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCCC1 ZINC001255123143 1062321033 /nfs/dbraw/zinc/32/10/33/1062321033.db2.gz YQLKLBFKSFJXCO-ACDBMABISA-N 2 1 312.501 4.494 20 0 DIADMP CCCCC[N@@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136283 1062324909 /nfs/dbraw/zinc/32/49/09/1062324909.db2.gz JLMGPWGADJWJMU-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCCC[NH+](C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136283 1062324930 /nfs/dbraw/zinc/32/49/30/1062324930.db2.gz JLMGPWGADJWJMU-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCCC[NH+](C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136283 1062324953 /nfs/dbraw/zinc/32/49/53/1062324953.db2.gz JLMGPWGADJWJMU-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136147 1062329356 /nfs/dbraw/zinc/32/93/56/1062329356.db2.gz HKEFGAARJJDOSU-LPOYBJAFSA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136147 1062329380 /nfs/dbraw/zinc/32/93/80/1062329380.db2.gz HKEFGAARJJDOSU-LPOYBJAFSA-N 2 1 312.501 4.445 20 0 DIADMP CCCCC[N@@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136282 1062329975 /nfs/dbraw/zinc/32/99/75/1062329975.db2.gz JLMGPWGADJWJMU-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCCC[NH+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136282 1062329996 /nfs/dbraw/zinc/32/99/96/1062329996.db2.gz JLMGPWGADJWJMU-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCCCC[NH+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136282 1062330009 /nfs/dbraw/zinc/33/00/09/1062330009.db2.gz JLMGPWGADJWJMU-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2CCCC24CCC4)C3)cc1 ZINC001255134827 1062332253 /nfs/dbraw/zinc/33/22/53/1062332253.db2.gz CZFOBHGPUCRIBJ-MXEMCNAFSA-N 2 1 324.512 4.494 20 0 DIADMP CC[N@@H+](CCC[NH2+]C1CCC2(CSC2)CC1)C1CCCCC1 ZINC001474614845 1062333322 /nfs/dbraw/zinc/33/33/22/1062333322.db2.gz DMLGNNKDHZTMAN-UHFFFAOYSA-N 2 1 324.578 4.297 20 0 DIADMP C[C@H]1CCCCC[N@@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145122 1062333692 /nfs/dbraw/zinc/33/36/92/1062333692.db2.gz ZDTKULIPKRFBRK-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145122 1062333713 /nfs/dbraw/zinc/33/37/13/1062333713.db2.gz ZDTKULIPKRFBRK-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145122 1062333736 /nfs/dbraw/zinc/33/37/36/1062333736.db2.gz ZDTKULIPKRFBRK-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145122 1062333759 /nfs/dbraw/zinc/33/37/59/1062333759.db2.gz ZDTKULIPKRFBRK-MJUUVYJYSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474616304 1062333995 /nfs/dbraw/zinc/33/39/95/1062333995.db2.gz NJOQOKDYMWGONP-RSPOEFSDSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142600 1062334223 /nfs/dbraw/zinc/33/42/23/1062334223.db2.gz DVNNKXSKKWWTRD-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142600 1062334246 /nfs/dbraw/zinc/33/42/46/1062334246.db2.gz DVNNKXSKKWWTRD-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142600 1062334269 /nfs/dbraw/zinc/33/42/69/1062334269.db2.gz DVNNKXSKKWWTRD-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142600 1062334290 /nfs/dbraw/zinc/33/42/90/1062334290.db2.gz DVNNKXSKKWWTRD-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145336 1062334628 /nfs/dbraw/zinc/33/46/28/1062334628.db2.gz AXDTXEZYJOFRPM-WOZUAGRISA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145336 1062334655 /nfs/dbraw/zinc/33/46/55/1062334655.db2.gz AXDTXEZYJOFRPM-WOZUAGRISA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145336 1062334680 /nfs/dbraw/zinc/33/46/80/1062334680.db2.gz AXDTXEZYJOFRPM-WOZUAGRISA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145336 1062334706 /nfs/dbraw/zinc/33/47/06/1062334706.db2.gz AXDTXEZYJOFRPM-WOZUAGRISA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCCCC[N@@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145121 1062335159 /nfs/dbraw/zinc/33/51/59/1062335159.db2.gz ZDTKULIPKRFBRK-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145121 1062335181 /nfs/dbraw/zinc/33/51/81/1062335181.db2.gz ZDTKULIPKRFBRK-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145121 1062335207 /nfs/dbraw/zinc/33/52/07/1062335207.db2.gz ZDTKULIPKRFBRK-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145121 1062335231 /nfs/dbraw/zinc/33/52/31/1062335231.db2.gz ZDTKULIPKRFBRK-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCCCCCC2)C3)cc1 ZINC001255145942 1062336656 /nfs/dbraw/zinc/33/66/56/1062336656.db2.gz XVXWUYHZEXJIOW-WKCHPHFGSA-N 2 1 312.501 4.448 20 0 DIADMP C[N@@H+](C[C@H]1CC1(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146262 1062337000 /nfs/dbraw/zinc/33/70/00/1062337000.db2.gz FEKVYBGWKGRFQI-ZRNYENFQSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146262 1062337022 /nfs/dbraw/zinc/33/70/22/1062337022.db2.gz FEKVYBGWKGRFQI-ZRNYENFQSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146262 1062337040 /nfs/dbraw/zinc/33/70/40/1062337040.db2.gz FEKVYBGWKGRFQI-ZRNYENFQSA-N 2 1 312.501 4.160 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC4(CC4)CC2)C3)cc1 ZINC001255143053 1062339274 /nfs/dbraw/zinc/33/92/74/1062339274.db2.gz VEVLJKMQKPPSHY-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255146430 1062340613 /nfs/dbraw/zinc/34/06/13/1062340613.db2.gz GPFKHWBXLKYUEM-JNVSZQSJSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255146430 1062340633 /nfs/dbraw/zinc/34/06/33/1062340633.db2.gz GPFKHWBXLKYUEM-JNVSZQSJSA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146430 1062340642 /nfs/dbraw/zinc/34/06/42/1062340642.db2.gz GPFKHWBXLKYUEM-JNVSZQSJSA-N 2 1 312.501 4.160 20 0 DIADMP CC(C)c1cccc(C[N@@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)c1 ZINC001474646496 1062370656 /nfs/dbraw/zinc/37/06/56/1062370656.db2.gz FCSDZBFJXCISHA-XLIONFOSSA-N 2 1 302.506 4.362 20 0 DIADMP CC1(C)CCC([N@@H+]2C[C@H]3CN(Cc4cccs4)C[C@H]3C2)CC1 ZINC001255302763 1062384239 /nfs/dbraw/zinc/38/42/39/1062384239.db2.gz JLUGYPPEFROANR-IYBDPMFKSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC([N@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001255302763 1062384263 /nfs/dbraw/zinc/38/42/63/1062384263.db2.gz JLUGYPPEFROANR-IYBDPMFKSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC([N@@H+]2C[C@H]3C[NH+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001255302763 1062384283 /nfs/dbraw/zinc/38/42/83/1062384283.db2.gz JLUGYPPEFROANR-IYBDPMFKSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC([NH+]2C[C@H]3C[N@@H+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001255302763 1062384305 /nfs/dbraw/zinc/38/43/05/1062384305.db2.gz JLUGYPPEFROANR-IYBDPMFKSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC([NH+]2C[C@H]3C[N@H+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001255302763 1062384328 /nfs/dbraw/zinc/38/43/28/1062384328.db2.gz JLUGYPPEFROANR-IYBDPMFKSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC(C)(C)CC1 ZINC001255308549 1062387866 /nfs/dbraw/zinc/38/78/66/1062387866.db2.gz TZDHVWZABAEOGN-IBGZPJMESA-N 2 1 314.517 4.409 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001474658256 1062389920 /nfs/dbraw/zinc/38/99/20/1062389920.db2.gz HRZMREVIAHGMHK-UHFFFAOYSA-N 2 1 312.457 4.192 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1cccc(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255318613 1062396521 /nfs/dbraw/zinc/39/65/21/1062396521.db2.gz AKAYGIOVJNCANG-BHIYHBOVSA-N 2 1 318.505 4.346 20 0 DIADMP CC(C)(C)[C@@]1(C[NH+]2CC(C)(C)C2)CC[N@@H+](Cc2ccccc2)C1 ZINC001474669083 1062400389 /nfs/dbraw/zinc/40/03/89/1062400389.db2.gz WDKBXTILKIVONV-NRFANRHFSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001474670579 1062401378 /nfs/dbraw/zinc/40/13/78/1062401378.db2.gz HLUUJHAAYUNQLR-WIYYLYMNSA-N 2 1 314.517 4.394 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001474670579 1062401388 /nfs/dbraw/zinc/40/13/88/1062401388.db2.gz HLUUJHAAYUNQLR-WIYYLYMNSA-N 2 1 314.517 4.394 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccc1 ZINC001255380489 1062421388 /nfs/dbraw/zinc/42/13/88/1062421388.db2.gz KQCSBKAMQKBYOW-SIKLNZKXSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)s1 ZINC001255381528 1062421773 /nfs/dbraw/zinc/42/17/73/1062421773.db2.gz PKHYAGZVZXUEMF-SFHVURJKSA-N 2 1 314.498 4.201 20 0 DIADMP CC1CCC([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255378956 1062422686 /nfs/dbraw/zinc/42/26/86/1062422686.db2.gz QGKHYGQNVDNMCX-SYYJFZTOSA-N 2 1 300.490 4.209 20 0 DIADMP FC1(F)CC[C@@H](C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383073 1062422796 /nfs/dbraw/zinc/42/27/96/1062422796.db2.gz ZOGZGIYQSJNMBP-MSOLQXFVSA-N 2 1 322.443 4.066 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+]C3(c4ccccc4)CC3)CC2)cc1 ZINC001255382518 1062423583 /nfs/dbraw/zinc/42/35/83/1062423583.db2.gz CVHUZVFICXDNSE-NRFANRHFSA-N 2 1 320.480 4.320 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+]C3(c4ccccc4)CC3)CC2)cc1 ZINC001255382520 1062424094 /nfs/dbraw/zinc/42/40/94/1062424094.db2.gz CVHUZVFICXDNSE-OAQYLSRUSA-N 2 1 320.480 4.320 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC001255385517 1062427592 /nfs/dbraw/zinc/42/75/92/1062427592.db2.gz IFOOQAYJNADVCQ-FSSWDIPSSA-N 2 1 320.480 4.187 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)C1CCCC1 ZINC001255386836 1062428159 /nfs/dbraw/zinc/42/81/59/1062428159.db2.gz CARKRUOPPRGFOO-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H](C)C[C@@H](C)[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255392557 1062428468 /nfs/dbraw/zinc/42/84/68/1062428468.db2.gz GPSGMLAPJDYFMO-NLWGTHIKSA-N 2 1 302.506 4.455 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)n1 ZINC001255393368 1062429762 /nfs/dbraw/zinc/42/97/62/1062429762.db2.gz NLOFKQYTVWXDEC-QUCCMNQESA-N 2 1 323.484 4.095 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)n1 ZINC001255393368 1062429765 /nfs/dbraw/zinc/42/97/65/1062429765.db2.gz NLOFKQYTVWXDEC-QUCCMNQESA-N 2 1 323.484 4.095 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH2+]CC3(CC4CC4)CC3)CC2)cc1 ZINC001255392220 1062429788 /nfs/dbraw/zinc/42/97/88/1062429788.db2.gz HFYNOIKMXKJAHW-FQEVSTJZSA-N 2 1 312.501 4.211 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255393254 1062429833 /nfs/dbraw/zinc/42/98/33/1062429833.db2.gz MWAHSUZCQXWWSZ-NRFANRHFSA-N 2 1 322.496 4.448 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400042 1062433825 /nfs/dbraw/zinc/43/38/25/1062433825.db2.gz DCPSMGCIIXEOBV-HKBOAZHASA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400042 1062433836 /nfs/dbraw/zinc/43/38/36/1062433836.db2.gz DCPSMGCIIXEOBV-HKBOAZHASA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400042 1062433846 /nfs/dbraw/zinc/43/38/46/1062433846.db2.gz DCPSMGCIIXEOBV-HKBOAZHASA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC001255400042 1062433853 /nfs/dbraw/zinc/43/38/53/1062433853.db2.gz DCPSMGCIIXEOBV-HKBOAZHASA-N 2 1 312.501 4.163 20 0 DIADMP C[N@@H+](CCc1ccccc1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255396748 1062433894 /nfs/dbraw/zinc/43/38/94/1062433894.db2.gz BMOSHFOKBQXUFT-QFIPXVFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+](CCc1ccccc1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255396748 1062433901 /nfs/dbraw/zinc/43/39/01/1062433901.db2.gz BMOSHFOKBQXUFT-QFIPXVFZSA-N 2 1 322.496 4.216 20 0 DIADMP C[NH+](CCc1ccccc1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255396748 1062433912 /nfs/dbraw/zinc/43/39/12/1062433912.db2.gz BMOSHFOKBQXUFT-QFIPXVFZSA-N 2 1 322.496 4.216 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC001255408240 1062437975 /nfs/dbraw/zinc/43/79/75/1062437975.db2.gz IUISIWQDXBJHMV-FCHUYYIVSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC001255408240 1062437990 /nfs/dbraw/zinc/43/79/90/1062437990.db2.gz IUISIWQDXBJHMV-FCHUYYIVSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CC[C@@H]3c3ccccc3)CC2)cc1 ZINC001255408240 1062438004 /nfs/dbraw/zinc/43/80/04/1062438004.db2.gz IUISIWQDXBJHMV-FCHUYYIVSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3C[C@@H]4CCCC[C@H]4C3)CC2)cc1 ZINC001255409490 1062438450 /nfs/dbraw/zinc/43/84/50/1062438450.db2.gz ZCIHBHQWZUSSFT-PCCBWWKXSA-N 2 1 312.501 4.163 20 0 DIADMP CC[NH+](CC)C1CC[NH+](CCCCCOc2ccccc2)CC1 ZINC001255466923 1062455291 /nfs/dbraw/zinc/45/52/91/1062455291.db2.gz GRMVVKQUIPDINF-UHFFFAOYSA-N 2 1 318.505 4.042 20 0 DIADMP Cc1cccnc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC001474747387 1062463046 /nfs/dbraw/zinc/46/30/46/1062463046.db2.gz BQMQKTDZVOKMOT-IEZWGBDMSA-N 2 1 315.505 4.084 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)C2CCC(C(F)(F)F)CC2)CC1 ZINC001255510841 1062467288 /nfs/dbraw/zinc/46/72/88/1062467288.db2.gz QZWSLDXAGBLRKU-XCXNNYRKSA-N 2 1 318.427 4.232 20 0 DIADMP CC/C=C/CC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001459892581 1062477784 /nfs/dbraw/zinc/47/77/84/1062477784.db2.gz QEZWVTIJTBJTSX-ONEGZZNKSA-N 2 1 312.501 4.331 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001255669698 1062510055 /nfs/dbraw/zinc/51/00/55/1062510055.db2.gz JZASRAQQGVMMMB-IPQPSQTFSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001255669698 1062510073 /nfs/dbraw/zinc/51/00/73/1062510073.db2.gz JZASRAQQGVMMMB-IPQPSQTFSA-N 2 1 304.453 4.128 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001255670104 1062511198 /nfs/dbraw/zinc/51/11/98/1062511198.db2.gz OROMZSNEXHWZRT-IYHXRUFHSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255701292 1062525298 /nfs/dbraw/zinc/52/52/98/1062525298.db2.gz UHUUZATWMHFEPB-KBUPBQIOSA-N 2 1 306.416 4.088 20 0 DIADMP FC(F)(F)[C@H]1CCC[C@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001255710146 1062532908 /nfs/dbraw/zinc/53/29/08/1062532908.db2.gz SZZFNQBLEIKZST-HOCLYGCPSA-N 2 1 318.427 4.058 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCCC[C@H](CCC[NH3+])C2)cc1 ZINC001255759692 1062582266 /nfs/dbraw/zinc/58/22/66/1062582266.db2.gz AWUYHLOTKDFGQM-QZTJIDSGSA-N 2 1 320.546 4.317 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCCC[C@@H](CCC[NH3+])C2)cc1 ZINC001255759693 1062583910 /nfs/dbraw/zinc/58/39/10/1062583910.db2.gz AWUYHLOTKDFGQM-ROUUACIJSA-N 2 1 320.546 4.317 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255783998 1062605103 /nfs/dbraw/zinc/60/51/03/1062605103.db2.gz SALOENBIAZQJHI-YFVAEKQCSA-N 2 1 314.517 4.441 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255861900 1062638765 /nfs/dbraw/zinc/63/87/65/1062638765.db2.gz IQPOMRCRPIYYPE-XFQXTVEOSA-N 2 1 318.480 4.271 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC001460111003 1062642965 /nfs/dbraw/zinc/64/29/65/1062642965.db2.gz JMBIBXBHGQUBTC-QGZVFWFLSA-N 2 1 312.860 4.252 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(F)cc(C(F)(F)F)c1 ZINC001255944768 1062664727 /nfs/dbraw/zinc/66/47/27/1062664727.db2.gz ZGBVLPZDDXGHHN-LBPRGKRZSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001255944925 1062666093 /nfs/dbraw/zinc/66/60/93/1062666093.db2.gz IAMAHZYZEVXECI-LBPRGKRZSA-N 2 1 303.277 4.203 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](CC1CC1)c1ccccc1F ZINC001255952650 1062670337 /nfs/dbraw/zinc/67/03/37/1062670337.db2.gz GGNPNTBBGXCYHX-BEFAXECRSA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CCCC[C@H]1c1cccc(OC)c1 ZINC001255964759 1062673679 /nfs/dbraw/zinc/67/36/79/1062673679.db2.gz SOLQCBPAVDGASC-PXNSSMCTSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CCCC[C@H]1c1cccc(OC)c1 ZINC001255964759 1062673687 /nfs/dbraw/zinc/67/36/87/1062673687.db2.gz SOLQCBPAVDGASC-PXNSSMCTSA-N 2 1 318.505 4.343 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2[C@@H](C)CC[NH+](CC)CC)cc1 ZINC001255963372 1062674241 /nfs/dbraw/zinc/67/42/41/1062674241.db2.gz HBYIPSMAZXIIAE-FXAWDEMLSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+](Cc1ccccn1)C1CCCCC1 ZINC001255966458 1062674433 /nfs/dbraw/zinc/67/44/33/1062674433.db2.gz KSBXXVHXMPVXRK-SFHVURJKSA-N 2 1 317.521 4.337 20 0 DIADMP Clc1cccc(C2CC[NH+](C3CC[NH+](C4CC4)CC3)CC2)c1 ZINC001256075239 1062698671 /nfs/dbraw/zinc/69/86/71/1062698671.db2.gz FXEIRTPOZPKRLL-UHFFFAOYSA-N 2 1 318.892 4.146 20 0 DIADMP c1[nH+]cn([C@@H]2CCC[C@H](c3ccccc3)C2)c1C1CC[NH2+]CC1 ZINC001256121268 1062722081 /nfs/dbraw/zinc/72/20/81/1062722081.db2.gz OMMMRUPQWUMHST-RBUKOAKNSA-N 2 1 309.457 4.249 20 0 DIADMP CC1(C)[C@@H](c2ccccc2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC001460257815 1062735429 /nfs/dbraw/zinc/73/54/29/1062735429.db2.gz MPUCKBMYVQNFNJ-LJQANCHMSA-N 2 1 300.490 4.131 20 0 DIADMP CC(C)CC[C@@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001256371612 1062794525 /nfs/dbraw/zinc/79/45/25/1062794525.db2.gz RMVHUHZOPOYTGP-GOSISDBHSA-N 2 1 314.517 4.334 20 0 DIADMP CC(C)CC[C@@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001256371612 1062794540 /nfs/dbraw/zinc/79/45/40/1062794540.db2.gz RMVHUHZOPOYTGP-GOSISDBHSA-N 2 1 314.517 4.334 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(C2CCCCC2)CC1 ZINC001460365437 1062814024 /nfs/dbraw/zinc/81/40/24/1062814024.db2.gz DJRHRHCDWQFTMF-UHFFFAOYSA-N 2 1 303.494 4.264 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC001256520667 1062843078 /nfs/dbraw/zinc/84/30/78/1062843078.db2.gz RZXMJMFELKSXIP-IPJJNNNSSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC001256520667 1062843096 /nfs/dbraw/zinc/84/30/96/1062843096.db2.gz RZXMJMFELKSXIP-IPJJNNNSSA-N 2 1 322.496 4.433 20 0 DIADMP C=Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001256527172 1062844911 /nfs/dbraw/zinc/84/49/11/1062844911.db2.gz QQOREEMCGAWGGK-GCJKJVERSA-N 2 1 320.480 4.472 20 0 DIADMP C=Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001256527172 1062844929 /nfs/dbraw/zinc/84/49/29/1062844929.db2.gz QQOREEMCGAWGGK-GCJKJVERSA-N 2 1 320.480 4.472 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256524007 1062845671 /nfs/dbraw/zinc/84/56/71/1062845671.db2.gz UJABLMIHCPDBHJ-SQQDLWTQSA-N 2 1 320.480 4.343 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256524007 1062845695 /nfs/dbraw/zinc/84/56/95/1062845695.db2.gz UJABLMIHCPDBHJ-SQQDLWTQSA-N 2 1 320.480 4.343 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[N@@H+]1Cc1ccccc1 ZINC001256528215 1062847939 /nfs/dbraw/zinc/84/79/39/1062847939.db2.gz CMHKPILGQYXBEX-ONCXSQPRSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[N@H+]1Cc1ccccc1 ZINC001256528215 1062847963 /nfs/dbraw/zinc/84/79/63/1062847963.db2.gz CMHKPILGQYXBEX-ONCXSQPRSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256527215 1062848892 /nfs/dbraw/zinc/84/88/92/1062848892.db2.gz QSQINPWCTBTCKY-GNBUJSLZSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256527215 1062848918 /nfs/dbraw/zinc/84/89/18/1062848918.db2.gz QSQINPWCTBTCKY-GNBUJSLZSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@@H]3CCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535866 1062854008 /nfs/dbraw/zinc/85/40/08/1062854008.db2.gz BBDIMPUGBYAADB-GFOJFJKKSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CC[C@@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535866 1062854031 /nfs/dbraw/zinc/85/40/31/1062854031.db2.gz BBDIMPUGBYAADB-GFOJFJKKSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CC[C@@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535866 1062854054 /nfs/dbraw/zinc/85/40/54/1062854054.db2.gz BBDIMPUGBYAADB-GFOJFJKKSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536238 1062857798 /nfs/dbraw/zinc/85/77/98/1062857798.db2.gz JTJSVHLEPHIOOL-XLIONFOSSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536238 1062857807 /nfs/dbraw/zinc/85/78/07/1062857807.db2.gz JTJSVHLEPHIOOL-XLIONFOSSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540545 1062859556 /nfs/dbraw/zinc/85/95/56/1062859556.db2.gz IVQSMSCRENJNHO-BVOGOJNSSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256540545 1062859578 /nfs/dbraw/zinc/85/95/78/1062859578.db2.gz IVQSMSCRENJNHO-BVOGOJNSSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256540523 1062860618 /nfs/dbraw/zinc/86/06/18/1062860618.db2.gz IQPPZNZCIJCXHX-SJLPKXTDSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256540523 1062860638 /nfs/dbraw/zinc/86/06/38/1062860638.db2.gz IQPPZNZCIJCXHX-SJLPKXTDSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540523 1062860658 /nfs/dbraw/zinc/86/06/58/1062860658.db2.gz IQPPZNZCIJCXHX-SJLPKXTDSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCCC(F)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256540523 1062860680 /nfs/dbraw/zinc/86/06/80/1062860680.db2.gz IQPPZNZCIJCXHX-SJLPKXTDSA-N 2 1 322.443 4.161 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256539871 1062865388 /nfs/dbraw/zinc/86/53/88/1062865388.db2.gz YNNIAIQDAFXWKQ-UWJYYQICSA-N 2 1 306.453 4.055 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256539871 1062865414 /nfs/dbraw/zinc/86/54/14/1062865414.db2.gz YNNIAIQDAFXWKQ-UWJYYQICSA-N 2 1 306.453 4.055 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256551506 1062866894 /nfs/dbraw/zinc/86/68/94/1062866894.db2.gz SMANHHYRUXJBDA-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256551506 1062866917 /nfs/dbraw/zinc/86/69/17/1062866917.db2.gz SMANHHYRUXJBDA-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@@H](C)C1 ZINC001256556307 1062882665 /nfs/dbraw/zinc/88/26/65/1062882665.db2.gz YRIZPTUVYUFXKR-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@@H](C)C1 ZINC001256556307 1062882676 /nfs/dbraw/zinc/88/26/76/1062882676.db2.gz YRIZPTUVYUFXKR-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[C@@H](C)C1 ZINC001256556307 1062882685 /nfs/dbraw/zinc/88/26/85/1062882685.db2.gz YRIZPTUVYUFXKR-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)[C@@H](C)C1 ZINC001256556307 1062882696 /nfs/dbraw/zinc/88/26/96/1062882696.db2.gz YRIZPTUVYUFXKR-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@H](C)C1 ZINC001256556310 1062885174 /nfs/dbraw/zinc/88/51/74/1062885174.db2.gz YRIZPTUVYUFXKR-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@H](C)C1 ZINC001256556310 1062885193 /nfs/dbraw/zinc/88/51/93/1062885193.db2.gz YRIZPTUVYUFXKR-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[C@H](C)C1 ZINC001256556310 1062885209 /nfs/dbraw/zinc/88/52/09/1062885209.db2.gz YRIZPTUVYUFXKR-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)[C@H](C)C1 ZINC001256556310 1062885223 /nfs/dbraw/zinc/88/52/23/1062885223.db2.gz YRIZPTUVYUFXKR-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256557396 1062886696 /nfs/dbraw/zinc/88/66/96/1062886696.db2.gz IVQSMSCRENJNHO-HZEGPAAWSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256557396 1062886719 /nfs/dbraw/zinc/88/67/19/1062886719.db2.gz IVQSMSCRENJNHO-HZEGPAAWSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256559262 1062887064 /nfs/dbraw/zinc/88/70/64/1062887064.db2.gz KCYRFVIECUPHQN-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256559262 1062887089 /nfs/dbraw/zinc/88/70/89/1062887089.db2.gz KCYRFVIECUPHQN-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559262 1062887114 /nfs/dbraw/zinc/88/71/14/1062887114.db2.gz KCYRFVIECUPHQN-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559262 1062887136 /nfs/dbraw/zinc/88/71/36/1062887136.db2.gz KCYRFVIECUPHQN-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(F)c(F)c1 ZINC001256567033 1062891505 /nfs/dbraw/zinc/89/15/05/1062891505.db2.gz RJBHQCAMIMGNRV-QGZVFWFLSA-N 2 1 310.432 4.268 20 0 DIADMP Cc1cccc([C@H]2CCC[N@H+]2C2CC[NH+](C(C)(C)C)CC2)c1 ZINC001256568914 1062894021 /nfs/dbraw/zinc/89/40/21/1062894021.db2.gz KPXWHYYOXDZLJG-LJQANCHMSA-N 2 1 300.490 4.395 20 0 DIADMP CC(C)Cc1ccc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)cc1 ZINC001460569210 1062916995 /nfs/dbraw/zinc/91/69/95/1062916995.db2.gz YVVQEHNXULNGFD-UHFFFAOYSA-N 2 1 314.517 4.335 20 0 DIADMP CC(C)C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001256617619 1062917493 /nfs/dbraw/zinc/91/74/93/1062917493.db2.gz USCKXQJOSUXHQT-IYHXRUFHSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001256617619 1062917516 /nfs/dbraw/zinc/91/75/16/1062917516.db2.gz USCKXQJOSUXHQT-IYHXRUFHSA-N 2 1 304.453 4.128 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CC[C@H]4CCCC[C@H]4C3)CC2)cc1 ZINC001256611472 1062919716 /nfs/dbraw/zinc/91/97/16/1062919716.db2.gz SSQUASZNDQHUEF-UXHICEINSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256861780 1063019592 /nfs/dbraw/zinc/01/95/92/1063019592.db2.gz BUKXEZHBRSUMGD-HXUWFJFHSA-N 2 1 309.457 4.134 20 0 DIADMP CCC1CCC([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)CC1 ZINC001256871384 1063026345 /nfs/dbraw/zinc/02/63/45/1063026345.db2.gz NUNREGZYDHKLNS-UHFFFAOYSA-N 2 1 304.522 4.296 20 0 DIADMP CCCCCC[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460744959 1063030959 /nfs/dbraw/zinc/03/09/59/1063030959.db2.gz FQUJVHJJKLFNBZ-VQTJNVASSA-N 2 1 300.490 4.021 20 0 DIADMP Fc1c(Cl)cccc1CC[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256904024 1063035759 /nfs/dbraw/zinc/03/57/59/1063035759.db2.gz BITKCUPMIWODOB-OAHLLOKOSA-N 2 1 324.871 4.018 20 0 DIADMP Fc1c(Cl)cccc1CC[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256904024 1063035783 /nfs/dbraw/zinc/03/57/83/1063035783.db2.gz BITKCUPMIWODOB-OAHLLOKOSA-N 2 1 324.871 4.018 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2cccc3cccnc32)CC1 ZINC001460749699 1063036064 /nfs/dbraw/zinc/03/60/64/1063036064.db2.gz RJHBWKCCUJZECT-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)CC1 ZINC001256896898 1063037572 /nfs/dbraw/zinc/03/75/72/1063037572.db2.gz FRCCHYIWCNCSBQ-NRXISQOPSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)CC1 ZINC001256896898 1063037586 /nfs/dbraw/zinc/03/75/86/1063037586.db2.gz FRCCHYIWCNCSBQ-NRXISQOPSA-N 2 1 318.427 4.104 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256905831 1063044647 /nfs/dbraw/zinc/04/46/47/1063044647.db2.gz UQASDKSLZPDIKX-CRAIPNDOSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256905831 1063044667 /nfs/dbraw/zinc/04/46/67/1063044667.db2.gz UQASDKSLZPDIKX-CRAIPNDOSA-N 2 1 320.908 4.268 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CC[C@H]3CCc4ccccc43)CC2)[nH+]c1C ZINC001460790453 1063059347 /nfs/dbraw/zinc/05/93/47/1063059347.db2.gz QCRJMCCDDWPANN-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C(C)C)CC1)c1ccccc1F ZINC001257207929 1063137709 /nfs/dbraw/zinc/13/77/09/1063137709.db2.gz ASKRAIYGRLKCRZ-IBGZPJMESA-N 2 1 306.469 4.375 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](CC2CC2)c2ccccc2F)CC1 ZINC001257211246 1063144145 /nfs/dbraw/zinc/14/41/45/1063144145.db2.gz CPLSKNBPYRKSIZ-LJQANCHMSA-N 2 1 304.453 4.129 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@@H+]2C2CC[NH+](C(C)C)CC2)cc1 ZINC001257215918 1063144656 /nfs/dbraw/zinc/14/46/56/1063144656.db2.gz AOXIINCAQOQPQW-FQEVSTJZSA-N 2 1 316.489 4.095 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2C2CC[NH+](C(C)C)CC2)cc1 ZINC001257215918 1063144671 /nfs/dbraw/zinc/14/46/71/1063144671.db2.gz AOXIINCAQOQPQW-FQEVSTJZSA-N 2 1 316.489 4.095 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@@H+]1C1CC[NH+](C(C)C)CC1 ZINC001257223739 1063147531 /nfs/dbraw/zinc/14/75/31/1063147531.db2.gz AIIONHNYKVBWLD-GOSISDBHSA-N 2 1 318.530 4.418 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C1CC[NH+](C(C)C)CC1 ZINC001257223739 1063147542 /nfs/dbraw/zinc/14/75/42/1063147542.db2.gz AIIONHNYKVBWLD-GOSISDBHSA-N 2 1 318.530 4.418 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2C2CC[NH+](C(C)C)CC2)c1 ZINC001257224360 1063147819 /nfs/dbraw/zinc/14/78/19/1063147819.db2.gz YZKYHOIRFJSJBZ-FQEVSTJZSA-N 2 1 300.490 4.313 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2C2CC[NH+](C(C)C)CC2)c1 ZINC001257224360 1063147828 /nfs/dbraw/zinc/14/78/28/1063147828.db2.gz YZKYHOIRFJSJBZ-FQEVSTJZSA-N 2 1 300.490 4.313 20 0 DIADMP CC(C)[NH+]1CCC([NH+]2CCC(c3ccc(F)cc3F)CC2)CC1 ZINC001257223653 1063148204 /nfs/dbraw/zinc/14/82/04/1063148204.db2.gz UQIMQPJQCRLUPC-UHFFFAOYSA-N 2 1 322.443 4.017 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](CCc3ccccc3)C2)CC1 ZINC001257223651 1063148856 /nfs/dbraw/zinc/14/88/56/1063148856.db2.gz UOHDGTOGLGCICR-FQEVSTJZSA-N 2 1 314.517 4.204 20 0 DIADMP CCC(CC)[NH+]1CCC([NH3+])(c2ccccc2C(F)(F)F)CC1 ZINC001257291894 1063183943 /nfs/dbraw/zinc/18/39/43/1063183943.db2.gz NNZOWANUQXFLAI-UHFFFAOYSA-N 2 1 314.395 4.144 20 0 DIADMP CCC[C@H](C)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001257308939 1063196766 /nfs/dbraw/zinc/19/67/66/1063196766.db2.gz LZHBDZVCOHZYLZ-DQAVMHLFSA-N 2 1 300.490 4.303 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@H](C(C)C)[NH+]1CCCC1 ZINC001461030037 1063200764 /nfs/dbraw/zinc/20/07/64/1063200764.db2.gz LHUKXPQERYIHQD-APEZIOSESA-N 2 1 320.908 4.453 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001257321292 1063201612 /nfs/dbraw/zinc/20/16/12/1063201612.db2.gz ZWTXVJVGHBROJY-AEFFLSMTSA-N 2 1 304.478 4.145 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001257323413 1063208055 /nfs/dbraw/zinc/20/80/55/1063208055.db2.gz BEFZAEOGQGEYKN-OAHLLOKOSA-N 2 1 308.897 4.425 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001257323413 1063208073 /nfs/dbraw/zinc/20/80/73/1063208073.db2.gz BEFZAEOGQGEYKN-OAHLLOKOSA-N 2 1 308.897 4.425 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001461047387 1063214227 /nfs/dbraw/zinc/21/42/27/1063214227.db2.gz WIMUMPAYJOTFAX-HOTGVXAUSA-N 2 1 320.521 4.343 20 0 DIADMP CSCc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC001461049523 1063216332 /nfs/dbraw/zinc/21/63/32/1063216332.db2.gz FFNGSOBSUKUEFN-KRWDZBQOSA-N 2 1 320.546 4.151 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001461051713 1063218788 /nfs/dbraw/zinc/21/87/88/1063218788.db2.gz LQZKYFLEEJGFTK-GHTZIAJQSA-N 2 1 314.517 4.036 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](C3CCCC3)C[C@H]21 ZINC001257350540 1063224087 /nfs/dbraw/zinc/22/40/87/1063224087.db2.gz FBKGHWBSWLLGGT-KFKAGJAMSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](C3CCCC3)C[C@H]21 ZINC001257350540 1063224105 /nfs/dbraw/zinc/22/41/05/1063224105.db2.gz FBKGHWBSWLLGGT-KFKAGJAMSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](C3CCCC3)C[C@H]21 ZINC001257350540 1063224126 /nfs/dbraw/zinc/22/41/26/1063224126.db2.gz FBKGHWBSWLLGGT-KFKAGJAMSA-N 2 1 318.530 4.223 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+]CC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC001461109623 1063260731 /nfs/dbraw/zinc/26/07/31/1063260731.db2.gz JPMCMPYYEJEXNB-VVLHAWIVSA-N 2 1 312.567 4.007 20 0 DIADMP CCCC[C@H](CC)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257424077 1063267874 /nfs/dbraw/zinc/26/78/74/1063267874.db2.gz AFRDFXGDMIXQMP-PMACEKPBSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@H](CC)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257424077 1063267893 /nfs/dbraw/zinc/26/78/93/1063267893.db2.gz AFRDFXGDMIXQMP-PMACEKPBSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@H](CC)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257424077 1063267912 /nfs/dbraw/zinc/26/79/12/1063267912.db2.gz AFRDFXGDMIXQMP-PMACEKPBSA-N 2 1 302.506 4.409 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001461120779 1063271413 /nfs/dbraw/zinc/27/14/13/1063271413.db2.gz LCIYNWLFCLEEEA-GOSISDBHSA-N 2 1 300.490 4.166 20 0 DIADMP CCCC[C@H](CC)[NH+]1C[C@H]2C[NH+](Cc3cccs3)C[C@@H]2C1 ZINC001257421179 1063271469 /nfs/dbraw/zinc/27/14/69/1063271469.db2.gz UGXLEYWSQJMNCW-ZACQAIPSSA-N 2 1 306.519 4.081 20 0 DIADMP CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1c1ccccc1 ZINC001257433784 1063278344 /nfs/dbraw/zinc/27/83/44/1063278344.db2.gz KFAZVHUOZRQHAV-YUXAGFNASA-N 2 1 322.496 4.433 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c(C)s1 ZINC001461133594 1063283090 /nfs/dbraw/zinc/28/30/90/1063283090.db2.gz WSNDCNHNQFNBMJ-UHFFFAOYSA-N 2 1 320.546 4.499 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](C1CCCCC1)CC2 ZINC001257455269 1063282790 /nfs/dbraw/zinc/28/27/90/1063282790.db2.gz DPMZQTDZBWWZFO-IBGZPJMESA-N 2 1 316.489 4.289 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001461173089 1063307597 /nfs/dbraw/zinc/30/75/97/1063307597.db2.gz WBZCMQSLPTWCGB-NHCUHLMSSA-N 2 1 314.517 4.178 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001461173089 1063307606 /nfs/dbraw/zinc/30/76/06/1063307606.db2.gz WBZCMQSLPTWCGB-NHCUHLMSSA-N 2 1 314.517 4.178 20 0 DIADMP CCC[C@H](C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC001461170814 1063309418 /nfs/dbraw/zinc/30/94/18/1063309418.db2.gz MVGMKCZSPNHLCU-UYAOXDASSA-N 2 1 302.506 4.280 20 0 DIADMP CCC(CC)C[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001461356256 1063440968 /nfs/dbraw/zinc/44/09/68/1063440968.db2.gz FZEYKRHQVKWBLH-XLIONFOSSA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC001257996347 1063456169 /nfs/dbraw/zinc/45/61/69/1063456169.db2.gz ZVAIDIUBARDITE-RLHVNXBHSA-N 2 1 314.517 4.421 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](C2CCC(c3ccccc3)CC2)CC1 ZINC001257999330 1063459808 /nfs/dbraw/zinc/45/98/08/1063459808.db2.gz FVVFKMYEEHLGCI-UHFFFAOYSA-N 2 1 300.490 4.129 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@@H+]2C2CC[NH+](CC(C)C)CC2)c1 ZINC001258011122 1063460815 /nfs/dbraw/zinc/46/08/15/1063460815.db2.gz IXKMYXVJFAPLHI-FQEVSTJZSA-N 2 1 300.490 4.252 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1C1CC[NH+](CC(C)C)CC1 ZINC001258017363 1063466143 /nfs/dbraw/zinc/46/61/43/1063466143.db2.gz FZKDZDRXPBLJMI-HXUWFJFHSA-N 2 1 300.490 4.116 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](C)Cc2ccc3ccccc3c2)CC1 ZINC001258017717 1063467109 /nfs/dbraw/zinc/46/71/09/1063467109.db2.gz MZKAPXPJAKBQFL-UHFFFAOYSA-N 2 1 310.485 4.392 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001258017304 1063467878 /nfs/dbraw/zinc/46/78/78/1063467878.db2.gz ZYFFJSJZNVCNDP-INIZCTEOSA-N 2 1 320.908 4.250 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001258017304 1063467889 /nfs/dbraw/zinc/46/78/89/1063467889.db2.gz ZYFFJSJZNVCNDP-INIZCTEOSA-N 2 1 320.908 4.250 20 0 DIADMP c1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)ccc1C[NH+]1CCCCC1 ZINC001473171626 1063475488 /nfs/dbraw/zinc/47/54/88/1063475488.db2.gz DENUMBHWFYNKJC-NHCUHLMSSA-N 2 1 312.501 4.437 20 0 DIADMP c1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)ccc1C[NH+]1CCCCC1 ZINC001473171625 1063477124 /nfs/dbraw/zinc/47/71/24/1063477124.db2.gz DENUMBHWFYNKJC-LEWJYISDSA-N 2 1 312.501 4.437 20 0 DIADMP CC(C)C[C@@H](C)C[C@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258062906 1063490342 /nfs/dbraw/zinc/49/03/42/1063490342.db2.gz QRSDBKTXZYYHQP-FCGDIQPGSA-N 2 1 324.553 4.198 20 0 DIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+]([C@H](C)C[C@H](C)CC(C)C)CC1 ZINC001258075257 1063503416 /nfs/dbraw/zinc/50/34/16/1063503416.db2.gz TXKWKJCLWDYXPS-QWFCFKBJSA-N 2 1 324.553 4.022 20 0 DIADMP Cc1cccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1C ZINC001258131906 1063528828 /nfs/dbraw/zinc/52/88/28/1063528828.db2.gz QVHYHOLNBGLUOP-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP CC(C)(CC1CCC1)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001258137203 1063532596 /nfs/dbraw/zinc/53/25/96/1063532596.db2.gz DUNIJZZAFOYBEA-UHFFFAOYSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1C ZINC001258141259 1063532660 /nfs/dbraw/zinc/53/26/60/1063532660.db2.gz WZZJFEBGICQYOO-RBUKOAKNSA-N 2 1 314.517 4.062 20 0 DIADMP C[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1C ZINC001258141259 1063532680 /nfs/dbraw/zinc/53/26/80/1063532680.db2.gz WZZJFEBGICQYOO-RBUKOAKNSA-N 2 1 314.517 4.062 20 0 DIADMP C[C@H]1CC([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@H](C)C1 ZINC001258160124 1063535539 /nfs/dbraw/zinc/53/55/39/1063535539.db2.gz JSLBAOUUGIWPGA-QZTJIDSGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C[C@@H](C)C1 ZINC001258167250 1063539119 /nfs/dbraw/zinc/53/91/19/1063539119.db2.gz HYCPLRVTBQGVGS-JYRKZWEQSA-N 2 1 314.517 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)CC1(C)C ZINC001461507675 1063542638 /nfs/dbraw/zinc/54/26/38/1063542638.db2.gz SJSVWDWTWJBTMG-INIZCTEOSA-N 2 1 306.881 4.182 20 0 DIADMP CSCC[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001258209925 1063563281 /nfs/dbraw/zinc/56/32/81/1063563281.db2.gz XAMSGIVKZUYFPZ-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP CSCC[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001258209925 1063563293 /nfs/dbraw/zinc/56/32/93/1063563293.db2.gz XAMSGIVKZUYFPZ-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2C[C@@H]3C[NH+](Cc4cccs4)C[C@H]3C2)C1 ZINC001258285511 1063587382 /nfs/dbraw/zinc/58/73/82/1063587382.db2.gz MOICOTCICNTSGJ-ULQDDVLXSA-N 2 1 318.530 4.081 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC001258293990 1063593028 /nfs/dbraw/zinc/59/30/28/1063593028.db2.gz FLNICGACZFEULP-JKSUJKDBSA-N 2 1 324.534 4.001 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+](Cc1ccccc1)C[C@@H](C)C[NH3+] ZINC001258333990 1063616832 /nfs/dbraw/zinc/61/68/32/1063616832.db2.gz QQASSIUUEZSNES-JKSUJKDBSA-N 2 1 308.535 4.004 20 0 DIADMP CCCCC(CCCC)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001258387093 1063630457 /nfs/dbraw/zinc/63/04/57/1063630457.db2.gz CYFTYEZGYMWUDU-HXUWFJFHSA-N 2 1 324.553 4.311 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001461663103 1063645279 /nfs/dbraw/zinc/64/52/79/1063645279.db2.gz MWUSYXJXGRTWLX-MRXNPFEDSA-N 2 1 320.908 4.114 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461663103 1063645288 /nfs/dbraw/zinc/64/52/88/1063645288.db2.gz MWUSYXJXGRTWLX-MRXNPFEDSA-N 2 1 320.908 4.114 20 0 DIADMP CCC(C)(C)CC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001461676110 1063651269 /nfs/dbraw/zinc/65/12/69/1063651269.db2.gz KZUMMYQQMGASIJ-UHFFFAOYSA-N 2 1 320.496 4.249 20 0 DIADMP c1ccc(C[C@@]2(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)C=CCCC2)cc1 ZINC001461688087 1063658975 /nfs/dbraw/zinc/65/89/75/1063658975.db2.gz VKCCGNVGYMEWIA-FDFHNCONSA-N 2 1 324.512 4.172 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001258462944 1063667163 /nfs/dbraw/zinc/66/71/63/1063667163.db2.gz UFBDTMWQOXBAJD-INIZCTEOSA-N 2 1 318.530 4.225 20 0 DIADMP CC1(C)CC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001258608663 1063707473 /nfs/dbraw/zinc/70/74/73/1063707473.db2.gz MUJXHBZHMKWBNH-AQNXPRMDSA-N 2 1 312.501 4.019 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2CCC(C)(C)C2)CC1 ZINC001258608638 1063707703 /nfs/dbraw/zinc/70/77/03/1063707703.db2.gz MGPNEXKYYTUXBY-IBGZPJMESA-N 2 1 318.480 4.301 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@H]2CCC(C)(C)C2)CC1 ZINC001258608638 1063707718 /nfs/dbraw/zinc/70/77/18/1063707718.db2.gz MGPNEXKYYTUXBY-IBGZPJMESA-N 2 1 318.480 4.301 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258652443 1063724005 /nfs/dbraw/zinc/72/40/05/1063724005.db2.gz VXPCSYHXPQHBOB-LWYYNNOASA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258652443 1063724013 /nfs/dbraw/zinc/72/40/13/1063724013.db2.gz VXPCSYHXPQHBOB-LWYYNNOASA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC001258653456 1063725282 /nfs/dbraw/zinc/72/52/82/1063725282.db2.gz RYLKHMQLROLPAV-RBUKOAKNSA-N 2 1 300.490 4.004 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C2CCCC2)C1 ZINC001258653456 1063725295 /nfs/dbraw/zinc/72/52/95/1063725295.db2.gz RYLKHMQLROLPAV-RBUKOAKNSA-N 2 1 300.490 4.004 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC001258653457 1063725343 /nfs/dbraw/zinc/72/53/43/1063725343.db2.gz RYLKHMQLROLPAV-RTBURBONSA-N 2 1 300.490 4.004 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C2CCCC2)C1 ZINC001258653457 1063725360 /nfs/dbraw/zinc/72/53/60/1063725360.db2.gz RYLKHMQLROLPAV-RTBURBONSA-N 2 1 300.490 4.004 20 0 DIADMP CCCCC[C@H](CCC)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001258666314 1063732222 /nfs/dbraw/zinc/73/22/22/1063732222.db2.gz GMPRZEUOCBKLQI-KRWDZBQOSA-N 3 1 313.574 4.211 20 0 DIADMP CCCCC[C@H](CCC)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001258673613 1063742224 /nfs/dbraw/zinc/74/22/24/1063742224.db2.gz MQCWFGRDGDXNJN-FQEVSTJZSA-N 2 1 324.553 4.311 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@H]3CC[N@@H+](CC)[C@@H](C)C3)oc21 ZINC001461861974 1063755546 /nfs/dbraw/zinc/75/55/46/1063755546.db2.gz RNMNXEUFQMAFDK-YJBOKZPZSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@H]3CC[N@H+](CC)[C@@H](C)C3)oc21 ZINC001461861974 1063755560 /nfs/dbraw/zinc/75/55/60/1063755560.db2.gz RNMNXEUFQMAFDK-YJBOKZPZSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@@H+](C)[C@H]3CC[NH+](CC)[C@@H](C)C3)oc21 ZINC001461861974 1063755572 /nfs/dbraw/zinc/75/55/72/1063755572.db2.gz RNMNXEUFQMAFDK-YJBOKZPZSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@H+](C)[C@H]3CC[NH+](CC)[C@@H](C)C3)oc21 ZINC001461861974 1063755582 /nfs/dbraw/zinc/75/55/82/1063755582.db2.gz RNMNXEUFQMAFDK-YJBOKZPZSA-N 2 1 314.473 4.300 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001461863438 1063758019 /nfs/dbraw/zinc/75/80/19/1063758019.db2.gz OOQNOJMLTNHWKD-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001461863438 1063758026 /nfs/dbraw/zinc/75/80/26/1063758026.db2.gz OOQNOJMLTNHWKD-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001461863438 1063758035 /nfs/dbraw/zinc/75/80/35/1063758035.db2.gz OOQNOJMLTNHWKD-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001461863438 1063758042 /nfs/dbraw/zinc/75/80/42/1063758042.db2.gz OOQNOJMLTNHWKD-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@@H]3CC[N@@H+](CC)[C@H](C)C3)oc21 ZINC001461861945 1063758185 /nfs/dbraw/zinc/75/81/85/1063758185.db2.gz RNMNXEUFQMAFDK-CRAIPNDOSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@@H]3CC[N@H+](CC)[C@H](C)C3)oc21 ZINC001461861945 1063758194 /nfs/dbraw/zinc/75/81/94/1063758194.db2.gz RNMNXEUFQMAFDK-CRAIPNDOSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@@H+](C)[C@@H]3CC[NH+](CC)[C@H](C)C3)oc21 ZINC001461861945 1063758205 /nfs/dbraw/zinc/75/82/05/1063758205.db2.gz RNMNXEUFQMAFDK-CRAIPNDOSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@H+](C)[C@@H]3CC[NH+](CC)[C@H](C)C3)oc21 ZINC001461861945 1063758214 /nfs/dbraw/zinc/75/82/14/1063758214.db2.gz RNMNXEUFQMAFDK-CRAIPNDOSA-N 2 1 314.473 4.300 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258697392 1063758613 /nfs/dbraw/zinc/75/86/13/1063758613.db2.gz PSWACLCLNOLRNO-DOTOQJQBSA-N 2 1 315.505 4.144 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001258701712 1063760016 /nfs/dbraw/zinc/76/00/16/1063760016.db2.gz MPEMDEGCCSUGCQ-WOJBJXKFSA-N 2 1 302.506 4.109 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001258713162 1063768372 /nfs/dbraw/zinc/76/83/72/1063768372.db2.gz DBBLFMYSZQESHW-QHAWAJNXSA-N 2 1 314.517 4.062 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH+]1C[C@H]2C[N@@H+](CCC)C[C@H]2C1 ZINC001258713162 1063768382 /nfs/dbraw/zinc/76/83/82/1063768382.db2.gz DBBLFMYSZQESHW-QHAWAJNXSA-N 2 1 314.517 4.062 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH+]1C[C@H]2C[N@H+](CCC)C[C@H]2C1 ZINC001258713162 1063768392 /nfs/dbraw/zinc/76/83/92/1063768392.db2.gz DBBLFMYSZQESHW-QHAWAJNXSA-N 2 1 314.517 4.062 20 0 DIADMP CC[C@@H]1C[N@@H+](CC2CC[NH+](CC)CC2)CC[C@@H]1c1ccccc1 ZINC001461880559 1063768797 /nfs/dbraw/zinc/76/87/97/1063768797.db2.gz JVQGKPGJZXIHDX-CTNGQTDRSA-N 2 1 314.517 4.234 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC001258738397 1063785855 /nfs/dbraw/zinc/78/58/55/1063785855.db2.gz RGCNVMOIKCQHJF-HOTGVXAUSA-N 2 1 308.897 4.125 20 0 DIADMP CCCC[C@H](CCC)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258753027 1063800518 /nfs/dbraw/zinc/80/05/18/1063800518.db2.gz PKXIFCGZGLQNBG-UXHICEINSA-N 2 1 302.506 4.457 20 0 DIADMP CCCC[C@H](CCC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258755849 1063800789 /nfs/dbraw/zinc/80/07/89/1063800789.db2.gz BCERTSLNDFEJOA-SFHVURJKSA-N 2 1 306.469 4.434 20 0 DIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919275 1063802657 /nfs/dbraw/zinc/80/26/57/1063802657.db2.gz NDGKCZHXACSGOM-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919275 1063802667 /nfs/dbraw/zinc/80/26/67/1063802667.db2.gz NDGKCZHXACSGOM-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919275 1063802682 /nfs/dbraw/zinc/80/26/82/1063802682.db2.gz NDGKCZHXACSGOM-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(C3CCCC3)c2)C1 ZINC001461919275 1063802698 /nfs/dbraw/zinc/80/26/98/1063802698.db2.gz NDGKCZHXACSGOM-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC001461922101 1063804843 /nfs/dbraw/zinc/80/48/43/1063804843.db2.gz SISOILSELOGWOL-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC001461922101 1063804854 /nfs/dbraw/zinc/80/48/54/1063804854.db2.gz SISOILSELOGWOL-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922101 1063804866 /nfs/dbraw/zinc/80/48/66/1063804866.db2.gz SISOILSELOGWOL-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922101 1063804878 /nfs/dbraw/zinc/80/48/78/1063804878.db2.gz SISOILSELOGWOL-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCCC[C@H]2c2cccc(OC)c2)CC1 ZINC001258774615 1063815109 /nfs/dbraw/zinc/81/51/09/1063815109.db2.gz UGCUVAHPIQZJKR-FQEVSTJZSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCCC[C@H]2c2cccc(OC)c2)CC1 ZINC001258774615 1063815121 /nfs/dbraw/zinc/81/51/21/1063815121.db2.gz UGCUVAHPIQZJKR-FQEVSTJZSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001258775425 1063816189 /nfs/dbraw/zinc/81/61/89/1063816189.db2.gz OJNWTKMBWKBWTR-HNNXBMFYSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001258775425 1063816202 /nfs/dbraw/zinc/81/62/02/1063816202.db2.gz OJNWTKMBWKBWTR-HNNXBMFYSA-N 2 1 306.881 4.004 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001258813787 1063842863 /nfs/dbraw/zinc/84/28/63/1063842863.db2.gz SRJMWEACVRRFRK-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001258812850 1063843182 /nfs/dbraw/zinc/84/31/82/1063843182.db2.gz NAKYAJGEMQTZJG-CABCVRRESA-N 2 1 306.881 4.169 20 0 DIADMP CC(C)C([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000379624638 1063984313 /nfs/dbraw/zinc/98/43/13/1063984313.db2.gz DQIPEKOYAWBRCA-PKOBYXMFSA-N 2 1 302.506 4.310 20 0 DIADMP CC(C)C([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000379624638 1063984318 /nfs/dbraw/zinc/98/43/18/1063984318.db2.gz DQIPEKOYAWBRCA-PKOBYXMFSA-N 2 1 302.506 4.310 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379638982 1063985585 /nfs/dbraw/zinc/98/55/85/1063985585.db2.gz VFCXYQNJNHMBOK-PGRDOPGGSA-N 2 1 322.496 4.392 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379638982 1063985592 /nfs/dbraw/zinc/98/55/92/1063985592.db2.gz VFCXYQNJNHMBOK-PGRDOPGGSA-N 2 1 322.496 4.392 20 0 DIADMP c1ccc(CCCC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000383554631 1064002839 /nfs/dbraw/zinc/00/28/39/1064002839.db2.gz YEELMLSGLOZIHL-UHFFFAOYSA-N 2 1 322.496 4.264 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517336 1064161457 /nfs/dbraw/zinc/16/14/57/1064161457.db2.gz ARXGCIACZBYXNK-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517336 1064161465 /nfs/dbraw/zinc/16/14/65/1064161465.db2.gz ARXGCIACZBYXNK-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390615981 1064165248 /nfs/dbraw/zinc/16/52/48/1064165248.db2.gz YDNKPGOSVRKXII-XLIONFOSSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390615981 1064165254 /nfs/dbraw/zinc/16/52/54/1064165254.db2.gz YDNKPGOSVRKXII-XLIONFOSSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1CC([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C[C@H](C)C1 ZINC000393624576 1064291047 /nfs/dbraw/zinc/29/10/47/1064291047.db2.gz HRUXRZDJNDXZDY-DBXWQHBBSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000393946121 1064312610 /nfs/dbraw/zinc/31/26/10/1064312610.db2.gz FYLLLRXBIDTOMQ-NLWGTHIKSA-N 2 1 302.506 4.313 20 0 DIADMP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccccc2)cc1 ZINC001279188044 1064336792 /nfs/dbraw/zinc/33/67/92/1064336792.db2.gz YEYUJIJQEXREFJ-SEJPIABJSA-N 2 1 306.453 4.068 20 0 DIADMP Cc1c(C)c(C)c(C[NH+]2C[C@@H]3CC[N@@H+](C)CC[C@@H]3C2)c(C)c1C ZINC001279269967 1064339341 /nfs/dbraw/zinc/33/93/41/1064339341.db2.gz MYSKOGFDIPILNC-BGYRXZFFSA-N 2 1 314.517 4.002 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c(C)c1C ZINC001279269967 1064339354 /nfs/dbraw/zinc/33/93/54/1064339354.db2.gz MYSKOGFDIPILNC-BGYRXZFFSA-N 2 1 314.517 4.002 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+]2C[C@@H]3CC[NH+](C)CC[C@@H]3C2)c(C)c1C ZINC001279269967 1064339363 /nfs/dbraw/zinc/33/93/63/1064339363.db2.gz MYSKOGFDIPILNC-BGYRXZFFSA-N 2 1 314.517 4.002 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)c2ccccc12 ZINC001279443718 1064350961 /nfs/dbraw/zinc/35/09/61/1064350961.db2.gz DAOHOFAUHMRRCU-OAQYLSRUSA-N 2 1 308.469 4.066 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c2ccccc12 ZINC001279443718 1064350967 /nfs/dbraw/zinc/35/09/67/1064350967.db2.gz DAOHOFAUHMRRCU-OAQYLSRUSA-N 2 1 308.469 4.066 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c2ccccc12 ZINC001279443718 1064350975 /nfs/dbraw/zinc/35/09/75/1064350975.db2.gz DAOHOFAUHMRRCU-OAQYLSRUSA-N 2 1 308.469 4.066 20 0 DIADMP CCCc1ccc(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)s1 ZINC001279582423 1064359799 /nfs/dbraw/zinc/35/97/99/1064359799.db2.gz LRMBDKRWVAWCOK-UHFFFAOYSA-N 2 1 306.519 4.008 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC2(C1)CCC[N@@H+](CC(C)(C)OC)C2 ZINC001280056223 1064379944 /nfs/dbraw/zinc/37/99/44/1064379944.db2.gz LQQPJZPYGGQYDG-GOSISDBHSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCC2(C1)CC[NH+](CCOCC)CC2 ZINC001280150764 1064382007 /nfs/dbraw/zinc/38/20/07/1064382007.db2.gz DOGFKALLSGVCQW-LJQANCHMSA-N 2 1 324.553 4.027 20 0 DIADMP Fc1ccc(C2([NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)CCC2)cc1 ZINC000643467826 1064413214 /nfs/dbraw/zinc/41/32/14/1064413214.db2.gz VTKDBAQBGQHABF-WOJBJXKFSA-N 2 1 324.443 4.288 20 0 DIADMP CCc1cc(NCCC[N@H+](CC)C2CCCCC2)nc(CC)n1 ZINC001307159384 1065288593 /nfs/dbraw/zinc/28/85/93/1065288593.db2.gz YJFFFKBKVJCNMH-UHFFFAOYSA-N 2 1 318.509 4.058 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCC3CCCC3)C2)CC1 ZINC001307440339 1065402069 /nfs/dbraw/zinc/40/20/69/1065402069.db2.gz JRLYEUGCASNPLB-FQEVSTJZSA-N 2 1 306.538 4.401 20 0 DIADMP c1ccc2c(c1)CC[C@H]2[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001307455106 1065410133 /nfs/dbraw/zinc/41/01/33/1065410133.db2.gz HNWIWFYJPBJTQB-GHTZIAJQSA-N 2 1 312.501 4.262 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@H+](C)[C@H]2CCN(C)[C@@H](C)C2)c1 ZINC001307516614 1065455938 /nfs/dbraw/zinc/45/59/38/1065455938.db2.gz KGBGRFNLTMDQRE-HKUYNNGSSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001307516614 1065455941 /nfs/dbraw/zinc/45/59/41/1065455941.db2.gz KGBGRFNLTMDQRE-HKUYNNGSSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001307516614 1065455946 /nfs/dbraw/zinc/45/59/46/1065455946.db2.gz KGBGRFNLTMDQRE-HKUYNNGSSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)c1 ZINC001307516614 1065455949 /nfs/dbraw/zinc/45/59/49/1065455949.db2.gz KGBGRFNLTMDQRE-HKUYNNGSSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)c1 ZINC001307516614 1065455956 /nfs/dbraw/zinc/45/59/56/1065455956.db2.gz KGBGRFNLTMDQRE-HKUYNNGSSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c(C)c1 ZINC001307524791 1065462623 /nfs/dbraw/zinc/46/26/23/1065462623.db2.gz ZUJFNALSTLCEBI-FHWLQOOXSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001307524791 1065462631 /nfs/dbraw/zinc/46/26/31/1065462631.db2.gz ZUJFNALSTLCEBI-FHWLQOOXSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c(C)c1 ZINC001307524791 1065462646 /nfs/dbraw/zinc/46/26/46/1065462646.db2.gz ZUJFNALSTLCEBI-FHWLQOOXSA-N 2 1 300.490 4.089 20 0 DIADMP c1ccc([C@]23CCCC[C@H]2C[N@@H+]3CCC[NH+]2CCCCC2)cc1 ZINC001307534990 1065468556 /nfs/dbraw/zinc/46/85/56/1065468556.db2.gz QLOSKHVSKCMKEW-LEWJYISDSA-N 2 1 312.501 4.264 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@H](CC1CCCC1)c1ccccc1 ZINC001307634474 1065531271 /nfs/dbraw/zinc/53/12/71/1065531271.db2.gz GRZLIUCWSODFLN-UXHICEINSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@H]([NH2+]CC1CCC2(CC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001307670757 1065554262 /nfs/dbraw/zinc/55/42/62/1065554262.db2.gz SYQCNGBCJFUODY-FUHWJXTLSA-N 2 1 304.522 4.199 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)C1CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001307670004 1065554660 /nfs/dbraw/zinc/55/46/60/1065554660.db2.gz OXQMRPXTUVULGV-LMMKCTJWSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001307785567 1065620084 /nfs/dbraw/zinc/62/00/84/1065620084.db2.gz NCDAQEXJZCVDFA-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001307785567 1065620086 /nfs/dbraw/zinc/62/00/86/1065620086.db2.gz NCDAQEXJZCVDFA-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001307785567 1065620089 /nfs/dbraw/zinc/62/00/89/1065620089.db2.gz NCDAQEXJZCVDFA-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP FCC[N@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001307824643 1065640190 /nfs/dbraw/zinc/64/01/90/1065640190.db2.gz MMHAEOJFKUZLIH-FQEVSTJZSA-N 2 1 318.480 4.113 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H]([C@H]2CCCC2(C)C)C1 ZINC001307867090 1065659886 /nfs/dbraw/zinc/65/98/86/1065659886.db2.gz FAJJUNWNJWTEKZ-QZTJIDSGSA-N 2 1 303.494 4.120 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H]([C@H]2CCCC2(C)C)C1 ZINC001307867090 1065659894 /nfs/dbraw/zinc/65/98/94/1065659894.db2.gz FAJJUNWNJWTEKZ-QZTJIDSGSA-N 2 1 303.494 4.120 20 0 DIADMP Cc1cccc(C)c1[C@@H]1CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001307921387 1065682120 /nfs/dbraw/zinc/68/21/20/1065682120.db2.gz WVJOPDSXZGSOPF-IBGZPJMESA-N 2 1 300.490 4.316 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2C[C@@]3(C)C[NH+](C)C[C@]3(C)C2)cc1 ZINC001307979327 1065709010 /nfs/dbraw/zinc/70/90/10/1065709010.db2.gz WVBKUUJKJFGWCU-PWIZWCRZSA-N 2 1 300.490 4.145 20 0 DIADMP C[C@H](c1ccc2c(c1)CCC2)[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001307980956 1065711532 /nfs/dbraw/zinc/71/15/32/1065711532.db2.gz ALKOAGOOSDABAU-QGZVFWFLSA-N 2 1 312.501 4.187 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001308037818 1065735705 /nfs/dbraw/zinc/73/57/05/1065735705.db2.gz HAJWFWLDPGGJEZ-UHFFFAOYSA-N 2 1 308.897 4.346 20 0 DIADMP CC1([NH+]2CCC2)CC[NH+](Cc2ccc(C3CCCC3)cc2)CC1 ZINC001308036032 1065735955 /nfs/dbraw/zinc/73/59/55/1065735955.db2.gz ZVBPVOWPXOAOOA-UHFFFAOYSA-N 2 1 312.501 4.404 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)CC1 ZINC001308180456 1065791784 /nfs/dbraw/zinc/79/17/84/1065791784.db2.gz IHBYERDQERCGDZ-ICSRJNTNSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182567 1065793390 /nfs/dbraw/zinc/79/33/90/1065793390.db2.gz ZPHUCELUIOLSPJ-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182567 1065793404 /nfs/dbraw/zinc/79/34/04/1065793404.db2.gz ZPHUCELUIOLSPJ-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP CC[C@H](C[NH2+]C/C(C)=C\c1ccc(Cl)cc1)[NH+]1CCCC1 ZINC001308195072 1065802827 /nfs/dbraw/zinc/80/28/27/1065802827.db2.gz XPHWQEGWLODAAD-WTQUMQLASA-N 2 1 306.881 4.207 20 0 DIADMP CCOc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(C)c1 ZINC001308202213 1065809484 /nfs/dbraw/zinc/80/94/84/1065809484.db2.gz DZQURJWLBVGJEC-GOSISDBHSA-N 2 1 318.505 4.138 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001308202408 1065810216 /nfs/dbraw/zinc/81/02/16/1065810216.db2.gz HGJNKYATUWZDOB-LJQANCHMSA-N 2 1 316.533 4.487 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC001308200025 1065811025 /nfs/dbraw/zinc/81/10/25/1065811025.db2.gz RSACAFIUDPNPDR-MBOZVWFJSA-N 2 1 300.490 4.197 20 0 DIADMP Cc1c(Cl)cccc1C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC001308204539 1065811732 /nfs/dbraw/zinc/81/17/32/1065811732.db2.gz ZOLAKUPOWRKVTR-OAHLLOKOSA-N 2 1 308.897 4.393 20 0 DIADMP C[C@H]1CCC[C@](C[NH2+]CC(C)(C)c2ccccc2)([NH+](C)C)C1 ZINC001308219102 1065827211 /nfs/dbraw/zinc/82/72/11/1065827211.db2.gz QVNCDYUQUMMBDP-PXNSSMCTSA-N 2 1 302.506 4.064 20 0 DIADMP CC[C@H](C)[N@H+](C)CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240763 1065847323 /nfs/dbraw/zinc/84/73/23/1065847323.db2.gz ZATYSSUWRCXPFS-ROUUACIJSA-N 2 1 318.549 4.483 20 0 DIADMP CC[C@H](C)[N@@H+](C)CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001308240763 1065847335 /nfs/dbraw/zinc/84/73/35/1065847335.db2.gz ZATYSSUWRCXPFS-ROUUACIJSA-N 2 1 318.549 4.483 20 0 DIADMP CCCCOc1ccccc1C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC001308254403 1065859823 /nfs/dbraw/zinc/85/98/23/1065859823.db2.gz NABWOZZYSMURPH-GOSISDBHSA-N 2 1 318.505 4.076 20 0 DIADMP CCCCOc1ccccc1C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC001308254403 1065859831 /nfs/dbraw/zinc/85/98/31/1065859831.db2.gz NABWOZZYSMURPH-GOSISDBHSA-N 2 1 318.505 4.076 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccc(F)cc2)CC1 ZINC001308271335 1065870621 /nfs/dbraw/zinc/87/06/21/1065870621.db2.gz OOQQWRLTEUNBTJ-MRXNPFEDSA-N 2 1 312.432 4.141 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc2occc2c1)[N@@H+](C)Cc1ccccc1 ZINC001308302279 1065896870 /nfs/dbraw/zinc/89/68/70/1065896870.db2.gz YMGFALWUIDQLDD-KRWDZBQOSA-N 2 1 322.452 4.433 20 0 DIADMP CCC(C)(C)c1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001308343821 1065927687 /nfs/dbraw/zinc/92/76/87/1065927687.db2.gz WKRWYJPERMVEPN-GOSISDBHSA-N 2 1 302.506 4.337 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CCCC2)CC1(C)C ZINC001308351492 1065932401 /nfs/dbraw/zinc/93/24/01/1065932401.db2.gz TXDNLDHYVQXIKU-LJQANCHMSA-N 2 1 314.517 4.252 20 0 DIADMP CC(C)c1ncc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)s1 ZINC001308360277 1065939116 /nfs/dbraw/zinc/93/91/16/1065939116.db2.gz NHOGQMABZBPZGB-UHFFFAOYSA-N 2 1 321.534 4.011 20 0 DIADMP C[C@@H]1CCC[C@H]1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382703 1065953104 /nfs/dbraw/zinc/95/31/04/1065953104.db2.gz RCOBNTKCXCMGJW-HOJAQTOUSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1CCC[C@H]1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382703 1065953112 /nfs/dbraw/zinc/95/31/12/1065953112.db2.gz RCOBNTKCXCMGJW-HOJAQTOUSA-N 2 1 312.501 4.209 20 0 DIADMP CCc1cccc2cc(CNCCC[N@@H+](C)CC(C)C)oc21 ZINC001308455990 1065999690 /nfs/dbraw/zinc/99/96/90/1065999690.db2.gz CJEUOAJFIIPYDW-UHFFFAOYSA-N 2 1 302.462 4.063 20 0 DIADMP CCc1cccc2cc(C[NH2+]CCC[N@H+](C)CC(C)C)oc21 ZINC001308455990 1065999705 /nfs/dbraw/zinc/99/97/05/1065999705.db2.gz CJEUOAJFIIPYDW-UHFFFAOYSA-N 2 1 302.462 4.063 20 0 DIADMP CCc1cccc2cc(C[NH2+]CCC[N@@H+](C)CC(C)C)oc21 ZINC001308455990 1065999715 /nfs/dbraw/zinc/99/97/15/1065999715.db2.gz CJEUOAJFIIPYDW-UHFFFAOYSA-N 2 1 302.462 4.063 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001308455622 1066000561 /nfs/dbraw/zinc/00/05/61/1066000561.db2.gz AYHAHKFNNLXNDD-BTHPGYMESA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC001308455622 1066000575 /nfs/dbraw/zinc/00/05/75/1066000575.db2.gz AYHAHKFNNLXNDD-BTHPGYMESA-N 2 1 314.517 4.454 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@H]3CCCC[N@@H+](C)C3)o2)cc1 ZINC001308464565 1066006639 /nfs/dbraw/zinc/00/66/39/1066006639.db2.gz JEXGSFQTQKZUAP-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@H]3CCCC[N@H+](C)C3)o2)cc1 ZINC001308464565 1066006646 /nfs/dbraw/zinc/00/66/46/1066006646.db2.gz JEXGSFQTQKZUAP-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@]23C[C@H]2CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001308521905 1066043468 /nfs/dbraw/zinc/04/34/68/1066043468.db2.gz JTVGGGFUNKIJNH-WLRLJWMZSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@]23C[C@H]2CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001308521905 1066043481 /nfs/dbraw/zinc/04/34/81/1066043481.db2.gz JTVGGGFUNKIJNH-WLRLJWMZSA-N 2 1 312.501 4.209 20 0 DIADMP CCCCC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001308546656 1066060540 /nfs/dbraw/zinc/06/05/40/1066060540.db2.gz UGLNNXIPLNMCFL-PKOBYXMFSA-N 2 1 300.490 4.352 20 0 DIADMP CCCCC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001308546656 1066060559 /nfs/dbraw/zinc/06/05/59/1066060559.db2.gz UGLNNXIPLNMCFL-PKOBYXMFSA-N 2 1 300.490 4.352 20 0 DIADMP CCCCC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001308546654 1066060972 /nfs/dbraw/zinc/06/09/72/1066060972.db2.gz UGLNNXIPLNMCFL-IEBWSBKVSA-N 2 1 300.490 4.352 20 0 DIADMP CCCCC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001308546654 1066060983 /nfs/dbraw/zinc/06/09/83/1066060983.db2.gz UGLNNXIPLNMCFL-IEBWSBKVSA-N 2 1 300.490 4.352 20 0 DIADMP CCCCC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001308546653 1066061260 /nfs/dbraw/zinc/06/12/60/1066061260.db2.gz UGLNNXIPLNMCFL-HKUYNNGSSA-N 2 1 300.490 4.352 20 0 DIADMP CCCCC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001308546653 1066061272 /nfs/dbraw/zinc/06/12/72/1066061272.db2.gz UGLNNXIPLNMCFL-HKUYNNGSSA-N 2 1 300.490 4.352 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(CC3CCC3)c2)[C@@H](C)C1 ZINC001308567732 1066079187 /nfs/dbraw/zinc/07/91/87/1066079187.db2.gz KLEJUFXXJDBNER-UWJYYQICSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(CC3CCC3)c2)[C@@H](C)C1 ZINC001308567732 1066079197 /nfs/dbraw/zinc/07/91/97/1066079197.db2.gz KLEJUFXXJDBNER-UWJYYQICSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(CC3CCC3)c2)[C@@H](C)C1 ZINC001308567732 1066079207 /nfs/dbraw/zinc/07/92/07/1066079207.db2.gz KLEJUFXXJDBNER-UWJYYQICSA-N 2 1 314.517 4.191 20 0 DIADMP C[N@H+](Cc1cccc(C2CCCC2)c1)C[C@@H]1CCC[NH+](C)C1 ZINC001308586237 1066101597 /nfs/dbraw/zinc/10/15/97/1066101597.db2.gz XKGBDNGCWNMXFV-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+](Cc1cccc(C2CCCC2)c1)C[C@@H]1CCC[N@H+](C)C1 ZINC001308586237 1066101602 /nfs/dbraw/zinc/10/16/02/1066101602.db2.gz XKGBDNGCWNMXFV-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+](Cc1cccc(C2CCCC2)c1)C[C@@H]1CCC[N@@H+](C)C1 ZINC001308586237 1066101607 /nfs/dbraw/zinc/10/16/07/1066101607.db2.gz XKGBDNGCWNMXFV-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001308592986 1066104765 /nfs/dbraw/zinc/10/47/65/1066104765.db2.gz YIEJLLGSEKHVSC-HXUWFJFHSA-N 2 1 312.501 4.187 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C/C=C\c2cc(C)c(C)cc2C)C1 ZINC001308594755 1066107110 /nfs/dbraw/zinc/10/71/10/1066107110.db2.gz QXTLKLFMVYTXIR-GWQNQTGSSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C/C=C\c2cc(C)c(C)cc2C)C1 ZINC001308594755 1066107114 /nfs/dbraw/zinc/10/71/14/1066107114.db2.gz QXTLKLFMVYTXIR-GWQNQTGSSA-N 2 1 314.517 4.289 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@H]2CC=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001308633621 1066128795 /nfs/dbraw/zinc/12/87/95/1066128795.db2.gz KNFVWRYWXOSCKJ-SVFBPWRDSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@H]2CC=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001308633621 1066128798 /nfs/dbraw/zinc/12/87/98/1066128798.db2.gz KNFVWRYWXOSCKJ-SVFBPWRDSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)C[C@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633621 1066128803 /nfs/dbraw/zinc/12/88/03/1066128803.db2.gz KNFVWRYWXOSCKJ-SVFBPWRDSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)C[C@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633621 1066128804 /nfs/dbraw/zinc/12/88/04/1066128804.db2.gz KNFVWRYWXOSCKJ-SVFBPWRDSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)C1CCC1 ZINC001308634048 1066128912 /nfs/dbraw/zinc/12/89/12/1066128912.db2.gz DGOASYGZTKDGFJ-LRGNLBRXSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001308634206 1066129353 /nfs/dbraw/zinc/12/93/53/1066129353.db2.gz GDEAACGREIMYDS-RZXSNQJFSA-N 2 1 312.501 4.065 20 0 DIADMP CC1=CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC001308636138 1066130652 /nfs/dbraw/zinc/13/06/52/1066130652.db2.gz UGQHBTQYYXCXFM-CIAFKFPVSA-N 2 1 324.512 4.376 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]C4CCCCC4)[C@H]3C2)cc1 ZINC001308636363 1066131584 /nfs/dbraw/zinc/13/15/84/1066131584.db2.gz ZRLGMWZMVCKNMO-JBACZVJFSA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)(C)[C@]1(C[NH+]2CCCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001308648012 1066135045 /nfs/dbraw/zinc/13/50/45/1066135045.db2.gz YBYHSDSYNICTLA-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001308735032 1066209821 /nfs/dbraw/zinc/20/98/21/1066209821.db2.gz CQIACQNILUGZMJ-KYJSFNMBSA-N 2 1 308.897 4.296 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H](C)CC12CC3CC(CC(C3)C1)C2 ZINC001308737087 1066211932 /nfs/dbraw/zinc/21/19/32/1066211932.db2.gz XQSRWUIGILOROI-SBXPZINTSA-N 2 1 306.538 4.301 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001308745483 1066218046 /nfs/dbraw/zinc/21/80/46/1066218046.db2.gz YEKKMSYMRZZYRI-UHFFFAOYSA-N 2 1 323.484 4.468 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001308745483 1066218060 /nfs/dbraw/zinc/21/80/60/1066218060.db2.gz YEKKMSYMRZZYRI-UHFFFAOYSA-N 2 1 323.484 4.468 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747208 1066221067 /nfs/dbraw/zinc/22/10/67/1066221067.db2.gz WDOGUABVXHTWCL-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747208 1066221085 /nfs/dbraw/zinc/22/10/85/1066221085.db2.gz WDOGUABVXHTWCL-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747208 1066221097 /nfs/dbraw/zinc/22/10/97/1066221097.db2.gz WDOGUABVXHTWCL-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747208 1066221108 /nfs/dbraw/zinc/22/11/08/1066221108.db2.gz WDOGUABVXHTWCL-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC001308790837 1066265695 /nfs/dbraw/zinc/26/56/95/1066265695.db2.gz AYFNEWVMRVILBX-YZGWKJHDSA-N 2 1 302.506 4.423 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC001308790837 1066265708 /nfs/dbraw/zinc/26/57/08/1066265708.db2.gz AYFNEWVMRVILBX-YZGWKJHDSA-N 2 1 302.506 4.423 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@H]3CC[C@@H]3C3CC3)C2)cc1 ZINC001308803768 1066279957 /nfs/dbraw/zinc/27/99/57/1066279957.db2.gz VXMJHOJVYDNSKX-NRSPTQNISA-N 2 1 312.501 4.067 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001308816007 1066291858 /nfs/dbraw/zinc/29/18/58/1066291858.db2.gz UBKOJTIVXSQMFK-OALUTQOASA-N 2 1 300.490 4.095 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001308816007 1066291865 /nfs/dbraw/zinc/29/18/65/1066291865.db2.gz UBKOJTIVXSQMFK-OALUTQOASA-N 2 1 300.490 4.095 20 0 DIADMP C[C@@H](CC1CCCCC1)C[N@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC001308920106 1066399860 /nfs/dbraw/zinc/39/98/60/1066399860.db2.gz ZJXDFJGOBGTCMB-ROUUACIJSA-N 2 1 315.505 4.199 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]C3CCC=CCC3)CC[N@H+]2C2CC2)cc1 ZINC001308944235 1066411005 /nfs/dbraw/zinc/41/10/05/1066411005.db2.gz RETGQVOMVPOJMO-PZJWPPBQSA-N 2 1 310.485 4.443 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]C3CCC=CCC3)CC[N@@H+]2C2CC2)cc1 ZINC001308944235 1066411009 /nfs/dbraw/zinc/41/10/09/1066411009.db2.gz RETGQVOMVPOJMO-PZJWPPBQSA-N 2 1 310.485 4.443 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]C3CCC=CCC3)CC[N@H+]2C2CC2)cc1 ZINC001308944236 1066411916 /nfs/dbraw/zinc/41/19/16/1066411916.db2.gz RETGQVOMVPOJMO-TZIWHRDSSA-N 2 1 310.485 4.443 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]C3CCC=CCC3)CC[N@@H+]2C2CC2)cc1 ZINC001308944236 1066411920 /nfs/dbraw/zinc/41/19/20/1066411920.db2.gz RETGQVOMVPOJMO-TZIWHRDSSA-N 2 1 310.485 4.443 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccs1 ZINC000236918967 202071111 /nfs/dbraw/zinc/07/11/11/202071111.db2.gz SHTZFGSTLWYKNA-SFHVURJKSA-N 2 1 314.498 4.453 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000188686219 200287957 /nfs/dbraw/zinc/28/79/57/200287957.db2.gz CDNCIOFLHDPCMT-OAHLLOKOSA-N 2 1 300.446 4.265 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)cn1 ZINC000274930784 130275214 /nfs/dbraw/zinc/27/52/14/130275214.db2.gz QTPNQWXFZNFNHX-LSDHHAIUSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)cn1 ZINC000274930782 130275229 /nfs/dbraw/zinc/27/52/29/130275229.db2.gz QTPNQWXFZNFNHX-GJZGRUSLSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Cl)ccc1Cl ZINC000275553032 130336508 /nfs/dbraw/zinc/33/65/08/130336508.db2.gz NLQPYXUGZHLXTN-VXGBXAGGSA-N 2 1 324.255 4.103 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(F)c2ccccc21 ZINC000340190883 131074871 /nfs/dbraw/zinc/07/48/71/131074871.db2.gz JFBOSPJMBCYTTD-CQSZACIVSA-N 2 1 311.404 4.225 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2nccc3ccccc32)CC1 ZINC000289552047 131395512 /nfs/dbraw/zinc/39/55/12/131395512.db2.gz CFOLWTFUUXTPLR-MRXNPFEDSA-N 2 1 311.473 4.006 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(-c2cccnc2)cc1 ZINC000297799246 132034767 /nfs/dbraw/zinc/03/47/67/132034767.db2.gz XGRGBOJFYWLMNG-INIZCTEOSA-N 2 1 321.468 4.026 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000037256063 331548629 /nfs/dbraw/zinc/54/86/29/331548629.db2.gz NQEMQYRVTGCMNQ-HNNXBMFYSA-N 2 1 301.261 4.128 20 0 DIADMP CC1(c2ccccc2)CCC([NH2+]C2CC[NH+](C3CC3)CC2)CC1 ZINC000152692158 331931352 /nfs/dbraw/zinc/93/13/52/331931352.db2.gz RHONCCVTWNVUDP-UHFFFAOYSA-N 2 1 312.501 4.103 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000518270005 332003438 /nfs/dbraw/zinc/00/34/38/332003438.db2.gz POSHODDHZKRQIR-KRWDZBQOSA-N 2 1 312.457 4.301 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000518270005 332003439 /nfs/dbraw/zinc/00/34/39/332003439.db2.gz POSHODDHZKRQIR-KRWDZBQOSA-N 2 1 312.457 4.301 20 0 DIADMP Cc1sccc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000559273245 332011890 /nfs/dbraw/zinc/01/18/90/332011890.db2.gz KVTLCIRRUPWJOF-WBVHZDCISA-N 2 1 320.527 4.291 20 0 DIADMP Cc1sccc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000559273245 332011891 /nfs/dbraw/zinc/01/18/91/332011891.db2.gz KVTLCIRRUPWJOF-WBVHZDCISA-N 2 1 320.527 4.291 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000520949882 332124090 /nfs/dbraw/zinc/12/40/90/332124090.db2.gz VJYUNLGFJKDOFQ-UFSZVFTQSA-N 2 1 300.490 4.192 20 0 DIADMP COc1cccc(Cl)c1CNCCC[N@@H+](C)C1CCCCC1 ZINC000317760887 332171279 /nfs/dbraw/zinc/17/12/79/332171279.db2.gz RISYRQJUIXNLBU-UHFFFAOYSA-N 2 1 324.896 4.093 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc21 ZINC000448028899 332201341 /nfs/dbraw/zinc/20/13/41/332201341.db2.gz PIDMDSPQWFXCSJ-OOSNJVJTSA-N 2 1 312.501 4.130 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc2ccc(C)cc2o1 ZINC000426052732 335096331 /nfs/dbraw/zinc/09/63/31/335096331.db2.gz ZGJQCPLFKZOVGU-HNNXBMFYSA-N 2 1 311.429 4.377 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)CCC2 ZINC000536423687 332242274 /nfs/dbraw/zinc/24/22/74/332242274.db2.gz GAKJEVVANMSAKE-ZAAXVRCTSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)CCC2 ZINC000536423687 332242275 /nfs/dbraw/zinc/24/22/75/332242275.db2.gz GAKJEVVANMSAKE-ZAAXVRCTSA-N 2 1 300.490 4.260 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000536476872 332250716 /nfs/dbraw/zinc/25/07/16/332250716.db2.gz WFIUDOJWXYGFNZ-UXHICEINSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000536476872 332250718 /nfs/dbraw/zinc/25/07/18/332250718.db2.gz WFIUDOJWXYGFNZ-UXHICEINSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]C3CC[NH+](C(C)C)CC3)oc2c1 ZINC000426070663 335098292 /nfs/dbraw/zinc/09/82/92/335098292.db2.gz PBMMKHMMJKJBPL-OAHLLOKOSA-N 2 1 300.446 4.265 20 0 DIADMP CN1CC[C@@H]([NH2+]Cc2ccccc2Cl)C[C@H]1c1ccccc1 ZINC000559722576 332278117 /nfs/dbraw/zinc/27/81/17/332278117.db2.gz XXKPDWAMMVNKAC-MJGOQNOKSA-N 2 1 314.860 4.265 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(F)c2ccccc21 ZINC000559740344 332278215 /nfs/dbraw/zinc/27/82/15/332278215.db2.gz OJEBHKTWBDNSEI-LSDHHAIUSA-N 2 1 312.432 4.114 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)C[C@@H]1c1ccccc1 ZINC000559766048 332279739 /nfs/dbraw/zinc/27/97/39/332279739.db2.gz FHQDWXKZFZPAJT-JBINPLMMSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)C[C@@H]1c1ccccc1 ZINC000559766048 332279740 /nfs/dbraw/zinc/27/97/40/332279740.db2.gz FHQDWXKZFZPAJT-JBINPLMMSA-N 2 1 312.501 4.380 20 0 DIADMP COC1CC[NH+](C2(C[NH2+][C@@H](C)CCC(C)(C)C)CCCC2)CC1 ZINC000560246240 332322924 /nfs/dbraw/zinc/32/29/24/332322924.db2.gz OWJVFKNDKLEDGH-KRWDZBQOSA-N 2 1 324.553 4.214 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000560251970 332323734 /nfs/dbraw/zinc/32/37/34/332323734.db2.gz NELGXSKCYRNDED-SJORKVTESA-N 2 1 316.489 4.000 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](Cc2ccc(C3CCCC3)cc2)CC1 ZINC000570241444 332730085 /nfs/dbraw/zinc/73/00/85/332730085.db2.gz HLHNNCILUOHEDV-UHFFFAOYSA-N 2 1 300.490 4.307 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000379037411 333098480 /nfs/dbraw/zinc/09/84/80/333098480.db2.gz DDDUOQBLCXTERI-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)C1 ZINC000320684160 335123761 /nfs/dbraw/zinc/12/37/61/335123761.db2.gz PHGUAZHIAKMYSN-QZTJIDSGSA-N 2 1 308.469 4.346 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H](c3ccccc3)C3CC3)C2)cc1 ZINC000310101972 333219385 /nfs/dbraw/zinc/21/93/85/333219385.db2.gz YDNOYVGEEWFNBN-KNQAVFIVSA-N 2 1 320.480 4.249 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCc2occc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310166069 333221485 /nfs/dbraw/zinc/22/14/85/333221485.db2.gz SFHCPDBUJUPSHQ-QRFRQXIXSA-N 2 1 324.468 4.157 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390565370 333300831 /nfs/dbraw/zinc/30/08/31/333300831.db2.gz BJECZBSKAIWAJF-BHIYHBOVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390565370 333300832 /nfs/dbraw/zinc/30/08/32/333300832.db2.gz BJECZBSKAIWAJF-BHIYHBOVSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cn1 ZINC000497850383 333301034 /nfs/dbraw/zinc/30/10/34/333301034.db2.gz ZDQDBMKTIKRGCS-VQIMIIECSA-N 2 1 321.484 4.162 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594416 333305150 /nfs/dbraw/zinc/30/51/50/333305150.db2.gz HAIOQRIHOJEBKE-OALUTQOASA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594416 333305151 /nfs/dbraw/zinc/30/51/51/333305151.db2.gz HAIOQRIHOJEBKE-OALUTQOASA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1CC[C@@H]1CCC[NH+]1C ZINC000502693375 333305265 /nfs/dbraw/zinc/30/52/65/333305265.db2.gz HYRRMAQKQHQDRX-ZCNNSNEGSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[NH+]1CC[C@@H]1CCC[N@@H+]1C ZINC000502693375 333305266 /nfs/dbraw/zinc/30/52/66/333305266.db2.gz HYRRMAQKQHQDRX-ZCNNSNEGSA-N 2 1 300.490 4.129 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[NH+]1CC[C@@H]1CCC[N@H+]1C ZINC000502693375 333305267 /nfs/dbraw/zinc/30/52/67/333305267.db2.gz HYRRMAQKQHQDRX-ZCNNSNEGSA-N 2 1 300.490 4.129 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccs1 ZINC000390644869 333310320 /nfs/dbraw/zinc/31/03/20/333310320.db2.gz IDHKWHFBSBCHBW-GOSISDBHSA-N 2 1 314.498 4.138 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccs1 ZINC000390644869 333310322 /nfs/dbraw/zinc/31/03/22/333310322.db2.gz IDHKWHFBSBCHBW-GOSISDBHSA-N 2 1 314.498 4.138 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390681187 333314688 /nfs/dbraw/zinc/31/46/88/333314688.db2.gz VWRLHOJUUKMUIQ-JPGZLTHCSA-N 2 1 312.501 4.350 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000390756996 333324273 /nfs/dbraw/zinc/32/42/73/333324273.db2.gz WXEQOQRNQNMWFQ-QUCCMNQESA-N 2 1 308.469 4.168 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000021518093 333423651 /nfs/dbraw/zinc/42/36/51/333423651.db2.gz IWFYDYZGFWLNDH-CYBMUJFWSA-N 2 1 302.384 4.088 20 0 DIADMP C[C@H]([NH2+]CCCc1c[nH+]cn1C)c1cc(Cl)ccc1Cl ZINC000565163898 333592916 /nfs/dbraw/zinc/59/29/16/333592916.db2.gz LQXCZICPQIXCOE-NSHDSACASA-N 2 1 312.244 4.010 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000280346507 334116727 /nfs/dbraw/zinc/11/67/27/334116727.db2.gz RVIMYVIOJUWDTJ-YLJYHZDGSA-N 2 1 315.505 4.025 20 0 DIADMP C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(Cl)c1)[C@@H]1CC[NH2+]C1 ZINC000415082670 334272043 /nfs/dbraw/zinc/27/20/43/334272043.db2.gz DOVDTWFLFAGDQY-YJLNNSPDSA-N 2 1 314.860 4.017 20 0 DIADMP CC(C)(C)c1nc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cs1 ZINC000415045315 334261181 /nfs/dbraw/zinc/26/11/81/334261181.db2.gz BMNGQUAVDGOGSJ-INIZCTEOSA-N 2 1 317.502 4.010 20 0 DIADMP Cc1nc2ccccc2n1C[C@H]1CCC[N@H+]1Cc1ccccc1F ZINC000534472096 334270621 /nfs/dbraw/zinc/27/06/21/334270621.db2.gz GSORSHRGJTYCJG-QGZVFWFLSA-N 2 1 323.415 4.148 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000534497344 334277739 /nfs/dbraw/zinc/27/77/39/334277739.db2.gz BWJUIIHHEDPEGV-AWEZNQCLSA-N 2 1 304.503 4.076 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)Cc1cccs1 ZINC000415090303 334280047 /nfs/dbraw/zinc/28/00/47/334280047.db2.gz YXJVESSPOCNNKR-WDYCEAGBSA-N 2 1 314.498 4.010 20 0 DIADMP Clc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000415104250 334282863 /nfs/dbraw/zinc/28/28/63/334282863.db2.gz KYEIAMHQBWKUSE-FVQBIDKESA-N 2 1 313.272 4.004 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117067 334283839 /nfs/dbraw/zinc/28/38/39/334283839.db2.gz FWALRRLGILVVJB-JVPBZIDWSA-N 2 1 314.860 4.484 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000531939174 334299636 /nfs/dbraw/zinc/29/96/36/334299636.db2.gz KNSBOQDTSGDXIL-GOSISDBHSA-N 2 1 316.489 4.066 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](C2c3ccccc3-c3ccccc32)CC1 ZINC000111054111 334301096 /nfs/dbraw/zinc/30/10/96/334301096.db2.gz HGKUMIZQAXFBKQ-UHFFFAOYSA-N 2 1 306.453 4.219 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCc3ccccc32)CC1 ZINC000531967589 334326464 /nfs/dbraw/zinc/32/64/64/334326464.db2.gz GTLUSFQTDBFSRC-VGOFRKELSA-N 2 1 320.480 4.489 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303783107 334330381 /nfs/dbraw/zinc/33/03/81/334330381.db2.gz SVEJBGBEKWJULW-RXVVDRJESA-N 2 1 308.469 4.172 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303783107 334330383 /nfs/dbraw/zinc/33/03/83/334330383.db2.gz SVEJBGBEKWJULW-RXVVDRJESA-N 2 1 308.469 4.172 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783107 334330384 /nfs/dbraw/zinc/33/03/84/334330384.db2.gz SVEJBGBEKWJULW-RXVVDRJESA-N 2 1 308.469 4.172 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783107 334330386 /nfs/dbraw/zinc/33/03/86/334330386.db2.gz SVEJBGBEKWJULW-RXVVDRJESA-N 2 1 308.469 4.172 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000534757357 334336653 /nfs/dbraw/zinc/33/66/53/334336653.db2.gz XWQLSJYKFZPFMY-XLIONFOSSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000534757357 334336654 /nfs/dbraw/zinc/33/66/54/334336654.db2.gz XWQLSJYKFZPFMY-XLIONFOSSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000534757357 334336656 /nfs/dbraw/zinc/33/66/56/334336656.db2.gz XWQLSJYKFZPFMY-XLIONFOSSA-N 2 1 311.473 4.179 20 0 DIADMP Cc1nccn1CC[N@H+]1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 ZINC000534954349 334352519 /nfs/dbraw/zinc/35/25/19/334352519.db2.gz MKHCEGXAIQALTO-LJQANCHMSA-N 2 1 311.473 4.326 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+](C)CCCn1cc[nH+]c1C ZINC000535051676 334360457 /nfs/dbraw/zinc/36/04/57/334360457.db2.gz WNWBQZHXRJIVBR-KRWDZBQOSA-N 2 1 305.853 4.318 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCCn1cc[nH+]c1C ZINC000535051676 334360458 /nfs/dbraw/zinc/36/04/58/334360458.db2.gz WNWBQZHXRJIVBR-KRWDZBQOSA-N 2 1 305.853 4.318 20 0 DIADMP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2F)CC1 ZINC000535083001 334366674 /nfs/dbraw/zinc/36/66/74/334366674.db2.gz RTRRAYJEEBPJAV-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2F)CC1 ZINC000535083001 334366675 /nfs/dbraw/zinc/36/66/75/334366675.db2.gz RTRRAYJEEBPJAV-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc2c(s1)CCCC2 ZINC000164630136 334635762 /nfs/dbraw/zinc/63/57/62/334635762.db2.gz SYGIAIBOESKNKC-CQSZACIVSA-N 2 1 317.502 4.263 20 0 DIADMP CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CCCCn1ccnc1C ZINC000343952309 335207401 /nfs/dbraw/zinc/20/74/01/335207401.db2.gz ZZWLXSHANMREQM-IBGZPJMESA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@@H](c1cccc(OC)c1)[N@H+](C)CCCCn1cc[nH+]c1C ZINC000343952309 335207403 /nfs/dbraw/zinc/20/74/03/335207403.db2.gz ZZWLXSHANMREQM-IBGZPJMESA-N 2 1 315.461 4.063 20 0 DIADMP CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CCCCn1cc[nH+]c1C ZINC000343952309 335207404 /nfs/dbraw/zinc/20/74/04/335207404.db2.gz ZZWLXSHANMREQM-IBGZPJMESA-N 2 1 315.461 4.063 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000344169735 335226984 /nfs/dbraw/zinc/22/69/84/335226984.db2.gz MOJCAGOJERCWSY-JXFKEZNVSA-N 2 1 311.473 4.349 20 0 DIADMP C[C@H](CC1CC1)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000344743089 335272649 /nfs/dbraw/zinc/27/26/49/335272649.db2.gz KBISAQJAQUYPRM-MRXNPFEDSA-N 2 1 312.457 4.190 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](CC1CCCCC1)C1CC1 ZINC000346145200 335381209 /nfs/dbraw/zinc/38/12/09/335381209.db2.gz GKNFZBGBEYAQMF-UHFFFAOYSA-N 2 1 324.472 4.120 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000346165735 335384284 /nfs/dbraw/zinc/38/42/84/335384284.db2.gz FBERFKIYGBFSEG-FQEVSTJZSA-N 2 1 324.472 4.120 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2cccc(F)c2)cc1 ZINC000346224236 335385964 /nfs/dbraw/zinc/38/59/64/335385964.db2.gz WKDFWEFKVSHGJB-OAHLLOKOSA-N 2 1 323.415 4.213 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1C(C)(C)C ZINC000535839400 335792499 /nfs/dbraw/zinc/79/24/99/335792499.db2.gz YXUXOSRTIILABW-HNNXBMFYSA-N 2 1 300.490 4.262 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CCN([C@H](C)c2cccc(Cl)c2F)C1 ZINC000480555890 336031091 /nfs/dbraw/zinc/03/10/91/336031091.db2.gz RLNHQAJUWYPIPG-KGLIPLIRSA-N 2 1 312.860 4.204 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000395239381 336053766 /nfs/dbraw/zinc/05/37/66/336053766.db2.gz XWHZSQUSDFAVEY-GOSISDBHSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000395239381 336053769 /nfs/dbraw/zinc/05/37/69/336053769.db2.gz XWHZSQUSDFAVEY-GOSISDBHSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2cc(C)ccc2C)C1 ZINC000324089072 336079640 /nfs/dbraw/zinc/07/96/40/336079640.db2.gz JCNZAESMXZYPIE-KNQAVFIVSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccccc1Cl)CC1CC1 ZINC000352257765 336207515 /nfs/dbraw/zinc/20/75/15/336207515.db2.gz XFRBBWAMBJVKSQ-UHFFFAOYSA-N 2 1 317.864 4.147 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccccc1Cl)CC1CC1 ZINC000352257765 336207516 /nfs/dbraw/zinc/20/75/16/336207516.db2.gz XFRBBWAMBJVKSQ-UHFFFAOYSA-N 2 1 317.864 4.147 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000352357475 336214018 /nfs/dbraw/zinc/21/40/18/336214018.db2.gz NTABHQPAMLMORN-OAHLLOKOSA-N 2 1 324.415 4.059 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cnc(C(C)C)s1 ZINC000532328867 336240641 /nfs/dbraw/zinc/24/06/41/336240641.db2.gz BJBREXVSCALJHV-RDJZCZTQSA-N 2 1 323.550 4.257 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1Cl ZINC000532482763 336251632 /nfs/dbraw/zinc/25/16/32/336251632.db2.gz BPFKSDDASRIQDD-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(-c2cccs2)cc1 ZINC000532507086 336252664 /nfs/dbraw/zinc/25/26/64/336252664.db2.gz VOCFLXXDELDTBX-JKSUJKDBSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Oc2ccccc2)cc1 ZINC000532505381 336252712 /nfs/dbraw/zinc/25/27/12/336252712.db2.gz IDQXNACWUYELNY-ZWKOTPCHSA-N 2 1 324.468 4.471 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000532509434 336252862 /nfs/dbraw/zinc/25/28/62/336252862.db2.gz VAORGPSTAYIFTR-MJGOQNOKSA-N 2 1 322.924 4.229 20 0 DIADMP C[N@H+](CCC1CCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000532711573 336267954 /nfs/dbraw/zinc/26/79/54/336267954.db2.gz NQSZZGMWNITMHY-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](CCC1CCCC1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000532711573 336267955 /nfs/dbraw/zinc/26/79/55/336267955.db2.gz NQSZZGMWNITMHY-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP COc1ccc2cc([C@H](C)N[C@H]3CC[N@H+]4CCCC[C@H]34)ccc2c1 ZINC000324893321 336271426 /nfs/dbraw/zinc/27/14/26/336271426.db2.gz ONFKKYGKAMROCU-ONGXBYRLSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@H]3CCN4CCCC[C@H]34)ccc2c1 ZINC000324893321 336271427 /nfs/dbraw/zinc/27/14/27/336271427.db2.gz ONFKKYGKAMROCU-ONGXBYRLSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCCC[C@H]34)ccc2c1 ZINC000324893321 336271428 /nfs/dbraw/zinc/27/14/28/336271428.db2.gz ONFKKYGKAMROCU-ONGXBYRLSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCCC[C@H]34)ccc2c1 ZINC000324893321 336271429 /nfs/dbraw/zinc/27/14/29/336271429.db2.gz ONFKKYGKAMROCU-ONGXBYRLSA-N 2 1 324.468 4.126 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000417994402 336287128 /nfs/dbraw/zinc/28/71/28/336287128.db2.gz YVNKARUWPISPKG-GZMOKQHVSA-N 2 1 312.501 4.033 20 0 DIADMP CC[NH+](CC)Cc1ccc(CNc2[nH]c3ccccc3[nH+]2)cc1 ZINC000301066587 336288142 /nfs/dbraw/zinc/28/81/42/336288142.db2.gz GQLACWJERAVYLZ-UHFFFAOYSA-N 2 1 308.429 4.017 20 0 DIADMP Clc1c[nH+]ccc1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000301500790 336310791 /nfs/dbraw/zinc/31/07/91/336310791.db2.gz FZCSPGVMLLRYNY-UHFFFAOYSA-N 2 1 307.869 4.192 20 0 DIADMP CCCC[N@H+](C)CC1CCN(c2cc[nH+]c3ccsc32)CC1 ZINC000301526901 336312659 /nfs/dbraw/zinc/31/26/59/336312659.db2.gz NUDXGUUUBLKBJE-UHFFFAOYSA-N 2 1 317.502 4.245 20 0 DIADMP CCCC[N@@H+](C)CC1CCN(c2cc[nH+]c3ccsc32)CC1 ZINC000301526901 336312660 /nfs/dbraw/zinc/31/26/60/336312660.db2.gz NUDXGUUUBLKBJE-UHFFFAOYSA-N 2 1 317.502 4.245 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000514100251 336332223 /nfs/dbraw/zinc/33/22/23/336332223.db2.gz URYANVYHCKICLF-FFZOFVMBSA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+](CC)CCC[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000514118991 336370073 /nfs/dbraw/zinc/37/00/73/336370073.db2.gz PTIYFWZFKDSDFS-UHFFFAOYSA-N 2 1 314.395 4.016 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000152443318 336384386 /nfs/dbraw/zinc/38/43/86/336384386.db2.gz JMGQLVPDFBGHPR-HOTGVXAUSA-N 2 1 318.530 4.322 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000152470332 336388826 /nfs/dbraw/zinc/38/88/26/336388826.db2.gz DXKRVUNSZGRYCG-NEPJUHHUSA-N 2 1 313.272 4.128 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](CCC(C)C)c1ccoc1 ZINC000353401468 336415608 /nfs/dbraw/zinc/41/56/08/336415608.db2.gz IDPILBABTYMZPR-CRAIPNDOSA-N 2 1 303.450 4.188 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cnccc2C)cc1 ZINC000356700873 336558651 /nfs/dbraw/zinc/55/86/51/336558651.db2.gz ROCPMVWOBKGOSH-HOTGVXAUSA-N 2 1 320.440 4.296 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H]2C[C@@H](C)Sc3sccc32)CC1 ZINC000358025511 336607104 /nfs/dbraw/zinc/60/71/04/336607104.db2.gz SBKLYVDYMCWPPU-CJNGLKHVSA-N 2 1 324.559 4.384 20 0 DIADMP C[C@H](C[NH2+][C@H]1CCSc2ccc(F)cc21)C[NH+]1CCCCC1 ZINC000360151989 336703107 /nfs/dbraw/zinc/70/31/07/336703107.db2.gz XJKLDYFVUXNXFN-PBHICJAKSA-N 2 1 322.493 4.074 20 0 DIADMP CSC1(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)CCC1 ZINC000368217206 336840362 /nfs/dbraw/zinc/84/03/62/336840362.db2.gz WOAWLVWMNTWRSV-INIZCTEOSA-N 2 1 318.530 4.087 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@]2(C)CCCS2)cc1 ZINC000120449689 336912192 /nfs/dbraw/zinc/91/21/92/336912192.db2.gz ISHDICGGZZIICJ-KDOFPFPSSA-N 2 1 315.486 4.117 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(F)cc(Cl)c2)c1 ZINC000485700329 337003448 /nfs/dbraw/zinc/00/34/48/337003448.db2.gz XHTLYPMWCBTIBK-UHFFFAOYSA-N 2 1 320.839 4.221 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccsc2)cc1F ZINC000178625768 337165657 /nfs/dbraw/zinc/16/56/57/337165657.db2.gz TWQKICFOPYMZPW-GFCCVEGCSA-N 2 1 315.417 4.232 20 0 DIADMP CCc1nc(C[NH+]2CCC(CCC[NH+](CC)CC)CC2)cs1 ZINC000182777545 337189764 /nfs/dbraw/zinc/18/97/64/337189764.db2.gz YYCMGMKFZSIRAP-UHFFFAOYSA-N 2 1 323.550 4.040 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cncc(C)c2)cc1 ZINC000184384538 337198151 /nfs/dbraw/zinc/19/81/51/337198151.db2.gz BGXDEQHZKYDVPZ-JKSUJKDBSA-N 2 1 320.440 4.296 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CCCC3)C2)s1 ZINC000582872090 337209486 /nfs/dbraw/zinc/20/94/86/337209486.db2.gz TYOODNUXXJRDMJ-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CCCC3)C2)s1 ZINC000582872090 337209487 /nfs/dbraw/zinc/20/94/87/337209487.db2.gz TYOODNUXXJRDMJ-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CCCC3)C2)s1 ZINC000582872090 337209488 /nfs/dbraw/zinc/20/94/88/337209488.db2.gz TYOODNUXXJRDMJ-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024176 337226394 /nfs/dbraw/zinc/22/63/94/337226394.db2.gz MBZMHSZMGZOVOL-RBUKOAKNSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024176 337226395 /nfs/dbraw/zinc/22/63/95/337226395.db2.gz MBZMHSZMGZOVOL-RBUKOAKNSA-N 2 1 310.485 4.106 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H](CC)c1ccccc1 ZINC000583171223 337251428 /nfs/dbraw/zinc/25/14/28/337251428.db2.gz YVMJCKSFZOPQDG-GOSISDBHSA-N 2 1 313.489 4.351 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H](CC)c1ccccc1 ZINC000583171223 337251429 /nfs/dbraw/zinc/25/14/29/337251429.db2.gz YVMJCKSFZOPQDG-GOSISDBHSA-N 2 1 313.489 4.351 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C)nc2C)cc1 ZINC000187439740 337266042 /nfs/dbraw/zinc/26/60/42/337266042.db2.gz OHWAYGSGCCFZLW-HNNXBMFYSA-N 2 1 320.440 4.043 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(C)CCCC1 ZINC000398115759 337306245 /nfs/dbraw/zinc/30/62/45/337306245.db2.gz FNPWSSJFSJZMNW-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)c1C ZINC000422734057 337684482 /nfs/dbraw/zinc/68/44/82/337684482.db2.gz CCAUROIRNSCWQF-PMACEKPBSA-N 2 1 319.452 4.328 20 0 DIADMP C[C@@H]([NH2+]CC1(c2cccs2)CCCCC1)c1c[nH+]ccc1N ZINC000422775069 337685973 /nfs/dbraw/zinc/68/59/73/337685973.db2.gz ZTFBZQWWAMIPEO-CQSZACIVSA-N 2 1 315.486 4.108 20 0 DIADMP c1ccc([C@@H]([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)cc1 ZINC000422813825 337687866 /nfs/dbraw/zinc/68/78/66/337687866.db2.gz ZWOYLXBHFSLKQK-PCCBWWKXSA-N 2 1 306.453 4.221 20 0 DIADMP C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc2ccccc21)C1C[NH2+]C1 ZINC000422911265 337690888 /nfs/dbraw/zinc/69/08/88/337690888.db2.gz SNJRWPIAHINXOS-AOMKIAJQSA-N 2 1 316.448 4.127 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccccc1)c1cccc2ccccc21)C1C[NH2+]C1 ZINC000422911266 337690949 /nfs/dbraw/zinc/69/09/49/337690949.db2.gz SNJRWPIAHINXOS-KSFYIVLOSA-N 2 1 316.448 4.127 20 0 DIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000422935219 337692442 /nfs/dbraw/zinc/69/24/42/337692442.db2.gz DJDQXPCQIZLXFJ-OZVIIMIRSA-N 2 1 308.878 4.206 20 0 DIADMP C[C@H]([NH3+])C[C@H](C)[NH2+]C1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423082200 337698534 /nfs/dbraw/zinc/69/85/34/337698534.db2.gz WMHDAJYYIVUASK-UWVGGRQHSA-N 2 1 320.786 4.063 20 0 DIADMP C[C@@]1(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000423140196 337701433 /nfs/dbraw/zinc/70/14/33/337701433.db2.gz XRYUZMKDVISRDR-CMOCDZPBSA-N 2 1 320.480 4.263 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]C3CCc4ccccc4CC3)CC[NH2+]2)cc1 ZINC000423155464 337701941 /nfs/dbraw/zinc/70/19/41/337701941.db2.gz LDTBQJDAZZYCKQ-YADHBBJMSA-N 2 1 320.480 4.017 20 0 DIADMP Clc1ccccc1C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccsc1 ZINC000423187113 337702996 /nfs/dbraw/zinc/70/29/96/337702996.db2.gz OZLGMBMKXBEWHZ-QGZVFWFLSA-N 2 1 320.889 4.027 20 0 DIADMP COc1cc([C@@H](C)[NH2+]CC2([NH3+])CCCCCC2)ccc1SC ZINC000423201656 337703743 /nfs/dbraw/zinc/70/37/43/337703743.db2.gz PKDVKRUFGVWJBI-CQSZACIVSA-N 2 1 322.518 4.119 20 0 DIADMP Clc1ccc([C@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2ccccc2)cc1 ZINC000423212697 337704553 /nfs/dbraw/zinc/70/45/53/337704553.db2.gz MAUXMFMXPVSZCF-HNAYVOBHSA-N 2 1 314.860 4.019 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cs1 ZINC000423295625 337710696 /nfs/dbraw/zinc/71/06/96/337710696.db2.gz XAUSBZYYVSNPTC-STQMWFEESA-N 2 1 303.475 4.137 20 0 DIADMP CC1(C)CC([NH2+]Cc2ccsc2C(F)(F)F)CC(C)(C)[NH2+]1 ZINC000527630791 337752913 /nfs/dbraw/zinc/75/29/13/337752913.db2.gz HLXCTWJSBKCKLA-UHFFFAOYSA-N 2 1 320.424 4.166 20 0 DIADMP c1ccc(C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000122848041 337925947 /nfs/dbraw/zinc/92/59/47/337925947.db2.gz YJKINICHGGYWGJ-QFIPXVFZSA-N 2 1 320.480 4.187 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2OCC)CC1 ZINC000122968752 337935001 /nfs/dbraw/zinc/93/50/01/337935001.db2.gz VJKQQXRHVLRIBZ-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000315017363 337979281 /nfs/dbraw/zinc/97/92/81/337979281.db2.gz KTMRRMOTEISDTA-ZIAGYGMSSA-N 2 1 323.550 4.132 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+][C@H]3CCC[C@H]([NH+](C)C)C3)oc2c1 ZINC000426032183 338019797 /nfs/dbraw/zinc/01/97/97/338019797.db2.gz XDKOEZBLHHYGLP-XIRDDKMYSA-N 2 1 300.446 4.265 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](CCCc2cccc3ccccc32)CC1 ZINC000429534473 338083306 /nfs/dbraw/zinc/08/33/06/338083306.db2.gz DUTLNKOPQZGLSE-FQEVSTJZSA-N 2 1 310.485 4.189 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]CCSCc2ccccc2)C1 ZINC000430750461 338113457 /nfs/dbraw/zinc/11/34/57/338113457.db2.gz NWSMAEOXKUGMPI-SFHVURJKSA-N 2 1 320.546 4.022 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]CCSCc1ccccc1 ZINC000430749741 338113511 /nfs/dbraw/zinc/11/35/11/338113511.db2.gz LHXXICNTXGYLRX-SFHVURJKSA-N 2 1 320.546 4.164 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000431332105 338128270 /nfs/dbraw/zinc/12/82/70/338128270.db2.gz IWEKAGSNLZHFSO-MDZRGWNJSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000431332105 338128271 /nfs/dbraw/zinc/12/82/71/338128271.db2.gz IWEKAGSNLZHFSO-MDZRGWNJSA-N 2 1 316.489 4.096 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000448523456 338152424 /nfs/dbraw/zinc/15/24/24/338152424.db2.gz ZIYIVLUSPSCYHX-MSOLQXFVSA-N 2 1 316.832 4.339 20 0 DIADMP CCCC[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccccc1 ZINC000432441060 338156611 /nfs/dbraw/zinc/15/66/11/338156611.db2.gz JJMAJOSMEQCGLJ-ICSRJNTNSA-N 2 1 318.505 4.008 20 0 DIADMP CC[NH+](Cc1cc(C[N@H+](CC)C(C)C)cc(OC)c1)C(C)C ZINC000432941882 338174632 /nfs/dbraw/zinc/17/46/32/338174632.db2.gz ZCDQOWNKIJEFHE-UHFFFAOYSA-N 2 1 306.494 4.156 20 0 DIADMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311845 338191312 /nfs/dbraw/zinc/19/13/12/338191312.db2.gz OCDSLEBEVDIWOW-FUHWJXTLSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311845 338191313 /nfs/dbraw/zinc/19/13/13/338191313.db2.gz OCDSLEBEVDIWOW-FUHWJXTLSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311845 338191314 /nfs/dbraw/zinc/19/13/14/338191314.db2.gz OCDSLEBEVDIWOW-FUHWJXTLSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433311845 338191315 /nfs/dbraw/zinc/19/13/15/338191315.db2.gz OCDSLEBEVDIWOW-FUHWJXTLSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311844 338191483 /nfs/dbraw/zinc/19/14/83/338191483.db2.gz OCDSLEBEVDIWOW-AEFFLSMTSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311844 338191484 /nfs/dbraw/zinc/19/14/84/338191484.db2.gz OCDSLEBEVDIWOW-AEFFLSMTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311844 338191485 /nfs/dbraw/zinc/19/14/85/338191485.db2.gz OCDSLEBEVDIWOW-AEFFLSMTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311844 338191486 /nfs/dbraw/zinc/19/14/86/338191486.db2.gz OCDSLEBEVDIWOW-AEFFLSMTSA-N 2 1 306.881 4.004 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)C1 ZINC000436228248 338262595 /nfs/dbraw/zinc/26/25/95/338262595.db2.gz AYKZXFWQKZUQCE-NJDAHSKKSA-N 2 1 314.517 4.108 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000436232941 338262745 /nfs/dbraw/zinc/26/27/45/338262745.db2.gz QLPYIFJPWRNFGN-HOJAQTOUSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)CCc3ccccc32)CC[N@@H+]1C ZINC000436295829 338266983 /nfs/dbraw/zinc/26/69/83/338266983.db2.gz SGWWGTVKYKSTDU-HHXXYDBFSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)CCc3ccccc32)CC[N@H+]1C ZINC000436295829 338266984 /nfs/dbraw/zinc/26/69/84/338266984.db2.gz SGWWGTVKYKSTDU-HHXXYDBFSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436312123 338268524 /nfs/dbraw/zinc/26/85/24/338268524.db2.gz JRERLDIJFHQYLA-NRSPTQNISA-N 2 1 314.517 4.280 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000437778916 338321070 /nfs/dbraw/zinc/32/10/70/338321070.db2.gz BGCHNJXCMDCXOK-SOLBZPMBSA-N 2 1 318.480 4.172 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCCCOc2ccccc2)C[C@@H]1C ZINC000438092858 338330917 /nfs/dbraw/zinc/33/09/17/338330917.db2.gz BIFQPSVXJWYLDY-OALUTQOASA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCCCOc2ccccc2)C[C@@H]1C ZINC000438092858 338330918 /nfs/dbraw/zinc/33/09/18/338330918.db2.gz BIFQPSVXJWYLDY-OALUTQOASA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCCCOc2ccccc2)C[C@@H]1C ZINC000438092858 338330919 /nfs/dbraw/zinc/33/09/19/338330919.db2.gz BIFQPSVXJWYLDY-OALUTQOASA-N 2 1 318.505 4.040 20 0 DIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438215244 338336824 /nfs/dbraw/zinc/33/68/24/338336824.db2.gz YRXXRZVCVGJKPE-ZVDSWSACSA-N 2 1 320.443 4.064 20 0 DIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438215244 338336825 /nfs/dbraw/zinc/33/68/25/338336825.db2.gz YRXXRZVCVGJKPE-ZVDSWSACSA-N 2 1 320.443 4.064 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000438844981 338353571 /nfs/dbraw/zinc/35/35/71/338353571.db2.gz XJWYMZLSVXVBEU-AABGKKOBSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000438844981 338353572 /nfs/dbraw/zinc/35/35/72/338353572.db2.gz XJWYMZLSVXVBEU-AABGKKOBSA-N 2 1 323.484 4.070 20 0 DIADMP FC(F)C1CCC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000442652921 338426834 /nfs/dbraw/zinc/42/68/34/338426834.db2.gz QLPYKPMXKWNVLL-UHFFFAOYSA-N 2 1 322.443 4.065 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC000449060711 338589366 /nfs/dbraw/zinc/58/93/66/338589366.db2.gz DTEBLTGZGCEIPC-SFHVURJKSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccccc1Oc1ccccc1 ZINC000459392547 339026652 /nfs/dbraw/zinc/02/66/52/339026652.db2.gz LMSTZNNBQWPBOB-INIZCTEOSA-N 2 1 321.424 4.106 20 0 DIADMP Cc1ccc(N2CCC([NH2+]Cc3ccc(C4CC4)cc3)CC2)[nH+]c1 ZINC000459424579 339028358 /nfs/dbraw/zinc/02/83/58/339028358.db2.gz GWARBTLDOJVAOD-UHFFFAOYSA-N 2 1 321.468 4.026 20 0 DIADMP Cc1cc(F)c(C[NH2+]Cc2cccc(C[NH+](C)C)c2)c(Cl)c1 ZINC000459466324 339030738 /nfs/dbraw/zinc/03/07/38/339030738.db2.gz OIANKKVLOXZNTH-UHFFFAOYSA-N 2 1 320.839 4.139 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459568376 339036335 /nfs/dbraw/zinc/03/63/35/339036335.db2.gz BPXPVOSIUJLWJK-LJQANCHMSA-N 2 1 309.457 4.199 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459568376 339036336 /nfs/dbraw/zinc/03/63/36/339036336.db2.gz BPXPVOSIUJLWJK-LJQANCHMSA-N 2 1 309.457 4.199 20 0 DIADMP c1ccc([C@@H]2CCCC[C@@H]2C[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459568145 339036442 /nfs/dbraw/zinc/03/64/42/339036442.db2.gz JFYCAKIJWQXLSM-NQIIRXRSSA-N 2 1 312.501 4.177 20 0 DIADMP Fc1ccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1Cl ZINC000459586630 339037346 /nfs/dbraw/zinc/03/73/46/339037346.db2.gz VOIBXCDUTHELPI-GOSISDBHSA-N 2 1 322.855 4.147 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H]1CCC[C@H]1c1ccccc1 ZINC000459689502 339043161 /nfs/dbraw/zinc/04/31/61/339043161.db2.gz GLJRKEYLNJWGJI-PMACEKPBSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H]1CCC[C@H]1c1ccccc1 ZINC000459689502 339043162 /nfs/dbraw/zinc/04/31/62/339043162.db2.gz GLJRKEYLNJWGJI-PMACEKPBSA-N 2 1 311.473 4.240 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000459721007 339044266 /nfs/dbraw/zinc/04/42/66/339044266.db2.gz ABYPUDLZTHIBJX-OXQOHEQNSA-N 2 1 316.464 4.083 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)C1 ZINC000462672795 339083834 /nfs/dbraw/zinc/08/38/34/339083834.db2.gz GGKFJBZUFYNFFI-MBOZVWFJSA-N 2 1 300.490 4.197 20 0 DIADMP CCC1CCC([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000462772482 339087832 /nfs/dbraw/zinc/08/78/32/339087832.db2.gz IFIOPAKCMYOMLH-VEDCXYSMSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801022 339089743 /nfs/dbraw/zinc/08/97/43/339089743.db2.gz BAXYSZQEZUGDFL-ZYSHUDEJSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(OC(C)(C)C)cc1 ZINC000462801022 339089744 /nfs/dbraw/zinc/08/97/44/339089744.db2.gz BAXYSZQEZUGDFL-ZYSHUDEJSA-N 2 1 316.489 4.141 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462837010 339093526 /nfs/dbraw/zinc/09/35/26/339093526.db2.gz VJMHPEDTPCVCBB-TXJVSEOTSA-N 2 1 300.490 4.018 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462837010 339093527 /nfs/dbraw/zinc/09/35/27/339093527.db2.gz VJMHPEDTPCVCBB-TXJVSEOTSA-N 2 1 300.490 4.018 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911836 339097690 /nfs/dbraw/zinc/09/76/90/339097690.db2.gz PACFSWWGAAYBKV-UZLBHIALSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911836 339097691 /nfs/dbraw/zinc/09/76/91/339097691.db2.gz PACFSWWGAAYBKV-UZLBHIALSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911836 339097692 /nfs/dbraw/zinc/09/76/92/339097692.db2.gz PACFSWWGAAYBKV-UZLBHIALSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC000462911836 339097693 /nfs/dbraw/zinc/09/76/93/339097693.db2.gz PACFSWWGAAYBKV-UZLBHIALSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000463075787 339104539 /nfs/dbraw/zinc/10/45/39/339104539.db2.gz RFUGNUBPBBIAQR-OXQOHEQNSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000463133408 339106741 /nfs/dbraw/zinc/10/67/41/339106741.db2.gz YEKQRLQELKSBOK-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000463133408 339106742 /nfs/dbraw/zinc/10/67/42/339106742.db2.gz YEKQRLQELKSBOK-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463132674 339106799 /nfs/dbraw/zinc/10/67/99/339106799.db2.gz BLTLCEWQNVTXQP-DENIHFKCSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000463132674 339106800 /nfs/dbraw/zinc/10/68/00/339106800.db2.gz BLTLCEWQNVTXQP-DENIHFKCSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000463141518 339106988 /nfs/dbraw/zinc/10/69/88/339106988.db2.gz CCJVSHSZFWCPOF-WAOWUJCRSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1 ZINC000463141518 339106989 /nfs/dbraw/zinc/10/69/89/339106989.db2.gz CCJVSHSZFWCPOF-WAOWUJCRSA-N 2 1 308.469 4.390 20 0 DIADMP CCC1(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CCC1 ZINC000463189268 339108684 /nfs/dbraw/zinc/10/86/84/339108684.db2.gz GQSOGXREAQSXEJ-UHFFFAOYSA-N 2 1 318.480 4.003 20 0 DIADMP CC(C)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207285 339109360 /nfs/dbraw/zinc/10/93/60/339109360.db2.gz RPAGXGPUMZOCFQ-PKOBYXMFSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207285 339109361 /nfs/dbraw/zinc/10/93/61/339109361.db2.gz RPAGXGPUMZOCFQ-PKOBYXMFSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463279857 339113023 /nfs/dbraw/zinc/11/30/23/339113023.db2.gz GLRCGGMBYCXDFH-UWVAXJGDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463279857 339113024 /nfs/dbraw/zinc/11/30/24/339113024.db2.gz GLRCGGMBYCXDFH-UWVAXJGDSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H](c3ccccc3)C2(C)C)C1 ZINC000464082606 339133677 /nfs/dbraw/zinc/13/36/77/339133677.db2.gz PEAPKWNVMKDVPO-HOJAQTOUSA-N 2 1 314.517 4.279 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000464782037 339153229 /nfs/dbraw/zinc/15/32/29/339153229.db2.gz VBJYFMLEZBYFQR-QAPCUYQASA-N 2 1 308.897 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C[NH+](CC)CC)C1 ZINC000464782037 339153230 /nfs/dbraw/zinc/15/32/30/339153230.db2.gz VBJYFMLEZBYFQR-QAPCUYQASA-N 2 1 308.897 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000464782038 339153413 /nfs/dbraw/zinc/15/34/13/339153413.db2.gz VBJYFMLEZBYFQR-YJBOKZPZSA-N 2 1 308.897 4.455 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000464782038 339153414 /nfs/dbraw/zinc/15/34/14/339153414.db2.gz VBJYFMLEZBYFQR-YJBOKZPZSA-N 2 1 308.897 4.455 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000464842713 339156930 /nfs/dbraw/zinc/15/69/30/339156930.db2.gz KWUMRTCCDCOFBK-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C)c(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000464842713 339156931 /nfs/dbraw/zinc/15/69/31/339156931.db2.gz KWUMRTCCDCOFBK-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C)c(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000464842713 339156932 /nfs/dbraw/zinc/15/69/32/339156932.db2.gz KWUMRTCCDCOFBK-NRFANRHFSA-N 2 1 322.496 4.257 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCCC[C@@H]1C ZINC000466357954 339200473 /nfs/dbraw/zinc/20/04/73/339200473.db2.gz ZYZWYJVONFGCRQ-FXQLRMTLSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCCC[C@@H]1C ZINC000466357954 339200474 /nfs/dbraw/zinc/20/04/74/339200474.db2.gz ZYZWYJVONFGCRQ-FXQLRMTLSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H](C[N@@H+]1CCC[C@@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460538 339205839 /nfs/dbraw/zinc/20/58/39/339205839.db2.gz CNMYILILXFYXQM-WXLSXGNJSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460538 339205840 /nfs/dbraw/zinc/20/58/40/339205840.db2.gz CNMYILILXFYXQM-WXLSXGNJSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](C[N@@H+]1CCC[C@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460536 339205858 /nfs/dbraw/zinc/20/58/58/339205858.db2.gz CNMYILILXFYXQM-QRNKSROTSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460536 339205859 /nfs/dbraw/zinc/20/58/59/339205859.db2.gz CNMYILILXFYXQM-QRNKSROTSA-N 2 1 320.443 4.065 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1Cl ZINC000467382216 339235719 /nfs/dbraw/zinc/23/57/19/339235719.db2.gz OIPYGDCTHYUPPB-GDBMZVCRSA-N 2 1 324.896 4.091 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1Cl ZINC000467382216 339235720 /nfs/dbraw/zinc/23/57/20/339235720.db2.gz OIPYGDCTHYUPPB-GDBMZVCRSA-N 2 1 324.896 4.091 20 0 DIADMP C[C@@H]1CCC[C@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000467454656 339239796 /nfs/dbraw/zinc/23/97/96/339239796.db2.gz QAOJUVGHLWLXHC-KPACCLEDSA-N 2 1 312.501 4.208 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)C1 ZINC000469126370 339280808 /nfs/dbraw/zinc/28/08/08/339280808.db2.gz XYGXWFNNZFLEFU-CRAIPNDOSA-N 2 1 306.881 4.113 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469740360 339297489 /nfs/dbraw/zinc/29/74/89/339297489.db2.gz XGXKSGWTVKURAK-KKSFZXQISA-N 2 1 318.420 4.449 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000469740357 339297529 /nfs/dbraw/zinc/29/75/29/339297529.db2.gz XGXKSGWTVKURAK-HRAATJIYSA-N 2 1 318.420 4.449 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000469789526 339300192 /nfs/dbraw/zinc/30/01/92/339300192.db2.gz YRSLHODBPSEVGN-SQGPQFPESA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000469789526 339300193 /nfs/dbraw/zinc/30/01/93/339300193.db2.gz YRSLHODBPSEVGN-SQGPQFPESA-N 2 1 300.490 4.065 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000470000823 339307858 /nfs/dbraw/zinc/30/78/58/339307858.db2.gz UTPOCHFFRJNRBG-CYBMUJFWSA-N 2 1 320.889 4.110 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(Cc3ccccc3)CCCCC2)CC[N@H+]1C ZINC000471591809 339348539 /nfs/dbraw/zinc/34/85/39/339348539.db2.gz AIVGKDIHQHKZOO-AZUAARDMSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(Cc3ccccc3)CCCCC2)CC[N@H+]1C ZINC000471591813 339348550 /nfs/dbraw/zinc/34/85/50/339348550.db2.gz AIVGKDIHQHKZOO-ICSRJNTNSA-N 2 1 314.517 4.252 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000471761598 339353374 /nfs/dbraw/zinc/35/33/74/339353374.db2.gz UDWZTQVVWCWCFF-KRWDZBQOSA-N 2 1 319.880 4.383 20 0 DIADMP CC(C)CC[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)cc1 ZINC000471771599 339353588 /nfs/dbraw/zinc/35/35/88/339353588.db2.gz NQXCZIDNKKAAIZ-GOSISDBHSA-N 2 1 319.880 4.383 20 0 DIADMP Fc1cccc(Cl)c1CCC[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000472579320 339374272 /nfs/dbraw/zinc/37/42/72/339374272.db2.gz HXJJBPGYXSFESP-CYBMUJFWSA-N 2 1 321.827 4.014 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(-c3ccccc3)o2)CC1 ZINC000472593876 339374834 /nfs/dbraw/zinc/37/48/34/339374834.db2.gz BVRVMHXODYYWIS-UHFFFAOYSA-N 2 1 310.441 4.007 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000472727388 339376592 /nfs/dbraw/zinc/37/65/92/339376592.db2.gz GFGFJFCQMBSSFV-FUHWJXTLSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000472727388 339376593 /nfs/dbraw/zinc/37/65/93/339376593.db2.gz GFGFJFCQMBSSFV-FUHWJXTLSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000472727388 339376594 /nfs/dbraw/zinc/37/65/94/339376594.db2.gz GFGFJFCQMBSSFV-FUHWJXTLSA-N 2 1 306.881 4.004 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)C1CCC(F)(F)CC1 ZINC000474047179 339398860 /nfs/dbraw/zinc/39/88/60/339398860.db2.gz PEXYVHALPXFUIG-HOTGVXAUSA-N 2 1 316.480 4.302 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)C1CCC(F)(F)CC1 ZINC000474047300 339399002 /nfs/dbraw/zinc/39/90/02/339399002.db2.gz PPHWZEHEEYPLOG-HOTGVXAUSA-N 2 1 316.480 4.445 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)[NH+]1CCCCC1)C1CCC(F)(F)CC1 ZINC000474049665 339399217 /nfs/dbraw/zinc/39/92/17/339399217.db2.gz AXNIXZJVIWDKRN-AWEZNQCLSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1CC[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000474055438 339399642 /nfs/dbraw/zinc/39/96/42/339399642.db2.gz LBGUGXCGNIFNBC-ZBFHGGJFSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@H]1CCCC[N@H+]1CC[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000474055438 339399643 /nfs/dbraw/zinc/39/96/43/339399643.db2.gz LBGUGXCGNIFNBC-ZBFHGGJFSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1CC[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000474055436 339399692 /nfs/dbraw/zinc/39/96/92/339399692.db2.gz LBGUGXCGNIFNBC-HOCLYGCPSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@H]1CCCC[N@H+]1CC[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000474055436 339399693 /nfs/dbraw/zinc/39/96/93/339399693.db2.gz LBGUGXCGNIFNBC-HOCLYGCPSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@H](C[NH+]1CCCCCC1)[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000474056565 339399761 /nfs/dbraw/zinc/39/97/61/339399761.db2.gz LNJFVMTVPZZJPS-CABCVRRESA-N 2 1 302.453 4.055 20 0 DIADMP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000484495712 339688023 /nfs/dbraw/zinc/68/80/23/339688023.db2.gz QMSDFVVFPRMWBM-MRXNPFEDSA-N 2 1 316.489 4.143 20 0 DIADMP CCC(CC)(C[NH2+]C[C@H]1CCSC1)[NH2+][C@H](C)c1ccccc1 ZINC000487288269 339749291 /nfs/dbraw/zinc/74/92/91/339749291.db2.gz MOAGYHZHRBEJIB-IAGOWNOFSA-N 2 1 320.546 4.239 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCC(C)(C)C)CC1 ZINC000496868206 340014945 /nfs/dbraw/zinc/01/49/45/340014945.db2.gz NASGCDYPFWEKJJ-UHFFFAOYSA-N 2 1 302.506 4.267 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCc3ccccc3)C2)CC1 ZINC000498818370 340023887 /nfs/dbraw/zinc/02/38/87/340023887.db2.gz PEPNQRJRNRQEDV-OAQYLSRUSA-N 2 1 314.517 4.063 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000498928809 340026240 /nfs/dbraw/zinc/02/62/40/340026240.db2.gz JOCHOIQWCUZRGU-JKSUJKDBSA-N 2 1 306.453 4.219 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000499058741 340028868 /nfs/dbraw/zinc/02/88/68/340028868.db2.gz YFMBFLBGRDHJPA-UHFFFAOYSA-N 2 1 317.864 4.290 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000499058741 340028869 /nfs/dbraw/zinc/02/88/69/340028869.db2.gz YFMBFLBGRDHJPA-UHFFFAOYSA-N 2 1 317.864 4.290 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499143300 340030988 /nfs/dbraw/zinc/03/09/88/340030988.db2.gz SZCYOCOQTWQIPV-LELZANKISA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)(C)CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499148679 340031109 /nfs/dbraw/zinc/03/11/09/340031109.db2.gz DDDNFSJRRAQTJI-LDLYASANSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2CCCCCC2)C3)cc1 ZINC000499160179 340031389 /nfs/dbraw/zinc/03/13/89/340031389.db2.gz IAUFSOKWKGPPDD-WKCHPHFGSA-N 2 1 312.501 4.494 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499247579 340033237 /nfs/dbraw/zinc/03/32/37/340033237.db2.gz VWRLHOJUUKMUIQ-XKRYSZRTSA-N 2 1 312.501 4.350 20 0 DIADMP Fc1ccc2c(N[C@H]3CC[N@H+](Cc4ccccc4)C3)cc[nH+]c2c1 ZINC000500468305 340059794 /nfs/dbraw/zinc/05/97/94/340059794.db2.gz BOBOLJIZEWJILS-KRWDZBQOSA-N 2 1 321.399 4.060 20 0 DIADMP Fc1ccc2c(N[C@H]3CC[N@@H+](Cc4ccccc4)C3)cc[nH+]c2c1 ZINC000500468305 340059795 /nfs/dbraw/zinc/05/97/95/340059795.db2.gz BOBOLJIZEWJILS-KRWDZBQOSA-N 2 1 321.399 4.060 20 0 DIADMP C[C@@H](C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000501077772 340073866 /nfs/dbraw/zinc/07/38/66/340073866.db2.gz OWZFCCBGCNWMAC-SFHVURJKSA-N 2 1 323.484 4.034 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)c1 ZINC000502251656 340097816 /nfs/dbraw/zinc/09/78/16/340097816.db2.gz RYQHDHTYTNIIMZ-AQNXPRMDSA-N 2 1 300.490 4.195 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@H]1CCC12CCC2 ZINC000502462131 340104626 /nfs/dbraw/zinc/10/46/26/340104626.db2.gz LQTGPRVHQVAOMR-KVPLUYHFSA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@@H]1C[C@]1([NH2+]CCCCn1cc[nH+]c1C)c1cccc(C)c1 ZINC000502514872 340106536 /nfs/dbraw/zinc/10/65/36/340106536.db2.gz XDPWRVPNDZCVDP-UYAOXDASSA-N 2 1 311.473 4.195 20 0 DIADMP CC[C@@H]1C[C@@]1([NH2+]CCCCn1cc[nH+]c1C)c1cccc(C)c1 ZINC000502514870 340106624 /nfs/dbraw/zinc/10/66/24/340106624.db2.gz XDPWRVPNDZCVDP-QUCCMNQESA-N 2 1 311.473 4.195 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000502687882 340110534 /nfs/dbraw/zinc/11/05/34/340110534.db2.gz SDGVETWHGQTZOL-AQNXPRMDSA-N 2 1 300.490 4.195 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC[C@@H]1CCC[NH+]1C ZINC000502703028 340111396 /nfs/dbraw/zinc/11/13/96/340111396.db2.gz UPTXRQXOIJPLEG-BBRMVZONSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000503035300 340119190 /nfs/dbraw/zinc/11/91/90/340119190.db2.gz NFMCPAFCFKLDGF-MISYRCLQSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000503035302 340119229 /nfs/dbraw/zinc/11/92/29/340119229.db2.gz NFMCPAFCFKLDGF-YZGWKJHDSA-N 2 1 300.490 4.034 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2ccc(F)cc2)CCCC1 ZINC000503060989 340119861 /nfs/dbraw/zinc/11/98/61/340119861.db2.gz CYGTWWUOPHPDOV-UHFFFAOYSA-N 2 1 315.436 4.170 20 0 DIADMP COc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)ccc1F ZINC000504900202 340155214 /nfs/dbraw/zinc/15/52/14/340155214.db2.gz SZUJBAPARIJTGV-HOTGVXAUSA-N 2 1 322.468 4.140 20 0 DIADMP COc1cc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)ccc1F ZINC000504900201 340155311 /nfs/dbraw/zinc/15/53/11/340155311.db2.gz SZUJBAPARIJTGV-CVEARBPZSA-N 2 1 322.468 4.140 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473439 340195158 /nfs/dbraw/zinc/19/51/58/340195158.db2.gz IXSADCWJCYKNJW-MAUKXSAKSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473439 340195159 /nfs/dbraw/zinc/19/51/59/340195159.db2.gz IXSADCWJCYKNJW-MAUKXSAKSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473439 340195160 /nfs/dbraw/zinc/19/51/60/340195160.db2.gz IXSADCWJCYKNJW-MAUKXSAKSA-N 2 1 320.546 4.451 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c(C)s1 ZINC000506473439 340195161 /nfs/dbraw/zinc/19/51/61/340195161.db2.gz IXSADCWJCYKNJW-MAUKXSAKSA-N 2 1 320.546 4.451 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCc2ccccc2)C1 ZINC000506483798 340195576 /nfs/dbraw/zinc/19/55/76/340195576.db2.gz XGJKWADDLIMYEA-CTNGQTDRSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC000506483798 340195577 /nfs/dbraw/zinc/19/55/77/340195577.db2.gz XGJKWADDLIMYEA-CTNGQTDRSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000506483798 340195578 /nfs/dbraw/zinc/19/55/78/340195578.db2.gz XGJKWADDLIMYEA-CTNGQTDRSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483713 340195600 /nfs/dbraw/zinc/19/56/00/340195600.db2.gz WCTMRTKOWCJLLI-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483713 340195601 /nfs/dbraw/zinc/19/56/01/340195601.db2.gz WCTMRTKOWCJLLI-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506483713 340195602 /nfs/dbraw/zinc/19/56/02/340195602.db2.gz WCTMRTKOWCJLLI-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506483713 340195603 /nfs/dbraw/zinc/19/56/03/340195603.db2.gz WCTMRTKOWCJLLI-KZNAEPCWSA-N 2 1 318.480 4.473 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3)s2)CC1 ZINC000506673699 340199181 /nfs/dbraw/zinc/19/91/81/340199181.db2.gz HOSBMVWXZHEOCV-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccccc3)s2)CC1 ZINC000506673699 340199182 /nfs/dbraw/zinc/19/91/82/340199182.db2.gz HOSBMVWXZHEOCV-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000507360961 340218141 /nfs/dbraw/zinc/21/81/41/340218141.db2.gz NYTBUSFYWNTJQH-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000507360961 340218142 /nfs/dbraw/zinc/21/81/42/340218142.db2.gz NYTBUSFYWNTJQH-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000508193226 340240269 /nfs/dbraw/zinc/24/02/69/340240269.db2.gz UKAZYZMIGVWQMG-KRWDZBQOSA-N 2 1 306.519 4.145 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000508193226 340240270 /nfs/dbraw/zinc/24/02/70/340240270.db2.gz UKAZYZMIGVWQMG-KRWDZBQOSA-N 2 1 306.519 4.145 20 0 DIADMP CCCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000508694127 340250763 /nfs/dbraw/zinc/25/07/63/340250763.db2.gz FCKWORVDOXGGSE-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508830657 340253984 /nfs/dbraw/zinc/25/39/84/340253984.db2.gz XOJSACJBSMHAKC-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508830657 340253985 /nfs/dbraw/zinc/25/39/85/340253985.db2.gz XOJSACJBSMHAKC-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508830657 340253986 /nfs/dbraw/zinc/25/39/86/340253986.db2.gz XOJSACJBSMHAKC-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(-c2cccc(F)c2)s1 ZINC000509615544 340274757 /nfs/dbraw/zinc/27/47/57/340274757.db2.gz DPWFWMLGXSRSNP-UHFFFAOYSA-N 2 1 320.477 4.374 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cccc(-c2ccccc2C)c1 ZINC000509976390 340284417 /nfs/dbraw/zinc/28/44/17/340284417.db2.gz ZLNCBAMPKXLNKB-UHFFFAOYSA-N 2 1 319.452 4.347 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1cccc(C)c1)c1cccc(F)c1 ZINC000510729380 340308529 /nfs/dbraw/zinc/30/85/29/340308529.db2.gz DCDNFQQPGBSBKS-FQEVSTJZSA-N 2 1 323.415 4.018 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(C)cc1)C1CCCC1 ZINC000510929666 340315233 /nfs/dbraw/zinc/31/52/33/340315233.db2.gz DWDPOVCEVMNOSJ-HXUWFJFHSA-N 2 1 311.473 4.411 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000510962487 340316500 /nfs/dbraw/zinc/31/65/00/340316500.db2.gz QZTNEBDLCSKAJO-QGZVFWFLSA-N 2 1 305.853 4.222 20 0 DIADMP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511017649 340318316 /nfs/dbraw/zinc/31/83/16/340318316.db2.gz RLWDPFBLRAVUHU-SLFFLAALSA-N 2 1 318.480 4.017 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000511039032 340319103 /nfs/dbraw/zinc/31/91/03/340319103.db2.gz YLAAIEGEIMMUAT-LJQANCHMSA-N 2 1 315.436 4.242 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511092580 340320484 /nfs/dbraw/zinc/32/04/84/340320484.db2.gz OTNWOTJXSPQRNF-QFBILLFUSA-N 2 1 322.443 4.033 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(C)C)cc2)C[C@H]1C ZINC000511148502 340322458 /nfs/dbraw/zinc/32/24/58/340322458.db2.gz YYBKRDBGUFJTQA-AEFFLSMTSA-N 2 1 320.546 4.492 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C/C=C/c2ccccc2)C1 ZINC000303528987 340330600 /nfs/dbraw/zinc/33/06/00/340330600.db2.gz GXOPLCMQMYJURM-NANPWHPPSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C/C=C/c2ccccc2)C1 ZINC000303528987 340330601 /nfs/dbraw/zinc/33/06/01/340330601.db2.gz GXOPLCMQMYJURM-NANPWHPPSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2)C1 ZINC000303528987 340330602 /nfs/dbraw/zinc/33/06/02/340330602.db2.gz GXOPLCMQMYJURM-NANPWHPPSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2)C1 ZINC000303528987 340330603 /nfs/dbraw/zinc/33/06/03/340330603.db2.gz GXOPLCMQMYJURM-NANPWHPPSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@H]([NH2+]Cc1ccc2occc2c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000511912624 340342695 /nfs/dbraw/zinc/34/26/95/340342695.db2.gz QQDAWKQUWGXIEJ-YJBOKZPZSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@H](CCC1CCCCC1)[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC000512013646 340345384 /nfs/dbraw/zinc/34/53/84/340345384.db2.gz DGDDICDKVZZQAY-CQSZACIVSA-N 2 1 309.523 4.043 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C/C=C/c2ccc(F)c(F)c2)C1 ZINC000512145339 340349924 /nfs/dbraw/zinc/34/99/24/340349924.db2.gz MZZRPPTZFYFZEV-IEXSPKMKSA-N 2 1 322.443 4.080 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cccc(F)c2F)C1 ZINC000512194458 340351901 /nfs/dbraw/zinc/35/19/01/340351901.db2.gz LAKGLADFDFJXGT-JKSUJKDBSA-N 2 1 322.443 4.051 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000512327216 340357244 /nfs/dbraw/zinc/35/72/44/340357244.db2.gz XOYUBWZQJIHBPD-WSTZPKSXSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512377702 340359426 /nfs/dbraw/zinc/35/94/26/340359426.db2.gz JXORJGPUKFKCJN-GDBMZVCRSA-N 2 1 306.881 4.083 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173344848 340363061 /nfs/dbraw/zinc/36/30/61/340363061.db2.gz FHVSVSVNERQYDM-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000173387766 340363960 /nfs/dbraw/zinc/36/39/60/340363960.db2.gz XYCPEDULBYIVFS-AWEZNQCLSA-N 2 1 318.411 4.267 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512557263 340366864 /nfs/dbraw/zinc/36/68/64/340366864.db2.gz OISWMPUGMYLIFP-DFNIBXOVSA-N 2 1 308.469 4.205 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000512557263 340366865 /nfs/dbraw/zinc/36/68/65/340366865.db2.gz OISWMPUGMYLIFP-DFNIBXOVSA-N 2 1 308.469 4.205 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512557263 340366866 /nfs/dbraw/zinc/36/68/66/340366866.db2.gz OISWMPUGMYLIFP-DFNIBXOVSA-N 2 1 308.469 4.205 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](CC(c2ccccc2)c2ccccc2)CC1 ZINC000513246632 340399205 /nfs/dbraw/zinc/39/92/05/340399205.db2.gz ACNOPTLWEYROSN-OAQYLSRUSA-N 2 1 322.496 4.235 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000513501426 340410968 /nfs/dbraw/zinc/41/09/68/340410968.db2.gz SXJYPNLSBGNBCG-BAAYTWLHSA-N 2 1 317.864 4.174 20 0 DIADMP Clc1csc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)c1 ZINC000193069486 340572041 /nfs/dbraw/zinc/57/20/41/340572041.db2.gz VUQBBLUZIJGPOG-UHFFFAOYSA-N 2 1 312.910 4.146 20 0 DIADMP CC(C)CC[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000236620163 340663168 /nfs/dbraw/zinc/66/31/68/340663168.db2.gz LMIHAYJFRVLXFA-SFHVURJKSA-N 2 1 302.506 4.108 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000237410204 340670726 /nfs/dbraw/zinc/67/07/26/340670726.db2.gz YIWIIOZTIRJCGO-KRWDZBQOSA-N 2 1 319.452 4.284 20 0 DIADMP C[C@H]1CCC[C@](C[NH2+]C2CCC(C(F)(F)F)CC2)([NH+](C)C)C1 ZINC000237545756 340671997 /nfs/dbraw/zinc/67/19/97/340671997.db2.gz FHZOBGMWGZCSCZ-LBDPXKHJSA-N 2 1 320.443 4.208 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000037424642 340785276 /nfs/dbraw/zinc/78/52/76/340785276.db2.gz ZVQDSDQDTFUWBC-UHFFFAOYSA-N 2 1 315.288 4.348 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1)c1cccc(O)c1 ZINC000126610284 340829189 /nfs/dbraw/zinc/82/91/89/340829189.db2.gz YTSOPTORALKPIU-TXPKVOOTSA-N 2 1 316.489 4.086 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(F)cc1)C1CCC1 ZINC000128291311 340865626 /nfs/dbraw/zinc/86/56/26/340865626.db2.gz AKDJNNPHEOJUKB-LJQANCHMSA-N 2 1 315.436 4.242 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000542268511 341002705 /nfs/dbraw/zinc/00/27/05/341002705.db2.gz STXZDXNHTQGQEA-KRWDZBQOSA-N 2 1 308.469 4.461 20 0 DIADMP Cc1cccc(CCC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000542529540 341012287 /nfs/dbraw/zinc/01/22/87/341012287.db2.gz IYVRVQVQTRJONI-AZUAARDMSA-N 2 1 314.517 4.170 20 0 DIADMP C[C@H](CCSc1ccccc1)[NH+]1CCC2(CCC[N@@H+]2C)CC1 ZINC000543191567 341036076 /nfs/dbraw/zinc/03/60/76/341036076.db2.gz HNLUYCALFRUJQC-QGZVFWFLSA-N 2 1 318.530 4.118 20 0 DIADMP C[C@H](CCSc1ccccc1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000543191567 341036077 /nfs/dbraw/zinc/03/60/77/341036077.db2.gz HNLUYCALFRUJQC-QGZVFWFLSA-N 2 1 318.530 4.118 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCc3ccsc3)C2)CC1 ZINC000543956188 341064228 /nfs/dbraw/zinc/06/42/28/341064228.db2.gz CBZVEQFVJGIMHJ-LJQANCHMSA-N 2 1 320.546 4.125 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCc2ccsc2)C1 ZINC000543960084 341064275 /nfs/dbraw/zinc/06/42/75/341064275.db2.gz SFCMYOMHOSAAHA-HKUYNNGSSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCc2ccsc2)C1 ZINC000543960084 341064276 /nfs/dbraw/zinc/06/42/76/341064276.db2.gz SFCMYOMHOSAAHA-HKUYNNGSSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCc2ccsc2)C1 ZINC000543960084 341064277 /nfs/dbraw/zinc/06/42/77/341064277.db2.gz SFCMYOMHOSAAHA-HKUYNNGSSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCc2ccsc2)C1 ZINC000543960087 341064386 /nfs/dbraw/zinc/06/43/86/341064386.db2.gz SFCMYOMHOSAAHA-PKOBYXMFSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCc2ccsc2)C1 ZINC000543960087 341064387 /nfs/dbraw/zinc/06/43/87/341064387.db2.gz SFCMYOMHOSAAHA-PKOBYXMFSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCc2ccsc2)C1 ZINC000543960087 341064388 /nfs/dbraw/zinc/06/43/88/341064388.db2.gz SFCMYOMHOSAAHA-PKOBYXMFSA-N 2 1 320.546 4.267 20 0 DIADMP C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000544010204 341066269 /nfs/dbraw/zinc/06/62/69/341066269.db2.gz ZMJBUEPCJOCTGO-PKOBYXMFSA-N 2 1 320.546 4.123 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CCC3(CCC[N@H+]3C)CC2)c(C)c1 ZINC000544126479 341071288 /nfs/dbraw/zinc/07/12/88/341071288.db2.gz GHLANHYYHBZMBR-SFHVURJKSA-N 2 1 300.490 4.233 20 0 DIADMP CCC(CC)(C[NH2+][C@H](C)[C@H]1CCCO1)[NH2+][C@@H](C)c1ccccc1 ZINC000544355443 341077803 /nfs/dbraw/zinc/07/78/03/341077803.db2.gz GHRGNFZZQDCFDG-YQVWRLOYSA-N 2 1 318.505 4.053 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)c1cc2ccccc2o1)[NH+]1CCCCC1 ZINC000544374194 341078897 /nfs/dbraw/zinc/07/88/97/341078897.db2.gz BQRQDNQOVRTATC-HZPDHXFCSA-N 2 1 300.446 4.348 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)c1cc(F)c(F)c(F)c1)[NH+]1CCCCC1 ZINC000544374603 341078936 /nfs/dbraw/zinc/07/89/36/341078936.db2.gz XPLWJWPDPIQFOZ-CHWSQXEVSA-N 2 1 314.395 4.019 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000544375224 341078989 /nfs/dbraw/zinc/07/89/89/341078989.db2.gz POHAFXGDTSRXJT-IRXDYDNUSA-N 2 1 304.478 4.000 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC[C@@H]2CCCCO2)CC1)CC(C)C ZINC000544400684 341080363 /nfs/dbraw/zinc/08/03/63/341080363.db2.gz LDUMJBWVFHHHPI-FQEVSTJZSA-N 2 1 324.553 4.026 20 0 DIADMP Cc1ccc(CCC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000544423948 341081639 /nfs/dbraw/zinc/08/16/39/341081639.db2.gz IMTPTRXIUBIGIT-UYAOXDASSA-N 2 1 314.517 4.170 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000131832586 341112457 /nfs/dbraw/zinc/11/24/57/341112457.db2.gz VNXVRJCMXNJUGZ-WIYYLYMNSA-N 2 1 322.496 4.281 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000545982879 341149544 /nfs/dbraw/zinc/14/95/44/341149544.db2.gz NHVUSCXNHDOQFE-GOSISDBHSA-N 2 1 317.864 4.366 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547399209 341211221 /nfs/dbraw/zinc/21/12/21/341211221.db2.gz NUKYIRQBPWBWKZ-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000136397839 341258422 /nfs/dbraw/zinc/25/84/22/341258422.db2.gz QZJSHPSWEJHBSH-UHFFFAOYSA-N 2 1 301.434 4.010 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000136397839 341258423 /nfs/dbraw/zinc/25/84/23/341258423.db2.gz QZJSHPSWEJHBSH-UHFFFAOYSA-N 2 1 301.434 4.010 20 0 DIADMP CC(C)[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000549085634 341285809 /nfs/dbraw/zinc/28/58/09/341285809.db2.gz DPJALNJWIPAUDT-NXCDMZCRSA-N 2 1 306.881 4.252 20 0 DIADMP CC(C)SCC[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138962 341286814 /nfs/dbraw/zinc/28/68/14/341286814.db2.gz OSYYAMVUGHJIJO-HKUYNNGSSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138962 341286815 /nfs/dbraw/zinc/28/68/15/341286815.db2.gz OSYYAMVUGHJIJO-HKUYNNGSSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138962 341286816 /nfs/dbraw/zinc/28/68/16/341286816.db2.gz OSYYAMVUGHJIJO-HKUYNNGSSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138962 341286817 /nfs/dbraw/zinc/28/68/17/341286817.db2.gz OSYYAMVUGHJIJO-HKUYNNGSSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000549138968 341286959 /nfs/dbraw/zinc/28/69/59/341286959.db2.gz OSYYAMVUGHJIJO-IEBWSBKVSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000549138968 341286960 /nfs/dbraw/zinc/28/69/60/341286960.db2.gz OSYYAMVUGHJIJO-IEBWSBKVSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000549138968 341286961 /nfs/dbraw/zinc/28/69/61/341286961.db2.gz OSYYAMVUGHJIJO-IEBWSBKVSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000549138968 341286962 /nfs/dbraw/zinc/28/69/62/341286962.db2.gz OSYYAMVUGHJIJO-IEBWSBKVSA-N 2 1 320.546 4.113 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245467150 341295743 /nfs/dbraw/zinc/29/57/43/341295743.db2.gz ZJFXHCXOWBLTIP-ZIAGYGMSSA-N 2 1 314.395 4.040 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245467150 341295744 /nfs/dbraw/zinc/29/57/44/341295744.db2.gz ZJFXHCXOWBLTIP-ZIAGYGMSSA-N 2 1 314.395 4.040 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245467150 341295745 /nfs/dbraw/zinc/29/57/45/341295745.db2.gz ZJFXHCXOWBLTIP-ZIAGYGMSSA-N 2 1 314.395 4.040 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000549613284 341299013 /nfs/dbraw/zinc/29/90/13/341299013.db2.gz CXINAQDYMHWCOL-YHELAOLJSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000549764283 341302634 /nfs/dbraw/zinc/30/26/34/341302634.db2.gz PCXLHONQNBIYAR-DGCLKSJQSA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000549764283 341302635 /nfs/dbraw/zinc/30/26/35/341302635.db2.gz PCXLHONQNBIYAR-DGCLKSJQSA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000549764285 341302643 /nfs/dbraw/zinc/30/26/43/341302643.db2.gz PCXLHONQNBIYAR-YPMHNXCESA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000549764285 341302644 /nfs/dbraw/zinc/30/26/44/341302644.db2.gz PCXLHONQNBIYAR-YPMHNXCESA-N 2 1 322.905 4.435 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245656432 341308083 /nfs/dbraw/zinc/30/80/83/341308083.db2.gz DSQACTBMAPFPTC-ZRSLWSEBSA-N 2 1 300.490 4.206 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2CC=CCC2)C3)cc1 ZINC000245665592 341308419 /nfs/dbraw/zinc/30/84/19/341308419.db2.gz GOOSGWGNBQITPW-WLRLJWMZSA-N 2 1 310.485 4.128 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725890 341311897 /nfs/dbraw/zinc/31/18/97/341311897.db2.gz PNXBZDYSOBVEPZ-FFGOWVMKSA-N 2 1 300.490 4.206 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245725886 341311946 /nfs/dbraw/zinc/31/19/46/341311946.db2.gz PNXBZDYSOBVEPZ-AFYVEPGGSA-N 2 1 300.490 4.206 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@]2(C1)CCCN(C)C2 ZINC000550239157 341313161 /nfs/dbraw/zinc/31/31/61/341313161.db2.gz QUOJFVSAVPMKLV-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239157 341313162 /nfs/dbraw/zinc/31/31/62/341313162.db2.gz QUOJFVSAVPMKLV-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000550239157 341313163 /nfs/dbraw/zinc/31/31/63/341313163.db2.gz QUOJFVSAVPMKLV-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000550239157 341313164 /nfs/dbraw/zinc/31/31/64/341313164.db2.gz QUOJFVSAVPMKLV-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000550239157 341313165 /nfs/dbraw/zinc/31/31/65/341313165.db2.gz QUOJFVSAVPMKLV-UWJYYQICSA-N 2 1 308.469 4.319 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000550587808 341318932 /nfs/dbraw/zinc/31/89/32/341318932.db2.gz GCDWQSLVBBSDNI-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000550587808 341318933 /nfs/dbraw/zinc/31/89/33/341318933.db2.gz GCDWQSLVBBSDNI-OALUTQOASA-N 2 1 314.860 4.265 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000550613008 341319335 /nfs/dbraw/zinc/31/93/35/341319335.db2.gz WCKFDZJJNJMZBA-ICSRJNTNSA-N 2 1 312.432 4.059 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1F ZINC000550613008 341319336 /nfs/dbraw/zinc/31/93/36/341319336.db2.gz WCKFDZJJNJMZBA-ICSRJNTNSA-N 2 1 312.432 4.059 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000550613010 341319517 /nfs/dbraw/zinc/31/95/17/341319517.db2.gz WCKFDZJJNJMZBA-UYAOXDASSA-N 2 1 312.432 4.059 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000550613010 341319518 /nfs/dbraw/zinc/31/95/18/341319518.db2.gz WCKFDZJJNJMZBA-UYAOXDASSA-N 2 1 312.432 4.059 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550623028 341319693 /nfs/dbraw/zinc/31/96/93/341319693.db2.gz RKUCMVIACVYZOF-LZQZEXGQSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550623028 341319694 /nfs/dbraw/zinc/31/96/94/341319694.db2.gz RKUCMVIACVYZOF-LZQZEXGQSA-N 2 1 314.498 4.104 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000245963033 341320054 /nfs/dbraw/zinc/32/00/54/341320054.db2.gz VDPUINRQUNTIGT-MSOLQXFVSA-N 2 1 303.494 4.025 20 0 DIADMP C[C@H](C1CC1)[NH+](C)Cc1cccc(C[N@H+](C)[C@H](C)C2CC2)c1 ZINC000550681198 341321309 /nfs/dbraw/zinc/32/13/09/341321309.db2.gz LXMZJRUNIPVFQF-HZPDHXFCSA-N 2 1 300.490 4.147 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550700287 341321640 /nfs/dbraw/zinc/32/16/40/341321640.db2.gz CUQSOSKJPHUAGK-NYVOZVTQSA-N 2 1 320.480 4.407 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550700287 341321641 /nfs/dbraw/zinc/32/16/41/341321641.db2.gz CUQSOSKJPHUAGK-NYVOZVTQSA-N 2 1 320.480 4.407 20 0 DIADMP C[C@H](F)CC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000550881966 341325274 /nfs/dbraw/zinc/32/52/74/341325274.db2.gz FIFRVERLMQAJJA-FRYIKTPZSA-N 2 1 318.480 4.015 20 0 DIADMP CC1=CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931760 341327055 /nfs/dbraw/zinc/32/70/55/341327055.db2.gz UUHILTRPIGJGDA-VQTJNVASSA-N 2 1 312.501 4.376 20 0 DIADMP CC1=CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931760 341327056 /nfs/dbraw/zinc/32/70/56/341327056.db2.gz UUHILTRPIGJGDA-VQTJNVASSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550997995 341328672 /nfs/dbraw/zinc/32/86/72/341328672.db2.gz VRCZRTBXTJUJIP-POAQFYNOSA-N 2 1 312.457 4.026 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550997995 341328673 /nfs/dbraw/zinc/32/86/73/341328673.db2.gz VRCZRTBXTJUJIP-POAQFYNOSA-N 2 1 312.457 4.026 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551015338 341329299 /nfs/dbraw/zinc/32/92/99/341329299.db2.gz WIGJQRVVOAVOLD-VLCRHTCISA-N 2 1 322.496 4.351 20 0 DIADMP Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551015338 341329300 /nfs/dbraw/zinc/32/93/00/341329300.db2.gz WIGJQRVVOAVOLD-VLCRHTCISA-N 2 1 322.496 4.351 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000551052203 341330367 /nfs/dbraw/zinc/33/03/67/341330367.db2.gz WWAZVDCIHFJIEL-GTAWCEEGSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000551052203 341330368 /nfs/dbraw/zinc/33/03/68/341330368.db2.gz WWAZVDCIHFJIEL-GTAWCEEGSA-N 2 1 300.490 4.380 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551083649 341331141 /nfs/dbraw/zinc/33/11/41/341331141.db2.gz KIJLJIPUOOOWKP-LRQRDZAKSA-N 2 1 323.484 4.130 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551083649 341331142 /nfs/dbraw/zinc/33/11/42/341331142.db2.gz KIJLJIPUOOOWKP-LRQRDZAKSA-N 2 1 323.484 4.130 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C[C@@H]1c1ccccc1 ZINC000551085625 341331185 /nfs/dbraw/zinc/33/11/85/341331185.db2.gz DCAMDAOOZUOVTE-CEWLAPEOSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C[C@@H]1c1ccccc1 ZINC000551085625 341331186 /nfs/dbraw/zinc/33/11/86/341331186.db2.gz DCAMDAOOZUOVTE-CEWLAPEOSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)[C@H]2CCC[C@@H]21 ZINC000551308024 341337917 /nfs/dbraw/zinc/33/79/17/341337917.db2.gz IUCWJIUJABJHLD-CHEUSRNYSA-N 2 1 318.892 4.048 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)C1CC1 ZINC000551530966 341344193 /nfs/dbraw/zinc/34/41/93/341344193.db2.gz ZNNFGKAWXFVOSO-NQIIRXRSSA-N 2 1 314.517 4.026 20 0 DIADMP FCCCCC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000551701583 341349341 /nfs/dbraw/zinc/34/93/41/341349341.db2.gz HEVWQLVMMFVWAC-UHFFFAOYSA-N 2 1 318.480 4.114 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC[N@@H+]1C ZINC000246893283 341358379 /nfs/dbraw/zinc/35/83/79/341358379.db2.gz DWVWNYPQFJZFAQ-BVGQSLNGSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC[N@H+]1C ZINC000246893283 341358380 /nfs/dbraw/zinc/35/83/80/341358380.db2.gz DWVWNYPQFJZFAQ-BVGQSLNGSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CCCC1 ZINC000248014414 341372262 /nfs/dbraw/zinc/37/22/62/341372262.db2.gz LOYMCARCJTXPFY-YXJHDRRASA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CCCC1 ZINC000248014414 341372263 /nfs/dbraw/zinc/37/22/63/341372263.db2.gz LOYMCARCJTXPFY-YXJHDRRASA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248391481 341376319 /nfs/dbraw/zinc/37/63/19/341376319.db2.gz CHSPSCLBRIKFCS-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248391481 341376320 /nfs/dbraw/zinc/37/63/20/341376320.db2.gz CHSPSCLBRIKFCS-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248409909 341376925 /nfs/dbraw/zinc/37/69/25/341376925.db2.gz XIBVETZKLCZBTH-NBQZKYEYSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248412023 341377105 /nfs/dbraw/zinc/37/71/05/341377105.db2.gz ZXBRGVGSQSKPOU-NNFUDEMPSA-N 2 1 316.489 4.146 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248412023 341377106 /nfs/dbraw/zinc/37/71/06/341377106.db2.gz ZXBRGVGSQSKPOU-NNFUDEMPSA-N 2 1 316.489 4.146 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(-c3cccnc3)c2)C[C@@H]1C ZINC000552290285 341384552 /nfs/dbraw/zinc/38/45/52/341384552.db2.gz FNVIGRRSRGEKPV-UWJYYQICSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@@H]1C ZINC000552290285 341384553 /nfs/dbraw/zinc/38/45/53/341384553.db2.gz FNVIGRRSRGEKPV-UWJYYQICSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(-c3cccnc3)c2)C[C@@H]1C ZINC000552290285 341384554 /nfs/dbraw/zinc/38/45/54/341384554.db2.gz FNVIGRRSRGEKPV-UWJYYQICSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000552343599 341388042 /nfs/dbraw/zinc/38/80/42/341388042.db2.gz HNPZFHUAZDDPHH-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000366429572 519781768 /nfs/dbraw/zinc/78/17/68/519781768.db2.gz GRGSGQYQQYVMJD-IVMQYODDSA-N 2 1 316.489 4.141 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1 ZINC000163468339 522562731 /nfs/dbraw/zinc/56/27/31/522562731.db2.gz ZMYPPHMIGPLTIG-IBGZPJMESA-N 2 1 309.457 4.100 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc12 ZINC000119663958 525145124 /nfs/dbraw/zinc/14/51/24/525145124.db2.gz NPSWGRCTEVJLPM-OAHLLOKOSA-N 2 1 324.468 4.126 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000156739961 525293848 /nfs/dbraw/zinc/29/38/48/525293848.db2.gz BTJKGWWKEIVBEN-HNNXBMFYSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1ccncc1 ZINC000266504619 525441081 /nfs/dbraw/zinc/44/10/81/525441081.db2.gz WEMAQDZPQQAYEF-MSOLQXFVSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1ccncc1 ZINC000266504629 525520311 /nfs/dbraw/zinc/52/03/11/525520311.db2.gz WEMAQDZPQQAYEF-ZWKOTPCHSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1ccsc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000236667014 525858715 /nfs/dbraw/zinc/85/87/15/525858715.db2.gz BPJVMWMWKIOLSH-UHFFFAOYSA-N 2 1 302.487 4.187 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(-c2ccccc2)o1 ZINC000338011061 527422073 /nfs/dbraw/zinc/42/20/73/527422073.db2.gz MHYDTYPFROUMEI-HNNXBMFYSA-N 2 1 309.413 4.192 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000338017679 527422271 /nfs/dbraw/zinc/42/22/71/527422271.db2.gz OOUNOFXPGTUCDQ-LLVKDONJSA-N 2 1 312.244 4.239 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000338008406 527422472 /nfs/dbraw/zinc/42/24/72/527422472.db2.gz SSRNFAXNAXTTQN-KRWDZBQOSA-N 2 1 303.475 4.164 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(SC(C)C)cc1 ZINC000338025725 527423062 /nfs/dbraw/zinc/42/30/62/527423062.db2.gz IRTXDFSKTJWVPI-OAHLLOKOSA-N 2 1 317.502 4.433 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000643521705 1047748901 /nfs/dbraw/zinc/74/89/01/1047748901.db2.gz XQKBNJLKNZKRNR-VHSXEESVSA-N 2 1 321.679 4.440 20 0 DIADMP CC(C)C(C)(C)C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579722485 1035530389 /nfs/dbraw/zinc/53/03/89/1035530389.db2.gz LFUPYYLJZYGKLF-HKUYNNGSSA-N 2 1 302.506 4.169 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546345 1035592089 /nfs/dbraw/zinc/59/20/89/1035592089.db2.gz NDRYSYQDFRYBQG-TZMCWYRMSA-N 2 1 321.534 4.074 20 0 DIADMP Fc1ccc([C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547263 1035601464 /nfs/dbraw/zinc/60/14/64/1035601464.db2.gz BXLWENKQQFTEMA-UXHICEINSA-N 2 1 324.443 4.179 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCSc3c(Cl)cccc32)CC1 ZINC000358065062 1035710087 /nfs/dbraw/zinc/71/00/87/1035710087.db2.gz RGRFEHJVRMEHCU-MRXNPFEDSA-N 2 1 324.921 4.339 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](F)C2)cc1 ZINC000579832791 1035778788 /nfs/dbraw/zinc/77/87/88/1035778788.db2.gz UGUGNPRLJSSFGS-RRQGHBQHSA-N 2 1 301.409 4.112 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000179398084 1035873705 /nfs/dbraw/zinc/87/37/05/1035873705.db2.gz BYQUQZMQMDCXPE-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000179398084 1035873726 /nfs/dbraw/zinc/87/37/26/1035873726.db2.gz BYQUQZMQMDCXPE-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183194447 1035918314 /nfs/dbraw/zinc/91/83/14/1035918314.db2.gz CHSPSCLBRIKFCS-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183194447 1035918329 /nfs/dbraw/zinc/91/83/29/1035918329.db2.gz CHSPSCLBRIKFCS-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)[C@H](CSc1ccccc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000180028986 1036027372 /nfs/dbraw/zinc/02/73/72/1036027372.db2.gz XKJJIOUCYJMUDY-IBGZPJMESA-N 2 1 318.530 4.020 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094773 1036032294 /nfs/dbraw/zinc/03/22/94/1036032294.db2.gz DYSVGNIALINBBH-GCJKJVERSA-N 2 1 320.480 4.158 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094773 1036032317 /nfs/dbraw/zinc/03/23/17/1036032317.db2.gz DYSVGNIALINBBH-GCJKJVERSA-N 2 1 320.480 4.158 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094756 1036034037 /nfs/dbraw/zinc/03/40/37/1036034037.db2.gz DYSVGNIALINBBH-XMSQKQJNSA-N 2 1 320.480 4.158 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000180094756 1036034058 /nfs/dbraw/zinc/03/40/58/1036034058.db2.gz DYSVGNIALINBBH-XMSQKQJNSA-N 2 1 320.480 4.158 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](c2cccs2)C2CCCC2)CC1 ZINC000037414131 1036063022 /nfs/dbraw/zinc/06/30/22/1036063022.db2.gz UJQUQVGUZUXECF-GOSISDBHSA-N 2 1 306.519 4.443 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@@H+]1C ZINC000443887440 1036157827 /nfs/dbraw/zinc/15/78/27/1036157827.db2.gz HCUIKQMKAQJAHY-YPMHNXCESA-N 2 1 323.362 4.148 20 0 DIADMP C[C@@H]1C[C@@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@H+]1C ZINC000443887440 1036157838 /nfs/dbraw/zinc/15/78/38/1036157838.db2.gz HCUIKQMKAQJAHY-YPMHNXCESA-N 2 1 323.362 4.148 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000109787682 1036222794 /nfs/dbraw/zinc/22/27/94/1036222794.db2.gz GKYYNGNZEREFBE-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c1 ZINC001648795584 1036249707 /nfs/dbraw/zinc/24/97/07/1036249707.db2.gz QEFDRTPVXWJNGJ-KRWDZBQOSA-N 2 1 312.457 4.252 20 0 DIADMP CCC[N@@H+](C)C[C@H](C[NH+](C)Cc1ccccc1)c1ccccc1 ZINC001167199317 1036265036 /nfs/dbraw/zinc/26/50/36/1036265036.db2.gz LXJVVBIBRTXNGW-OAQYLSRUSA-N 2 1 310.485 4.244 20 0 DIADMP CCC[NH+](C)C[C@H](C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC001167199317 1036265046 /nfs/dbraw/zinc/26/50/46/1036265046.db2.gz LXJVVBIBRTXNGW-OAQYLSRUSA-N 2 1 310.485 4.244 20 0 DIADMP CCC[NH+](C)C[C@H](C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC001167199317 1036265058 /nfs/dbraw/zinc/26/50/58/1036265058.db2.gz LXJVVBIBRTXNGW-OAQYLSRUSA-N 2 1 310.485 4.244 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]C2CCC(C)CC2)CC1 ZINC000236825414 1036318362 /nfs/dbraw/zinc/31/83/62/1036318362.db2.gz SNIHNIKSZHWMAU-TVRKMHQQSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1c(Cl)cccc1C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001648811225 1036492010 /nfs/dbraw/zinc/49/20/10/1036492010.db2.gz IILXJHIJTOWFIF-IYBDPMFKSA-N 2 1 322.924 4.496 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1Cl ZINC001648817063 1036576962 /nfs/dbraw/zinc/57/69/62/1036576962.db2.gz SHIPYNZYTAMACT-MRXNPFEDSA-N 2 1 308.897 4.393 20 0 DIADMP C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)CCCc1c[nH+]cn1C ZINC000579974561 1036662975 /nfs/dbraw/zinc/66/29/75/1036662975.db2.gz MGRPNXKJDVPCHH-HUUCEWRRSA-N 2 1 319.880 4.130 20 0 DIADMP C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000579974561 1036662981 /nfs/dbraw/zinc/66/29/81/1036662981.db2.gz MGRPNXKJDVPCHH-HUUCEWRRSA-N 2 1 319.880 4.130 20 0 DIADMP COCCC1(C[NH2+]C[C@]2([NH+](C)C)CCC[C@@H](C)C2)CCCCC1 ZINC001648895832 1036679029 /nfs/dbraw/zinc/67/90/29/1036679029.db2.gz ZREUMPKLFXRZIM-QUCCMNQESA-N 2 1 324.553 4.074 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006013 1036710613 /nfs/dbraw/zinc/71/06/13/1036710613.db2.gz HXQFVGXQEQUNBX-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006013 1036710641 /nfs/dbraw/zinc/71/06/41/1036710641.db2.gz HXQFVGXQEQUNBX-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006013 1036710659 /nfs/dbraw/zinc/71/06/59/1036710659.db2.gz HXQFVGXQEQUNBX-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006013 1036710680 /nfs/dbraw/zinc/71/06/80/1036710680.db2.gz HXQFVGXQEQUNBX-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000683691243 1036715721 /nfs/dbraw/zinc/71/57/21/1036715721.db2.gz XATGUTFIZCKEHC-CDHQVMDDSA-N 2 1 311.473 4.302 20 0 DIADMP CC(C)C([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)C ZINC000683693053 1036717360 /nfs/dbraw/zinc/71/73/60/1036717360.db2.gz ZQIYIXPNMGVMFA-OWZKRDHZSA-N 2 1 314.517 4.452 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cnc(C3CCCCC3)s2)C1 ZINC000580044684 1036898306 /nfs/dbraw/zinc/89/83/06/1036898306.db2.gz MEGRIGFROPIVCZ-HNNXBMFYSA-N 2 1 321.534 4.012 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000398023176 1037083183 /nfs/dbraw/zinc/08/31/83/1037083183.db2.gz KWHYCSMFSXAMGL-GCJKJVERSA-N 2 1 322.496 4.249 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398042219 1037110736 /nfs/dbraw/zinc/11/07/36/1037110736.db2.gz SVGOPDMTIILJJH-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398042219 1037110740 /nfs/dbraw/zinc/11/07/40/1037110740.db2.gz SVGOPDMTIILJJH-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP c1[nH+]c(C2CC[NH+]([C@H]3CCc4ccccc43)CC2)n2c1CCCC2 ZINC000684004644 1037228484 /nfs/dbraw/zinc/22/84/84/1037228484.db2.gz AKLHHGDLTQDQNO-FQEVSTJZSA-N 2 1 321.468 4.086 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C=CCCCCC1 ZINC000398179723 1037271022 /nfs/dbraw/zinc/27/10/22/1037271022.db2.gz WSZZBPSWUOMEDB-NRSPTQNISA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C=CCCCCC1 ZINC000398179723 1037271038 /nfs/dbraw/zinc/27/10/38/1037271038.db2.gz WSZZBPSWUOMEDB-NRSPTQNISA-N 2 1 312.501 4.376 20 0 DIADMP CCC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398228700 1037297662 /nfs/dbraw/zinc/29/76/62/1037297662.db2.gz YZBIVOYNUVDDRI-QUWFBVPJSA-N 2 1 314.517 4.455 20 0 DIADMP CCC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398228700 1037297677 /nfs/dbraw/zinc/29/76/77/1037297677.db2.gz YZBIVOYNUVDDRI-QUWFBVPJSA-N 2 1 314.517 4.455 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[N@@H+](CC3CCCC3)C2)cc1 ZINC000656401156 1037442319 /nfs/dbraw/zinc/44/23/19/1037442319.db2.gz AJYIUYCMKSMVPX-CMOCDZPBSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[NH+](CC3CCCC3)C2)cc1 ZINC000656401156 1037442325 /nfs/dbraw/zinc/44/23/25/1037442325.db2.gz AJYIUYCMKSMVPX-CMOCDZPBSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[NH+](CC3CCCC3)C2)cc1 ZINC000656401156 1037442332 /nfs/dbraw/zinc/44/23/32/1037442332.db2.gz AJYIUYCMKSMVPX-CMOCDZPBSA-N 2 1 324.512 4.019 20 0 DIADMP Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477556 1037886234 /nfs/dbraw/zinc/88/62/34/1037886234.db2.gz GHEOGMNNRANONF-FXAWDEMLSA-N 2 1 311.473 4.134 20 0 DIADMP Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477556 1037886246 /nfs/dbraw/zinc/88/62/46/1037886246.db2.gz GHEOGMNNRANONF-FXAWDEMLSA-N 2 1 311.473 4.134 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(C(F)F)c(F)c2)CC1 ZINC000891561228 1038039803 /nfs/dbraw/zinc/03/98/03/1038039803.db2.gz KILXYHOEAUCZSZ-UHFFFAOYSA-N 2 1 314.395 4.068 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(C(F)F)c(F)c2)CC1 ZINC000891561228 1038039824 /nfs/dbraw/zinc/03/98/24/1038039824.db2.gz KILXYHOEAUCZSZ-UHFFFAOYSA-N 2 1 314.395 4.068 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc2ccccc2s1 ZINC000126470449 1038104275 /nfs/dbraw/zinc/10/42/75/1038104275.db2.gz ZNGSEJUNTLHCIH-ZDUSSCGKSA-N 2 1 300.471 4.179 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341719553 1038247832 /nfs/dbraw/zinc/24/78/32/1038247832.db2.gz CGBGIHMMPBBWTR-BFYDXBDKSA-N 2 1 322.880 4.016 20 0 DIADMP Cc1nccn1CC[N@@H+](Cc1ccc(F)cc1)C1CCCCC1 ZINC000535664961 1038280519 /nfs/dbraw/zinc/28/05/19/1038280519.db2.gz FIKAIWQVVCPXTI-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccc(F)cc1)C1CCCCC1 ZINC000535664961 1038280536 /nfs/dbraw/zinc/28/05/36/1038280536.db2.gz FIKAIWQVVCPXTI-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccc(F)cc1)C1CCCCC1 ZINC000535664961 1038280540 /nfs/dbraw/zinc/28/05/40/1038280540.db2.gz FIKAIWQVVCPXTI-UHFFFAOYSA-N 2 1 315.436 4.166 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@@H]1c1cccc(C)c1C ZINC000535668625 1038313424 /nfs/dbraw/zinc/31/34/24/1038313424.db2.gz UONOGUFBOXXUSQ-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@@H]1c1cccc(C)c1C ZINC000535668625 1038313439 /nfs/dbraw/zinc/31/34/39/1038313439.db2.gz UONOGUFBOXXUSQ-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP CC(C)[C@@H](C[NH2+][C@@H](C)C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914716 1038376817 /nfs/dbraw/zinc/37/68/17/1038376817.db2.gz YGOFVMRRDZXBEN-WSTZPKSXSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@@H](C[NH2+][C@@H](C)C[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914716 1038376832 /nfs/dbraw/zinc/37/68/32/1038376832.db2.gz YGOFVMRRDZXBEN-WSTZPKSXSA-N 2 1 302.506 4.136 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1CCC2(CCCCC2)CC1 ZINC000342100450 1038422612 /nfs/dbraw/zinc/42/26/12/1038422612.db2.gz OIFXXGDUHCADSC-UHFFFAOYSA-N 2 1 303.494 4.454 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000604902876 1038460019 /nfs/dbraw/zinc/46/00/19/1038460019.db2.gz GKLKTWFFZFZKGC-WOJBJXKFSA-N 2 1 314.517 4.234 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102096 1038514289 /nfs/dbraw/zinc/51/42/89/1038514289.db2.gz CJDJYUZVCZAQCO-JSGCOSHPSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102096 1038514299 /nfs/dbraw/zinc/51/42/99/1038514299.db2.gz CJDJYUZVCZAQCO-JSGCOSHPSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102096 1038514312 /nfs/dbraw/zinc/51/43/12/1038514312.db2.gz CJDJYUZVCZAQCO-JSGCOSHPSA-N 2 1 314.395 4.068 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102096 1038514324 /nfs/dbraw/zinc/51/43/24/1038514324.db2.gz CJDJYUZVCZAQCO-JSGCOSHPSA-N 2 1 314.395 4.068 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1cc2ccncc2s1)C1CCCCC1 ZINC000657299571 1038522034 /nfs/dbraw/zinc/52/20/34/1038522034.db2.gz YPCORXLBPSSLPL-UHFFFAOYSA-N 2 1 317.502 4.041 20 0 DIADMP Clc1ccc(CCC[NH+]2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000607151275 1038659420 /nfs/dbraw/zinc/65/94/20/1038659420.db2.gz TWCWATQLOMHDHR-UHFFFAOYSA-N 2 1 320.908 4.223 20 0 DIADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1cc(Cl)ccc1Cl ZINC000582428386 1038664150 /nfs/dbraw/zinc/66/41/50/1038664150.db2.gz LQXCZICPQIXCOE-LLVKDONJSA-N 2 1 312.244 4.010 20 0 DIADMP c1csc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000111391938 1038668658 /nfs/dbraw/zinc/66/86/58/1038668658.db2.gz YFWUFGLJGSXTGX-AYHJJNSGSA-N 2 1 312.482 4.033 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000684953144 1038736853 /nfs/dbraw/zinc/73/68/53/1038736853.db2.gz AFNPXDFGSFLNBS-HXUWFJFHSA-N 2 1 323.484 4.089 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000608061367 1038761676 /nfs/dbraw/zinc/76/16/76/1038761676.db2.gz RBELWGJWPYUHRT-ZIAGYGMSSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000608061367 1038761681 /nfs/dbraw/zinc/76/16/81/1038761681.db2.gz RBELWGJWPYUHRT-ZIAGYGMSSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H]2CCC[C@H]21)C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564659 1038887038 /nfs/dbraw/zinc/88/70/38/1038887038.db2.gz YMUIVAWWYWCZAR-NCQGUEQISA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H](C[NH+]1CCC[C@@H]2CCC[C@@H]21)C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000608564659 1038887054 /nfs/dbraw/zinc/88/70/54/1038887054.db2.gz YMUIVAWWYWCZAR-NCQGUEQISA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H](C[NH+]1CCC[C@@H]2CCC[C@@H]21)C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000608564659 1038887071 /nfs/dbraw/zinc/88/70/71/1038887071.db2.gz YMUIVAWWYWCZAR-NCQGUEQISA-N 2 1 304.522 4.152 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863273 1038930100 /nfs/dbraw/zinc/93/01/00/1038930100.db2.gz HCAOIUWNEKGJHW-QAPCUYQASA-N 2 1 315.461 4.210 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863273 1038930116 /nfs/dbraw/zinc/93/01/16/1038930116.db2.gz HCAOIUWNEKGJHW-QAPCUYQASA-N 2 1 315.461 4.210 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863274 1038932017 /nfs/dbraw/zinc/93/20/17/1038932017.db2.gz HCAOIUWNEKGJHW-YJBOKZPZSA-N 2 1 315.461 4.210 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000342863274 1038932027 /nfs/dbraw/zinc/93/20/27/1038932027.db2.gz HCAOIUWNEKGJHW-YJBOKZPZSA-N 2 1 315.461 4.210 20 0 DIADMP CC1(C)CC[C@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc21 ZINC000090972745 1039029371 /nfs/dbraw/zinc/02/93/71/1039029371.db2.gz NKJNKMFLBYDKNT-FGTMMUONSA-N 2 1 312.501 4.058 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C2CC(C(F)(F)F)C2)cc1 ZINC000348752718 1039087314 /nfs/dbraw/zinc/08/73/14/1039087314.db2.gz HDPAMNJQWXVETJ-QGLTVNCISA-N 2 1 323.362 4.172 20 0 DIADMP FC1(F)CCC(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)CC1 ZINC001207347421 1039088762 /nfs/dbraw/zinc/08/87/62/1039088762.db2.gz UPIYLMZRCSNCEO-QGZVFWFLSA-N 2 1 314.464 4.152 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1C[C@@H](c2ccccc2)C1(C)C ZINC000123330402 1039144591 /nfs/dbraw/zinc/14/45/91/1039144591.db2.gz MENWREFFYZUECK-OALUTQOASA-N 2 1 311.473 4.144 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1C[C@H](c2ccccc2)C1(C)C ZINC000123330020 1039145689 /nfs/dbraw/zinc/14/56/89/1039145689.db2.gz MENWREFFYZUECK-MOPGFXCFSA-N 2 1 311.473 4.144 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498728 1039276509 /nfs/dbraw/zinc/27/65/09/1039276509.db2.gz VIJFDKHCCVHCPD-KGLIPLIRSA-N 2 1 320.864 4.469 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498728 1039276518 /nfs/dbraw/zinc/27/65/18/1039276518.db2.gz VIJFDKHCCVHCPD-KGLIPLIRSA-N 2 1 320.864 4.469 20 0 DIADMP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540147525 1039427524 /nfs/dbraw/zinc/42/75/24/1039427524.db2.gz ADHDSBPTILNELM-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCCC2 ZINC000540168874 1039436450 /nfs/dbraw/zinc/43/64/50/1039436450.db2.gz NXSRXVRGZYVRME-HZPDHXFCSA-N 2 1 311.473 4.057 20 0 DIADMP COc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C(C)C)cc1 ZINC000540299531 1039470335 /nfs/dbraw/zinc/47/03/35/1039470335.db2.gz KQFLZTCSEBYQRX-PXNSSMCTSA-N 2 1 318.505 4.102 20 0 DIADMP C[C@@H](NCC[C@@H]1CCC[N@H+]1C)c1cccc(Cl)c1Cl ZINC000540410986 1039488349 /nfs/dbraw/zinc/48/83/49/1039488349.db2.gz IVAVOKSYKXUVPY-NEPJUHHUSA-N 2 1 301.261 4.128 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)C[C@H](C)CCc2ccccc2)CC1 ZINC000540507602 1039509325 /nfs/dbraw/zinc/50/93/25/1039509325.db2.gz ZGHDDSQELUZDRL-GOSISDBHSA-N 2 1 302.506 4.060 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H](CCc2ccccc2)c2ccccc2)CC1 ZINC000540606126 1039525968 /nfs/dbraw/zinc/52/59/68/1039525968.db2.gz CRRFZLXDKBXVIQ-JOCHJYFZSA-N 2 1 320.480 4.212 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2c2ccccc2Cl)CC1 ZINC000657823900 1039587199 /nfs/dbraw/zinc/58/71/99/1039587199.db2.gz PYRVQSMELVHRBH-FUHWJXTLSA-N 2 1 306.881 4.050 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCC(C)(F)F)C1 ZINC000929644404 1039594474 /nfs/dbraw/zinc/59/44/74/1039594474.db2.gz REQUCWMMUYRENV-CVEARBPZSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000929644404 1039594485 /nfs/dbraw/zinc/59/44/85/1039594485.db2.gz REQUCWMMUYRENV-CVEARBPZSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCC(C)(F)F)C1 ZINC000929644404 1039594499 /nfs/dbraw/zinc/59/44/99/1039594499.db2.gz REQUCWMMUYRENV-CVEARBPZSA-N 2 1 302.453 4.008 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](C)C2CCCCCC2)[C@@H](C)C1 ZINC000541544989 1039698282 /nfs/dbraw/zinc/69/82/82/1039698282.db2.gz CBDZIXUJVKWPTD-BJLQDIEVSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC[C@@H]1CCCC[N@@H+]1C ZINC000541660432 1039727607 /nfs/dbraw/zinc/72/76/07/1039727607.db2.gz DMNBSZFIKDQISE-HOTGVXAUSA-N 2 1 300.446 4.266 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC[C@@H]1CCCC[N@H+]1C ZINC000541660432 1039727624 /nfs/dbraw/zinc/72/76/24/1039727624.db2.gz DMNBSZFIKDQISE-HOTGVXAUSA-N 2 1 300.446 4.266 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cccc(F)c2)cc1 ZINC000086279453 1039757779 /nfs/dbraw/zinc/75/77/79/1039757779.db2.gz JVDWLGKFMYIHOP-AWEZNQCLSA-N 2 1 309.388 4.171 20 0 DIADMP c1cc(CCC[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cs1 ZINC000542100577 1039789045 /nfs/dbraw/zinc/78/90/45/1039789045.db2.gz DYFRNPZUIUIRCC-IBGZPJMESA-N 2 1 320.546 4.269 20 0 DIADMP Cc1ncc([C@@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)s1 ZINC000090406319 1039793216 /nfs/dbraw/zinc/79/32/16/1039793216.db2.gz KBZQARIMZIQSIE-CQSZACIVSA-N 2 1 321.534 4.147 20 0 DIADMP CC(C)[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cccnc1 ZINC000091280321 1039837189 /nfs/dbraw/zinc/83/71/89/1039837189.db2.gz FVIZSFYEAUEEKD-LJQANCHMSA-N 2 1 303.494 4.023 20 0 DIADMP c1c[nH]c([C@H]2CCC[N@H+](Cc3ccc(-c4ccccc4)o3)C2)n1 ZINC000092071317 1039867338 /nfs/dbraw/zinc/86/73/38/1039867338.db2.gz XFFBSEODFLYEEY-INIZCTEOSA-N 2 1 307.397 4.049 20 0 DIADMP CC(C)(C[N@H+]1CCC[C@H]([NH3+])CC1)Sc1ccc(Cl)cc1 ZINC001205087578 1039934468 /nfs/dbraw/zinc/93/44/68/1039934468.db2.gz GAYFUHRVJIFABL-AWEZNQCLSA-N 2 1 312.910 4.024 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000492602776 1039986619 /nfs/dbraw/zinc/98/66/19/1039986619.db2.gz QOGVQMYDYFGZPV-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C(C)(C)C(F)F ZINC000657889073 1040036373 /nfs/dbraw/zinc/03/63/73/1040036373.db2.gz PXOKJXNLFQZBGF-GJZGRUSLSA-N 2 1 324.459 4.481 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000685424834 1040040329 /nfs/dbraw/zinc/04/03/29/1040040329.db2.gz HNCHWTIBNANQKX-LZLYRXPVSA-N 2 1 308.535 4.403 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000685424834 1040040344 /nfs/dbraw/zinc/04/03/44/1040040344.db2.gz HNCHWTIBNANQKX-LZLYRXPVSA-N 2 1 308.535 4.403 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CC3)[C@@H]1c1cccs1 ZINC000657890301 1040052040 /nfs/dbraw/zinc/05/20/40/1040052040.db2.gz RUJPELRKGZPYQX-DJIMGWMZSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CC3)[C@@H]1c1cccs1 ZINC000657890301 1040052060 /nfs/dbraw/zinc/05/20/60/1040052060.db2.gz RUJPELRKGZPYQX-DJIMGWMZSA-N 2 1 304.503 4.053 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470311 1040067563 /nfs/dbraw/zinc/06/75/63/1040067563.db2.gz FHTZFTRFZVEQIU-HNAYVOBHSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470311 1040067577 /nfs/dbraw/zinc/06/75/77/1040067577.db2.gz FHTZFTRFZVEQIU-HNAYVOBHSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470311 1040067595 /nfs/dbraw/zinc/06/75/95/1040067595.db2.gz FHTZFTRFZVEQIU-HNAYVOBHSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470311 1040067603 /nfs/dbraw/zinc/06/76/03/1040067603.db2.gz FHTZFTRFZVEQIU-HNAYVOBHSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@@H]1CCCC12CCC2 ZINC000708571057 1040089313 /nfs/dbraw/zinc/08/93/13/1040089313.db2.gz QBAHQPHIZZKVCJ-MISYRCLQSA-N 2 1 312.501 4.067 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000309719927 1040090015 /nfs/dbraw/zinc/09/00/15/1040090015.db2.gz LWYAPIZADXLWQI-TZIWHRDSSA-N 2 1 308.469 4.249 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCC[C@H]1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309749960 1040094905 /nfs/dbraw/zinc/09/49/05/1040094905.db2.gz ZAHBHBNFLGZDBW-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309763119 1040095726 /nfs/dbraw/zinc/09/57/26/1040095726.db2.gz FHVIPDVUWZCXHC-WMZOPIPTSA-N 2 1 314.498 4.057 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310080405 1040105091 /nfs/dbraw/zinc/10/50/91/1040105091.db2.gz IUPZTYZXKGEZJJ-VXKWHMMOSA-N 2 1 322.496 4.119 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC000310069750 1040107253 /nfs/dbraw/zinc/10/72/53/1040107253.db2.gz CVVJJWZINBUHLO-DENIHFKCSA-N 2 1 320.480 4.094 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310282568 1040115343 /nfs/dbraw/zinc/11/53/43/1040115343.db2.gz WSDYJRDBZDZVBQ-KNKQGSTJSA-N 2 1 322.496 4.290 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000685657921 1040197624 /nfs/dbraw/zinc/19/76/24/1040197624.db2.gz QCAMGROJWNLADG-GUDVDZBRSA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000685657921 1040197635 /nfs/dbraw/zinc/19/76/35/1040197635.db2.gz QCAMGROJWNLADG-GUDVDZBRSA-N 2 1 317.521 4.126 20 0 DIADMP C[C@@H]([NH2+]CCSC(C)(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309720048 1040214725 /nfs/dbraw/zinc/21/47/25/1040214725.db2.gz NKYJNXOYWLDBGN-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1 ZINC000658064697 1040285466 /nfs/dbraw/zinc/28/54/66/1040285466.db2.gz QDKSKZDRMNINLT-HZPDHXFCSA-N 2 1 320.440 4.030 20 0 DIADMP CC[C@@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000658237116 1040378006 /nfs/dbraw/zinc/37/80/06/1040378006.db2.gz YWKIZHSZNRHONL-SOAGJPPSSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000309695597 1040721226 /nfs/dbraw/zinc/72/12/26/1040721226.db2.gz DWWUXGQBXKCBNW-SJLPKXTDSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000309695594 1040721781 /nfs/dbraw/zinc/72/17/81/1040721781.db2.gz DWWUXGQBXKCBNW-FUHWJXTLSA-N 2 1 314.498 4.311 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000414065918 1040813563 /nfs/dbraw/zinc/81/35/63/1040813563.db2.gz GQVXOVJTKWQEKN-SJLPKXTDSA-N 2 1 317.864 4.161 20 0 DIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)C2)c1 ZINC000414075123 1040822083 /nfs/dbraw/zinc/82/20/83/1040822083.db2.gz XJRGTGDPFYCDJO-LESCRADOSA-N 2 1 318.892 4.050 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccncc2)cc1 ZINC000414170057 1040949534 /nfs/dbraw/zinc/94/95/34/1040949534.db2.gz BNLBRTLLIFBZSE-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]CC[C@@H]3CCC[N@@H+](C)C3)oc2c1 ZINC000414202403 1040992560 /nfs/dbraw/zinc/99/25/60/1040992560.db2.gz YNPLIOLZYNBXEE-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP C[C@@H](C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000809738640 1041240460 /nfs/dbraw/zinc/24/04/60/1041240460.db2.gz CRPVHVGVGCVVCA-INIZCTEOSA-N 2 1 314.448 4.123 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1cc[nH+]cc1Cl ZINC000301527986 1041244809 /nfs/dbraw/zinc/24/48/09/1041244809.db2.gz GPCABOMIWSFPHQ-RHSMWYFYSA-N 2 1 315.848 4.058 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1cc[nH+]cc1Cl ZINC000301527986 1041244828 /nfs/dbraw/zinc/24/48/28/1041244828.db2.gz GPCABOMIWSFPHQ-RHSMWYFYSA-N 2 1 315.848 4.058 20 0 DIADMP CCCCCC[C@@H](CC)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001170587389 1041264064 /nfs/dbraw/zinc/26/40/64/1041264064.db2.gz PWWPIOMAAGIPSQ-QGZVFWFLSA-N 3 1 313.574 4.211 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121052 1041326885 /nfs/dbraw/zinc/32/68/85/1041326885.db2.gz MPRHGPCRNRKDRK-UKRRQHHQSA-N 2 1 323.550 4.132 20 0 DIADMP CCCCCC[C@@H](CC)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001170601981 1041366516 /nfs/dbraw/zinc/36/65/16/1041366516.db2.gz UXWMMBDIZKXCGL-QUCCMNQESA-N 2 1 324.553 4.311 20 0 DIADMP CC1(C)CCC[C@@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001203208317 1041369678 /nfs/dbraw/zinc/36/96/78/1041369678.db2.gz QXCPYCUAKGPVOY-LJQANCHMSA-N 2 1 314.517 4.457 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H](CC)CC(F)F)CC1 ZINC000659847345 1041440751 /nfs/dbraw/zinc/44/07/51/1041440751.db2.gz NIKDGBFZNSMTFK-OAHLLOKOSA-N 2 1 304.469 4.112 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2ccsc2S1 ZINC000178254925 1041493283 /nfs/dbraw/zinc/49/32/83/1041493283.db2.gz KNIMAKFTAXKBPE-BLLLJJGKSA-N 2 1 322.543 4.138 20 0 DIADMP c1csc(C2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)c1 ZINC000166665590 1041529381 /nfs/dbraw/zinc/52/93/81/1041529381.db2.gz MJCZHERVEHHBCW-IAGOWNOFSA-N 2 1 318.530 4.166 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236810732 1041532638 /nfs/dbraw/zinc/53/26/38/1041532638.db2.gz KSYUIZBCDDZFKA-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236810732 1041532644 /nfs/dbraw/zinc/53/26/44/1041532644.db2.gz KSYUIZBCDDZFKA-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP Cc1cccc(C)c1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000812838518 1041655232 /nfs/dbraw/zinc/65/52/32/1041655232.db2.gz VIODCPQZKLHEIZ-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([N@@H+](C3CCCCC3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170738170 1041806156 /nfs/dbraw/zinc/80/61/56/1041806156.db2.gz KVIUWYFIONJXLR-GDBXOISBSA-N 2 1 304.522 4.326 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH+]3CCC([NH3+])(c4ccccc4Cl)CC3)C[C@@H]21 ZINC001170739175 1041808935 /nfs/dbraw/zinc/80/89/35/1041808935.db2.gz QDQNTKIBZPVAOZ-RBVVOMGSSA-N 2 1 318.892 4.024 20 0 DIADMP C[N@@H+](C[C@@H]1CC[C@@H](c2ccccc2)C1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000660540723 1041830172 /nfs/dbraw/zinc/83/01/72/1041830172.db2.gz FLNFXDADLUWUCO-CTLHLVSWSA-N 2 1 312.501 4.127 20 0 DIADMP C[NH+](C[C@@H]1CC[C@@H](c2ccccc2)C1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000660540723 1041830178 /nfs/dbraw/zinc/83/01/78/1041830178.db2.gz FLNFXDADLUWUCO-CTLHLVSWSA-N 2 1 312.501 4.127 20 0 DIADMP C[NH+](C[C@@H]1CC[C@@H](c2ccccc2)C1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000660540723 1041830184 /nfs/dbraw/zinc/83/01/84/1041830184.db2.gz FLNFXDADLUWUCO-CTLHLVSWSA-N 2 1 312.501 4.127 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692626 1041883804 /nfs/dbraw/zinc/88/38/04/1041883804.db2.gz MEHAKQVWSXFRNS-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692626 1041883813 /nfs/dbraw/zinc/88/38/13/1041883813.db2.gz MEHAKQVWSXFRNS-QZTJIDSGSA-N 2 1 323.484 4.131 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H](c2cccnc2)C2CCCCC2)C1 ZINC000652208759 1041975948 /nfs/dbraw/zinc/97/59/48/1041975948.db2.gz OHCBVOISXFUNIN-PXNSSMCTSA-N 2 1 315.505 4.025 20 0 DIADMP CC[N@H+](CCC[NH2+][C@H](C)c1cnn(C(C)C)c1)C1CCCCC1 ZINC000652237116 1041980889 /nfs/dbraw/zinc/98/08/89/1041980889.db2.gz HLJULRQOPGSNNW-QGZVFWFLSA-N 2 1 320.525 4.159 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H](C)c1cnn(C(C)C)c1)C1CCCCC1 ZINC000652237116 1041980898 /nfs/dbraw/zinc/98/08/98/1041980898.db2.gz HLJULRQOPGSNNW-QGZVFWFLSA-N 2 1 320.525 4.159 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1F ZINC000164625641 1042025927 /nfs/dbraw/zinc/02/59/27/1042025927.db2.gz XMSVHZUASMSDJT-CYBMUJFWSA-N 2 1 321.465 4.184 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+]CCCc1c(F)cccc1Cl ZINC001206085136 1042055511 /nfs/dbraw/zinc/05/55/11/1042055511.db2.gz RVWICDHOKJNDAH-CQSZACIVSA-N 2 1 314.876 4.122 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+]CCCc1c(F)cccc1Cl ZINC001206085136 1042055522 /nfs/dbraw/zinc/05/55/22/1042055522.db2.gz RVWICDHOKJNDAH-CQSZACIVSA-N 2 1 314.876 4.122 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)C2)cc1 ZINC000663344061 1042126461 /nfs/dbraw/zinc/12/64/61/1042126461.db2.gz NHZAZFMBYZZHMX-HMXCVIKNSA-N 2 1 312.501 4.034 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2cccc(Cl)c2C1 ZINC001170896767 1042146530 /nfs/dbraw/zinc/14/65/30/1042146530.db2.gz IZXIBQBFBGYLRV-NVXWUHKLSA-N 2 1 320.908 4.051 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000121656525 1042151146 /nfs/dbraw/zinc/15/11/46/1042151146.db2.gz QZGRMWHJTOVBFF-CYBMUJFWSA-N 2 1 314.395 4.230 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463766 1042177054 /nfs/dbraw/zinc/17/70/54/1042177054.db2.gz BKHWIFSGHHROOR-FXAWDEMLSA-N 2 1 316.489 4.141 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463766 1042177057 /nfs/dbraw/zinc/17/70/57/1042177057.db2.gz BKHWIFSGHHROOR-FXAWDEMLSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470292 1042181834 /nfs/dbraw/zinc/18/18/34/1042181834.db2.gz UJXUCLOGTWPNEF-RDJZCZTQSA-N 2 1 312.457 4.205 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2ccccc2o1 ZINC000663470292 1042181835 /nfs/dbraw/zinc/18/18/35/1042181835.db2.gz UJXUCLOGTWPNEF-RDJZCZTQSA-N 2 1 312.457 4.205 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c(C)s1 ZINC000663472140 1042184900 /nfs/dbraw/zinc/18/49/00/1042184900.db2.gz YYRRWJBUTMIERC-WMLDXEAASA-N 2 1 306.519 4.138 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1ccccc1F ZINC001167824733 1042212379 /nfs/dbraw/zinc/21/23/79/1042212379.db2.gz GBSXBHCYIZGOPV-LPHOPBHVSA-N 2 1 306.469 4.473 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc2ccccc2s1 ZINC000278924075 1042215565 /nfs/dbraw/zinc/21/55/65/1042215565.db2.gz IFHBLWMJRQKXMO-ZIAGYGMSSA-N 2 1 311.454 4.011 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc2ccccc2s1 ZINC000278924066 1042215740 /nfs/dbraw/zinc/21/57/40/1042215740.db2.gz IFHBLWMJRQKXMO-KGLIPLIRSA-N 2 1 311.454 4.011 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1ccccc1OC ZINC001167827427 1042219146 /nfs/dbraw/zinc/21/91/46/1042219146.db2.gz VUHWDNMAZSFDOX-MJGOQNOKSA-N 2 1 318.505 4.343 20 0 DIADMP Cc1ccccc1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)C1CC1 ZINC000820810550 1042228845 /nfs/dbraw/zinc/22/88/45/1042228845.db2.gz ZAEIVOWZJJDJEM-ZJVRTDGDSA-N 2 1 310.485 4.194 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001167838184 1042249688 /nfs/dbraw/zinc/24/96/88/1042249688.db2.gz RIHPEUGACWXKTK-SFHVURJKSA-N 2 1 318.505 4.090 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@H](C)c1ccc(OC)cc1 ZINC001167838034 1042249921 /nfs/dbraw/zinc/24/99/21/1042249921.db2.gz PAIZIAFCNYUGAU-DLBZAZTESA-N 2 1 306.494 4.199 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CC[C@@H]2CC2(Cl)Cl)CC1 ZINC000822583120 1042289976 /nfs/dbraw/zinc/28/99/76/1042289976.db2.gz JAKMSECINNKIQW-OAHLLOKOSA-N 2 1 321.336 4.014 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCc2c3ccccc3oc2C1 ZINC001167842037 1042257366 /nfs/dbraw/zinc/25/73/66/1042257366.db2.gz WBMXLNIPEZVAIV-MRXNPFEDSA-N 2 1 314.473 4.301 20 0 DIADMP c1csc([C@H]([NH2+]C[C@@H]2CCc3[nH+]ccn3C2)C2CCCC2)c1 ZINC000279035137 1042262304 /nfs/dbraw/zinc/26/23/04/1042262304.db2.gz WPCAKVYNFLMGGT-KBXCAEBGSA-N 2 1 315.486 4.028 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]CC2(C)CCC2)C[N@H+]1Cc1ccccc1 ZINC000434774539 1042305141 /nfs/dbraw/zinc/30/51/41/1042305141.db2.gz HQOKAONRKBWJFY-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(C)cc1)C1CCC1 ZINC000187246274 1042308363 /nfs/dbraw/zinc/30/83/63/1042308363.db2.gz WNCTWWTXVZYKKC-HXUWFJFHSA-N 2 1 311.473 4.411 20 0 DIADMP CC(C)(C)[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)cc1 ZINC000320134646 1042309816 /nfs/dbraw/zinc/30/98/16/1042309816.db2.gz JWHSKBXNVMJTJG-SFHVURJKSA-N 2 1 304.453 4.129 20 0 DIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(OCCC(C)C)cc2)CC1 ZINC000320145099 1042310477 /nfs/dbraw/zinc/31/04/77/1042310477.db2.gz IODXTYSXGIFBMJ-UHFFFAOYSA-N 2 1 318.505 4.076 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2oc3ccccc3c2C)CC1 ZINC000124125589 1042351689 /nfs/dbraw/zinc/35/16/89/1042351689.db2.gz PZPYVEWVWPWAAH-HNNXBMFYSA-N 2 1 300.446 4.266 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000391414383 1042355101 /nfs/dbraw/zinc/35/51/01/1042355101.db2.gz XBXHXQSVFZYOMV-HOTGVXAUSA-N 2 1 314.473 4.348 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000391414383 1042355106 /nfs/dbraw/zinc/35/51/06/1042355106.db2.gz XBXHXQSVFZYOMV-HOTGVXAUSA-N 2 1 314.473 4.348 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H](c3ccccc3)C[C@H](C)C2)C1 ZINC000391478031 1042374085 /nfs/dbraw/zinc/37/40/85/1042374085.db2.gz XKHNXXJHLYUFCI-ZSXPUABSSA-N 2 1 314.517 4.279 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000237515766 1042378243 /nfs/dbraw/zinc/37/82/43/1042378243.db2.gz RSLRLNXOHCRYHP-LJQANCHMSA-N 2 1 322.496 4.353 20 0 DIADMP Clc1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000237850391 1042380655 /nfs/dbraw/zinc/38/06/55/1042380655.db2.gz ADESSXNVVQYHBT-UHFFFAOYSA-N 2 1 306.881 4.227 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CC2CCCC2)c2ccccc2)CC[N@@H+]1C ZINC000513349389 1042534506 /nfs/dbraw/zinc/53/45/06/1042534506.db2.gz YBTLYKBKSSLTFR-LSTHTHJFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CC2CCCC2)c2ccccc2)CC[N@H+]1C ZINC000513349389 1042534510 /nfs/dbraw/zinc/53/45/10/1042534510.db2.gz YBTLYKBKSSLTFR-LSTHTHJFSA-N 2 1 300.490 4.380 20 0 DIADMP CCc1ccc([C@H]2CCC[N@H+](CCCn3cc[nH+]c3C)C2)cc1 ZINC000513371921 1042537174 /nfs/dbraw/zinc/53/71/74/1042537174.db2.gz QZOWOUHWZVOZSM-FQEVSTJZSA-N 2 1 311.473 4.024 20 0 DIADMP CCc1ccc([C@H]2CCC[N@@H+](CCCn3cc[nH+]c3C)C2)cc1 ZINC000513371921 1042537176 /nfs/dbraw/zinc/53/71/76/1042537176.db2.gz QZOWOUHWZVOZSM-FQEVSTJZSA-N 2 1 311.473 4.024 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513494119 1042547382 /nfs/dbraw/zinc/54/73/82/1042547382.db2.gz GEBKAWBLIYMRKX-BWPNAZKDSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccncc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000279979624 1042561085 /nfs/dbraw/zinc/56/10/85/1042561085.db2.gz QKRFEIFUUVAQNS-GOSISDBHSA-N 2 1 323.484 4.054 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)[C@H]1CCC[NH2+]C1 ZINC000422783223 1042689848 /nfs/dbraw/zinc/68/98/48/1042689848.db2.gz NTYHZQOQGHOVCY-WOPDTQHZSA-N 2 1 301.261 4.032 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)c2ccccc21 ZINC000422935311 1042693042 /nfs/dbraw/zinc/69/30/42/1042693042.db2.gz HEEVKUBKIDYVCW-QZTJIDSGSA-N 2 1 312.844 4.454 20 0 DIADMP Cc1cc([C@H]([NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C2CC2)ccc1F ZINC000423018130 1042695571 /nfs/dbraw/zinc/69/55/71/1042695571.db2.gz XXZVGGNSDLLDNX-VAMGGRTRSA-N 2 1 310.416 4.320 20 0 DIADMP C[C@@H]([NH2+]C1CCC(c2ccc(F)cc2)CC1)c1c[nH+]ccc1N ZINC000423026481 1042696355 /nfs/dbraw/zinc/69/63/55/1042696355.db2.gz BIEJVQXBXMXGQU-BZOOQXSSSA-N 2 1 313.420 4.010 20 0 DIADMP C[C@@H]([NH3+])C[C@@H](C)[NH2+]C1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423082199 1042696761 /nfs/dbraw/zinc/69/67/61/1042696761.db2.gz WMHDAJYYIVUASK-NXEZZACHSA-N 2 1 320.786 4.063 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]C3CCc4ccccc4CC3)CC[NH2+]2)cc1 ZINC000423155462 1042698770 /nfs/dbraw/zinc/69/87/70/1042698770.db2.gz LDTBQJDAZZYCKQ-FGZHOGPDSA-N 2 1 320.480 4.017 20 0 DIADMP [NH3+][C@H](C[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1)C1CC1 ZINC000423313561 1042705363 /nfs/dbraw/zinc/70/53/63/1042705363.db2.gz FVXOEUSJAWCSRA-SJORKVTESA-N 2 1 320.889 4.012 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@H]2CC[NH2+][C@@H](C)C2)c2ccccc2)c1 ZINC000423369412 1042708195 /nfs/dbraw/zinc/70/81/95/1042708195.db2.gz BYAYRPKKHWFPJS-HFSMHLIXSA-N 2 1 308.469 4.123 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000423395366 1042710608 /nfs/dbraw/zinc/71/06/08/1042710608.db2.gz SPPHMRSWYSXWJH-LMMKCTJWSA-N 2 1 324.468 4.057 20 0 DIADMP C[C@@H]([NH3+])[C@H](C)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423453064 1042714942 /nfs/dbraw/zinc/71/49/42/1042714942.db2.gz XCWPEQVDQFCWOJ-RDBSUJKOSA-N 2 1 302.393 4.004 20 0 DIADMP C[C@@H]1CC2(C[N@H+]1Cc1csc(Cl)c1Cl)CC[NH2+]CC2 ZINC000424388029 1042738603 /nfs/dbraw/zinc/73/86/03/1042738603.db2.gz YYORTHYITZVIMI-SNVBAGLBSA-N 2 1 319.301 4.019 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2CCCC(F)(F)C2)CC1 ZINC000513902125 1042762394 /nfs/dbraw/zinc/76/23/94/1042762394.db2.gz ICPPWHZROFBJQA-KRWDZBQOSA-N 2 1 316.480 4.256 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000514248547 1042776750 /nfs/dbraw/zinc/77/67/50/1042776750.db2.gz RTDCCQMNEBFQFE-XHSDSOJGSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000514248544 1042777296 /nfs/dbraw/zinc/77/72/96/1042777296.db2.gz RTDCCQMNEBFQFE-ARFHVFGLSA-N 2 1 314.464 4.055 20 0 DIADMP Cc1ccc(Cl)cc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167961318 1042843973 /nfs/dbraw/zinc/84/39/73/1042843973.db2.gz IAFOBJOKNRNPRY-YQQQUEKLSA-N 2 1 318.892 4.143 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccc1Cl ZINC001167961754 1042848483 /nfs/dbraw/zinc/84/84/83/1042848483.db2.gz PMYNOZHZUVGZRA-LNRIEFBSSA-N 2 1 318.892 4.396 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccc1Cl ZINC001167961754 1042848487 /nfs/dbraw/zinc/84/84/87/1042848487.db2.gz PMYNOZHZUVGZRA-LNRIEFBSSA-N 2 1 318.892 4.396 20 0 DIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc4ccccc4c3)C2)CC1 ZINC000517782390 1042897358 /nfs/dbraw/zinc/89/73/58/1042897358.db2.gz JRZAFXQSAWBJQB-NRFANRHFSA-N 2 1 308.469 4.004 20 0 DIADMP C[N@@H+](CC[C@@H]1CCC[NH+]1C)C1c2ccccc2-c2ccccc21 ZINC001167966869 1042952366 /nfs/dbraw/zinc/95/23/66/1042952366.db2.gz BHCYCZORWYAPQC-INIZCTEOSA-N 2 1 306.453 4.173 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+][C@@H]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001167968571 1042956543 /nfs/dbraw/zinc/95/65/43/1042956543.db2.gz RQHBLCBTIJDUTA-XGMMJMCCSA-N 2 1 316.533 4.340 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(-c3ccccc3)c2)C1 ZINC000520200807 1043024014 /nfs/dbraw/zinc/02/40/14/1043024014.db2.gz XDLGEOYRMXCZKM-IBGZPJMESA-N 2 1 308.469 4.175 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc3ccccc32)C1 ZINC000520205842 1043024132 /nfs/dbraw/zinc/02/41/32/1043024132.db2.gz GIWBDGGKNRPIDA-GOSISDBHSA-N 2 1 310.485 4.442 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000520205080 1043024437 /nfs/dbraw/zinc/02/44/37/1043024437.db2.gz SFEXUOPNSWPQFK-ZZQAKOBNSA-N 2 1 314.517 4.438 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](Cc1cccc(Cl)c1)C(C)C ZINC000441334105 1043036292 /nfs/dbraw/zinc/03/62/92/1043036292.db2.gz CBZCCHMBPCXKDI-UHFFFAOYSA-N 2 1 305.853 4.146 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](Cc1cccc(Cl)c1)C(C)C ZINC000441334105 1043036298 /nfs/dbraw/zinc/03/62/98/1043036298.db2.gz CBZCCHMBPCXKDI-UHFFFAOYSA-N 2 1 305.853 4.146 20 0 DIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccccc1C(F)(F)F ZINC000441359850 1043038286 /nfs/dbraw/zinc/03/82/86/1043038286.db2.gz VHNCBSMKKLYLGS-OAHLLOKOSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccccc1C(F)(F)F ZINC000441359850 1043038292 /nfs/dbraw/zinc/03/82/92/1043038292.db2.gz VHNCBSMKKLYLGS-OAHLLOKOSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1ccccc1C(F)(F)F ZINC000441359850 1043038296 /nfs/dbraw/zinc/03/82/96/1043038296.db2.gz VHNCBSMKKLYLGS-OAHLLOKOSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1ccccc1C(F)(F)F ZINC000441359850 1043038299 /nfs/dbraw/zinc/03/82/99/1043038299.db2.gz VHNCBSMKKLYLGS-OAHLLOKOSA-N 2 1 314.395 4.012 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441402718 1043042961 /nfs/dbraw/zinc/04/29/61/1043042961.db2.gz BGGQCZNGVAFSAL-ZRGWGRIASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441402718 1043042968 /nfs/dbraw/zinc/04/29/68/1043042968.db2.gz BGGQCZNGVAFSAL-ZRGWGRIASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441402718 1043042974 /nfs/dbraw/zinc/04/29/74/1043042974.db2.gz BGGQCZNGVAFSAL-ZRGWGRIASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441402718 1043042980 /nfs/dbraw/zinc/04/29/80/1043042980.db2.gz BGGQCZNGVAFSAL-ZRGWGRIASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccncc1 ZINC000173918702 1043055566 /nfs/dbraw/zinc/05/55/66/1043055566.db2.gz WGRUHUUVUNZPQY-MSOLQXFVSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccncc1 ZINC000173923636 1043055680 /nfs/dbraw/zinc/05/56/80/1043055680.db2.gz NAVJHPYJFLSDBU-ROUUACIJSA-N 2 1 323.484 4.307 20 0 DIADMP C[N@H+](Cc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167992787 1043058886 /nfs/dbraw/zinc/05/88/86/1043058886.db2.gz LDXHFOMSVJEBRZ-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167992787 1043058892 /nfs/dbraw/zinc/05/88/92/1043058892.db2.gz LDXHFOMSVJEBRZ-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP C[NH+](Cc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167992787 1043058901 /nfs/dbraw/zinc/05/89/01/1043058901.db2.gz LDXHFOMSVJEBRZ-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP C[NH+](Cc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167992787 1043058910 /nfs/dbraw/zinc/05/89/10/1043058910.db2.gz LDXHFOMSVJEBRZ-DFNIBXOVSA-N 2 1 318.892 4.177 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995117 1043068451 /nfs/dbraw/zinc/06/84/51/1043068451.db2.gz WYPIOPNLSCVJCT-YOFSQIOKSA-N 2 1 316.464 4.053 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC(N1CCC[C@@H]3CCCC[C@@H]31)C2 ZINC001167994651 1043069549 /nfs/dbraw/zinc/06/95/49/1043069549.db2.gz IZEZTRSPNUNICN-BYDNXPSSSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@@H]3CCCC[C@@H]31)C2 ZINC001167994651 1043069565 /nfs/dbraw/zinc/06/95/65/1043069565.db2.gz IZEZTRSPNUNICN-BYDNXPSSSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@@H]3CCCC[C@@H]31)C2 ZINC001167994651 1043069578 /nfs/dbraw/zinc/06/95/78/1043069578.db2.gz IZEZTRSPNUNICN-BYDNXPSSSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@@H+]1CCC[C@@H]3CCCC[C@@H]31)C2 ZINC001167994651 1043069589 /nfs/dbraw/zinc/06/95/89/1043069589.db2.gz IZEZTRSPNUNICN-BYDNXPSSSA-N 2 1 302.506 4.046 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@H+]1CCC[C@@H]3CCCC[C@@H]31)C2 ZINC001167994651 1043069604 /nfs/dbraw/zinc/06/96/04/1043069604.db2.gz IZEZTRSPNUNICN-BYDNXPSSSA-N 2 1 302.506 4.046 20 0 DIADMP CCCOc1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000178787428 1043137383 /nfs/dbraw/zinc/13/73/83/1043137383.db2.gz KYDZSOISEJRCCJ-INIZCTEOSA-N 2 1 315.461 4.111 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866217481 1043161306 /nfs/dbraw/zinc/16/13/06/1043161306.db2.gz FEVHZFILVNNHOZ-GFCCVEGCSA-N 2 1 321.852 4.006 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(C)ccn1 ZINC000866290772 1043173751 /nfs/dbraw/zinc/17/37/51/1043173751.db2.gz YRSHFHYLPWJBKD-KRWDZBQOSA-N 2 1 303.494 4.084 20 0 DIADMP C[C@H]1CC([NH2+]Cc2ccsc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168005110 1043242519 /nfs/dbraw/zinc/24/25/19/1043242519.db2.gz FZIJRRMCJBBSDD-HOTGVXAUSA-N 2 1 314.498 4.279 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC(C)(C)C)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005954 1043254657 /nfs/dbraw/zinc/25/46/57/1043254657.db2.gz LEIFWDZEEAMNRH-IZZQQSIFSA-N 2 1 302.506 4.454 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1ccc(C)cc1)C1CCC1 ZINC000427703501 1043298019 /nfs/dbraw/zinc/29/80/19/1043298019.db2.gz FRUXLQDSENELRJ-OXQOHEQNSA-N 2 1 311.473 4.267 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(Cl)nc1 ZINC000270483629 1043389181 /nfs/dbraw/zinc/38/91/81/1043389181.db2.gz KWSCKOMTTJFSFL-GJZGRUSLSA-N 2 1 309.885 4.040 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2S1 ZINC000872025956 1043424420 /nfs/dbraw/zinc/42/44/20/1043424420.db2.gz WEIQMXLUHISIKP-ZOBUZTSGSA-N 2 1 316.514 4.219 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccc(CF)cc3)C2)CC1 ZINC000777567359 1043434994 /nfs/dbraw/zinc/43/49/94/1043434994.db2.gz SYNLRUNIDSDCBN-HXUWFJFHSA-N 2 1 318.480 4.100 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccc(CF)cc3)C2)CC1 ZINC000777567359 1043435000 /nfs/dbraw/zinc/43/50/00/1043435000.db2.gz SYNLRUNIDSDCBN-HXUWFJFHSA-N 2 1 318.480 4.100 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000442875679 1043444011 /nfs/dbraw/zinc/44/40/11/1043444011.db2.gz UFQVZINBJAMIAS-IAGOWNOFSA-N 2 1 320.546 4.427 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CC[C@@H]2C2CC2)C[N@H+]1Cc1ccccc1 ZINC000558252603 1043473790 /nfs/dbraw/zinc/47/37/90/1043473790.db2.gz QCWGTAUAMOPBII-XRULBBBTSA-N 2 1 312.501 4.065 20 0 DIADMP CC1CC[NH+](CCC[NH2+]Cc2ccc(-c3ccccc3)o2)CC1 ZINC000521821999 1043487179 /nfs/dbraw/zinc/48/71/79/1043487179.db2.gz NYPHPGIRNWAYCK-UHFFFAOYSA-N 2 1 312.457 4.158 20 0 DIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584747 1043511791 /nfs/dbraw/zinc/51/17/91/1043511791.db2.gz ZQMNICQGTHREBL-FXAWDEMLSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584747 1043511799 /nfs/dbraw/zinc/51/17/99/1043511799.db2.gz ZQMNICQGTHREBL-FXAWDEMLSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1 ZINC000777584747 1043511807 /nfs/dbraw/zinc/51/18/07/1043511807.db2.gz ZQMNICQGTHREBL-FXAWDEMLSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777584747 1043511819 /nfs/dbraw/zinc/51/18/19/1043511819.db2.gz ZQMNICQGTHREBL-FXAWDEMLSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1csc(Cl)c1 ZINC000191127877 1043524102 /nfs/dbraw/zinc/52/41/02/1043524102.db2.gz DHYMPYJJGQSMEZ-SNVBAGLBSA-N 2 1 300.899 4.361 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000388924973 1043544217 /nfs/dbraw/zinc/54/42/17/1043544217.db2.gz VWJSSWZODCTDES-ZFWWWQNUSA-N 2 1 318.461 4.127 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168019227 1043566456 /nfs/dbraw/zinc/56/64/56/1043566456.db2.gz HPHHVMFABQGLID-CWPLJXCYSA-N 2 1 312.457 4.119 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168019227 1043566465 /nfs/dbraw/zinc/56/64/65/1043566465.db2.gz HPHHVMFABQGLID-CWPLJXCYSA-N 2 1 312.457 4.119 20 0 DIADMP c1ccc(C(c2ccccc2)[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000558724888 1043580925 /nfs/dbraw/zinc/58/09/25/1043580925.db2.gz ILLYSBYWKIQLEG-IBGZPJMESA-N 2 1 320.480 4.194 20 0 DIADMP C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cccc(C[NH+](C)C)c1 ZINC000926488690 1043585375 /nfs/dbraw/zinc/58/53/75/1043585375.db2.gz JZFMHWKOXRTHDW-GFCCVEGCSA-N 2 1 322.374 4.016 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926574760 1043600858 /nfs/dbraw/zinc/60/08/58/1043600858.db2.gz YFLBRURADFTTGO-RYUDHWBXSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539981 1043615743 /nfs/dbraw/zinc/61/57/43/1043615743.db2.gz NUAUTAWWHWXHAC-OXJNMPFZSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539981 1043615750 /nfs/dbraw/zinc/61/57/50/1043615750.db2.gz NUAUTAWWHWXHAC-OXJNMPFZSA-N 2 1 321.468 4.282 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)C1 ZINC001648960831 1043633989 /nfs/dbraw/zinc/63/39/89/1043633989.db2.gz WFBLDXXCGFDDHY-FQEVSTJZSA-N 2 1 322.496 4.484 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)CCc1ccccc1 ZINC000191471326 1043644063 /nfs/dbraw/zinc/64/40/63/1043644063.db2.gz RMMYPHHUJPMDCU-SFHVURJKSA-N 2 1 313.489 4.179 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)CCc1ccccc1 ZINC000191471326 1043644071 /nfs/dbraw/zinc/64/40/71/1043644071.db2.gz RMMYPHHUJPMDCU-SFHVURJKSA-N 2 1 313.489 4.179 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)CCc1ccccc1 ZINC000191471326 1043644077 /nfs/dbraw/zinc/64/40/77/1043644077.db2.gz RMMYPHHUJPMDCU-SFHVURJKSA-N 2 1 313.489 4.179 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)c1ccc(F)cc1F ZINC000191505108 1043650474 /nfs/dbraw/zinc/65/04/74/1043650474.db2.gz NGBSPQUDVOJRGS-AWEZNQCLSA-N 2 1 321.415 4.197 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)c1ccc(F)cc1F ZINC000191505108 1043650492 /nfs/dbraw/zinc/65/04/92/1043650492.db2.gz NGBSPQUDVOJRGS-AWEZNQCLSA-N 2 1 321.415 4.197 20 0 DIADMP Cc1ccc(C[NH+](C)CCCCC[N@H+](C)Cc2ccc(C)o2)o1 ZINC000354276897 1043691757 /nfs/dbraw/zinc/69/17/57/1043691757.db2.gz DBGGNCXSOXGKKH-UHFFFAOYSA-N 2 1 318.461 4.224 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000474367475 1043754418 /nfs/dbraw/zinc/75/44/18/1043754418.db2.gz HLSQTTSERIDYAT-MQVJKMGUSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C1CC1 ZINC000777696635 1043763742 /nfs/dbraw/zinc/76/37/42/1043763742.db2.gz SKUBSZKTLNXWES-FQEVSTJZSA-N 2 1 315.505 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470721 1043789976 /nfs/dbraw/zinc/78/99/76/1043789976.db2.gz AXGGNPGMCHYGBH-VQJWOFKYSA-N 2 1 324.921 4.110 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474470721 1043789988 /nfs/dbraw/zinc/78/99/88/1043789988.db2.gz AXGGNPGMCHYGBH-VQJWOFKYSA-N 2 1 324.921 4.110 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000356395821 1043836839 /nfs/dbraw/zinc/83/68/39/1043836839.db2.gz UITPEBIDKNSZTM-DUQGCJEPSA-N 2 1 309.457 4.150 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000356395821 1043836852 /nfs/dbraw/zinc/83/68/52/1043836852.db2.gz UITPEBIDKNSZTM-DUQGCJEPSA-N 2 1 309.457 4.150 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC2(C)C)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039206 1043853397 /nfs/dbraw/zinc/85/33/97/1043853397.db2.gz CGPMSNDJGHEFCT-IZZQQSIFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCC2(C)C)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039206 1043853413 /nfs/dbraw/zinc/85/34/13/1043853413.db2.gz CGPMSNDJGHEFCT-IZZQQSIFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC2(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039206 1043853427 /nfs/dbraw/zinc/85/34/27/1043853427.db2.gz CGPMSNDJGHEFCT-IZZQQSIFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC2(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039206 1043853447 /nfs/dbraw/zinc/85/34/47/1043853447.db2.gz CGPMSNDJGHEFCT-IZZQQSIFSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CC([N@H+]2CCCC[C@H]2C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039448 1043859635 /nfs/dbraw/zinc/85/96/35/1043859635.db2.gz DXCSZUIHVDYIBG-KZNAEPCWSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCCC[C@H]2C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039448 1043859652 /nfs/dbraw/zinc/85/96/52/1043859652.db2.gz DXCSZUIHVDYIBG-KZNAEPCWSA-N 2 1 300.490 4.302 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2nccc3ccccc32)CC1 ZINC000289671297 1043862086 /nfs/dbraw/zinc/86/20/86/1043862086.db2.gz JEOOKGLWEFIPQB-MRXNPFEDSA-N 2 1 311.473 4.150 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCCC2(F)F)C[C@H]1c1ccccc1 ZINC000453244875 1043868436 /nfs/dbraw/zinc/86/84/36/1043868436.db2.gz HPXQSPMTKSTPLS-SQNIBIBYSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCCCC2(F)F)C[C@H]1c1ccccc1 ZINC000453244875 1043868452 /nfs/dbraw/zinc/86/84/52/1043868452.db2.gz HPXQSPMTKSTPLS-SQNIBIBYSA-N 2 1 322.443 4.237 20 0 DIADMP C[C@H]1CC([NH+]2CCCCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040751 1043883651 /nfs/dbraw/zinc/88/36/51/1043883651.db2.gz OWFVBMKIQPEVOC-ROUUACIJSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC1(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412703 1043884996 /nfs/dbraw/zinc/88/49/96/1043884996.db2.gz ZODHWLYMFSPGCO-XHSDSOJGSA-N 2 1 314.464 4.055 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCC[C@H](C(C)C)C3)CC2)[nH+]1 ZINC000474725302 1043895554 /nfs/dbraw/zinc/89/55/54/1043895554.db2.gz LYTYCJIRXITKJC-HKUYNNGSSA-N 2 1 315.505 4.163 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H](C)C2CCSCC2)C1 ZINC000474711667 1043898069 /nfs/dbraw/zinc/89/80/69/1043898069.db2.gz RUOBYHQGAVVHKZ-HZPDHXFCSA-N 2 1 312.567 4.008 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H](C)C2CCSCC2)C1 ZINC000474711667 1043898080 /nfs/dbraw/zinc/89/80/80/1043898080.db2.gz RUOBYHQGAVVHKZ-HZPDHXFCSA-N 2 1 312.567 4.008 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H]2CCc3cc(Cl)ccc32)CC1 ZINC000777896397 1043917424 /nfs/dbraw/zinc/91/74/24/1043917424.db2.gz JHKBOEWNDMWZIP-LJQANCHMSA-N 2 1 320.908 4.380 20 0 DIADMP CC(C)Oc1ccccc1C[N@@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001137139028 1043926458 /nfs/dbraw/zinc/92/64/58/1043926458.db2.gz BAMMILWJTAPYME-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C[C@H](CC(C)C)c1ccccc1 ZINC000474813437 1043929285 /nfs/dbraw/zinc/92/92/85/1043929285.db2.gz CMPPXGCVOSQQHF-FQEVSTJZSA-N 2 1 313.489 4.391 20 0 DIADMP C[C@@H]1CC[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1F ZINC001168041994 1043932053 /nfs/dbraw/zinc/93/20/53/1043932053.db2.gz XKSXTGYXGPZNJF-NHAYFPRASA-N 2 1 318.480 4.108 20 0 DIADMP C[C@@H]1CC[N@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C[C@H]1F ZINC001168041994 1043932059 /nfs/dbraw/zinc/93/20/59/1043932059.db2.gz XKSXTGYXGPZNJF-NHAYFPRASA-N 2 1 318.480 4.108 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]C2(c3ccc(Cl)cc3)CC2)CC1 ZINC000561839122 1044012208 /nfs/dbraw/zinc/01/22/08/1044012208.db2.gz ICCZGQHUQMJPSP-UHFFFAOYSA-N 2 1 306.881 4.182 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCC(F)(F)C2)cc1 ZINC000358287150 1044047604 /nfs/dbraw/zinc/04/76/04/1044047604.db2.gz AKLNLWSLSWLSPO-BBRMVZONSA-N 2 1 319.399 4.409 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)cc1 ZINC000358287157 1044047906 /nfs/dbraw/zinc/04/79/06/1044047906.db2.gz AKLNLWSLSWLSPO-XJKSGUPXSA-N 2 1 319.399 4.409 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2(C3CC3)CCC2)cc1 ZINC000358355969 1044059994 /nfs/dbraw/zinc/05/99/94/1044059994.db2.gz SXWZNLJFTWLOIN-HNNXBMFYSA-N 2 1 309.457 4.412 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCc2sccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000358474850 1044074436 /nfs/dbraw/zinc/07/44/36/1044074436.db2.gz VEXZQPGMAWWADP-DAYGRLMNSA-N 2 1 318.530 4.368 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](CNCc2cc(Cl)sc2Cl)C1 ZINC001649175939 1044112614 /nfs/dbraw/zinc/11/26/14/1044112614.db2.gz RXWFFJKKFWLZPW-NSHDSACASA-N 2 1 321.317 4.265 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCCc4occc43)CC2)C1 ZINC000359113966 1044132908 /nfs/dbraw/zinc/13/29/08/1044132908.db2.gz JLBVPNJZZVAYLO-AYBZRNKSSA-N 2 1 316.489 4.290 20 0 DIADMP C[C@H](C[N@H+]1CCCC2(CC[NH+](C)CC2)C1)c1cccc(Cl)c1 ZINC000798956758 1044154413 /nfs/dbraw/zinc/15/44/13/1044154413.db2.gz NESDYWKQPJNXHV-MRXNPFEDSA-N 2 1 320.908 4.251 20 0 DIADMP c1cnc2c(c1)cccc2C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001137175561 1044162607 /nfs/dbraw/zinc/16/26/07/1044162607.db2.gz CHYWKMMYARKNHF-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@@H](CC[NH2+][C@@H]1CCSc2ccc(F)cc21)[NH+]1CCCCC1 ZINC000346877639 1044166622 /nfs/dbraw/zinc/16/66/22/1044166622.db2.gz KJACQOVKQFELHP-WMLDXEAASA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H](CC[NH2+][C@@H]1CCSc2ccc(F)cc21)[NH+]1CCCCC1 ZINC000346876499 1044166729 /nfs/dbraw/zinc/16/67/29/1044166729.db2.gz KJACQOVKQFELHP-RHSMWYFYSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000359659688 1044187743 /nfs/dbraw/zinc/18/77/43/1044187743.db2.gz ISROZVQDOSGFCT-INIZCTEOSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCc3sccc32)C1 ZINC000359946344 1044219312 /nfs/dbraw/zinc/21/93/12/1044219312.db2.gz ZDXKONUUFUZHOG-WBVHZDCISA-N 2 1 306.519 4.227 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCOc3ccccc32)C1 ZINC000359943559 1044220088 /nfs/dbraw/zinc/22/00/88/1044220088.db2.gz QJJYQHOXMZCCNL-MJGOQNOKSA-N 2 1 316.489 4.002 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1OC ZINC000360029633 1044227788 /nfs/dbraw/zinc/22/77/88/1044227788.db2.gz QEUQSCIGKJNCEU-INMHGKMJSA-N 2 1 322.880 4.016 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1OC ZINC000360029633 1044227804 /nfs/dbraw/zinc/22/78/04/1044227804.db2.gz QEUQSCIGKJNCEU-INMHGKMJSA-N 2 1 322.880 4.016 20 0 DIADMP CC(C)(C[NH2+]Cc1cnc(C2CCCC2)s1)C[NH+]1CCCC1 ZINC000360177966 1044243928 /nfs/dbraw/zinc/24/39/28/1044243928.db2.gz QVOHFIDSUVEYCW-UHFFFAOYSA-N 2 1 321.534 4.012 20 0 DIADMP CC(C)[C@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(Cl)cc1F ZINC000563353015 1044250113 /nfs/dbraw/zinc/25/01/13/1044250113.db2.gz GNNHNCMRRYHIHI-KRWDZBQOSA-N 2 1 323.843 4.132 20 0 DIADMP Cn1cncc1CCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000563354260 1044251718 /nfs/dbraw/zinc/25/17/18/1044251718.db2.gz IEYRJDOXRZHZKM-UHFFFAOYSA-N 2 1 319.452 4.171 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000563354260 1044251726 /nfs/dbraw/zinc/25/17/26/1044251726.db2.gz IEYRJDOXRZHZKM-UHFFFAOYSA-N 2 1 319.452 4.171 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000563354260 1044251738 /nfs/dbraw/zinc/25/17/38/1044251738.db2.gz IEYRJDOXRZHZKM-UHFFFAOYSA-N 2 1 319.452 4.171 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C)(C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168053340 1044260255 /nfs/dbraw/zinc/26/02/55/1044260255.db2.gz NVJZFQDAHHKPCI-IZZQQSIFSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(C)(C)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168053340 1044260268 /nfs/dbraw/zinc/26/02/68/1044260268.db2.gz NVJZFQDAHHKPCI-IZZQQSIFSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC(C)(C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053340 1044260278 /nfs/dbraw/zinc/26/02/78/1044260278.db2.gz NVJZFQDAHHKPCI-IZZQQSIFSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC(C)(C)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053340 1044260290 /nfs/dbraw/zinc/26/02/90/1044260290.db2.gz NVJZFQDAHHKPCI-IZZQQSIFSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2ccsc2S1 ZINC000360494200 1044277121 /nfs/dbraw/zinc/27/71/21/1044277121.db2.gz DBDFNSPTAZFGPO-BLLLJJGKSA-N 2 1 322.543 4.280 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000360497160 1044278620 /nfs/dbraw/zinc/27/86/20/1044278620.db2.gz XWXIPOAMLHKOBK-ZDUSSCGKSA-N 2 1 321.534 4.242 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1 ZINC000563570853 1044282982 /nfs/dbraw/zinc/28/29/82/1044282982.db2.gz JUQIIEYZFYKPIY-ATZDWAIDSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1nccc2ccccc21 ZINC000563574091 1044283905 /nfs/dbraw/zinc/28/39/05/1044283905.db2.gz PGHCLWFTQMPGLY-QGZVFWFLSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2[C@H]2CC[C@@](C)(c3ccccc3)C2)CC1 ZINC000475133287 1044284063 /nfs/dbraw/zinc/28/40/63/1044284063.db2.gz ZAOUGMQZBWHCLF-VQTJNVASSA-N 2 1 312.501 4.057 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCC(C)(C)c2ccccc21 ZINC000360654782 1044295631 /nfs/dbraw/zinc/29/56/31/1044295631.db2.gz AFUGYBJWBSLZHT-IBGZPJMESA-N 2 1 311.473 4.374 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC000563720698 1044306678 /nfs/dbraw/zinc/30/66/78/1044306678.db2.gz BEXKSAAQFJPYMZ-SFHVURJKSA-N 2 1 317.864 4.233 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC000563720698 1044306686 /nfs/dbraw/zinc/30/66/86/1044306686.db2.gz BEXKSAAQFJPYMZ-SFHVURJKSA-N 2 1 317.864 4.233 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H]2CC(C)(C)Cc3occc32)CC1 ZINC000360854820 1044318793 /nfs/dbraw/zinc/31/87/93/1044318793.db2.gz CTYFSPMUWYXSEM-KRWDZBQOSA-N 2 1 304.478 4.147 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+]Cc1cc2cc(F)ccc2o1)C(C)(C)C ZINC000360916099 1044329584 /nfs/dbraw/zinc/32/95/84/1044329584.db2.gz MSQKNGNWUAYQCB-KRWDZBQOSA-N 2 1 306.425 4.028 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCCC[C@@H]3C3CC3)C2)cc1 ZINC000475285718 1044347046 /nfs/dbraw/zinc/34/70/46/1044347046.db2.gz HDYFLYBXUKRCJE-HMXCVIKNSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000361078472 1044357750 /nfs/dbraw/zinc/35/77/50/1044357750.db2.gz HWIDIJQRQIBAPM-QFBILLFUSA-N 2 1 316.489 4.014 20 0 DIADMP C[N@H+](CCCNc1cc[nH+]c2ccsc21)Cc1ccccc1 ZINC000361160270 1044368484 /nfs/dbraw/zinc/36/84/84/1044368484.db2.gz VZYBGIFLPFLPNX-UHFFFAOYSA-N 2 1 311.454 4.230 20 0 DIADMP C[N@@H+](CCCNc1cc[nH+]c2ccsc21)Cc1ccccc1 ZINC000361160270 1044368496 /nfs/dbraw/zinc/36/84/96/1044368496.db2.gz VZYBGIFLPFLPNX-UHFFFAOYSA-N 2 1 311.454 4.230 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1cc(C)ccc1C ZINC000348261547 1044378610 /nfs/dbraw/zinc/37/86/10/1044378610.db2.gz GMWLXCPDQRGQSZ-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1cc(C)ccc1C ZINC000348261547 1044378623 /nfs/dbraw/zinc/37/86/23/1044378623.db2.gz GMWLXCPDQRGQSZ-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP CC[C@@H]1CC[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168066251 1044418615 /nfs/dbraw/zinc/41/86/15/1044418615.db2.gz MEJRXEIBFPHHMY-OKZBNKHCSA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CC[N@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168066251 1044418617 /nfs/dbraw/zinc/41/86/17/1044418617.db2.gz MEJRXEIBFPHHMY-OKZBNKHCSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CCSc2c(F)cccc21)C[NH+]1CCCCC1 ZINC000336851132 1044439729 /nfs/dbraw/zinc/43/97/29/1044439729.db2.gz HEJVQPTZEDRUFD-YOEHRIQHSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000565563624 1044444187 /nfs/dbraw/zinc/44/41/87/1044444187.db2.gz SRLDNCOYXKUSMF-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000565563624 1044444197 /nfs/dbraw/zinc/44/41/97/1044444197.db2.gz SRLDNCOYXKUSMF-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563624 1044444205 /nfs/dbraw/zinc/44/42/05/1044444205.db2.gz SRLDNCOYXKUSMF-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563624 1044444211 /nfs/dbraw/zinc/44/42/11/1044444211.db2.gz SRLDNCOYXKUSMF-OXQOHEQNSA-N 2 1 300.490 4.259 20 0 DIADMP CSc1ccc(C[N@@H+](C2CCCC2)C2CCN(C)CC2)s1 ZINC001142031295 1044462691 /nfs/dbraw/zinc/46/26/91/1044462691.db2.gz DUHSFTORZJVWKH-UHFFFAOYSA-N 2 1 324.559 4.309 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCOc3c(Cl)cccc32)C1 ZINC000361971901 1044465145 /nfs/dbraw/zinc/46/51/45/1044465145.db2.gz OASVNTNAMXYEEF-JJRVBVJISA-N 2 1 322.880 4.016 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCOc3c(Cl)cccc32)C1 ZINC000361971898 1044466101 /nfs/dbraw/zinc/46/61/01/1044466101.db2.gz OASVNTNAMXYEEF-CKEIUWERSA-N 2 1 322.880 4.016 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000566039415 1044471612 /nfs/dbraw/zinc/47/16/12/1044471612.db2.gz OVMONCXDCOGDLM-ZCNNSNEGSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@@H](C)c2ccc(Cl)cc2)C1 ZINC000566587745 1044500544 /nfs/dbraw/zinc/50/05/44/1044500544.db2.gz FNJBFTCLAIOGEW-PMPSAXMXSA-N 2 1 308.897 4.152 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccc(C)cc2C)C1 ZINC000348317686 1044502002 /nfs/dbraw/zinc/50/20/02/1044502002.db2.gz KTUDUVRGUMATOD-IBGZPJMESA-N 2 1 311.473 4.078 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccc(C)cc2C)C1 ZINC000348317686 1044502013 /nfs/dbraw/zinc/50/20/13/1044502013.db2.gz KTUDUVRGUMATOD-IBGZPJMESA-N 2 1 311.473 4.078 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCC2(F)CCC2)cc1 ZINC000348321184 1044509807 /nfs/dbraw/zinc/50/98/07/1044509807.db2.gz MIQBRDYVKXGQHT-CQSZACIVSA-N 2 1 301.409 4.114 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(Cl)nc1 ZINC000179099390 1044518142 /nfs/dbraw/zinc/51/81/42/1044518142.db2.gz AJQBNCVWBCMALT-CQSZACIVSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(Cl)nc1 ZINC000179099390 1044518157 /nfs/dbraw/zinc/51/81/57/1044518157.db2.gz AJQBNCVWBCMALT-CQSZACIVSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148030 1044546810 /nfs/dbraw/zinc/54/68/10/1044546810.db2.gz AMPOZOSMWRJRCS-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148030 1044546821 /nfs/dbraw/zinc/54/68/21/1044546821.db2.gz AMPOZOSMWRJRCS-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148030 1044546834 /nfs/dbraw/zinc/54/68/34/1044546834.db2.gz AMPOZOSMWRJRCS-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148030 1044546847 /nfs/dbraw/zinc/54/68/47/1044546847.db2.gz AMPOZOSMWRJRCS-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-c2ccncc2)cc1 ZINC000339077016 1044548605 /nfs/dbraw/zinc/54/86/05/1044548605.db2.gz XSHRWYVADUXWBM-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP CC1(C)CC([NH2+]Cc2cscc2C(F)(F)F)CC(C)(C)[NH2+]1 ZINC000567457826 1044567372 /nfs/dbraw/zinc/56/73/72/1044567372.db2.gz YURUDPGBLKWRAR-UHFFFAOYSA-N 2 1 320.424 4.166 20 0 DIADMP Clc1ccc(C2=CC[N@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000444568420 1044568240 /nfs/dbraw/zinc/56/82/40/1044568240.db2.gz IYJNKJSQTCSQKE-UHFFFAOYSA-N 2 1 318.892 4.305 20 0 DIADMP Clc1ccc(C2=CC[N@@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000444568420 1044568253 /nfs/dbraw/zinc/56/82/53/1044568253.db2.gz IYJNKJSQTCSQKE-UHFFFAOYSA-N 2 1 318.892 4.305 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C[C@@H](C)CCc2ccccc2)c1 ZINC001649170704 1044587543 /nfs/dbraw/zinc/58/75/43/1044587543.db2.gz CJXVZSBTZJSCLP-IBGZPJMESA-N 2 1 324.512 4.497 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000885923191 1044591467 /nfs/dbraw/zinc/59/14/67/1044591467.db2.gz SSZUWRSIODVTIB-OALUTQOASA-N 2 1 322.537 4.113 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000567966220 1044594663 /nfs/dbraw/zinc/59/46/63/1044594663.db2.gz VAAXMJSJRFJESL-WXLSXGNJSA-N 2 1 320.443 4.064 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000568408871 1044623878 /nfs/dbraw/zinc/62/38/78/1044623878.db2.gz DFJHLZSKYWSZAX-AWEZNQCLSA-N 2 1 317.864 4.232 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000568408871 1044623885 /nfs/dbraw/zinc/62/38/85/1044623885.db2.gz DFJHLZSKYWSZAX-AWEZNQCLSA-N 2 1 317.864 4.232 20 0 DIADMP Cc1ccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524047 1044631540 /nfs/dbraw/zinc/63/15/40/1044631540.db2.gz PTEOVRIGOPEVHR-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524047 1044631547 /nfs/dbraw/zinc/63/15/47/1044631547.db2.gz PTEOVRIGOPEVHR-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524047 1044631552 /nfs/dbraw/zinc/63/15/52/1044631552.db2.gz PTEOVRIGOPEVHR-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524047 1044631560 /nfs/dbraw/zinc/63/15/60/1044631560.db2.gz PTEOVRIGOPEVHR-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524050 1044632418 /nfs/dbraw/zinc/63/24/18/1044632418.db2.gz PTEOVRIGOPEVHR-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524050 1044632427 /nfs/dbraw/zinc/63/24/27/1044632427.db2.gz PTEOVRIGOPEVHR-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524050 1044632433 /nfs/dbraw/zinc/63/24/33/1044632433.db2.gz PTEOVRIGOPEVHR-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000568524050 1044632438 /nfs/dbraw/zinc/63/24/38/1044632438.db2.gz PTEOVRIGOPEVHR-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP CC[C@@H](c1ccc(F)cc1F)[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000523442176 1044638373 /nfs/dbraw/zinc/63/83/73/1044638373.db2.gz ONOZKYGOYFXDGF-IBGZPJMESA-N 2 1 324.459 4.468 20 0 DIADMP C[C@H]1CC[C@H]1[NH2+]CC1([N@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233204 1044671034 /nfs/dbraw/zinc/67/10/34/1044671034.db2.gz NYRSJIOLMACFBO-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1CC[C@H]1[NH2+]CC1([N@@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233204 1044671038 /nfs/dbraw/zinc/67/10/38/1044671038.db2.gz NYRSJIOLMACFBO-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cscc1C(F)(F)F ZINC000356132744 1044741813 /nfs/dbraw/zinc/74/18/13/1044741813.db2.gz WEKWFQLUOSLMCD-ZDUSSCGKSA-N 2 1 320.424 4.073 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000570289777 1044747187 /nfs/dbraw/zinc/74/71/87/1044747187.db2.gz OEQXWWWVOLSEDB-SFHVURJKSA-N 2 1 317.864 4.137 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000570694609 1044777130 /nfs/dbraw/zinc/77/71/30/1044777130.db2.gz KRTNMQRNRWIKAR-SFHVURJKSA-N 2 1 317.864 4.233 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000570694609 1044777141 /nfs/dbraw/zinc/77/71/41/1044777141.db2.gz KRTNMQRNRWIKAR-SFHVURJKSA-N 2 1 317.864 4.233 20 0 DIADMP CC1=C[C@H](C)C[C@H](C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000570764250 1044780514 /nfs/dbraw/zinc/78/05/14/1044780514.db2.gz FUUOQKUUVOMZCO-WNHJNPCNSA-N 2 1 304.522 4.221 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000571096807 1044797432 /nfs/dbraw/zinc/79/74/32/1044797432.db2.gz UBGOKCKHXHXZGU-FHWLQOOXSA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000571096807 1044797441 /nfs/dbraw/zinc/79/74/41/1044797441.db2.gz UBGOKCKHXHXZGU-FHWLQOOXSA-N 2 1 317.521 4.126 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C(c1ccccc1)c1ccccc1 ZINC000125683539 1044805537 /nfs/dbraw/zinc/80/55/37/1044805537.db2.gz LBLCKQSFLNOGEA-UHFFFAOYSA-N 2 1 319.452 4.351 20 0 DIADMP CC(C)(C)[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(F)c1 ZINC000459390029 1044819625 /nfs/dbraw/zinc/81/96/25/1044819625.db2.gz IDBMFYTZLIJDEZ-GOSISDBHSA-N 2 1 304.453 4.129 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000370671288 1044848789 /nfs/dbraw/zinc/84/87/89/1044848789.db2.gz PHQWQELLBVXPEK-ARFHVFGLSA-N 2 1 304.503 4.076 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H]2CCCc3ccccc32)CC1 ZINC000524596677 1044885333 /nfs/dbraw/zinc/88/53/33/1044885333.db2.gz PCFAJPYCRPVVHN-HXUWFJFHSA-N 2 1 300.490 4.116 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000372524744 1044917213 /nfs/dbraw/zinc/91/72/13/1044917213.db2.gz VOEMRQZVFZJOBR-HBMCJLEFSA-N 2 1 323.484 4.158 20 0 DIADMP CSc1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCC2 ZINC000573845162 1044925829 /nfs/dbraw/zinc/92/58/29/1044925829.db2.gz RLUDJARZTSKJAF-IYHXRUFHSA-N 2 1 316.514 4.001 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC(C)(C)C)cc1 ZINC000372806290 1044928174 /nfs/dbraw/zinc/92/81/74/1044928174.db2.gz UHJPYKIRDVIUAT-RYQLBKOJSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC(C)(C)C)cc1 ZINC000372806287 1044928524 /nfs/dbraw/zinc/92/85/24/1044928524.db2.gz UHJPYKIRDVIUAT-JQHSSLGASA-N 2 1 316.489 4.141 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](CC1CCCC1)c1ccccc1 ZINC000338021550 1044974763 /nfs/dbraw/zinc/97/47/63/1044974763.db2.gz VKSRRXLRFBUOHY-FQEVSTJZSA-N 2 1 311.473 4.493 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(F)c2ccccc21 ZINC000575213513 1044993084 /nfs/dbraw/zinc/99/30/84/1044993084.db2.gz FQAWGIADOMHKDV-GJZGRUSLSA-N 2 1 300.421 4.114 20 0 DIADMP C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411425160 1045004762 /nfs/dbraw/zinc/00/47/62/1045004762.db2.gz QJOZZYAZPRCRRD-GOSISDBHSA-N 2 1 323.484 4.261 20 0 DIADMP C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411413297 1045006918 /nfs/dbraw/zinc/00/69/18/1045006918.db2.gz CYJMEGSAINEWAQ-SFHVURJKSA-N 2 1 323.484 4.261 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446761793 1045037390 /nfs/dbraw/zinc/03/73/90/1045037390.db2.gz ZZEYRTSTUASSGI-FQEVSTJZSA-N 2 1 300.490 4.300 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000359946342 1045054274 /nfs/dbraw/zinc/05/42/74/1045054274.db2.gz ZDXKONUUFUZHOG-NVXWUHKLSA-N 2 1 306.519 4.227 20 0 DIADMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000576400991 1045055420 /nfs/dbraw/zinc/05/54/20/1045055420.db2.gz PFEIVULXZVJCPV-MRXNPFEDSA-N 2 1 322.443 4.019 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000576400991 1045055433 /nfs/dbraw/zinc/05/54/33/1045055433.db2.gz PFEIVULXZVJCPV-MRXNPFEDSA-N 2 1 322.443 4.019 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCc3ccccc32)cc1F ZINC000153700364 1045059663 /nfs/dbraw/zinc/05/96/63/1045059663.db2.gz XUQBTSHSCTWWTI-LJQANCHMSA-N 2 1 321.399 4.097 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@H]1CCCN(C)C1 ZINC000525488193 1045078072 /nfs/dbraw/zinc/07/80/72/1045078072.db2.gz FRFZBXFRSUYRFG-IRXDYDNUSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000525488193 1045078084 /nfs/dbraw/zinc/07/80/84/1045078084.db2.gz FRFZBXFRSUYRFG-IRXDYDNUSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000525488193 1045078095 /nfs/dbraw/zinc/07/80/95/1045078095.db2.gz FRFZBXFRSUYRFG-IRXDYDNUSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000525488193 1045078106 /nfs/dbraw/zinc/07/81/06/1045078106.db2.gz FRFZBXFRSUYRFG-IRXDYDNUSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000525488193 1045078114 /nfs/dbraw/zinc/07/81/14/1045078114.db2.gz FRFZBXFRSUYRFG-IRXDYDNUSA-N 2 1 302.506 4.319 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771719 1045078386 /nfs/dbraw/zinc/07/83/86/1045078386.db2.gz CGXTZCOYNDPYPH-VDGAXYAQSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771719 1045078396 /nfs/dbraw/zinc/07/83/96/1045078396.db2.gz CGXTZCOYNDPYPH-VDGAXYAQSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@@H+]1CCCC[C@H]1C ZINC000576864234 1045084402 /nfs/dbraw/zinc/08/44/02/1045084402.db2.gz RSEKIOPNLQRDCW-YVIAXDQVSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@H+]1CCCC[C@H]1C ZINC000576864234 1045084409 /nfs/dbraw/zinc/08/44/09/1045084409.db2.gz RSEKIOPNLQRDCW-YVIAXDQVSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000459796030 1045117566 /nfs/dbraw/zinc/11/75/66/1045117566.db2.gz VYDFQKPDGSTQHK-QRNKSROTSA-N 2 1 320.443 4.065 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447572424 1045146925 /nfs/dbraw/zinc/14/69/25/1045146925.db2.gz BTIZMLJEFXVXLD-YSTOQKLRSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000525991308 1045150834 /nfs/dbraw/zinc/15/08/34/1045150834.db2.gz KSKDCWDPHNQFPV-JENIJYKNSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734235 1045173127 /nfs/dbraw/zinc/17/31/27/1045173127.db2.gz URUFGUPLLIFQRY-SLYNCCJLSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734235 1045173129 /nfs/dbraw/zinc/17/31/29/1045173129.db2.gz URUFGUPLLIFQRY-SLYNCCJLSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000447734235 1045173131 /nfs/dbraw/zinc/17/31/31/1045173131.db2.gz URUFGUPLLIFQRY-SLYNCCJLSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000447734235 1045173132 /nfs/dbraw/zinc/17/31/32/1045173132.db2.gz URUFGUPLLIFQRY-SLYNCCJLSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1)c1c(F)cccc1F ZINC000924722845 1045194441 /nfs/dbraw/zinc/19/44/41/1045194441.db2.gz WCIMSOFWIUSSQG-UONOGXRCSA-N 2 1 318.411 4.438 20 0 DIADMP C[NH+]1CCC([NH2+]Cc2ccc(-c3ccccc3)c(Cl)c2)CC1 ZINC000527630743 1045242510 /nfs/dbraw/zinc/24/25/10/1045242510.db2.gz GPCBFJKSMFOTSQ-UHFFFAOYSA-N 2 1 314.860 4.191 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCc2cc(F)c(Cl)cc21 ZINC000527871307 1045271629 /nfs/dbraw/zinc/27/16/29/1045271629.db2.gz UCPGUPICOMNDPA-QGZVFWFLSA-N 2 1 321.827 4.041 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)[C@@H]1CC12CC2 ZINC000527872741 1045271949 /nfs/dbraw/zinc/27/19/49/1045271949.db2.gz YSRFJUPJYOXLDJ-UZLBHIALSA-N 2 1 324.468 4.190 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CC12CC2 ZINC000527897811 1045276014 /nfs/dbraw/zinc/27/60/14/1045276014.db2.gz HZQJQVGKDDWYAQ-YTQUADARSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CC12CC2 ZINC000527897811 1045276022 /nfs/dbraw/zinc/27/60/22/1045276022.db2.gz HZQJQVGKDDWYAQ-YTQUADARSA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@H](C)c1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000527905698 1045279476 /nfs/dbraw/zinc/27/94/76/1045279476.db2.gz RBHMBCIONDQXQM-LITUSFTRSA-N 2 1 300.490 4.476 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccccc2)c1 ZINC000579185987 1045299575 /nfs/dbraw/zinc/29/95/75/1045299575.db2.gz JESURXXFPPZSPA-ZWKOTPCHSA-N 2 1 308.469 4.346 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CCC([NH+](C)C)CC1 ZINC000449013484 1045331015 /nfs/dbraw/zinc/33/10/15/1045331015.db2.gz LBDDDSZHQWXSBI-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000449036533 1045337202 /nfs/dbraw/zinc/33/72/02/1045337202.db2.gz UNEAQDPFPLXJSK-SFHVURJKSA-N 2 1 308.469 4.046 20 0 DIADMP c1cc2cccc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)c2o1 ZINC000449061989 1045339439 /nfs/dbraw/zinc/33/94/39/1045339439.db2.gz KCLDUWAGHGNYNK-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCC34CCC4)C2)c1 ZINC000449106379 1045346156 /nfs/dbraw/zinc/34/61/56/1045346156.db2.gz LQPMWIFFTXINIT-FUHWJXTLSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCC34CCC4)C2)c1 ZINC000449106379 1045346161 /nfs/dbraw/zinc/34/61/61/1045346161.db2.gz LQPMWIFFTXINIT-FUHWJXTLSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3CCCC34CCC4)C2)c1 ZINC000449106381 1045346805 /nfs/dbraw/zinc/34/68/05/1045346805.db2.gz LQPMWIFFTXINIT-WMZOPIPTSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CCCC34CCC4)C2)c1 ZINC000449106381 1045346809 /nfs/dbraw/zinc/34/68/09/1045346809.db2.gz LQPMWIFFTXINIT-WMZOPIPTSA-N 2 1 318.530 4.273 20 0 DIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000449092878 1045349040 /nfs/dbraw/zinc/34/90/40/1045349040.db2.gz VNIIVKADQUJLSP-QXCFHYIPSA-N 2 1 318.892 4.193 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000449175094 1045354345 /nfs/dbraw/zinc/35/43/45/1045354345.db2.gz QGBZZODTQZNLPC-PKOBYXMFSA-N 2 1 308.469 4.234 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cs1 ZINC000449162669 1045356811 /nfs/dbraw/zinc/35/68/11/1045356811.db2.gz SSEGCNCHLNMIHP-DOTOQJQBSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)cs1 ZINC000449162669 1045356815 /nfs/dbraw/zinc/35/68/15/1045356815.db2.gz SSEGCNCHLNMIHP-DOTOQJQBSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000119242602 1045411756 /nfs/dbraw/zinc/41/17/56/1045411756.db2.gz WUWXLOJDOXZOLL-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000119242602 1045411758 /nfs/dbraw/zinc/41/17/58/1045411758.db2.gz WUWXLOJDOXZOLL-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000449557165 1045413618 /nfs/dbraw/zinc/41/36/18/1045413618.db2.gz QDKLZBQXGYPBIZ-SEJPIABJSA-N 2 1 320.480 4.377 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CC1 ZINC001204690063 1045429753 /nfs/dbraw/zinc/42/97/53/1045429753.db2.gz LQDAANXQSRQQPD-MHJFOBGBSA-N 2 1 306.538 4.399 20 0 DIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000449778534 1045436579 /nfs/dbraw/zinc/43/65/79/1045436579.db2.gz WPAFEZGPQTXVTA-QXCFHYIPSA-N 2 1 318.892 4.193 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CC(F)(F)C1 ZINC000529550893 1045496212 /nfs/dbraw/zinc/49/62/12/1045496212.db2.gz QOGYNTSMMLGVGD-CABCVRRESA-N 2 1 322.443 4.235 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]C[C@]2(C)CCCS2)CC1 ZINC000628217228 1045547273 /nfs/dbraw/zinc/54/72/73/1045547273.db2.gz PGUXTPYAUKYRMJ-APWZRJJASA-N 2 1 318.530 4.087 20 0 DIADMP C[C@@H](NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714735 1045574647 /nfs/dbraw/zinc/57/46/47/1045574647.db2.gz AKISXLIYDAREOV-IEBWSBKVSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714735 1045574656 /nfs/dbraw/zinc/57/46/56/1045574656.db2.gz AKISXLIYDAREOV-IEBWSBKVSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccoc1 ZINC000390714735 1045574662 /nfs/dbraw/zinc/57/46/62/1045574662.db2.gz AKISXLIYDAREOV-IEBWSBKVSA-N 2 1 312.457 4.233 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC/C=C\c1ccccc1 ZINC000450861549 1045581172 /nfs/dbraw/zinc/58/11/72/1045581172.db2.gz YULIRQCBTLRJIV-GHXNOFRVSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC/C=C\c1ccccc1 ZINC000450861549 1045581178 /nfs/dbraw/zinc/58/11/78/1045581178.db2.gz YULIRQCBTLRJIV-GHXNOFRVSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1ccc(Cl)cc1 ZINC000450853419 1045584953 /nfs/dbraw/zinc/58/49/53/1045584953.db2.gz HWFUFKSMBWBKEQ-UHFFFAOYSA-N 2 1 319.880 4.054 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000450853419 1045584963 /nfs/dbraw/zinc/58/49/63/1045584963.db2.gz HWFUFKSMBWBKEQ-UHFFFAOYSA-N 2 1 319.880 4.054 20 0 DIADMP C[C@H]([NH2+][C@H]1CC2CCC1CC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381944219 1045585442 /nfs/dbraw/zinc/58/54/42/1045585442.db2.gz BLHYAWBEXOBBBX-KCEWSHNRSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCCF ZINC000391023556 1045591680 /nfs/dbraw/zinc/59/16/80/1045591680.db2.gz QVTUOZQGBFFPDX-SFHVURJKSA-N 2 1 306.469 4.017 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCCCF ZINC000391023556 1045591689 /nfs/dbraw/zinc/59/16/89/1045591689.db2.gz QVTUOZQGBFFPDX-SFHVURJKSA-N 2 1 306.469 4.017 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C\c2ccc(Cl)cc2)C[C@H]1C ZINC000530335382 1045645926 /nfs/dbraw/zinc/64/59/26/1045645926.db2.gz NIFRGSYWKGIIIF-XSRQRWQSSA-N 2 1 306.881 4.158 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C\c2ccc(Cl)cc2)C[C@H]1C ZINC000530335382 1045645918 /nfs/dbraw/zinc/64/59/18/1045645918.db2.gz NIFRGSYWKGIIIF-XSRQRWQSSA-N 2 1 306.881 4.158 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C\c2ccc(Cl)cc2)C[C@H]1C ZINC000530335382 1045645923 /nfs/dbraw/zinc/64/59/23/1045645923.db2.gz NIFRGSYWKGIIIF-XSRQRWQSSA-N 2 1 306.881 4.158 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C\c2ccc(Cl)cc2)C[C@H]1C ZINC000530335382 1045645935 /nfs/dbraw/zinc/64/59/35/1045645935.db2.gz NIFRGSYWKGIIIF-XSRQRWQSSA-N 2 1 306.881 4.158 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629556380 1045678586 /nfs/dbraw/zinc/67/85/86/1045678586.db2.gz OPBCKYGYQKRKOI-GUDVDZBRSA-N 2 1 312.844 4.452 20 0 DIADMP [NH3+][C@H]1C[C@@H]([NH2+][C@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629548932 1045678666 /nfs/dbraw/zinc/67/86/66/1045678666.db2.gz OPBCKYGYQKRKOI-GBESFXJTSA-N 2 1 312.844 4.452 20 0 DIADMP CCCCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000779439814 1045730595 /nfs/dbraw/zinc/73/05/95/1045730595.db2.gz PQLDDEIDZVBQPU-ACDBMABISA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@H](N(C)Cc2sc3ccccc3c2Cl)CC[N@H+]1C ZINC000530905330 1045749595 /nfs/dbraw/zinc/74/95/95/1045749595.db2.gz KPHIAWVYWQXKRR-CHWSQXEVSA-N 2 1 322.905 4.469 20 0 DIADMP C[C@@H]1C[C@@H](N(C)Cc2sc3ccccc3c2Cl)CC[N@H+]1C ZINC000530905334 1045750548 /nfs/dbraw/zinc/75/05/48/1045750548.db2.gz KPHIAWVYWQXKRR-OLZOCXBDSA-N 2 1 322.905 4.469 20 0 DIADMP COc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC000753656327 1045785203 /nfs/dbraw/zinc/78/52/03/1045785203.db2.gz ZZCOVEDDJBWJCE-ZWKOTPCHSA-N 2 1 318.505 4.083 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CCN1C ZINC000531143663 1045792045 /nfs/dbraw/zinc/79/20/45/1045792045.db2.gz MUDJWLKKWBVGGP-UTKZUKDTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143663 1045792072 /nfs/dbraw/zinc/79/20/72/1045792072.db2.gz MUDJWLKKWBVGGP-UTKZUKDTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3)cc2)CC[NH+]1C ZINC000531143663 1045792080 /nfs/dbraw/zinc/79/20/80/1045792080.db2.gz MUDJWLKKWBVGGP-UTKZUKDTSA-N 2 1 308.469 4.268 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2ncccc21 ZINC000631568562 1045871202 /nfs/dbraw/zinc/87/12/02/1045871202.db2.gz DXPORVVQXZIETE-OAQYLSRUSA-N 2 1 323.484 4.089 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC000531687434 1045891510 /nfs/dbraw/zinc/89/15/10/1045891510.db2.gz WKCYBPACXRGKKC-ACAXCVFMSA-N 2 1 300.490 4.033 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1Cl ZINC000531688297 1045892628 /nfs/dbraw/zinc/89/26/28/1045892628.db2.gz JNAWCPLUSNQGGT-CQSZACIVSA-N 2 1 324.896 4.120 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CCCC24CC4)C3)cc1 ZINC000631665958 1045901141 /nfs/dbraw/zinc/90/11/41/1045901141.db2.gz VDGWASYYMZIGLK-HAGHYFMRSA-N 2 1 310.485 4.104 20 0 DIADMP CC(C)c1ccc(CCC[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1 ZINC000531713584 1045903575 /nfs/dbraw/zinc/90/35/75/1045903575.db2.gz CPMWBWRSZLXQDX-SQGPQFPESA-N 2 1 302.506 4.061 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000531711523 1045904119 /nfs/dbraw/zinc/90/41/19/1045904119.db2.gz NCAPMKOXEAAYPM-SQGPQFPESA-N 2 1 300.490 4.380 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc2ncccc12 ZINC001137630636 1045911533 /nfs/dbraw/zinc/91/15/33/1045911533.db2.gz HXZKDBJAGZOUCT-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc2ncccc12 ZINC001137630636 1045911541 /nfs/dbraw/zinc/91/15/41/1045911541.db2.gz HXZKDBJAGZOUCT-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP Clc1ccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCC2)cc1 ZINC000453068815 1045916301 /nfs/dbraw/zinc/91/63/01/1045916301.db2.gz JTMHXFZFAQESNB-IBGZPJMESA-N 2 1 318.892 4.398 20 0 DIADMP Clc1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCC2)cc1 ZINC000453072728 1045918060 /nfs/dbraw/zinc/91/80/60/1045918060.db2.gz FWNKZZTVEDDAOK-IFXJQAMLSA-N 2 1 318.892 4.255 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1csc2ccccc21 ZINC000754740783 1045922733 /nfs/dbraw/zinc/92/27/33/1045922733.db2.gz UCNCWZPNDBIXML-KGLIPLIRSA-N 2 1 313.470 4.393 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)c1ccncc1 ZINC000453126538 1045946581 /nfs/dbraw/zinc/94/65/81/1045946581.db2.gz QKUXFPHXUJZPNF-UTKZUKDTSA-N 2 1 323.484 4.348 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cs1 ZINC000453193604 1045973930 /nfs/dbraw/zinc/97/39/30/1045973930.db2.gz FMKVCFIKWPOVIX-HRCADAONSA-N 2 1 306.519 4.360 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccsc1 ZINC000453200006 1045980497 /nfs/dbraw/zinc/98/04/97/1045980497.db2.gz UCLJZPLEGWOQQZ-MPGHIAIKSA-N 2 1 306.519 4.442 20 0 DIADMP CC(F)(F)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453215787 1045987570 /nfs/dbraw/zinc/98/75/70/1045987570.db2.gz GZXYLVCEDUPDOA-KURKYZTESA-N 2 1 322.443 4.065 20 0 DIADMP COc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC000902406871 1045992316 /nfs/dbraw/zinc/99/23/16/1045992316.db2.gz VTPLYGSFDMEIKO-LSTHTHJFSA-N 2 1 324.468 4.148 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1C(C)(C)C ZINC000453340979 1046045072 /nfs/dbraw/zinc/04/50/72/1046045072.db2.gz HKDKUATXMBJKDX-MGNMYUMUSA-N 2 1 300.490 4.260 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453377674 1046073502 /nfs/dbraw/zinc/07/35/02/1046073502.db2.gz YWMSCHZNTRCRGP-BPIHKTFHSA-N 2 1 316.489 4.141 20 0 DIADMP C[N@@H+](CCCC[NH2+]C1c2ccccc2-c2ccccc21)C1CC1 ZINC000453404786 1046077978 /nfs/dbraw/zinc/07/79/78/1046077978.db2.gz PWLOQKWNYWZNBX-UHFFFAOYSA-N 2 1 306.453 4.220 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(C(F)(F)F)c1 ZINC000453403160 1046078127 /nfs/dbraw/zinc/07/81/27/1046078127.db2.gz AQZXCLSYKAPZSL-CYBMUJFWSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc2ccccc2s1 ZINC000453405262 1046078284 /nfs/dbraw/zinc/07/82/84/1046078284.db2.gz QFTXZXQZGORPPW-CQSZACIVSA-N 2 1 302.487 4.426 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(OC(C)(C)C)cc1 ZINC000453412634 1046079167 /nfs/dbraw/zinc/07/91/67/1046079167.db2.gz WDRVZRRZEICBPG-MRXNPFEDSA-N 2 1 318.505 4.389 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCCOc2c(Cl)cccc21)C1CC1 ZINC000453410011 1046080133 /nfs/dbraw/zinc/08/01/33/1046080133.db2.gz UOOABAPSTZIHEU-QGZVFWFLSA-N 2 1 322.880 4.018 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H](c1cccs1)C1CCCC1)C1CC1 ZINC000453394778 1046081007 /nfs/dbraw/zinc/08/10/07/1046081007.db2.gz HAWWMFOTWOPGID-SFHVURJKSA-N 2 1 306.519 4.443 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H](C2CC2)C2CCC2)C3)cc1 ZINC000453439161 1046083418 /nfs/dbraw/zinc/08/34/18/1046083418.db2.gz VXPDFEXBGCKAMN-LRSLUSHPSA-N 2 1 324.512 4.350 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1cc(F)ccc1C(F)(F)F ZINC001138093375 1046090884 /nfs/dbraw/zinc/09/08/84/1046090884.db2.gz AZEGCYXXUNESTK-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(F)ccc1C(F)(F)F ZINC001138093375 1046090899 /nfs/dbraw/zinc/09/08/99/1046090899.db2.gz AZEGCYXXUNESTK-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C(F)(F)F)s1 ZINC000903010865 1046141018 /nfs/dbraw/zinc/14/10/18/1046141018.db2.gz RFOIZUNPOBKJHR-YEJSDXFRSA-N 2 1 318.408 4.043 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C(F)(F)F)s1 ZINC000903010865 1046141024 /nfs/dbraw/zinc/14/10/24/1046141024.db2.gz RFOIZUNPOBKJHR-YEJSDXFRSA-N 2 1 318.408 4.043 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C(F)(F)F)s1 ZINC000903010864 1046141305 /nfs/dbraw/zinc/14/13/05/1046141305.db2.gz RFOIZUNPOBKJHR-WAAKLRNESA-N 2 1 318.408 4.043 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C(F)(F)F)s1 ZINC000903010864 1046141308 /nfs/dbraw/zinc/14/13/08/1046141308.db2.gz RFOIZUNPOBKJHR-WAAKLRNESA-N 2 1 318.408 4.043 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903015736 1046142649 /nfs/dbraw/zinc/14/26/49/1046142649.db2.gz BRBAXWXWOVQFNQ-NEPJUHHUSA-N 2 1 320.424 4.149 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1cc(F)ccc1F ZINC000903120266 1046167492 /nfs/dbraw/zinc/16/74/92/1046167492.db2.gz MYIIGTYAAFGHJH-RFXRPKLXSA-N 2 1 320.427 4.163 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1cc(F)ccc1F ZINC000903120266 1046167500 /nfs/dbraw/zinc/16/75/00/1046167500.db2.gz MYIIGTYAAFGHJH-RFXRPKLXSA-N 2 1 320.427 4.163 20 0 DIADMP c1ccc([C@@H](CC2CC2)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903137658 1046171293 /nfs/dbraw/zinc/17/12/93/1046171293.db2.gz OPBPQUGSSLVGFJ-VCYXJBJXSA-N 2 1 310.485 4.275 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC001138542697 1046216467 /nfs/dbraw/zinc/21/64/67/1046216467.db2.gz FMPQGXQDJIMENF-FQEVSTJZSA-N 2 1 317.436 4.170 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC001138542697 1046216485 /nfs/dbraw/zinc/21/64/85/1046216485.db2.gz FMPQGXQDJIMENF-FQEVSTJZSA-N 2 1 317.436 4.170 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+][C@H]1CC[C@H](c2ccccc2)C1)c1cccnc1 ZINC000903380528 1046262264 /nfs/dbraw/zinc/26/22/64/1046262264.db2.gz NFHBAPOIEWLHHD-JBACZVJFSA-N 2 1 323.484 4.000 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC3(C2)CC[NH+](C)CC3)s1 ZINC001138754855 1046289103 /nfs/dbraw/zinc/28/91/03/1046289103.db2.gz JWABDYXCYPYDJF-UHFFFAOYSA-N 2 1 306.519 4.008 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168180956 1046293288 /nfs/dbraw/zinc/29/32/88/1046293288.db2.gz VLGGSDSZJNOSTQ-HNNXBMFYSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168180957 1046293984 /nfs/dbraw/zinc/29/39/84/1046293984.db2.gz VLGGSDSZJNOSTQ-OAHLLOKOSA-N 2 1 308.897 4.077 20 0 DIADMP [NH3+]CC1([C@H]2CCCC[N@H+]2Cc2cccc(C(F)F)c2)CCC1 ZINC000903812986 1046326378 /nfs/dbraw/zinc/32/63/78/1046326378.db2.gz WRYRYBKQKJMCGD-MRXNPFEDSA-N 2 1 308.416 4.108 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000638762128 1046340311 /nfs/dbraw/zinc/34/03/11/1046340311.db2.gz BEAIDWWRKPPPFJ-SOLBZPMBSA-N 2 1 320.427 4.132 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000638762128 1046340320 /nfs/dbraw/zinc/34/03/20/1046340320.db2.gz BEAIDWWRKPPPFJ-SOLBZPMBSA-N 2 1 320.427 4.132 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)CC(F)F ZINC000639284255 1046377780 /nfs/dbraw/zinc/37/77/80/1046377780.db2.gz WHXYPIQHCWHIQO-ZVZYQTTQSA-N 2 1 322.443 4.235 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)CC(F)F ZINC000639284255 1046377796 /nfs/dbraw/zinc/37/77/96/1046377796.db2.gz WHXYPIQHCWHIQO-ZVZYQTTQSA-N 2 1 322.443 4.235 20 0 DIADMP CC(C)(F)CC[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639314948 1046380348 /nfs/dbraw/zinc/38/03/48/1046380348.db2.gz AMVLXZFKAFPLGW-FUHWJXTLSA-N 2 1 304.453 4.082 20 0 DIADMP CC(C)(F)CC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639314948 1046380366 /nfs/dbraw/zinc/38/03/66/1046380366.db2.gz AMVLXZFKAFPLGW-FUHWJXTLSA-N 2 1 304.453 4.082 20 0 DIADMP Cc1cccc2[nH]cc(C[N@H+](C)CC3CC[NH+](C(C)C)CC3)c21 ZINC001139197429 1046408028 /nfs/dbraw/zinc/40/80/28/1046408028.db2.gz OPSOIEPZCYPQRQ-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP CC1CCC([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001168205875 1046420401 /nfs/dbraw/zinc/42/04/01/1046420401.db2.gz LQWJJUUWQMZFHI-FMMXVMRKSA-N 2 1 318.480 4.476 20 0 DIADMP C[N@@H+](Cc1ccc(-n2ccnc2)cc1)C12CC3CC(CC(C3)C1)C2 ZINC001139360594 1046436683 /nfs/dbraw/zinc/43/66/83/1046436683.db2.gz XZSUWOQUFAIIBS-UHFFFAOYSA-N 2 1 321.468 4.273 20 0 DIADMP CN(Cc1ccc(-c2ccc(Cl)cc2)o1)C1CC[NH+](C)CC1 ZINC001139416818 1046446608 /nfs/dbraw/zinc/44/66/08/1046446608.db2.gz ZRLXVOPHFMBLMG-UHFFFAOYSA-N 2 1 318.848 4.126 20 0 DIADMP CC(C)[C@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202938706 1046453169 /nfs/dbraw/zinc/45/31/69/1046453169.db2.gz JUQDTCVCMIGKRG-WOZUAGRISA-N 2 1 314.517 4.136 20 0 DIADMP c1ccc2ncc(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)cc2c1 ZINC001137282142 1046460630 /nfs/dbraw/zinc/46/06/30/1046460630.db2.gz DZDGNCFRGOVLBY-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc2ncc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)cc2c1 ZINC001137282142 1046460632 /nfs/dbraw/zinc/46/06/32/1046460632.db2.gz DZDGNCFRGOVLBY-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP CN1CCC([N@@H+](Cc2cnc3ccccc3c2)C2CCCC2)CC1 ZINC001137286002 1046469746 /nfs/dbraw/zinc/46/97/46/1046469746.db2.gz RWDPNULZSCFYSG-UHFFFAOYSA-N 2 1 323.484 4.074 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125798407 1046472019 /nfs/dbraw/zinc/47/20/19/1046472019.db2.gz REBOEIXPGXJJFU-RDTXWAMCSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000125798407 1046472020 /nfs/dbraw/zinc/47/20/20/1046472020.db2.gz REBOEIXPGXJJFU-RDTXWAMCSA-N 2 1 310.432 4.126 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C(C)(C)C)c1 ZINC000677240730 1046476385 /nfs/dbraw/zinc/47/63/85/1046476385.db2.gz JDCLZKVMQXDUBH-FHWLQOOXSA-N 2 1 300.490 4.299 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677240331 1046477367 /nfs/dbraw/zinc/47/73/67/1046477367.db2.gz GUSKSCKZQXYCHI-JQHSSLGASA-N 2 1 318.530 4.465 20 0 DIADMP Cc1cccc(C2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCCC2)c1 ZINC000677237421 1046477748 /nfs/dbraw/zinc/47/77/48/1046477748.db2.gz GTVRKZSDTBSOEU-UXHICEINSA-N 2 1 312.501 4.023 20 0 DIADMP C[N@@H+](Cc1sc2ccccc2c1Cl)C1CCC([NH3+])CC1 ZINC000091847205 1046485395 /nfs/dbraw/zinc/48/53/95/1046485395.db2.gz XUEWEYDHBIVVRV-UHFFFAOYSA-N 2 1 308.878 4.256 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccccc1C(F)F ZINC001139800233 1046518099 /nfs/dbraw/zinc/51/80/99/1046518099.db2.gz HAGBEZYDDUCVSH-DLBZAZTESA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccccc1C(F)F ZINC001139800233 1046518110 /nfs/dbraw/zinc/51/81/10/1046518110.db2.gz HAGBEZYDDUCVSH-DLBZAZTESA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccccc1C(F)F ZINC001139800233 1046518121 /nfs/dbraw/zinc/51/81/21/1046518121.db2.gz HAGBEZYDDUCVSH-DLBZAZTESA-N 2 1 322.443 4.463 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000677753728 1046522170 /nfs/dbraw/zinc/52/21/70/1046522170.db2.gz PHFABJASGLKEAM-SFHLNBCPSA-N 2 1 312.501 4.404 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1cccnc1 ZINC000359864100 1046526769 /nfs/dbraw/zinc/52/67/69/1046526769.db2.gz ABRPJJURSGBZAV-ACRUOGEOSA-N 2 1 323.484 4.205 20 0 DIADMP C[N@@H+](Cc1ccc(-n2ccnc2)cc1)Cc1ccccc1C1CC1 ZINC001139883590 1046542821 /nfs/dbraw/zinc/54/28/21/1046542821.db2.gz YEDFJVMIHATCLG-UHFFFAOYSA-N 2 1 317.436 4.382 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCCN1Cc1cc2ccccc2[nH]1 ZINC001137319842 1046547657 /nfs/dbraw/zinc/54/76/57/1046547657.db2.gz PNSTXEJSPDFANX-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cc2ccccc2[nH]1 ZINC001137319842 1046547671 /nfs/dbraw/zinc/54/76/71/1046547671.db2.gz PNSTXEJSPDFANX-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cc2ccccc2[nH]1 ZINC001137319842 1046547684 /nfs/dbraw/zinc/54/76/84/1046547684.db2.gz PNSTXEJSPDFANX-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC001137319842 1046547699 /nfs/dbraw/zinc/54/76/99/1046547699.db2.gz PNSTXEJSPDFANX-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC001137319842 1046547713 /nfs/dbraw/zinc/54/77/13/1046547713.db2.gz PNSTXEJSPDFANX-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP c1ccc2c(c1)cncc2C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001139895777 1046550546 /nfs/dbraw/zinc/55/05/46/1046550546.db2.gz MSOCAWXHZYQHFX-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc2cc(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ncc2c1 ZINC001139997737 1046564234 /nfs/dbraw/zinc/56/42/34/1046564234.db2.gz KMUIYUXZEPHELX-OAQYLSRUSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc2cc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ncc2c1 ZINC001139997737 1046564248 /nfs/dbraw/zinc/56/42/48/1046564248.db2.gz KMUIYUXZEPHELX-OAQYLSRUSA-N 2 1 323.484 4.075 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cscc2Cl)CC1 ZINC000678139511 1046567729 /nfs/dbraw/zinc/56/77/29/1046567729.db2.gz ZAWZXOZRDMDJGQ-UHFFFAOYSA-N 2 1 314.926 4.345 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](Cc1ccccc1)C1CC1 ZINC001140025561 1046571468 /nfs/dbraw/zinc/57/14/68/1046571468.db2.gz CYUQZCJAHSQKEG-UHFFFAOYSA-N 2 1 317.436 4.345 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC001140025561 1046571478 /nfs/dbraw/zinc/57/14/78/1046571478.db2.gz CYUQZCJAHSQKEG-UHFFFAOYSA-N 2 1 317.436 4.345 20 0 DIADMP CC(C)c1csc(C[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)n1 ZINC000925283233 1046572738 /nfs/dbraw/zinc/57/27/38/1046572738.db2.gz OAILIXZVROSSSB-CQSZACIVSA-N 2 1 317.502 4.179 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc2cnccc21 ZINC001140144610 1046600476 /nfs/dbraw/zinc/60/04/76/1046600476.db2.gz FTQJQWNCILQBNL-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc2cnccc21 ZINC001140144610 1046600479 /nfs/dbraw/zinc/60/04/79/1046600479.db2.gz FTQJQWNCILQBNL-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc2cnccc21 ZINC001140144610 1046600485 /nfs/dbraw/zinc/60/04/85/1046600485.db2.gz FTQJQWNCILQBNL-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP c1ccc(C2CC2)c(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000678339457 1046621110 /nfs/dbraw/zinc/62/11/10/1046621110.db2.gz MNEPMXGUDYKEEJ-WIYYLYMNSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000678339457 1046621117 /nfs/dbraw/zinc/62/11/17/1046621117.db2.gz MNEPMXGUDYKEEJ-WIYYLYMNSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000678339457 1046621126 /nfs/dbraw/zinc/62/11/26/1046621126.db2.gz MNEPMXGUDYKEEJ-WIYYLYMNSA-N 2 1 310.485 4.013 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)n1 ZINC000678412930 1046630350 /nfs/dbraw/zinc/63/03/50/1046630350.db2.gz BWEKFAZPMMTUME-SOLBZPMBSA-N 2 1 317.521 4.107 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000248825294 1046636902 /nfs/dbraw/zinc/63/69/02/1046636902.db2.gz FYMVSILIKKXRRI-RONGEGOHSA-N 2 1 318.892 4.252 20 0 DIADMP c1cc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)cc2c1CCC2 ZINC001203025837 1046662570 /nfs/dbraw/zinc/66/25/70/1046662570.db2.gz FTKBDAVJJBVKRW-UHFFFAOYSA-N 2 1 324.512 4.016 20 0 DIADMP c1cc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)cc2c1CCC2 ZINC001203025837 1046662575 /nfs/dbraw/zinc/66/25/75/1046662575.db2.gz FTKBDAVJJBVKRW-UHFFFAOYSA-N 2 1 324.512 4.016 20 0 DIADMP c1ccc(-c2ccc(CC[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000678598568 1046672921 /nfs/dbraw/zinc/67/29/21/1046672921.db2.gz IWVHGRQXVFPMES-YADHBBJMSA-N 2 1 320.480 4.113 20 0 DIADMP C[C@@H](NCc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000245960894 1046678482 /nfs/dbraw/zinc/67/84/82/1046678482.db2.gz UVNXEZRGCKAXRX-QZTJIDSGSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000245960894 1046678493 /nfs/dbraw/zinc/67/84/93/1046678493.db2.gz UVNXEZRGCKAXRX-QZTJIDSGSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000245960894 1046678505 /nfs/dbraw/zinc/67/85/05/1046678505.db2.gz UVNXEZRGCKAXRX-QZTJIDSGSA-N 2 1 323.484 4.164 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678769171 1046696705 /nfs/dbraw/zinc/69/67/05/1046696705.db2.gz MUCVHXDARDISHY-UWVAXJGDSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CC(C)(C)c2ccccc2)CC1 ZINC000678818547 1046709439 /nfs/dbraw/zinc/70/94/39/1046709439.db2.gz WJQNDMMOKHLWCN-UHFFFAOYSA-N 2 1 302.506 4.016 20 0 DIADMP CC[N@@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860796 1046749313 /nfs/dbraw/zinc/74/93/13/1046749313.db2.gz YHIKTRUXCQLTQA-VAMGGRTRSA-N 2 1 315.505 4.206 20 0 DIADMP CC[N@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860796 1046749330 /nfs/dbraw/zinc/74/93/30/1046749330.db2.gz YHIKTRUXCQLTQA-VAMGGRTRSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@H+](C)[C@@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860796 1046749345 /nfs/dbraw/zinc/74/93/45/1046749345.db2.gz YHIKTRUXCQLTQA-VAMGGRTRSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860796 1046749356 /nfs/dbraw/zinc/74/93/56/1046749356.db2.gz YHIKTRUXCQLTQA-VAMGGRTRSA-N 2 1 315.505 4.206 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]C2(c3ccc(F)cc3)CCC2)CC1 ZINC000679016513 1046759396 /nfs/dbraw/zinc/75/93/96/1046759396.db2.gz PTVRWHYRMYXTRG-UHFFFAOYSA-N 2 1 304.453 4.057 20 0 DIADMP C[C@H](N[C@H]1CC[N@H+](CC2CC2)C1)c1ccc(F)c2ccccc21 ZINC000645406981 1046789173 /nfs/dbraw/zinc/78/91/73/1046789173.db2.gz UWYIDVXMLNZEJU-HOCLYGCPSA-N 2 1 312.432 4.114 20 0 DIADMP C[C@H](c1ccco1)[N@@H+](C)C/C=C/C[NH+](C)[C@@H](C)c1ccco1 ZINC000069066399 1046790632 /nfs/dbraw/zinc/79/06/32/1046790632.db2.gz YXWYPCNKAGUWMS-AXHPFZFWSA-N 2 1 302.418 4.115 20 0 DIADMP C[C@H](c1ccco1)[NH+](C)C/C=C/C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069066399 1046790643 /nfs/dbraw/zinc/79/06/43/1046790643.db2.gz YXWYPCNKAGUWMS-AXHPFZFWSA-N 2 1 302.418 4.115 20 0 DIADMP C[C@H](c1ccco1)[NH+](C)C/C=C/C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069066399 1046790651 /nfs/dbraw/zinc/79/06/51/1046790651.db2.gz YXWYPCNKAGUWMS-AXHPFZFWSA-N 2 1 302.418 4.115 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000645457572 1046792581 /nfs/dbraw/zinc/79/25/81/1046792581.db2.gz QPPMUJLHEGMSGW-MYGLTJDJSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000645457572 1046792590 /nfs/dbraw/zinc/79/25/90/1046792590.db2.gz QPPMUJLHEGMSGW-MYGLTJDJSA-N 2 1 320.480 4.358 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc2ccncc21 ZINC001140644648 1046830206 /nfs/dbraw/zinc/83/02/06/1046830206.db2.gz WPCXAVJFWAEWPW-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000248405916 1046841139 /nfs/dbraw/zinc/84/11/39/1046841139.db2.gz RWEBBSUFGBSQKJ-QRFRQXIXSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)[N@@H+](CCCc1ccccc1Cl)[C@H]1CCC[NH2+]CC1 ZINC001206581524 1046902870 /nfs/dbraw/zinc/90/28/70/1046902870.db2.gz JXBXYQSXLOFYLX-KRWDZBQOSA-N 2 1 308.897 4.125 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001140803569 1046906777 /nfs/dbraw/zinc/90/67/77/1046906777.db2.gz RTHGGNIGTPSSNM-QGZVFWFLSA-N 2 1 305.425 4.018 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001140803569 1046906794 /nfs/dbraw/zinc/90/67/94/1046906794.db2.gz RTHGGNIGTPSSNM-QGZVFWFLSA-N 2 1 305.425 4.018 20 0 DIADMP C[N@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1ccccc1C(F)(F)F ZINC001140805689 1046906881 /nfs/dbraw/zinc/90/68/81/1046906881.db2.gz DJPYPIQJZPUUEH-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP C[N@@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1ccccc1C(F)(F)F ZINC001140805689 1046906888 /nfs/dbraw/zinc/90/68/88/1046906888.db2.gz DJPYPIQJZPUUEH-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1ccco1 ZINC000680351868 1046969899 /nfs/dbraw/zinc/96/98/99/1046969899.db2.gz GZJDTICPJIXKPN-IJXRJRJASA-N 2 1 324.468 4.231 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccco1 ZINC000680351868 1046969908 /nfs/dbraw/zinc/96/99/08/1046969908.db2.gz GZJDTICPJIXKPN-IJXRJRJASA-N 2 1 324.468 4.231 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)c1ccco1 ZINC000680351869 1046970151 /nfs/dbraw/zinc/97/01/51/1046970151.db2.gz GZJDTICPJIXKPN-MTFMMBMASA-N 2 1 324.468 4.231 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccco1 ZINC000680351869 1046970160 /nfs/dbraw/zinc/97/01/60/1046970160.db2.gz GZJDTICPJIXKPN-MTFMMBMASA-N 2 1 324.468 4.231 20 0 DIADMP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)F ZINC000647318964 1046975355 /nfs/dbraw/zinc/97/53/55/1046975355.db2.gz HDIULEBJBQWHKQ-LEUOFYLZSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c2ccccc21 ZINC000647344459 1046985844 /nfs/dbraw/zinc/98/58/44/1046985844.db2.gz QXXUWRIJZRZVKS-OJAWGZOXSA-N 2 1 320.480 4.170 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799176747 1047008290 /nfs/dbraw/zinc/00/82/90/1047008290.db2.gz BHVMZSJNUYMOAA-OAHLLOKOSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799177105 1047009066 /nfs/dbraw/zinc/00/90/66/1047009066.db2.gz LDCJKAFCDUJNMY-SFHVURJKSA-N 2 1 304.453 4.085 20 0 DIADMP CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799178136 1047009174 /nfs/dbraw/zinc/00/91/74/1047009174.db2.gz MUUDIMSHDSBRNB-SFHVURJKSA-N 2 1 322.443 4.224 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]([C@@H]3CCc4c3cccc4Cl)C2)CC1 ZINC000799178635 1047009587 /nfs/dbraw/zinc/00/95/87/1047009587.db2.gz ZSOQFRXKPDHMKJ-GOSISDBHSA-N 2 1 318.892 4.135 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799179136 1047010014 /nfs/dbraw/zinc/01/00/14/1047010014.db2.gz DGDLCBMSPKCIAL-HNNXBMFYSA-N 2 1 306.881 4.209 20 0 DIADMP c1csc(-c2ccccc2C[NH+]2CCC([NH+]3CCC3)CC2)c1 ZINC001141097651 1047013548 /nfs/dbraw/zinc/01/35/48/1047013548.db2.gz UFGURGGZDQTJNE-UHFFFAOYSA-N 2 1 312.482 4.085 20 0 DIADMP C[C@H](CC[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000648068250 1047032942 /nfs/dbraw/zinc/03/29/42/1047032942.db2.gz MOZJWFMQYIKZIJ-QIJUGHKUSA-N 2 1 322.496 4.115 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccs1 ZINC000379624688 1047081970 /nfs/dbraw/zinc/08/19/70/1047081970.db2.gz JPYCVHBPRMTJKU-XYJFISCASA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccs1 ZINC000379624688 1047081985 /nfs/dbraw/zinc/08/19/85/1047081985.db2.gz JPYCVHBPRMTJKU-XYJFISCASA-N 2 1 314.498 4.452 20 0 DIADMP Cc1nccn1CCC[N@H+](C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000536732999 1047087056 /nfs/dbraw/zinc/08/70/56/1047087056.db2.gz PIGOKMWRWNRBJX-GJZGRUSLSA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000536732999 1047087066 /nfs/dbraw/zinc/08/70/66/1047087066.db2.gz PIGOKMWRWNRBJX-GJZGRUSLSA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000536732999 1047087080 /nfs/dbraw/zinc/08/70/80/1047087080.db2.gz PIGOKMWRWNRBJX-GJZGRUSLSA-N 2 1 319.880 4.359 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379643923 1047090323 /nfs/dbraw/zinc/09/03/23/1047090323.db2.gz BPAQJPXLWRUNGE-XLIONFOSSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379643923 1047090339 /nfs/dbraw/zinc/09/03/39/1047090339.db2.gz BPAQJPXLWRUNGE-XLIONFOSSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379643915 1047090593 /nfs/dbraw/zinc/09/05/93/1047090593.db2.gz BPAQJPXLWRUNGE-FXAWDEMLSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379643915 1047090608 /nfs/dbraw/zinc/09/06/08/1047090608.db2.gz BPAQJPXLWRUNGE-FXAWDEMLSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CC(C(F)F)C1 ZINC000681090072 1047091140 /nfs/dbraw/zinc/09/11/40/1047091140.db2.gz XBGYNYYVSVFKFJ-NNGSBXSVSA-N 2 1 322.443 4.194 20 0 DIADMP Cc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379651978 1047091574 /nfs/dbraw/zinc/09/15/74/1047091574.db2.gz VOJPAGVKISWNKI-WIYYLYMNSA-N 2 1 308.469 4.138 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379656670 1047096322 /nfs/dbraw/zinc/09/63/22/1047096322.db2.gz QDKBUPCOPZIKEA-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379656670 1047096331 /nfs/dbraw/zinc/09/63/31/1047096331.db2.gz QDKBUPCOPZIKEA-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657514 1047097750 /nfs/dbraw/zinc/09/77/50/1047097750.db2.gz TUMSJRMAXGHLMA-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657514 1047097765 /nfs/dbraw/zinc/09/77/65/1047097765.db2.gz TUMSJRMAXGHLMA-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657678 1047098033 /nfs/dbraw/zinc/09/80/33/1047098033.db2.gz UJABLMIHCPDBHJ-QATSVWFZSA-N 2 1 320.480 4.343 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(-c3ccccc3C)c2)C1 ZINC001116019133 1047102077 /nfs/dbraw/zinc/10/20/77/1047102077.db2.gz QUKOCGLPVNRLPN-HXUWFJFHSA-N 2 1 322.496 4.484 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)cc1 ZINC000536830612 1047103002 /nfs/dbraw/zinc/10/30/02/1047103002.db2.gz DMNYDFLDNKEIHJ-XLIONFOSSA-N 2 1 318.505 4.104 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000536833837 1047106913 /nfs/dbraw/zinc/10/69/13/1047106913.db2.gz PCDFTIQNBPXGRO-KSZLIROESA-N 2 1 320.546 4.246 20 0 DIADMP CC[C@H](CSc1ccc(C)c(C)c1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000536833837 1047106918 /nfs/dbraw/zinc/10/69/18/1047106918.db2.gz PCDFTIQNBPXGRO-KSZLIROESA-N 2 1 320.546 4.246 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841140 1047107797 /nfs/dbraw/zinc/10/77/97/1047107797.db2.gz WCQVJPRFMIJDOL-MAUKXSAKSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841140 1047107807 /nfs/dbraw/zinc/10/78/07/1047107807.db2.gz WCQVJPRFMIJDOL-MAUKXSAKSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000536843473 1047107843 /nfs/dbraw/zinc/10/78/43/1047107843.db2.gz DATWJMODWQAHHW-XOJVJZLVSA-N 2 1 314.517 4.205 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCc3ccc(Cl)cc32)CC1 ZINC000536875401 1047117932 /nfs/dbraw/zinc/11/79/32/1047117932.db2.gz HTURNDFHGQYTOE-QGZVFWFLSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC(C)(C)CCCc2ccccc2)CC[N@H+]1C ZINC000536875736 1047118080 /nfs/dbraw/zinc/11/80/80/1047118080.db2.gz JVKHZHAXUXCRMD-HKUYNNGSSA-N 2 1 302.506 4.108 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180925 1047147655 /nfs/dbraw/zinc/14/76/55/1047147655.db2.gz BSANLANLKQVJOL-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180925 1047147659 /nfs/dbraw/zinc/14/76/59/1047147659.db2.gz BSANLANLKQVJOL-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180925 1047147666 /nfs/dbraw/zinc/14/76/66/1047147666.db2.gz BSANLANLKQVJOL-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(OCC(C)C)c2)C[C@@H]1C ZINC000537180925 1047147674 /nfs/dbraw/zinc/14/76/74/1047147674.db2.gz BSANLANLKQVJOL-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1cc2cc(Cl)ccc2o1 ZINC000537297138 1047161697 /nfs/dbraw/zinc/16/16/97/1047161697.db2.gz PINLUPKPNWKONW-ZDUSSCGKSA-N 2 1 306.837 4.223 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(C(F)(F)F)cc1 ZINC000682649211 1047210323 /nfs/dbraw/zinc/21/03/23/1047210323.db2.gz GJBDPBMBFWBLCL-XJKSGUPXSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC12CCCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000682734768 1047217911 /nfs/dbraw/zinc/21/79/11/1047217911.db2.gz ZRKDPXXMVSBTMY-DFQSSKMNSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390749244 1047300507 /nfs/dbraw/zinc/30/05/07/1047300507.db2.gz RMEMZJFWHYDYPY-ICSRJNTNSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1cncs1 ZINC000897929876 1047303347 /nfs/dbraw/zinc/30/33/47/1047303347.db2.gz CTPCMIQBZNYCFW-CQSZACIVSA-N 2 1 323.550 4.473 20 0 DIADMP Cc1cccnc1[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)C(C)(C)C ZINC000897995955 1047309770 /nfs/dbraw/zinc/30/97/70/1047309770.db2.gz VQZNUBZTACBJNR-SFHVURJKSA-N 2 1 317.521 4.330 20 0 DIADMP c1sc2ccccc2c1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897985149 1047311244 /nfs/dbraw/zinc/31/12/44/1047311244.db2.gz KDOPOEQHSVUQAX-UHFFFAOYSA-N 2 1 300.471 4.008 20 0 DIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808186 1047329058 /nfs/dbraw/zinc/32/90/58/1047329058.db2.gz IPPOMSAJAPTWRX-QZTJIDSGSA-N 2 1 323.484 4.130 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808186 1047329071 /nfs/dbraw/zinc/32/90/71/1047329071.db2.gz IPPOMSAJAPTWRX-QZTJIDSGSA-N 2 1 323.484 4.130 20 0 DIADMP CC[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533396 1047346690 /nfs/dbraw/zinc/34/66/90/1047346690.db2.gz TYKHPPZOPQZFBB-WBMJQRKESA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533396 1047346703 /nfs/dbraw/zinc/34/67/03/1047346703.db2.gz TYKHPPZOPQZFBB-WBMJQRKESA-N 2 1 315.288 4.376 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)c(F)c2)CC1 ZINC000212498270 1047429927 /nfs/dbraw/zinc/42/99/27/1047429927.db2.gz VVHJSPUBIQRIEV-CYBMUJFWSA-N 2 1 312.860 4.394 20 0 DIADMP CCCc1ccc(C[NH+]2CCC3(CCn4c(C)c[nH+]c43)CC2)cc1 ZINC001142360159 1047433843 /nfs/dbraw/zinc/43/38/43/1047433843.db2.gz XQODLTARINLCSN-UHFFFAOYSA-N 2 1 323.484 4.082 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2C2CCC([NH+](C)C)CC2)cc1 ZINC001168324208 1047446711 /nfs/dbraw/zinc/44/67/11/1047446711.db2.gz KFMGNDXKJBGMAH-AFMYVXGZSA-N 2 1 316.489 4.095 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](Cc2ccccn2)C2CCCCC2)CC1 ZINC001168328143 1047458722 /nfs/dbraw/zinc/45/87/22/1047458722.db2.gz XDUKKNQGDVKBAL-UHFFFAOYSA-N 2 1 315.505 4.089 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2C2CCC([NH+](C)C)CC2)c1 ZINC001168330961 1047470742 /nfs/dbraw/zinc/47/07/42/1047470742.db2.gz WEULVNXBAWDRET-MHJFOBGBSA-N 2 1 300.490 4.313 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001168336971 1047492154 /nfs/dbraw/zinc/49/21/54/1047492154.db2.gz JNHDKSNKWSHKEA-AVAKVYKDSA-N 2 1 320.908 4.440 20 0 DIADMP Cc1nccn1CCC[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000091856694 1047523570 /nfs/dbraw/zinc/52/35/70/1047523570.db2.gz SDXQDUDYVTYGPP-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000091856694 1047523575 /nfs/dbraw/zinc/52/35/75/1047523575.db2.gz SDXQDUDYVTYGPP-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP C[N@@H+](CCCSc1ccccc1Cl)C1CCC([NH3+])CC1 ZINC000843355701 1047543139 /nfs/dbraw/zinc/54/31/39/1047543139.db2.gz UWFOJTNSBOCURP-UHFFFAOYSA-N 2 1 312.910 4.024 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(C(F)F)cc2)CC1 ZINC001143256029 1047544423 /nfs/dbraw/zinc/54/44/23/1047544423.db2.gz AXNUJRKKVTWMTA-UHFFFAOYSA-N 2 1 310.432 4.321 20 0 DIADMP c1ccc(C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000122848225 1047558062 /nfs/dbraw/zinc/55/80/62/1047558062.db2.gz YJKINICHGGYWGJ-JOCHJYFZSA-N 2 1 320.480 4.187 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001206632168 1047567789 /nfs/dbraw/zinc/56/77/89/1047567789.db2.gz GOBHTUMYYMTWJH-MRXNPFEDSA-N 2 1 312.432 4.054 20 0 DIADMP CC(C)Cc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000315125588 1047597422 /nfs/dbraw/zinc/59/74/22/1047597422.db2.gz BBQCWDYAGOPYHC-MIJOPJBOSA-N 2 1 300.490 4.161 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2CCc2ccccc2)C1 ZINC001206641572 1047601482 /nfs/dbraw/zinc/60/14/82/1047601482.db2.gz YZBKKAAUEMSEBS-FQEVSTJZSA-N 2 1 322.496 4.033 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000537950237 1047645716 /nfs/dbraw/zinc/64/57/16/1047645716.db2.gz NOLNSTOZVAOUQA-MAUKXSAKSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000537950237 1047645719 /nfs/dbraw/zinc/64/57/19/1047645719.db2.gz NOLNSTOZVAOUQA-MAUKXSAKSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccc(F)cc2)C2CC2)C1 ZINC000538057888 1047656401 /nfs/dbraw/zinc/65/64/01/1047656401.db2.gz GTHVFTPZHCFIGJ-JXFKEZNVSA-N 2 1 318.480 4.379 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1F ZINC001168359549 1047692149 /nfs/dbraw/zinc/69/21/49/1047692149.db2.gz BPZKYAZNDLYVAV-FQEVSTJZSA-N 2 1 318.480 4.377 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2csc3ccccc23)[C@@H](C)C1 ZINC000538717315 1047699459 /nfs/dbraw/zinc/69/94/59/1047699459.db2.gz TVPQFGBJUGZOFE-YOEHRIQHSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2csc3ccccc23)[C@@H](C)C1 ZINC000538717315 1047699461 /nfs/dbraw/zinc/69/94/61/1047699461.db2.gz TVPQFGBJUGZOFE-YOEHRIQHSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2csc3ccccc23)[C@@H](C)C1 ZINC000538717315 1047699466 /nfs/dbraw/zinc/69/94/66/1047699466.db2.gz TVPQFGBJUGZOFE-YOEHRIQHSA-N 2 1 302.487 4.063 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2csc3ccccc23)C1 ZINC000538722040 1047700596 /nfs/dbraw/zinc/70/05/96/1047700596.db2.gz ULPWOEHXVAAWQY-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2csc3ccccc23)C1 ZINC000538722040 1047700598 /nfs/dbraw/zinc/70/05/98/1047700598.db2.gz ULPWOEHXVAAWQY-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000538722040 1047700602 /nfs/dbraw/zinc/70/06/02/1047700602.db2.gz ULPWOEHXVAAWQY-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP CCc1ccc(C2=CC[N@H+](CCCCn3cc[nH+]c3C)CC2)cc1 ZINC000538956819 1047720617 /nfs/dbraw/zinc/72/06/17/1047720617.db2.gz YFPLMUNMDLMULR-UHFFFAOYSA-N 2 1 323.484 4.323 20 0 DIADMP CCc1ccc(C2=CC[N@@H+](CCCCn3cc[nH+]c3C)CC2)cc1 ZINC000538956819 1047720623 /nfs/dbraw/zinc/72/06/23/1047720623.db2.gz YFPLMUNMDLMULR-UHFFFAOYSA-N 2 1 323.484 4.323 20 0 DIADMP C[N@@H+](CCC1CCCC1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538943382 1047720883 /nfs/dbraw/zinc/72/08/83/1047720883.db2.gz KRPBXBNTOXFPSL-UHFFFAOYSA-N 2 1 315.505 4.200 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cccs2)C2CCCC2)C1 ZINC000538985387 1047722344 /nfs/dbraw/zinc/72/23/44/1047722344.db2.gz RMKJPRCGIHIENN-CRAIPNDOSA-N 2 1 306.519 4.301 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cccs2)C2CCCC2)C1 ZINC000538985389 1047723256 /nfs/dbraw/zinc/72/32/56/1047723256.db2.gz RMKJPRCGIHIENN-MAUKXSAKSA-N 2 1 306.519 4.301 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000539062558 1047730348 /nfs/dbraw/zinc/73/03/48/1047730348.db2.gz ZEFOGVLXBPKANR-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000539062558 1047730353 /nfs/dbraw/zinc/73/03/53/1047730353.db2.gz ZEFOGVLXBPKANR-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP CCc1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C(C)C)cc1 ZINC000539162636 1047738757 /nfs/dbraw/zinc/73/87/57/1047738757.db2.gz IHPAZWVTSLSNRG-FXAWDEMLSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+]2C)cc1 ZINC000539300909 1047744829 /nfs/dbraw/zinc/74/48/29/1047744829.db2.gz QRQHKGUSUGAKSE-WBVHZDCISA-N 2 1 306.519 4.322 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+]2C)cc1 ZINC000539300906 1047745047 /nfs/dbraw/zinc/74/50/47/1047745047.db2.gz QRQHKGUSUGAKSE-DOTOQJQBSA-N 2 1 306.519 4.322 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@H](C)CCc3ccccc3)CC2)[nH+]c1C ZINC001197844477 1047885785 /nfs/dbraw/zinc/88/57/85/1047885785.db2.gz GTTDUUNIOHNHNF-OAHLLOKOSA-N 2 1 311.473 4.227 20 0 DIADMP CCCc1ccc(C[N@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)s1 ZINC001183065223 1047887421 /nfs/dbraw/zinc/88/74/21/1047887421.db2.gz IHVSMNCIAYHGMM-YJBOKZPZSA-N 2 1 308.535 4.253 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC(N2CCCCC2)C1)c1ccc(F)c(F)c1 ZINC000479528521 1047914682 /nfs/dbraw/zinc/91/46/82/1047914682.db2.gz PHLDQCXIMNPUGB-LADRWXRNSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(F)c(F)c1 ZINC000479528521 1047914690 /nfs/dbraw/zinc/91/46/90/1047914690.db2.gz PHLDQCXIMNPUGB-LADRWXRNSA-N 2 1 322.443 4.268 20 0 DIADMP CCCOc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479535713 1047922022 /nfs/dbraw/zinc/92/20/22/1047922022.db2.gz ISPOJNRAOZURDT-IPJUCJBFSA-N 2 1 316.489 4.143 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1C ZINC000479537766 1047922061 /nfs/dbraw/zinc/92/20/61/1047922061.db2.gz AMHUDJFZUDLMLA-LMDPOFIKSA-N 2 1 300.490 4.279 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1C ZINC000479537768 1047922551 /nfs/dbraw/zinc/92/25/51/1047922551.db2.gz AMHUDJFZUDLMLA-VIQWUECVSA-N 2 1 300.490 4.279 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC001205280476 1047955195 /nfs/dbraw/zinc/95/51/95/1047955195.db2.gz AFGQEBZGQMCDKE-SFHVURJKSA-N 2 1 300.471 4.118 20 0 DIADMP c1cc(Nc2ccc3c[nH+]ccc3c2)cc(O[C@H]2CCC[NH2+]C2)c1 ZINC001160217756 1048001182 /nfs/dbraw/zinc/00/11/82/1048001182.db2.gz AUHAVWSSONFOHB-FQEVSTJZSA-N 2 1 319.408 4.109 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000554089724 1048008555 /nfs/dbraw/zinc/00/85/55/1048008555.db2.gz YQMMQUJMXXZGLM-AABGKKOBSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000554089724 1048008569 /nfs/dbraw/zinc/00/85/69/1048008569.db2.gz YQMMQUJMXXZGLM-AABGKKOBSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2sc(Cl)c3ccccc32)CC1 ZINC001205296328 1048035109 /nfs/dbraw/zinc/03/51/09/1048035109.db2.gz MKFGMIPUSUPKRS-INIZCTEOSA-N 2 1 308.878 4.258 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C/C=C\c1cc(C)c(C)cc1C ZINC001199219767 1048045169 /nfs/dbraw/zinc/04/51/69/1048045169.db2.gz OIRXPFHIBPZQDO-IDTUSYRASA-N 2 1 311.473 4.056 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]C2CCCCC2)cc1 ZINC001199277270 1048053093 /nfs/dbraw/zinc/05/30/93/1048053093.db2.gz YVBNQYQTRFHVOD-KRWDZBQOSA-N 2 1 300.490 4.483 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c1 ZINC001199345208 1048056065 /nfs/dbraw/zinc/05/60/65/1048056065.db2.gz PCEYAUNSTUZBPR-OAHLLOKOSA-N 2 1 308.897 4.250 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329748 1048057557 /nfs/dbraw/zinc/05/75/57/1048057557.db2.gz YZKDRZWJYKEHCB-SJODPALPSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1ccc2cc[nH+]c(N(Cc3ccccc3)C[C@H](C)C[NH3+])c2c1 ZINC001160661722 1048074622 /nfs/dbraw/zinc/07/46/22/1048074622.db2.gz IZBRFRMJQBCCAP-QGZVFWFLSA-N 2 1 319.452 4.145 20 0 DIADMP CC[N@@H+](Cc1ccc(CF)cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC001175060789 1048087643 /nfs/dbraw/zinc/08/76/43/1048087643.db2.gz CRLPTLLJFORCBI-UHFFFAOYSA-N 2 1 314.448 4.240 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@@H+]1CCC[C@@H](C)C1 ZINC000480226200 1048096613 /nfs/dbraw/zinc/09/66/13/1048096613.db2.gz LMRAHOLMTXCBRM-ZIAGYGMSSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000480226200 1048096626 /nfs/dbraw/zinc/09/66/26/1048096626.db2.gz LMRAHOLMTXCBRM-ZIAGYGMSSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC000480226195 1048097685 /nfs/dbraw/zinc/09/76/85/1048097685.db2.gz LMRAHOLMTXCBRM-KBPBESRZSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000480226195 1048097699 /nfs/dbraw/zinc/09/76/99/1048097699.db2.gz LMRAHOLMTXCBRM-KBPBESRZSA-N 2 1 308.432 4.208 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000480616874 1048191826 /nfs/dbraw/zinc/19/18/26/1048191826.db2.gz WNTGBXLPRZBDFW-ZYSHUDEJSA-N 2 1 318.530 4.465 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000480616874 1048191832 /nfs/dbraw/zinc/19/18/32/1048191832.db2.gz WNTGBXLPRZBDFW-ZYSHUDEJSA-N 2 1 318.530 4.465 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc(F)ccc1F ZINC000480608634 1048192332 /nfs/dbraw/zinc/19/23/32/1048192332.db2.gz KKOGQSXTHKIIFC-HUUCEWRRSA-N 2 1 310.432 4.128 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000480618004 1048193471 /nfs/dbraw/zinc/19/34/71/1048193471.db2.gz ZZTLTTIFSYCREE-IAGOWNOFSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc(F)cc(F)c1 ZINC000480628189 1048194938 /nfs/dbraw/zinc/19/49/38/1048194938.db2.gz WPRCHCRPVVWGFA-CABCVRRESA-N 2 1 310.432 4.128 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(F)c1 ZINC000480607463 1048195122 /nfs/dbraw/zinc/19/51/22/1048195122.db2.gz GDWSGMYXYKBFLI-CVEARBPZSA-N 2 1 322.468 4.140 20 0 DIADMP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000480630665 1048195724 /nfs/dbraw/zinc/19/57/24/1048195724.db2.gz MUVQZWJTNAAHMR-IRXDYDNUSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1F ZINC000480625723 1048200243 /nfs/dbraw/zinc/20/02/43/1048200243.db2.gz NOTBYDKJFLMOJC-HUUCEWRRSA-N 2 1 310.432 4.270 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1cccc2F ZINC000480635038 1048201113 /nfs/dbraw/zinc/20/11/13/1048201113.db2.gz VJLRKOOKYQEMBK-KXBFYZLASA-N 2 1 304.453 4.057 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc2c(c1)COC2 ZINC000480636946 1048205035 /nfs/dbraw/zinc/20/50/35/1048205035.db2.gz GGHDIEOXOKMINJ-SJORKVTESA-N 2 1 316.489 4.022 20 0 DIADMP C[C@H](N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646437 1048208385 /nfs/dbraw/zinc/20/83/85/1048208385.db2.gz VIUNVCDCDIDRIS-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CCN2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646437 1048208398 /nfs/dbraw/zinc/20/83/98/1048208398.db2.gz VIUNVCDCDIDRIS-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646437 1048208406 /nfs/dbraw/zinc/20/84/06/1048208406.db2.gz VIUNVCDCDIDRIS-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646437 1048208419 /nfs/dbraw/zinc/20/84/19/1048208419.db2.gz VIUNVCDCDIDRIS-NDXORKPFSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000480693319 1048216693 /nfs/dbraw/zinc/21/66/93/1048216693.db2.gz BIWBNICZGSMLHA-RBSFLKMASA-N 2 1 320.443 4.350 20 0 DIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3csc4ccccc34)C2)CC1 ZINC000554879465 1048219873 /nfs/dbraw/zinc/21/98/73/1048219873.db2.gz UEPLKVZKAHKTSP-MRXNPFEDSA-N 2 1 314.498 4.065 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000480718794 1048227837 /nfs/dbraw/zinc/22/78/37/1048227837.db2.gz FSRCKDINVKYJDH-HKUYNNGSSA-N 2 1 320.546 4.020 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000480718794 1048227847 /nfs/dbraw/zinc/22/78/47/1048227847.db2.gz FSRCKDINVKYJDH-HKUYNNGSSA-N 2 1 320.546 4.020 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000480770390 1048242409 /nfs/dbraw/zinc/24/24/09/1048242409.db2.gz RMPVGXRISFOKLQ-AUUYWEPGSA-N 2 1 318.892 4.181 20 0 DIADMP c1ccc2c(c1)CC[N@@H+](C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001201400471 1048250179 /nfs/dbraw/zinc/25/01/79/1048250179.db2.gz RJHPWULBWFHPIB-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP c1ccc2c(c1)CC[N@H+](C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001201400471 1048250190 /nfs/dbraw/zinc/25/01/90/1048250190.db2.gz RJHPWULBWFHPIB-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001201426698 1048264237 /nfs/dbraw/zinc/26/42/37/1048264237.db2.gz HFUGWCWMZPTUIL-KRWDZBQOSA-N 2 1 316.464 4.078 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001201426698 1048264244 /nfs/dbraw/zinc/26/42/44/1048264244.db2.gz HFUGWCWMZPTUIL-KRWDZBQOSA-N 2 1 316.464 4.078 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CC(C)(C)C)C[C@H]21 ZINC001201435931 1048273658 /nfs/dbraw/zinc/27/36/58/1048273658.db2.gz YLAFHGVHNBFSDL-CGTJXYLNSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CC(C)(C)C)C[C@H]21 ZINC001201435931 1048273667 /nfs/dbraw/zinc/27/36/67/1048273667.db2.gz YLAFHGVHNBFSDL-CGTJXYLNSA-N 2 1 320.546 4.327 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](CC(C)(C)C)C[C@H]21 ZINC001201435931 1048273675 /nfs/dbraw/zinc/27/36/75/1048273675.db2.gz YLAFHGVHNBFSDL-CGTJXYLNSA-N 2 1 320.546 4.327 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCC[C@@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC001201491425 1048283250 /nfs/dbraw/zinc/28/32/50/1048283250.db2.gz JTDRPIYFFCVWMD-QCFAMHMHSA-N 2 1 314.517 4.455 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026113 1048292853 /nfs/dbraw/zinc/29/28/53/1048292853.db2.gz SBHUHBFYYONIMJ-SJORKVTESA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026113 1048292866 /nfs/dbraw/zinc/29/28/66/1048292866.db2.gz SBHUHBFYYONIMJ-SJORKVTESA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044709 1048297177 /nfs/dbraw/zinc/29/71/77/1048297177.db2.gz YPUCYWNMIUVLJC-WMLDXEAASA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044709 1048297194 /nfs/dbraw/zinc/29/71/94/1048297194.db2.gz YPUCYWNMIUVLJC-WMLDXEAASA-N 2 1 324.896 4.121 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001201559616 1048317523 /nfs/dbraw/zinc/31/75/23/1048317523.db2.gz MDLYCZFNBZIYNI-QGZVFWFLSA-N 2 1 303.494 4.145 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]C[C@H](C)CCc2ccccc2)C1 ZINC001201558701 1048318653 /nfs/dbraw/zinc/31/86/53/1048318653.db2.gz UQFNPNMJTZCLNQ-CTNGQTDRSA-N 2 1 316.533 4.213 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)C1 ZINC000481296748 1048356020 /nfs/dbraw/zinc/35/60/20/1048356020.db2.gz URAVNERIUWYVDY-ZWKOTPCHSA-N 2 1 308.469 4.346 20 0 DIADMP CCCCC[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201727659 1048356216 /nfs/dbraw/zinc/35/62/16/1048356216.db2.gz TZMZNEBRIDUVBT-UHFFFAOYSA-N 2 1 306.519 4.226 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](CCC(C)C)c2ccc(OC)cc2)C1 ZINC000481301216 1048363295 /nfs/dbraw/zinc/36/32/95/1048363295.db2.gz XZTDOXZKAZAIQU-XLIONFOSSA-N 2 1 318.505 4.104 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3c4ccccc4sc32)C1 ZINC000481321105 1048364728 /nfs/dbraw/zinc/36/47/28/1048364728.db2.gz KLRQRZJHLCXKKW-YOEHRIQHSA-N 2 1 314.498 4.210 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCc3c4ccccc4sc32)C1 ZINC000481321102 1048364991 /nfs/dbraw/zinc/36/49/91/1048364991.db2.gz KLRQRZJHLCXKKW-PBHICJAKSA-N 2 1 314.498 4.210 20 0 DIADMP CC(C)C[N@@H+](CC[C@H]1CCCC1(F)F)CC1CC[NH+](C)CC1 ZINC001175601280 1048368695 /nfs/dbraw/zinc/36/86/95/1048368695.db2.gz IYNUPYFULGIJCE-QGZVFWFLSA-N 2 1 316.480 4.112 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2-c2cc[nH+]cc2C(F)(F)F)c1 ZINC001162910474 1048386863 /nfs/dbraw/zinc/38/68/63/1048386863.db2.gz UUMGSLAWAJWBAI-JTQLQIEISA-N 2 1 305.303 4.064 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555597466 1048401605 /nfs/dbraw/zinc/40/16/05/1048401605.db2.gz IHEIQFMXHKBPQP-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555597466 1048401613 /nfs/dbraw/zinc/40/16/13/1048401613.db2.gz IHEIQFMXHKBPQP-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000555597466 1048401620 /nfs/dbraw/zinc/40/16/20/1048401620.db2.gz IHEIQFMXHKBPQP-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1cccc2ccccc21)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000555597466 1048401629 /nfs/dbraw/zinc/40/16/29/1048401629.db2.gz IHEIQFMXHKBPQP-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)CCc1ccc(Cl)cc1 ZINC001175688888 1048417847 /nfs/dbraw/zinc/41/78/47/1048417847.db2.gz QKPRRVACNGPXDO-UHFFFAOYSA-N 2 1 308.897 4.080 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000157350422 1048420386 /nfs/dbraw/zinc/42/03/86/1048420386.db2.gz REWYCUAQYPZIOX-RCCFBDPRSA-N 2 1 304.865 4.008 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCCC2)CC[N@H+]1C ZINC000481554234 1048427867 /nfs/dbraw/zinc/42/78/67/1048427867.db2.gz ASWGMHNMEIVOSV-CRAIPNDOSA-N 2 1 320.908 4.224 20 0 DIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cc(O)cc(Cl)c1 ZINC001202074611 1048453611 /nfs/dbraw/zinc/45/36/11/1048453611.db2.gz RNVLEUKXPYTKHZ-UHFFFAOYSA-N 2 1 324.896 4.180 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162778 1048462911 /nfs/dbraw/zinc/46/29/11/1048462911.db2.gz NXTPGFGVEXRMHW-OFQRWUPVSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162778 1048462915 /nfs/dbraw/zinc/46/29/15/1048462915.db2.gz NXTPGFGVEXRMHW-OFQRWUPVSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162778 1048462924 /nfs/dbraw/zinc/46/29/24/1048462924.db2.gz NXTPGFGVEXRMHW-OFQRWUPVSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162778 1048462928 /nfs/dbraw/zinc/46/29/28/1048462928.db2.gz NXTPGFGVEXRMHW-OFQRWUPVSA-N 2 1 324.559 4.337 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)c2)c1 ZINC000481920654 1048528716 /nfs/dbraw/zinc/52/87/16/1048528716.db2.gz FSBZXTXRUBLLMD-LAUBAEHRSA-N 2 1 308.469 4.234 20 0 DIADMP [NH2+]=C(Nc1ccc([C@H]2CCC[NH2+]2)cn1)C12CC3CC(CC(C3)C1)C2 ZINC001163838778 1048534204 /nfs/dbraw/zinc/53/42/04/1048534204.db2.gz BIXRAXDZSPFHKV-SJFHUFEGSA-N 2 1 324.472 4.112 20 0 DIADMP Cc1ccc(C[C@@H]([NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)C2CC2)cc1 ZINC000482321612 1048587099 /nfs/dbraw/zinc/58/70/99/1048587099.db2.gz PTWVKQNZXZQYPW-TZIWHRDSSA-N 2 1 314.517 4.026 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)C(C)(C)c2ccccc2)C1 ZINC000482343532 1048589457 /nfs/dbraw/zinc/58/94/57/1048589457.db2.gz HRLJKQGLTQXKLS-ZWKOTPCHSA-N 2 1 302.506 4.063 20 0 DIADMP CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000482352181 1048591109 /nfs/dbraw/zinc/59/11/09/1048591109.db2.gz AIVMOGZNBUIYGH-QUCCMNQESA-N 2 1 320.496 4.103 20 0 DIADMP Cc1ccccc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482438078 1048609088 /nfs/dbraw/zinc/60/90/88/1048609088.db2.gz LESARQUQTXOFHI-PZJWPPBQSA-N 2 1 322.496 4.210 20 0 DIADMP Cc1cc[nH+]c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1C ZINC001164487830 1048633784 /nfs/dbraw/zinc/63/37/84/1048633784.db2.gz ZALPLPURTMGPJK-VAMGGRTRSA-N 2 1 321.468 4.021 20 0 DIADMP Cc1[nH+]c2ccc(NCC[C@@H]3CCC[N@H+](C)C3)cc2n1C(C)C ZINC001165289444 1048674112 /nfs/dbraw/zinc/67/41/12/1048674112.db2.gz BNOLMFZRMOOPRD-INIZCTEOSA-N 2 1 314.477 4.069 20 0 DIADMP Cc1[nH+]c2ccc(NCC[C@@H]3CCC[N@@H+](C)C3)cc2n1C(C)C ZINC001165289444 1048674122 /nfs/dbraw/zinc/67/41/22/1048674122.db2.gz BNOLMFZRMOOPRD-INIZCTEOSA-N 2 1 314.477 4.069 20 0 DIADMP CCC(C)(C)CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716622496 1048678512 /nfs/dbraw/zinc/67/85/12/1048678512.db2.gz VNRRXEVCCALWBF-ZCNNSNEGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000640532834 1048679845 /nfs/dbraw/zinc/67/98/45/1048679845.db2.gz KNYAWZWGIWKYCA-INIZCTEOSA-N 2 1 321.509 4.231 20 0 DIADMP C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC000640532834 1048679857 /nfs/dbraw/zinc/67/98/57/1048679857.db2.gz KNYAWZWGIWKYCA-INIZCTEOSA-N 2 1 321.509 4.231 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC000668169724 1048710028 /nfs/dbraw/zinc/71/00/28/1048710028.db2.gz YBSVCSRFWNVYNM-UHFFFAOYSA-N 2 1 324.472 4.147 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC000668169724 1048710034 /nfs/dbraw/zinc/71/00/34/1048710034.db2.gz YBSVCSRFWNVYNM-UHFFFAOYSA-N 2 1 324.472 4.147 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H]2CCc3ccc(F)cc32)CC1 ZINC001190408475 1048734301 /nfs/dbraw/zinc/73/43/01/1048734301.db2.gz ZMUAJUSFLWALMK-HXUWFJFHSA-N 2 1 318.480 4.257 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCC(C)(C)C[C@H]3C)CC2)[nH+]1 ZINC000483158997 1048743923 /nfs/dbraw/zinc/74/39/23/1048743923.db2.gz MTRXVPRMJYOTAP-CRAIPNDOSA-N 2 1 315.505 4.163 20 0 DIADMP C(=C/C[N@@H+](CC1CC1)C1CCC1)\C[NH+](CC1CC1)C1CCC1 ZINC000483310372 1048779401 /nfs/dbraw/zinc/77/94/01/1048779401.db2.gz CJRHLWAGARABQE-OWOJBTEDSA-N 2 1 302.506 4.072 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716653649 1048785876 /nfs/dbraw/zinc/78/58/76/1048785876.db2.gz BFNQYAHQMAIFJD-OTWHNJEPSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000483495366 1048804180 /nfs/dbraw/zinc/80/41/80/1048804180.db2.gz YTOSEDBBLDIPMZ-MAODMQOUSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483495366 1048804204 /nfs/dbraw/zinc/80/42/04/1048804204.db2.gz YTOSEDBBLDIPMZ-MAODMQOUSA-N 2 1 308.469 4.317 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](CN(C)Cc3ccsc3)C2)s1 ZINC000852023894 1048820832 /nfs/dbraw/zinc/82/08/32/1048820832.db2.gz ZEGJIVRUWLRYBZ-OAHLLOKOSA-N 2 1 320.527 4.072 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)Cc3ccsc3)C2)s1 ZINC000852023894 1048820849 /nfs/dbraw/zinc/82/08/49/1048820849.db2.gz ZEGJIVRUWLRYBZ-OAHLLOKOSA-N 2 1 320.527 4.072 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)Cc3ccsc3)C2)s1 ZINC000852023894 1048820867 /nfs/dbraw/zinc/82/08/67/1048820867.db2.gz ZEGJIVRUWLRYBZ-OAHLLOKOSA-N 2 1 320.527 4.072 20 0 DIADMP CC[NH+](CC)[C@H](C[NH2+][C@@H]1CCCc2ccccc2C1)CC(C)C ZINC001177210215 1048846268 /nfs/dbraw/zinc/84/62/68/1048846268.db2.gz ZWBQIFSJZFVURC-RTWAWAEBSA-N 2 1 316.533 4.280 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000483726136 1048846796 /nfs/dbraw/zinc/84/67/96/1048846796.db2.gz MCFLMTDWMRQREL-ZIFCJYIRSA-N 2 1 318.505 4.389 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000483726136 1048846817 /nfs/dbraw/zinc/84/68/17/1048846817.db2.gz MCFLMTDWMRQREL-ZIFCJYIRSA-N 2 1 318.505 4.389 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000483724064 1048847265 /nfs/dbraw/zinc/84/72/65/1048847265.db2.gz GBPCVQVJOUVGFW-HQRMLTQVSA-N 2 1 318.505 4.245 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000483724064 1048847280 /nfs/dbraw/zinc/84/72/80/1048847280.db2.gz GBPCVQVJOUVGFW-HQRMLTQVSA-N 2 1 318.505 4.245 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001191099242 1048848657 /nfs/dbraw/zinc/84/86/57/1048848657.db2.gz KSJSZWHFKLTIID-LJQANCHMSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000483732916 1048848974 /nfs/dbraw/zinc/84/89/74/1048848974.db2.gz URZSYJYBGNCFAE-IPELMVKDSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000483732916 1048848989 /nfs/dbraw/zinc/84/89/89/1048848989.db2.gz URZSYJYBGNCFAE-IPELMVKDSA-N 2 1 322.924 4.370 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000163371438 1048890729 /nfs/dbraw/zinc/89/07/29/1048890729.db2.gz TUACGYSINCKOHU-CQSZACIVSA-N 2 1 308.432 4.352 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC001177299537 1048861449 /nfs/dbraw/zinc/86/14/49/1048861449.db2.gz UKVKKVIKGQFQDE-WOJBJXKFSA-N 2 1 316.533 4.500 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(C2CC2)c1 ZINC001177299418 1048862213 /nfs/dbraw/zinc/86/22/13/1048862213.db2.gz PPKVLKUJDDVXKL-KRWDZBQOSA-N 2 1 300.490 4.308 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccccn1 ZINC000483846306 1048865380 /nfs/dbraw/zinc/86/53/80/1048865380.db2.gz DZWPRXAWHRVBHF-LJQANCHMSA-N 2 1 305.510 4.267 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)cc1F ZINC001177453595 1048886460 /nfs/dbraw/zinc/88/64/60/1048886460.db2.gz CBYRQYKLCCNNLO-JJRVBVJISA-N 2 1 315.436 4.234 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001191258626 1048897547 /nfs/dbraw/zinc/89/75/47/1048897547.db2.gz OUEVIAMZKBUOPI-HMXCVIKNSA-N 2 1 314.517 4.377 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001191258626 1048897553 /nfs/dbraw/zinc/89/75/53/1048897553.db2.gz OUEVIAMZKBUOPI-HMXCVIKNSA-N 2 1 314.517 4.377 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001191258626 1048897562 /nfs/dbraw/zinc/89/75/62/1048897562.db2.gz OUEVIAMZKBUOPI-HMXCVIKNSA-N 2 1 314.517 4.377 20 0 DIADMP CC(C)Cc1ccc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC001191260116 1048900648 /nfs/dbraw/zinc/90/06/48/1048900648.db2.gz ZTGKNDQLNBNAMV-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccc(C[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC001191260116 1048900665 /nfs/dbraw/zinc/90/06/65/1048900665.db2.gz ZTGKNDQLNBNAMV-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccc(C[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)cc1 ZINC001191260116 1048900679 /nfs/dbraw/zinc/90/06/79/1048900679.db2.gz ZTGKNDQLNBNAMV-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccc(C[NH+](C)CC[C@@H]2CCCC[N@H+]2C)cc1 ZINC001191260116 1048900693 /nfs/dbraw/zinc/90/06/93/1048900693.db2.gz ZTGKNDQLNBNAMV-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP C[N@@H+](CCC(C)(C)C1CC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233860 1048907239 /nfs/dbraw/zinc/90/72/39/1048907239.db2.gz QBXVNBYWEHJWKT-LJQANCHMSA-N 2 1 314.517 4.267 20 0 DIADMP C[NH+](CCC(C)(C)C1CC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191233860 1048907249 /nfs/dbraw/zinc/90/72/49/1048907249.db2.gz QBXVNBYWEHJWKT-LJQANCHMSA-N 2 1 314.517 4.267 20 0 DIADMP C[NH+](CCC(C)(C)C1CC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191233860 1048907259 /nfs/dbraw/zinc/90/72/59/1048907259.db2.gz QBXVNBYWEHJWKT-LJQANCHMSA-N 2 1 314.517 4.267 20 0 DIADMP Cc1cc(C)cc(-c2ccc(C[NH2+]C[C@H]3CCC[N@H+](C)C3)cc2)c1 ZINC001177795454 1048946225 /nfs/dbraw/zinc/94/62/25/1048946225.db2.gz SQQNSYBTRQMXIK-HXUWFJFHSA-N 2 1 322.496 4.402 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+]([C@H](C)c3ccccc3)CC2)cc(C)n1 ZINC001177876320 1048949669 /nfs/dbraw/zinc/94/96/69/1048949669.db2.gz ZXOXSKKTIPNLAD-GOSISDBHSA-N 2 1 323.484 4.014 20 0 DIADMP CC(C)[N@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)CC1CC1 ZINC001191723591 1048984078 /nfs/dbraw/zinc/98/40/78/1048984078.db2.gz UETLQQPGCUWUCT-UHFFFAOYSA-N 2 1 300.490 4.293 20 0 DIADMP Cc1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c(C)c1 ZINC001203739641 1048985617 /nfs/dbraw/zinc/98/56/17/1048985617.db2.gz NLMZWKIBEDZXRR-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)c1 ZINC001203739641 1048985627 /nfs/dbraw/zinc/98/56/27/1048985627.db2.gz NLMZWKIBEDZXRR-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC001203739641 1048985639 /nfs/dbraw/zinc/98/56/39/1048985639.db2.gz NLMZWKIBEDZXRR-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC001203749412 1048989722 /nfs/dbraw/zinc/98/97/22/1048989722.db2.gz DNRSWCDUPATGKX-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1ccc(C)c(C[NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)c1 ZINC001203749412 1048989732 /nfs/dbraw/zinc/98/97/32/1048989732.db2.gz DNRSWCDUPATGKX-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2csc3ccccc23)C1 ZINC001178249997 1049000958 /nfs/dbraw/zinc/00/09/58/1049000958.db2.gz ZGURKAVGLJDHSR-INIZCTEOSA-N 2 1 316.514 4.359 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@H]1CCCCS1 ZINC001178291007 1049011716 /nfs/dbraw/zinc/01/17/16/1049011716.db2.gz QBMMWSHDEHFECL-GOSISDBHSA-N 2 1 320.546 4.020 20 0 DIADMP c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2cccc(C[NH+]3CCCCC3)c2)c1 ZINC001191939416 1049019826 /nfs/dbraw/zinc/01/98/26/1049019826.db2.gz UIZXPINUBFDXNC-NRFANRHFSA-N 2 1 323.484 4.338 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2c[nH+]ccc2N(C)C)CC(C)(C)C1 ZINC001178601298 1049065934 /nfs/dbraw/zinc/06/59/34/1049065934.db2.gz NTACQAHQRCSESQ-JKSUJKDBSA-N 2 1 303.494 4.090 20 0 DIADMP Cc1ccc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)s1 ZINC001204035876 1049067616 /nfs/dbraw/zinc/06/76/16/1049067616.db2.gz ZBWPENGDQOIJQV-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)s1 ZINC001204035876 1049067630 /nfs/dbraw/zinc/06/76/30/1049067630.db2.gz ZBWPENGDQOIJQV-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195132140 1049070031 /nfs/dbraw/zinc/07/00/31/1049070031.db2.gz YMYSLWZTYDQSKP-AEFFLSMTSA-N 2 1 314.498 4.229 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@H]1CC[C@@H](C)SC1)c1ccccc1 ZINC001204063339 1049076136 /nfs/dbraw/zinc/07/61/36/1049076136.db2.gz DKTPNPPSCQUJNM-NEWSRXKRSA-N 2 1 320.546 4.333 20 0 DIADMP c1ccc2c(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccnc2c1 ZINC001204086539 1049079543 /nfs/dbraw/zinc/07/95/43/1049079543.db2.gz DBPMOIJYZAXWJI-IBGZPJMESA-N 2 1 323.484 4.075 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccnc2ccccc12 ZINC001204091741 1049084854 /nfs/dbraw/zinc/08/48/54/1049084854.db2.gz RPUJXSTXAJXKII-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccnc2ccccc12 ZINC001204091741 1049084866 /nfs/dbraw/zinc/08/48/66/1049084866.db2.gz RPUJXSTXAJXKII-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccnc2ccccc12 ZINC001204091741 1049084878 /nfs/dbraw/zinc/08/48/78/1049084878.db2.gz RPUJXSTXAJXKII-OALUTQOASA-N 2 1 323.484 4.074 20 0 DIADMP CCc1ccc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)cc1 ZINC001204175470 1049104515 /nfs/dbraw/zinc/10/45/15/1049104515.db2.gz DBSZPCJXHMUQKG-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP CCc1ccc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)cc1 ZINC001204175470 1049104520 /nfs/dbraw/zinc/10/45/20/1049104520.db2.gz DBSZPCJXHMUQKG-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001178922086 1049109176 /nfs/dbraw/zinc/10/91/76/1049109176.db2.gz PALXEIIOXDDRAT-HSALFYBXSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001178922086 1049109184 /nfs/dbraw/zinc/10/91/84/1049109184.db2.gz PALXEIIOXDDRAT-HSALFYBXSA-N 2 1 312.501 4.208 20 0 DIADMP CC[C@@H](C)[C@@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001192909089 1049147074 /nfs/dbraw/zinc/14/70/74/1049147074.db2.gz CGEPDUTZPSNCAP-IAGOWNOFSA-N 2 1 303.494 4.055 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CC2CCC(C)(C)CC2)cc1 ZINC001192918656 1049148274 /nfs/dbraw/zinc/14/82/74/1049148274.db2.gz NYPOAEUTZJHDIC-UHFFFAOYSA-N 2 1 302.506 4.396 20 0 DIADMP CCC1(CC)CCC([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC001179266581 1049149609 /nfs/dbraw/zinc/14/96/09/1049149609.db2.gz QYMWWPWRZROBTN-SFHVURJKSA-N 2 1 306.538 4.447 20 0 DIADMP C([NH2+]C1CCC2(CCC2)CC1)[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001179387158 1049163094 /nfs/dbraw/zinc/16/30/94/1049163094.db2.gz YLHKOBGCAOHTHW-IBGZPJMESA-N 2 1 304.522 4.486 20 0 DIADMP C([NH2+]C1CCC2(CCC2)CC1)[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001179387158 1049163098 /nfs/dbraw/zinc/16/30/98/1049163098.db2.gz YLHKOBGCAOHTHW-IBGZPJMESA-N 2 1 304.522 4.486 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(OC(C)C)cc2)CC1 ZINC001204455600 1049166734 /nfs/dbraw/zinc/16/67/34/1049166734.db2.gz ALYRLKBCCVWOIS-UHFFFAOYSA-N 2 1 318.505 4.170 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+]Cc1c[nH+]ccc1N(C)C ZINC001179541575 1049179466 /nfs/dbraw/zinc/17/94/66/1049179466.db2.gz OPTJIJCJWPSERC-UHFFFAOYSA-N 2 1 319.452 4.153 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001204550051 1049188300 /nfs/dbraw/zinc/18/83/00/1049188300.db2.gz FNWBPWWIHRDXCI-HZPDHXFCSA-N 2 1 322.924 4.496 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615536 1049200780 /nfs/dbraw/zinc/20/07/80/1049200780.db2.gz IVEJXWGIJBITOC-MFUYTVRRSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615536 1049200790 /nfs/dbraw/zinc/20/07/90/1049200790.db2.gz IVEJXWGIJBITOC-MFUYTVRRSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001204615536 1049200798 /nfs/dbraw/zinc/20/07/98/1049200798.db2.gz IVEJXWGIJBITOC-MFUYTVRRSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204615536 1049200807 /nfs/dbraw/zinc/20/08/07/1049200807.db2.gz IVEJXWGIJBITOC-MFUYTVRRSA-N 2 1 314.517 4.431 20 0 DIADMP CCSc1cccc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c1 ZINC001204616167 1049201432 /nfs/dbraw/zinc/20/14/32/1049201432.db2.gz PJJKCIDVKFIDTF-KRWDZBQOSA-N 2 1 306.519 4.105 20 0 DIADMP CCSc1cccc(C[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c1 ZINC001204616167 1049201441 /nfs/dbraw/zinc/20/14/41/1049201441.db2.gz PJJKCIDVKFIDTF-KRWDZBQOSA-N 2 1 306.519 4.105 20 0 DIADMP CCSc1cccc(C[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c1 ZINC001204616167 1049201453 /nfs/dbraw/zinc/20/14/53/1049201453.db2.gz PJJKCIDVKFIDTF-KRWDZBQOSA-N 2 1 306.519 4.105 20 0 DIADMP CCSc1cccc(C[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c1 ZINC001204616167 1049201461 /nfs/dbraw/zinc/20/14/61/1049201461.db2.gz PJJKCIDVKFIDTF-KRWDZBQOSA-N 2 1 306.519 4.105 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc(C[NH+](C)C)cc2)nc1 ZINC001204621368 1049203687 /nfs/dbraw/zinc/20/36/87/1049203687.db2.gz WXHKEJZHAIIDHF-KRWDZBQOSA-N 2 1 323.484 4.185 20 0 DIADMP C[N@@H+](CC1(C)CC[NH2+]CC1)C(c1ccccc1)c1ccccc1 ZINC001204646382 1049210843 /nfs/dbraw/zinc/21/08/43/1049210843.db2.gz QZVYSZYSLAETSL-UHFFFAOYSA-N 2 1 308.469 4.098 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2Oc2ccc(Cl)cc2)CC1 ZINC001204646576 1049210921 /nfs/dbraw/zinc/21/09/21/1049210921.db2.gz VJSDNCWSNHZHTM-UHFFFAOYSA-N 2 1 316.832 4.055 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000858098524 1049216997 /nfs/dbraw/zinc/21/69/97/1049216997.db2.gz NQUYMSPQFVKCAW-PLACYPQZSA-N 2 1 312.501 4.319 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](C3c4ccccc4-c4ccccc43)CC[C@@H]21 ZINC000485335779 1049223500 /nfs/dbraw/zinc/22/35/00/1049223500.db2.gz GQCAAPFTYMNWOC-KKSFZXQISA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](C3c4ccccc4-c4ccccc43)CC[C@@H]21 ZINC000485335779 1049223511 /nfs/dbraw/zinc/22/35/11/1049223511.db2.gz GQCAAPFTYMNWOC-KKSFZXQISA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](C3c4ccccc4-c4ccccc43)CC[C@@H]21 ZINC000485335779 1049223520 /nfs/dbraw/zinc/22/35/20/1049223520.db2.gz GQCAAPFTYMNWOC-KKSFZXQISA-N 2 1 318.464 4.173 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924891 1049228709 /nfs/dbraw/zinc/22/87/09/1049228709.db2.gz LQRNZMNUKZNUGQ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001179924891 1049228717 /nfs/dbraw/zinc/22/87/17/1049228717.db2.gz LQRNZMNUKZNUGQ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC001179924891 1049228721 /nfs/dbraw/zinc/22/87/21/1049228721.db2.gz LQRNZMNUKZNUGQ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC001179924891 1049228729 /nfs/dbraw/zinc/22/87/29/1049228729.db2.gz LQRNZMNUKZNUGQ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCC1CCCC1 ZINC001193649284 1049240587 /nfs/dbraw/zinc/24/05/87/1049240587.db2.gz NRKWXDCZRGHSHL-GHTZIAJQSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCCC1CCCC1 ZINC001193649284 1049240596 /nfs/dbraw/zinc/24/05/96/1049240596.db2.gz NRKWXDCZRGHSHL-GHTZIAJQSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@H](C[N@H+]1CCCC2(CC[NH2+]CC2)C1)c1cccc2ccccc21 ZINC001204727830 1049242322 /nfs/dbraw/zinc/24/23/22/1049242322.db2.gz REFKLDIYWUBCRQ-GOSISDBHSA-N 2 1 322.496 4.409 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204743011 1049249460 /nfs/dbraw/zinc/24/94/60/1049249460.db2.gz XFQGOCZPFAQSQC-UHFFFAOYSA-N 2 1 314.498 4.175 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)CC1 ZINC001204749852 1049250945 /nfs/dbraw/zinc/25/09/45/1049250945.db2.gz LYBVPODWEUMPHR-UHFFFAOYSA-N 2 1 320.908 4.426 20 0 DIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097393 1049275605 /nfs/dbraw/zinc/27/56/05/1049275605.db2.gz DAVMRSHZVUKNRM-NRFANRHFSA-N 2 1 314.517 4.335 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097393 1049275619 /nfs/dbraw/zinc/27/56/19/1049275619.db2.gz DAVMRSHZVUKNRM-NRFANRHFSA-N 2 1 314.517 4.335 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097393 1049275634 /nfs/dbraw/zinc/27/56/34/1049275634.db2.gz DAVMRSHZVUKNRM-NRFANRHFSA-N 2 1 314.517 4.335 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097393 1049275646 /nfs/dbraw/zinc/27/56/46/1049275646.db2.gz DAVMRSHZVUKNRM-NRFANRHFSA-N 2 1 314.517 4.335 20 0 DIADMP CC[C@H](C)[C@@H](C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1)OC ZINC001180225661 1049311034 /nfs/dbraw/zinc/31/10/34/1049311034.db2.gz VNKUMVOOPTWAMG-NLWGTHIKSA-N 2 1 324.553 4.024 20 0 DIADMP CC(C)(C[N@@H+]1CCC[C@@](C)([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001204938863 1049317331 /nfs/dbraw/zinc/31/73/31/1049317331.db2.gz NQDIUPZLPHHXPG-MRXNPFEDSA-N 2 1 312.910 4.024 20 0 DIADMP CC(C)(C[N@H+]1CCC[C@@](C)([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001204938863 1049317339 /nfs/dbraw/zinc/31/73/39/1049317339.db2.gz NQDIUPZLPHHXPG-MRXNPFEDSA-N 2 1 312.910 4.024 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001205009501 1049339695 /nfs/dbraw/zinc/33/96/95/1049339695.db2.gz VFSNKNFSYXSLJS-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001205009501 1049339714 /nfs/dbraw/zinc/33/97/14/1049339714.db2.gz VFSNKNFSYXSLJS-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000777130161 1049358303 /nfs/dbraw/zinc/35/83/03/1049358303.db2.gz PTTPZECTUCXSOG-YSDSKTICSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000777130161 1049358316 /nfs/dbraw/zinc/35/83/16/1049358316.db2.gz PTTPZECTUCXSOG-YSDSKTICSA-N 2 1 300.490 4.064 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000485871608 1049358528 /nfs/dbraw/zinc/35/85/28/1049358528.db2.gz QDKALBRYKRIHOZ-PWRODBHTSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000485871608 1049358538 /nfs/dbraw/zinc/35/85/38/1049358538.db2.gz QDKALBRYKRIHOZ-PWRODBHTSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000485871601 1049359441 /nfs/dbraw/zinc/35/94/41/1049359441.db2.gz QDKALBRYKRIHOZ-HBMCJLEFSA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000485871601 1049359451 /nfs/dbraw/zinc/35/94/51/1049359451.db2.gz QDKALBRYKRIHOZ-HBMCJLEFSA-N 2 1 323.484 4.240 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001205076776 1049367134 /nfs/dbraw/zinc/36/71/34/1049367134.db2.gz VUFFPJGEIRUJPO-KSSFIOAISA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001205076776 1049367143 /nfs/dbraw/zinc/36/71/43/1049367143.db2.gz VUFFPJGEIRUJPO-KSSFIOAISA-N 2 1 314.860 4.319 20 0 DIADMP CC(C)[C@H]1CCc2ccccc2[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001180622766 1049385620 /nfs/dbraw/zinc/38/56/20/1049385620.db2.gz JXQOWNKUVHCEOF-GYDKDSOHSA-N 2 1 312.501 4.161 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC[C@H]([NH3+])CC1 ZINC001205123927 1049386057 /nfs/dbraw/zinc/38/60/57/1049386057.db2.gz HKGDQDSOGGVIRT-SFHVURJKSA-N 2 1 310.441 4.101 20 0 DIADMP c1c(C[N@H+]2CCCC[C@H]2c2ccccc2)sc2c1CC[NH2+]C2 ZINC001205171164 1049401420 /nfs/dbraw/zinc/40/14/20/1049401420.db2.gz LJUGJWJOALVMTQ-SFHVURJKSA-N 2 1 312.482 4.121 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001205265284 1049421310 /nfs/dbraw/zinc/42/13/10/1049421310.db2.gz PMDQMHPHFMNSMC-HXUWFJFHSA-N 2 1 310.441 4.182 20 0 DIADMP COc1ccc(-c2cccc(C[N@H+]3CCC[C@](C)([NH3+])CC3)c2)cc1 ZINC001205266707 1049422022 /nfs/dbraw/zinc/42/20/22/1049422022.db2.gz WKSFUWNYKYBVBQ-NRFANRHFSA-N 2 1 324.468 4.066 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC1 ZINC001205272926 1049423151 /nfs/dbraw/zinc/42/31/51/1049423151.db2.gz AROLOZUJQCRYES-GOSISDBHSA-N 2 1 300.471 4.118 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)CC1 ZINC001205273283 1049423927 /nfs/dbraw/zinc/42/39/27/1049423927.db2.gz JLWVQCYQPUCCCX-HXUWFJFHSA-N 2 1 308.425 4.289 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205280649 1049426427 /nfs/dbraw/zinc/42/64/27/1049426427.db2.gz FHTLIEOMKZZWJB-NRFANRHFSA-N 2 1 308.469 4.365 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)cc2)cc1 ZINC001205280704 1049427602 /nfs/dbraw/zinc/42/76/02/1049427602.db2.gz GSZGZGVGRLRCFX-OAQYLSRUSA-N 2 1 308.469 4.365 20 0 DIADMP c1cc2c(cccc2C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)[nH]1 ZINC001205281962 1049427731 /nfs/dbraw/zinc/42/77/31/1049427731.db2.gz KEWQOKQAVKDXCL-GOSISDBHSA-N 2 1 311.473 4.008 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCC[C@](C)([NH3+])CC3)c2)cc1 ZINC001205288138 1049429492 /nfs/dbraw/zinc/42/94/92/1049429492.db2.gz GSAXEGSUPILYHY-NRFANRHFSA-N 2 1 308.469 4.365 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC001205296366 1049431684 /nfs/dbraw/zinc/43/16/84/1049431684.db2.gz NQMBNCRCTIZGSW-HKUYNNGSSA-N 2 1 318.505 4.062 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)cccc1-c1ccccc1 ZINC001205318968 1049435734 /nfs/dbraw/zinc/43/57/34/1049435734.db2.gz XHBQRRTWYIMHKV-OXJNMPFZSA-N 2 1 308.469 4.079 20 0 DIADMP C[C@@H]1CC[NH2+]CC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001205324933 1049439327 /nfs/dbraw/zinc/43/93/27/1049439327.db2.gz IBBXNHZSSVOEFI-MRXNPFEDSA-N 2 1 319.452 4.019 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[NH2+]CC[C@H]2C)c1 ZINC001205333233 1049441428 /nfs/dbraw/zinc/44/14/28/1049441428.db2.gz XZNKMWHRQRYLMG-GOSISDBHSA-N 2 1 308.469 4.154 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385834 1049455444 /nfs/dbraw/zinc/45/54/44/1049455444.db2.gz RRTLIPQRFTWZPZ-WZGPROSRSA-N 2 1 304.522 4.198 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc2ccccc2[nH]1 ZINC000775622462 1049457733 /nfs/dbraw/zinc/45/77/33/1049457733.db2.gz WCQNHCKDQWBHII-DLBZAZTESA-N 2 1 313.489 4.473 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775627034 1049458551 /nfs/dbraw/zinc/45/85/51/1049458551.db2.gz FOSQBOQTEYSGEI-SJORKVTESA-N 2 1 313.489 4.187 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccccc3[nH]2)C1 ZINC000775627033 1049458622 /nfs/dbraw/zinc/45/86/22/1049458622.db2.gz FOSQBOQTEYSGEI-IRXDYDNUSA-N 2 1 313.489 4.187 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC001181514225 1049486659 /nfs/dbraw/zinc/48/66/59/1049486659.db2.gz BCVBQDPXKSIOTA-YLJYHZDGSA-N 2 1 306.538 4.257 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)cc1 ZINC001205545567 1049495123 /nfs/dbraw/zinc/49/51/23/1049495123.db2.gz JJBBMOUZHBFXSD-XLIONFOSSA-N 2 1 320.496 4.142 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1sccc1Cl ZINC000486936634 1049496548 /nfs/dbraw/zinc/49/65/48/1049496548.db2.gz GCGSQQJLZINIMR-ZDUSSCGKSA-N 2 1 300.899 4.146 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC1 ZINC001205571261 1049501099 /nfs/dbraw/zinc/50/10/99/1049501099.db2.gz SECJFWBHABXMCZ-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001181707042 1049504921 /nfs/dbraw/zinc/50/49/21/1049504921.db2.gz IHAVTSBJHVCRDJ-SZGWODLWSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001181707042 1049504932 /nfs/dbraw/zinc/50/49/32/1049504932.db2.gz IHAVTSBJHVCRDJ-SZGWODLWSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1C ZINC001181707042 1049504940 /nfs/dbraw/zinc/50/49/40/1049504940.db2.gz IHAVTSBJHVCRDJ-SZGWODLWSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC001181707042 1049504950 /nfs/dbraw/zinc/50/49/50/1049504950.db2.gz IHAVTSBJHVCRDJ-SZGWODLWSA-N 2 1 312.501 4.182 20 0 DIADMP c1cc2cc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2[nH]1 ZINC001205593975 1049506310 /nfs/dbraw/zinc/50/63/10/1049506310.db2.gz MPFYBXUXIQNFQE-IBGZPJMESA-N 2 1 311.473 4.008 20 0 DIADMP C[C@@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)CC[C@@H]1C[NH3+] ZINC001205599858 1049506918 /nfs/dbraw/zinc/50/69/18/1049506918.db2.gz AIQTXPYRVQRCCY-WIYYLYMNSA-N 2 1 322.496 4.125 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC[C@@H]1C[NH3+] ZINC001205602691 1049508621 /nfs/dbraw/zinc/50/86/21/1049508621.db2.gz LOHRWYFZQORSEJ-LAUBAEHRSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC[C@@H]1C[NH3+] ZINC001205603510 1049509834 /nfs/dbraw/zinc/50/98/34/1049509834.db2.gz PPROREPWACDNTN-IEBWSBKVSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC[C@@H]1C[NH3+] ZINC001205604445 1049510186 /nfs/dbraw/zinc/51/01/86/1049510186.db2.gz VROGDSQVSUUWDL-IEBWSBKVSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2-c2cccs2)CC[C@@H]1C[NH3+] ZINC001205628448 1049513330 /nfs/dbraw/zinc/51/33/30/1049513330.db2.gz VEYSDAPHILPFAR-HZPDHXFCSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)CC[C@@H]1C[NH3+] ZINC001205618255 1049513754 /nfs/dbraw/zinc/51/37/54/1049513754.db2.gz TWOBJJZBVMCVQL-NVXWUHKLSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CC[C@@H]1C[NH3+] ZINC001205626256 1049513872 /nfs/dbraw/zinc/51/38/72/1049513872.db2.gz FBGUKWZBIVYPCM-VQIMIIECSA-N 2 1 320.480 4.065 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC[C@@H]1C[NH3+] ZINC001205626977 1049513923 /nfs/dbraw/zinc/51/39/23/1049513923.db2.gz LDLBRRSRKSNVBA-DYESRHJHSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccccc2-c2cccs2)CC[C@@H]1C[NH3+] ZINC001205628449 1049514102 /nfs/dbraw/zinc/51/41/02/1049514102.db2.gz VEYSDAPHILPFAR-JKSUJKDBSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2sc(Cl)c3ccccc32)CC[C@H]1C[NH3+] ZINC001205651322 1049522961 /nfs/dbraw/zinc/52/29/61/1049522961.db2.gz CSIKQLLUQOOGQX-OLZOCXBDSA-N 2 1 322.905 4.362 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2sc(Cl)c3ccccc32)CC[C@@H]1C[NH3+] ZINC001205651321 1049524245 /nfs/dbraw/zinc/52/42/45/1049524245.db2.gz CSIKQLLUQOOGQX-CHWSQXEVSA-N 2 1 322.905 4.362 20 0 DIADMP CC(C)(C)[N@H+](Cc1ccccc1)C1CC[NH+](CC2CC2)CC1 ZINC001168372370 1049525857 /nfs/dbraw/zinc/52/58/57/1049525857.db2.gz VXPNZHVCMJQNPK-UHFFFAOYSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)C1CC[NH+](CC2CC2)CC1 ZINC001168372370 1049525871 /nfs/dbraw/zinc/52/58/71/1049525871.db2.gz VXPNZHVCMJQNPK-UHFFFAOYSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205677453 1049530198 /nfs/dbraw/zinc/53/01/98/1049530198.db2.gz CPAVCSWIVJZFTL-WOJBJXKFSA-N 2 1 302.506 4.396 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)[C@H](C)c1nccc2ccccc21 ZINC001205685229 1049532159 /nfs/dbraw/zinc/53/21/59/1049532159.db2.gz RTUYGONXIKNVPE-QGZVFWFLSA-N 2 1 313.489 4.350 20 0 DIADMP CC[NH+](CC)CCC[N@H+](C)Cc1oc2c(cccc2C)c1C ZINC001195790254 1049570396 /nfs/dbraw/zinc/57/03/96/1049570396.db2.gz ROWYMSSQTQJLEZ-UHFFFAOYSA-N 2 1 302.462 4.213 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)Cc1oc2c(cccc2C)c1C ZINC001195790254 1049570411 /nfs/dbraw/zinc/57/04/11/1049570411.db2.gz ROWYMSSQTQJLEZ-UHFFFAOYSA-N 2 1 302.462 4.213 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827957 1049576954 /nfs/dbraw/zinc/57/69/54/1049576954.db2.gz IIBGTSMHQDKQPJ-KXBFYZLASA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccccc2-c2ccc(F)cc2)C1 ZINC001205827957 1049576965 /nfs/dbraw/zinc/57/69/65/1049576965.db2.gz IIBGTSMHQDKQPJ-KXBFYZLASA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205902207 1049595994 /nfs/dbraw/zinc/59/59/94/1049595994.db2.gz IQNXDPWALQBCQB-HNAYVOBHSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205903261 1049596940 /nfs/dbraw/zinc/59/69/40/1049596940.db2.gz NURVQIRBOHJRDB-DNVCBOLYSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001205904721 1049597541 /nfs/dbraw/zinc/59/75/41/1049597541.db2.gz WSPZEDGHCWAMJZ-IAGOWNOFSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205903260 1049597891 /nfs/dbraw/zinc/59/78/91/1049597891.db2.gz NURVQIRBOHJRDB-BEFAXECRSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001205923227 1049602783 /nfs/dbraw/zinc/60/27/83/1049602783.db2.gz LGTZDVBXVAQRHG-YJBOKZPZSA-N 2 1 312.432 4.052 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC001205927414 1049604362 /nfs/dbraw/zinc/60/43/62/1049604362.db2.gz WOMLQCIYUBHYCU-XLAORIBOSA-N 2 1 320.546 4.340 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1c(C)cccc1C ZINC001196021329 1049604625 /nfs/dbraw/zinc/60/46/25/1049604625.db2.gz FZXVGYUAJVNRLA-LJQANCHMSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1c(C)cccc1C ZINC001196021329 1049604632 /nfs/dbraw/zinc/60/46/32/1049604632.db2.gz FZXVGYUAJVNRLA-LJQANCHMSA-N 2 1 311.473 4.426 20 0 DIADMP [NH3+][C@H]1CCCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001205932324 1049606833 /nfs/dbraw/zinc/60/68/33/1049606833.db2.gz QNEYTRPWVGTHQT-HNNXBMFYSA-N 2 1 310.466 4.368 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001205995480 1049621124 /nfs/dbraw/zinc/62/11/24/1049621124.db2.gz OIYYGTGDKDTUIE-DZGCQCFKSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(Oc3ccccc3)c2)CCC[C@@H]1C[NH3+] ZINC001205995806 1049622078 /nfs/dbraw/zinc/62/20/78/1049622078.db2.gz QPGWHGSPAKDTDV-PKOBYXMFSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3cccs3)s2)CCC[C@H]1C[NH3+] ZINC001206002790 1049626619 /nfs/dbraw/zinc/62/66/19/1049626619.db2.gz BFSVGZSEWSTVQW-KGLIPLIRSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)cccc1-c1ccccc1 ZINC001206027272 1049632019 /nfs/dbraw/zinc/63/20/19/1049632019.db2.gz VNWMKZOHQMTBIH-XLIONFOSSA-N 2 1 322.496 4.469 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)cccc1-c1ccccc1 ZINC001206027271 1049632107 /nfs/dbraw/zinc/63/21/07/1049632107.db2.gz VNWMKZOHQMTBIH-PXNSSMCTSA-N 2 1 322.496 4.469 20 0 DIADMP CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001196264759 1049636011 /nfs/dbraw/zinc/63/60/11/1049636011.db2.gz YZJWFLKNRABWAI-PRJVBOEPSA-N 2 1 312.501 4.435 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)c1 ZINC000488433966 1049653370 /nfs/dbraw/zinc/65/33/70/1049653370.db2.gz RXDXZIGWWRJBFJ-ZWKOTPCHSA-N 2 1 320.546 4.148 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436088 1049654649 /nfs/dbraw/zinc/65/46/49/1049654649.db2.gz WWTNOJDSMSRGOA-FXAWDEMLSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436088 1049654659 /nfs/dbraw/zinc/65/46/59/1049654659.db2.gz WWTNOJDSMSRGOA-FXAWDEMLSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436089 1049654822 /nfs/dbraw/zinc/65/48/22/1049654822.db2.gz WWTNOJDSMSRGOA-PXNSSMCTSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC2(CC2)CC1 ZINC000488436089 1049654830 /nfs/dbraw/zinc/65/48/30/1049654830.db2.gz WWTNOJDSMSRGOA-PXNSSMCTSA-N 2 1 312.501 4.209 20 0 DIADMP CCCC[N@@H+](CCc1ccncc1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196544224 1049671086 /nfs/dbraw/zinc/67/10/86/1049671086.db2.gz CAKSGBVNUURITK-UHFFFAOYSA-N 2 1 317.521 4.035 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)CC1 ZINC001206205306 1049682106 /nfs/dbraw/zinc/68/21/06/1049682106.db2.gz PQAUPYXBJQSGFX-HXUWFJFHSA-N 2 1 312.501 4.336 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]C2CCC(C)(c3ccccc3)CC2)C1 ZINC001206215538 1049684071 /nfs/dbraw/zinc/68/40/71/1049684071.db2.gz PHHRZLOMWRARHQ-KMFTYDHNSA-N 2 1 314.517 4.208 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001206263264 1049693359 /nfs/dbraw/zinc/69/33/59/1049693359.db2.gz JUJCRTFCNIWDGF-QFBILLFUSA-N 2 1 320.908 4.440 20 0 DIADMP C[C@H]1C[NH2+]CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001206278169 1049698833 /nfs/dbraw/zinc/69/88/33/1049698833.db2.gz ZMZISSXDRXPZLH-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@H]1C[NH2+]CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001206278169 1049698836 /nfs/dbraw/zinc/69/88/36/1049698836.db2.gz ZMZISSXDRXPZLH-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC1 ZINC001206311029 1049708264 /nfs/dbraw/zinc/70/82/64/1049708264.db2.gz GOTDDVWNNSDFBR-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP CC(C)Oc1ccc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)cc1Cl ZINC001206318237 1049709360 /nfs/dbraw/zinc/70/93/60/1049709360.db2.gz OGECWVKBYDKVOX-GOSISDBHSA-N 2 1 324.896 4.078 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)c(Cl)c1Cl ZINC001206318554 1049709477 /nfs/dbraw/zinc/70/94/77/1049709477.db2.gz REGYPDQQNQXZNX-INIZCTEOSA-N 2 1 315.288 4.253 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC001206318468 1049710717 /nfs/dbraw/zinc/71/07/17/1049710717.db2.gz PZRIDPSVSYRDDD-NRFANRHFSA-N 2 1 308.469 4.305 20 0 DIADMP Cc1cc(Cl)c(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)c(Cl)c1 ZINC001206324438 1049712146 /nfs/dbraw/zinc/71/21/46/1049712146.db2.gz BHXCVMQJZHEALX-MRXNPFEDSA-N 2 1 315.288 4.253 20 0 DIADMP Cc1cnc(-c2ccccc2)c(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)c1 ZINC001206326452 1049713459 /nfs/dbraw/zinc/71/34/59/1049713459.db2.gz NRELZQSIXYFDAD-NRFANRHFSA-N 2 1 323.484 4.008 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206326259 1049713625 /nfs/dbraw/zinc/71/36/25/1049713625.db2.gz MBZKSEDDUJDKLS-INIZCTEOSA-N 2 1 315.288 4.253 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206326260 1049713667 /nfs/dbraw/zinc/71/36/67/1049713667.db2.gz MBZKSEDDUJDKLS-MRXNPFEDSA-N 2 1 315.288 4.253 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)cc(C)c1OC(C)C ZINC001206326205 1049714130 /nfs/dbraw/zinc/71/41/30/1049714130.db2.gz LHEXIHWFWRAAPV-FQEVSTJZSA-N 2 1 318.505 4.042 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC001206360773 1049721550 /nfs/dbraw/zinc/72/15/50/1049721550.db2.gz BHAGOMYGABPCJX-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC001206360773 1049721558 /nfs/dbraw/zinc/72/15/58/1049721558.db2.gz BHAGOMYGABPCJX-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[N@H+]1CC[C@@H]1CCC[NH+]1C ZINC001197246448 1049732287 /nfs/dbraw/zinc/73/22/87/1049732287.db2.gz RDXOTRXBWIEPOU-NZSAHSFTSA-N 2 1 300.490 4.127 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[NH+]1CC[C@@H]1CCC[N@@H+]1C ZINC001197246448 1049732292 /nfs/dbraw/zinc/73/22/92/1049732292.db2.gz RDXOTRXBWIEPOU-NZSAHSFTSA-N 2 1 300.490 4.127 20 0 DIADMP CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@@H](C)c1ccccc1 ZINC000489320679 1049743453 /nfs/dbraw/zinc/74/34/53/1049743453.db2.gz BHSSFGVRWBKCMG-SFHVURJKSA-N 2 1 323.484 4.381 20 0 DIADMP CC(C)Oc1ccc(Cl)cc1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206550038 1049752885 /nfs/dbraw/zinc/75/28/85/1049752885.db2.gz UAQIIKZYPTYGAT-SFHVURJKSA-N 2 1 324.896 4.078 20 0 DIADMP CC(C)Oc1ccc(Cl)cc1C[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206550038 1049752890 /nfs/dbraw/zinc/75/28/90/1049752890.db2.gz UAQIIKZYPTYGAT-SFHVURJKSA-N 2 1 324.896 4.078 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC001206540517 1049753851 /nfs/dbraw/zinc/75/38/51/1049753851.db2.gz BVVFJHJORCQDSU-QFIPXVFZSA-N 2 1 322.496 4.269 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCCC[C@@](C)(C[NH3+])C2)cc1 ZINC001206540551 1049754132 /nfs/dbraw/zinc/75/41/32/1049754132.db2.gz CEXFLMJXBHLUIX-FQEVSTJZSA-N 2 1 318.505 4.207 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)C1 ZINC001206556088 1049755320 /nfs/dbraw/zinc/75/53/20/1049755320.db2.gz NSGJAPCZRXPVCD-JOCHJYFZSA-N 2 1 320.480 4.209 20 0 DIADMP CC(C)Oc1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)cc1Cl ZINC001206563526 1049757118 /nfs/dbraw/zinc/75/71/18/1049757118.db2.gz FSXLJTORQVQNFK-GOSISDBHSA-N 2 1 324.896 4.078 20 0 DIADMP CC(C)Oc1ccc(C[N@H+]2CCCC[C@](C)(C[NH3+])C2)cc1Cl ZINC001206563526 1049757124 /nfs/dbraw/zinc/75/71/24/1049757124.db2.gz FSXLJTORQVQNFK-GOSISDBHSA-N 2 1 324.896 4.078 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(C(C)(C)C)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206580078 1049760899 /nfs/dbraw/zinc/76/08/99/1049760899.db2.gz CANZNGNUVKVHRK-LJQANCHMSA-N 2 1 302.506 4.337 20 0 DIADMP CC(C)[N@@H+](Cc1cc2cc(Cl)ccc2[nH]1)[C@H]1CCC[NH2+]CC1 ZINC001206579946 1049761093 /nfs/dbraw/zinc/76/10/93/1049761093.db2.gz BMCLHLBLYBCTMW-KRWDZBQOSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2[nH]cc(Cl)c21)[C@H]1CCC[NH2+]CC1 ZINC001206581069 1049762521 /nfs/dbraw/zinc/76/25/21/1049762521.db2.gz HXEZFAHJMCRZHP-HNNXBMFYSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206583834 1049762578 /nfs/dbraw/zinc/76/25/78/1049762578.db2.gz XDEXIJSLKDLSRX-INIZCTEOSA-N 2 1 314.395 4.058 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)CCCO2 ZINC000489518105 1049762821 /nfs/dbraw/zinc/76/28/21/1049762821.db2.gz RLZQBRXDJVQCOA-VDZJLULYSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)CCCO2 ZINC000489518105 1049762827 /nfs/dbraw/zinc/76/28/27/1049762827.db2.gz RLZQBRXDJVQCOA-VDZJLULYSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)CCCO2 ZINC000489518105 1049762832 /nfs/dbraw/zinc/76/28/32/1049762832.db2.gz RLZQBRXDJVQCOA-VDZJLULYSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)[N@H+](Cc1cccc(Cl)c1Cl)[C@H]1CCC[NH2+]CC1 ZINC001206583823 1049762848 /nfs/dbraw/zinc/76/28/48/1049762848.db2.gz WXAOMIVVDDHSFP-AWEZNQCLSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(Cl)c1Cl)[C@H]1CCC[NH2+]CC1 ZINC001206583823 1049762859 /nfs/dbraw/zinc/76/28/59/1049762859.db2.gz WXAOMIVVDDHSFP-AWEZNQCLSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@H+](Cc1cc(Cl)ccc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206583840 1049762872 /nfs/dbraw/zinc/76/28/72/1049762872.db2.gz XFKHMNBRVAKWFF-OAHLLOKOSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1cc(Cl)ccc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206583840 1049762876 /nfs/dbraw/zinc/76/28/76/1049762876.db2.gz XFKHMNBRVAKWFF-OAHLLOKOSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2[nH]cc(Cl)c21)[C@@H]1CCC[NH2+]CC1 ZINC001206581071 1049762916 /nfs/dbraw/zinc/76/29/16/1049762916.db2.gz HXEZFAHJMCRZHP-OAHLLOKOSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)CCCO2 ZINC000489518103 1049763030 /nfs/dbraw/zinc/76/30/30/1049763030.db2.gz RLZQBRXDJVQCOA-KVSKMBFKSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)CCCO2 ZINC000489518103 1049763036 /nfs/dbraw/zinc/76/30/36/1049763036.db2.gz RLZQBRXDJVQCOA-KVSKMBFKSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)CCCO2 ZINC000489518103 1049763038 /nfs/dbraw/zinc/76/30/38/1049763038.db2.gz RLZQBRXDJVQCOA-KVSKMBFKSA-N 2 1 316.489 4.096 20 0 DIADMP CCOc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1CC ZINC001206589970 1049763736 /nfs/dbraw/zinc/76/37/36/1049763736.db2.gz JQLRYMZLFQJISQ-IBGZPJMESA-N 2 1 318.505 4.000 20 0 DIADMP CCOc1ccc(Cl)cc1C[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206591323 1049763948 /nfs/dbraw/zinc/76/39/48/1049763948.db2.gz RKAKYJOEZFYVLN-KRWDZBQOSA-N 2 1 324.896 4.091 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2ccccc2)nc1)[C@@H]1CCC[NH2+]CC1 ZINC001206590413 1049764692 /nfs/dbraw/zinc/76/46/92/1049764692.db2.gz LKMYQIQEGSUGHV-HXUWFJFHSA-N 2 1 323.484 4.101 20 0 DIADMP Cc1cc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c(F)cc1Cl ZINC001206598707 1049765837 /nfs/dbraw/zinc/76/58/37/1049765837.db2.gz LIJXTHNZBWXANA-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1cc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c(F)cc1Cl ZINC001206598707 1049765844 /nfs/dbraw/zinc/76/58/44/1049765844.db2.gz LIJXTHNZBWXANA-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(OC(C)(C)C)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206597969 1049766110 /nfs/dbraw/zinc/76/61/10/1049766110.db2.gz GYDGFDTZAMPZTR-SFHVURJKSA-N 2 1 318.505 4.216 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(C2CCC2)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206599944 1049767514 /nfs/dbraw/zinc/76/75/14/1049767514.db2.gz ZMMQFSRLUUHXAD-FQEVSTJZSA-N 2 1 300.490 4.307 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCCC[C@H](C[NH3+])C2)cc1 ZINC001206606116 1049768064 /nfs/dbraw/zinc/76/80/64/1049768064.db2.gz DSEWDWJHVJEPAV-IEBWSBKVSA-N 2 1 302.506 4.049 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1Cl ZINC001206606097 1049768486 /nfs/dbraw/zinc/76/84/86/1049768486.db2.gz DBNJCYGTKPTMSM-INIZCTEOSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1cc(F)cc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1Cl ZINC001206606097 1049768492 /nfs/dbraw/zinc/76/84/92/1049768492.db2.gz DBNJCYGTKPTMSM-INIZCTEOSA-N 2 1 312.860 4.140 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCCC[C@@H](C[NH3+])C2)cc1 ZINC001206606117 1049768510 /nfs/dbraw/zinc/76/85/10/1049768510.db2.gz DSEWDWJHVJEPAV-MJGOQNOKSA-N 2 1 302.506 4.049 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)C1 ZINC001206606538 1049768900 /nfs/dbraw/zinc/76/89/00/1049768900.db2.gz OMLSUZPSCKTSMA-SFHVURJKSA-N 2 1 310.441 4.040 20 0 DIADMP Cc1ccc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c(C)c1Cl ZINC001206606822 1049769096 /nfs/dbraw/zinc/76/90/96/1049769096.db2.gz UBHHIJCXVUIBRF-KRWDZBQOSA-N 2 1 308.897 4.309 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001206727475 1049785381 /nfs/dbraw/zinc/78/53/81/1049785381.db2.gz IMUJPJIXCUNDEC-NRSPTQNISA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)C1CC1 ZINC001206727475 1049785383 /nfs/dbraw/zinc/78/53/83/1049785383.db2.gz IMUJPJIXCUNDEC-NRSPTQNISA-N 2 1 312.501 4.379 20 0 DIADMP Cc1csc2sc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@@H]3C)c(C)c12 ZINC001206769080 1049795139 /nfs/dbraw/zinc/79/51/39/1049795139.db2.gz NHKGILVOTFWFGJ-WCQYABFASA-N 2 1 308.516 4.139 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)[N@H+](CC[C@H]3CCCC[NH+]3C)C2)cc1 ZINC000490105578 1049799422 /nfs/dbraw/zinc/79/94/22/1049799422.db2.gz XBPWEQSPNAXYPY-MISYRCLQSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)[NH+](CC[C@H]3CCCC[N@@H+]3C)C2)cc1 ZINC000490105578 1049799426 /nfs/dbraw/zinc/79/94/26/1049799426.db2.gz XBPWEQSPNAXYPY-MISYRCLQSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)[NH+](CC[C@H]3CCCC[N@H+]3C)C2)cc1 ZINC000490105578 1049799430 /nfs/dbraw/zinc/79/94/30/1049799430.db2.gz XBPWEQSPNAXYPY-MISYRCLQSA-N 2 1 300.490 4.047 20 0 DIADMP CC[C@H](C[N@H+]1CCCC[C@H]1[C@@H](C)C[NH+](C)C)c1ccccc1 ZINC001206800782 1049801756 /nfs/dbraw/zinc/80/17/56/1049801756.db2.gz MYKZHJDACAQCSD-NSHGMRRFSA-N 2 1 302.506 4.232 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001206807232 1049803172 /nfs/dbraw/zinc/80/31/72/1049803172.db2.gz HYIQBZUBWZMDSS-CHWSQXEVSA-N 2 1 306.500 4.036 20 0 DIADMP Fc1ccc(C2CCC([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000490150470 1049803456 /nfs/dbraw/zinc/80/34/56/1049803456.db2.gz MWCIEQKDETXHQK-HFPIOELMSA-N 2 1 316.464 4.068 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccccc1CCc1ccccc1 ZINC001206805680 1049803574 /nfs/dbraw/zinc/80/35/74/1049803574.db2.gz CGQOVGXQGSTJDB-UYAOXDASSA-N 2 1 322.496 4.031 20 0 DIADMP Cc1c(C[N@@H+]2C[C@@H](C[NH3+])CC[C@H]2C)cccc1-c1ccccc1 ZINC001206805288 1049803974 /nfs/dbraw/zinc/80/39/74/1049803974.db2.gz BQTVGRXESIJMGL-SJLPKXTDSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1C[C@@H](C[NH3+])CC[C@@H]1C ZINC001206808154 1049804339 /nfs/dbraw/zinc/80/43/39/1049804339.db2.gz JVUSKSYXGIKUBY-ZWKOTPCHSA-N 2 1 324.468 4.347 20 0 DIADMP Cc1occc1C[N@@H+](C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000490423108 1049827941 /nfs/dbraw/zinc/82/79/41/1049827941.db2.gz NDXWEGYDDKBITA-UZLBHIALSA-N 2 1 312.457 4.073 20 0 DIADMP Cc1occc1C[N@H+](C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000490423108 1049827958 /nfs/dbraw/zinc/82/79/58/1049827958.db2.gz NDXWEGYDDKBITA-UZLBHIALSA-N 2 1 312.457 4.073 20 0 DIADMP CCC[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@H](C)CC ZINC001207287289 1049875978 /nfs/dbraw/zinc/87/59/78/1049875978.db2.gz RUVOPYIUYFODTQ-GOSISDBHSA-N 2 1 302.506 4.409 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1CCc1cccc(Cl)c1 ZINC001207425832 1049891630 /nfs/dbraw/zinc/89/16/30/1049891630.db2.gz NHSLUNHYSYNFJP-RBUKOAKNSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCc1cccc(Cl)c1 ZINC001207425832 1049891633 /nfs/dbraw/zinc/89/16/33/1049891633.db2.gz NHSLUNHYSYNFJP-RBUKOAKNSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCc1cccc(Cl)c1 ZINC001207425832 1049891636 /nfs/dbraw/zinc/89/16/36/1049891636.db2.gz NHSLUNHYSYNFJP-RBUKOAKNSA-N 2 1 320.908 4.221 20 0 DIADMP C[N@@H+](CCC1CC[NH+](C)CC1)Cc1ccc(Cl)cc1Cl ZINC001207479973 1049897721 /nfs/dbraw/zinc/89/77/21/1049897721.db2.gz QXEJVOUFEICKNX-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](CC(c2ccccc2)c2ccccc2)CC1 ZINC001207526812 1049904730 /nfs/dbraw/zinc/90/47/30/1049904730.db2.gz FMOVSUUJUMAKIJ-UHFFFAOYSA-N 2 1 322.496 4.235 20 0 DIADMP Cc1cccc(CC[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001207534728 1049905528 /nfs/dbraw/zinc/90/55/28/1049905528.db2.gz PEIVAMWCWKLXHV-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP Cc1cccc(CC[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001207534728 1049905533 /nfs/dbraw/zinc/90/55/33/1049905533.db2.gz PEIVAMWCWKLXHV-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1C[C@@H]2CC[C@H]([NH+](C)C)C[C@@H]2C1 ZINC001207783036 1049939072 /nfs/dbraw/zinc/93/90/72/1049939072.db2.gz AGDMHTBORVDEPF-MDNKFWRPSA-N 2 1 306.538 4.255 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001207837296 1049943579 /nfs/dbraw/zinc/94/35/79/1049943579.db2.gz OPYGOKAROIXEFA-HNNXBMFYSA-N 2 1 311.473 4.148 20 0 DIADMP Cc1cccc2c1cc[nH+]c2N1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000571911800 1049969575 /nfs/dbraw/zinc/96/95/75/1049969575.db2.gz GEZAUEPUXJHRER-UHFFFAOYSA-N 2 1 311.473 4.100 20 0 DIADMP Cc1cccc2c1cc[nH+]c2N1CCC(C[N@H+](C)C(C)C)CC1 ZINC000571911800 1049969592 /nfs/dbraw/zinc/96/95/92/1049969592.db2.gz GEZAUEPUXJHRER-UHFFFAOYSA-N 2 1 311.473 4.100 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)ccc1F ZINC000571901457 1049969851 /nfs/dbraw/zinc/96/98/51/1049969851.db2.gz FQKHPVKYQJGQKK-QUCCMNQESA-N 2 1 312.432 4.059 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)ccc1F ZINC000571901457 1049969859 /nfs/dbraw/zinc/96/98/59/1049969859.db2.gz FQKHPVKYQJGQKK-QUCCMNQESA-N 2 1 312.432 4.059 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000588177729 1049972432 /nfs/dbraw/zinc/97/24/32/1049972432.db2.gz APGIKBFAGHUQOG-WHPBDHBRSA-N 2 1 300.490 4.334 20 0 DIADMP C[N@@H+](CC1(C)CC[NH+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC001208105020 1049974139 /nfs/dbraw/zinc/97/41/39/1049974139.db2.gz QSHZZZGGMOVUEE-UHFFFAOYSA-N 2 1 322.496 4.440 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)CC1(C)CC[NH+](C)CC1 ZINC001208114652 1049974603 /nfs/dbraw/zinc/97/46/03/1049974603.db2.gz ACYFMBDXPAUQNN-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC/C=C\CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208135340 1049976228 /nfs/dbraw/zinc/97/62/28/1049976228.db2.gz DAAHWACILXETNZ-FBQMEGEOSA-N 2 1 300.490 4.187 20 0 DIADMP CC/C=C\CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208135340 1049976232 /nfs/dbraw/zinc/97/62/32/1049976232.db2.gz DAAHWACILXETNZ-FBQMEGEOSA-N 2 1 300.490 4.187 20 0 DIADMP CC/C=C\CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208135340 1049976235 /nfs/dbraw/zinc/97/62/35/1049976235.db2.gz DAAHWACILXETNZ-FBQMEGEOSA-N 2 1 300.490 4.187 20 0 DIADMP CC/C=C\CCC[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001208133359 1049976314 /nfs/dbraw/zinc/97/63/14/1049976314.db2.gz RMGNIWQYLWQUQY-ARJAWSKDSA-N 2 1 316.489 4.314 20 0 DIADMP Cc1ccc([C@H](C)CC[NH+]2CCC([NH+]3CCCCC3)CC2)o1 ZINC001208152743 1049977520 /nfs/dbraw/zinc/97/75/20/1049977520.db2.gz VSRRWSFELSYTJC-MRXNPFEDSA-N 2 1 304.478 4.032 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+](C)CC2CC[NH+](C(C)C)CC2)o1 ZINC001208152961 1049978132 /nfs/dbraw/zinc/97/81/32/1049978132.db2.gz BSLXXWROBFOKHY-INIZCTEOSA-N 2 1 306.494 4.134 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)cc1 ZINC000571947764 1049978889 /nfs/dbraw/zinc/97/88/89/1049978889.db2.gz PRXCXBAQTBSWKY-UHFFFAOYSA-N 2 1 322.452 4.195 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)o1 ZINC001208155757 1049979028 /nfs/dbraw/zinc/97/90/28/1049979028.db2.gz OKMYHZPEKBZLMO-PKOBYXMFSA-N 2 1 318.505 4.422 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)CC1 ZINC001208166236 1049980087 /nfs/dbraw/zinc/98/00/87/1049980087.db2.gz AHPSLGHIXKZGDG-QUCCMNQESA-N 2 1 316.533 4.319 20 0 DIADMP Cc1ccc([C@H](C)CC[NH+]2CCC(C)([NH+]3CCCC3)CC2)o1 ZINC001208159715 1049980186 /nfs/dbraw/zinc/98/01/86/1049980186.db2.gz CQVZEQYXKHVJAM-MRXNPFEDSA-N 2 1 304.478 4.032 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@@H+](C)CCC[NH+]1CCCC1 ZINC001208207193 1049985580 /nfs/dbraw/zinc/98/55/80/1049985580.db2.gz WCICXFKWDOTPEG-GOSISDBHSA-N 2 1 312.542 4.026 20 0 DIADMP C[N@@H+](C[C@@H]1CCC[NH+](C)C1)C(c1ccccc1)c1ccccc1 ZINC001208603845 1049997412 /nfs/dbraw/zinc/99/74/12/1049997412.db2.gz GYNFQEZASSATRH-GOSISDBHSA-N 2 1 308.469 4.050 20 0 DIADMP C[NH+](C[C@@H]1CCC[N@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC001208603845 1049997421 /nfs/dbraw/zinc/99/74/21/1049997421.db2.gz GYNFQEZASSATRH-GOSISDBHSA-N 2 1 308.469 4.050 20 0 DIADMP C[NH+](C[C@@H]1CCC[N@@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC001208603845 1049997425 /nfs/dbraw/zinc/99/74/25/1049997425.db2.gz GYNFQEZASSATRH-GOSISDBHSA-N 2 1 308.469 4.050 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206348 1049998379 /nfs/dbraw/zinc/99/83/79/1049998379.db2.gz PUOYKCZOLCUVSX-QUWFBVPJSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206348 1049998385 /nfs/dbraw/zinc/99/83/85/1049998385.db2.gz PUOYKCZOLCUVSX-QUWFBVPJSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206348 1049998389 /nfs/dbraw/zinc/99/83/89/1049998389.db2.gz PUOYKCZOLCUVSX-QUWFBVPJSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206348 1049998394 /nfs/dbraw/zinc/99/83/94/1049998394.db2.gz PUOYKCZOLCUVSX-QUWFBVPJSA-N 2 1 314.517 4.232 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)CCC(C)(C)c2ccccc2)CC1 ZINC001208668645 1050000586 /nfs/dbraw/zinc/00/05/86/1050000586.db2.gz YYCRFSHIGFYGIQ-UHFFFAOYSA-N 2 1 316.533 4.407 20 0 DIADMP C[C@@H](C[NH+]1CCC([NH+]2CCC2)CC1)c1cccc2ccccc21 ZINC001208710406 1050006061 /nfs/dbraw/zinc/00/60/61/1050006061.db2.gz HNRVPRUCYRUWEP-KRWDZBQOSA-N 2 1 308.469 4.113 20 0 DIADMP CC(C)CCC[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001208735138 1050006981 /nfs/dbraw/zinc/00/69/81/1050006981.db2.gz URXWETLUQYBPMY-IBGZPJMESA-N 2 1 318.505 4.392 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC4(CCC4)CC3)C2)cc1 ZINC001208931296 1050023953 /nfs/dbraw/zinc/02/39/53/1050023953.db2.gz IXDIIJPPOYIYRO-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP C[C@@]1(F)CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208932848 1050024534 /nfs/dbraw/zinc/02/45/34/1050024534.db2.gz RAQHIDZAIVVKMD-VQTJNVASSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208932848 1050024539 /nfs/dbraw/zinc/02/45/39/1050024539.db2.gz RAQHIDZAIVVKMD-VQTJNVASSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208932848 1050024544 /nfs/dbraw/zinc/02/45/44/1050024544.db2.gz RAQHIDZAIVVKMD-VQTJNVASSA-N 2 1 318.480 4.113 20 0 DIADMP CCC[N@H+](CC1CC1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929147 1050024685 /nfs/dbraw/zinc/02/46/85/1050024685.db2.gz OKUDUOHYJGBENS-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[N@@H+](CC1CC1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929147 1050024687 /nfs/dbraw/zinc/02/46/87/1050024687.db2.gz OKUDUOHYJGBENS-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[NH+](CC1CC1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929147 1050024689 /nfs/dbraw/zinc/02/46/89/1050024689.db2.gz OKUDUOHYJGBENS-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[NH+](CC1CC1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929147 1050024690 /nfs/dbraw/zinc/02/46/90/1050024690.db2.gz OKUDUOHYJGBENS-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[N@@H+](Cc1cccs1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208932068 1050024710 /nfs/dbraw/zinc/02/47/10/1050024710.db2.gz FARGZJHHEUNLNJ-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP C[N@H+](Cc1cccs1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208932068 1050024713 /nfs/dbraw/zinc/02/47/13/1050024713.db2.gz FARGZJHHEUNLNJ-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1cccs1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208932068 1050024716 /nfs/dbraw/zinc/02/47/16/1050024716.db2.gz FARGZJHHEUNLNJ-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1cccs1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208932068 1050024719 /nfs/dbraw/zinc/02/47/19/1050024719.db2.gz FARGZJHHEUNLNJ-GOSISDBHSA-N 2 1 314.498 4.092 20 0 DIADMP C[C@H]1CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208931266 1050024762 /nfs/dbraw/zinc/02/47/62/1050024762.db2.gz IRZPBSFBPNENOD-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208931266 1050024767 /nfs/dbraw/zinc/02/47/67/1050024767.db2.gz IRZPBSFBPNENOD-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208931266 1050024774 /nfs/dbraw/zinc/02/47/74/1050024774.db2.gz IRZPBSFBPNENOD-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP FC1(F)CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208932890 1050024890 /nfs/dbraw/zinc/02/48/90/1050024890.db2.gz RYHWZEGYRADPEL-GOSISDBHSA-N 2 1 322.443 4.020 20 0 DIADMP FC1(F)CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208932890 1050024892 /nfs/dbraw/zinc/02/48/92/1050024892.db2.gz RYHWZEGYRADPEL-GOSISDBHSA-N 2 1 322.443 4.020 20 0 DIADMP FC1(F)CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208932890 1050024898 /nfs/dbraw/zinc/02/48/98/1050024898.db2.gz RYHWZEGYRADPEL-GOSISDBHSA-N 2 1 322.443 4.020 20 0 DIADMP C[C@@H]1CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208931268 1050025611 /nfs/dbraw/zinc/02/56/11/1050025611.db2.gz IRZPBSFBPNENOD-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208931268 1050025617 /nfs/dbraw/zinc/02/56/17/1050025617.db2.gz IRZPBSFBPNENOD-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208931268 1050025620 /nfs/dbraw/zinc/02/56/20/1050025620.db2.gz IRZPBSFBPNENOD-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1CCCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935116 1050025761 /nfs/dbraw/zinc/02/57/61/1050025761.db2.gz IHOBOLGXQQBLNS-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935116 1050025769 /nfs/dbraw/zinc/02/57/69/1050025769.db2.gz IHOBOLGXQQBLNS-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208935116 1050025776 /nfs/dbraw/zinc/02/57/76/1050025776.db2.gz IHOBOLGXQQBLNS-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208935116 1050025780 /nfs/dbraw/zinc/02/57/80/1050025780.db2.gz IHOBOLGXQQBLNS-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC4(CCC4)CC3)C2)cc1 ZINC001208931295 1050025889 /nfs/dbraw/zinc/02/58/89/1050025889.db2.gz IXDIIJPPOYIYRO-FQEVSTJZSA-N 2 1 312.501 4.165 20 0 DIADMP C[C@@]1(F)CCCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931770 1050026191 /nfs/dbraw/zinc/02/61/91/1050026191.db2.gz MIIAQHZZUPACCN-VQTJNVASSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931770 1050026195 /nfs/dbraw/zinc/02/61/95/1050026195.db2.gz MIIAQHZZUPACCN-VQTJNVASSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931770 1050026201 /nfs/dbraw/zinc/02/62/01/1050026201.db2.gz MIIAQHZZUPACCN-VQTJNVASSA-N 2 1 318.480 4.113 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947044 1050026646 /nfs/dbraw/zinc/02/66/46/1050026646.db2.gz YBWBMEBSVJGWFI-PMACEKPBSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208947044 1050026650 /nfs/dbraw/zinc/02/66/50/1050026650.db2.gz YBWBMEBSVJGWFI-PMACEKPBSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208947044 1050026652 /nfs/dbraw/zinc/02/66/52/1050026652.db2.gz YBWBMEBSVJGWFI-PMACEKPBSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208947044 1050026657 /nfs/dbraw/zinc/02/66/57/1050026657.db2.gz YBWBMEBSVJGWFI-PMACEKPBSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940079 1050027827 /nfs/dbraw/zinc/02/78/27/1050027827.db2.gz ONZVBBMPDIRCGQ-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940079 1050027832 /nfs/dbraw/zinc/02/78/32/1050027832.db2.gz ONZVBBMPDIRCGQ-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208940079 1050027836 /nfs/dbraw/zinc/02/78/36/1050027836.db2.gz ONZVBBMPDIRCGQ-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208940079 1050027840 /nfs/dbraw/zinc/02/78/40/1050027840.db2.gz ONZVBBMPDIRCGQ-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP Cc1ccccc1C[N@@H+](C)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208937842 1050028044 /nfs/dbraw/zinc/02/80/44/1050028044.db2.gz VKYHPQRFMVUXGN-NRFANRHFSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccccc1C[NH+](C)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208937842 1050028050 /nfs/dbraw/zinc/02/80/50/1050028050.db2.gz VKYHPQRFMVUXGN-NRFANRHFSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccccc1C[NH+](C)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208937842 1050028057 /nfs/dbraw/zinc/02/80/57/1050028057.db2.gz VKYHPQRFMVUXGN-NRFANRHFSA-N 2 1 322.496 4.339 20 0 DIADMP C[C@@H]1CCC[N@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@H]1C ZINC001208935152 1050028439 /nfs/dbraw/zinc/02/84/39/1050028439.db2.gz INGFUMKCZXDROI-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)[C@H]1C ZINC001208935152 1050028445 /nfs/dbraw/zinc/02/84/45/1050028445.db2.gz INGFUMKCZXDROI-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)[C@H]1C ZINC001208935152 1050028452 /nfs/dbraw/zinc/02/84/52/1050028452.db2.gz INGFUMKCZXDROI-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@H]1C ZINC001208935152 1050028457 /nfs/dbraw/zinc/02/84/57/1050028457.db2.gz INGFUMKCZXDROI-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1C[C@@H]1C[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001209433883 1050058381 /nfs/dbraw/zinc/05/83/81/1050058381.db2.gz WGJZEEQLHWGJHI-UYAOXDASSA-N 2 1 312.501 4.021 20 0 DIADMP c1cc2ccc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)cc2[nH]1 ZINC001209512677 1050065396 /nfs/dbraw/zinc/06/53/96/1050065396.db2.gz NRQWBVAISFZQPF-LJQANCHMSA-N 2 1 311.473 4.008 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(Cl)c1 ZINC000589999400 1050069349 /nfs/dbraw/zinc/06/93/49/1050069349.db2.gz FYVSUZLMAXSIJW-UHFFFAOYSA-N 2 1 316.876 4.424 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2[nH]cc(Cl)c21)C1CCN(C)CC1 ZINC001209660996 1050074704 /nfs/dbraw/zinc/07/47/04/1050074704.db2.gz MXUTZSMAAIZXRO-UHFFFAOYSA-N 2 1 319.880 4.126 20 0 DIADMP Nc1cc[nH+]cc1C[NH+]1CCC(c2csc3ccccc32)CC1 ZINC001209733456 1050080665 /nfs/dbraw/zinc/08/06/65/1050080665.db2.gz MXZMEIXZNMCOHO-UHFFFAOYSA-N 2 1 323.465 4.088 20 0 DIADMP CC[NH+](CC)Cc1ccc(Nc2c(C)[nH+]c3ccccn32)cc1 ZINC001209821779 1050089087 /nfs/dbraw/zinc/08/90/87/1050089087.db2.gz AQMYQONXNUMKDV-UHFFFAOYSA-N 2 1 308.429 4.228 20 0 DIADMP c1[nH]c2ccc(Nc3ccc(C[NH+]4CCCCC4)cc3)cc2[nH+]1 ZINC001209849049 1050094582 /nfs/dbraw/zinc/09/45/82/1050094582.db2.gz UCNIAEOSCJINKN-UHFFFAOYSA-N 2 1 306.413 4.292 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2ccc(F)cc2Cl)CC1 ZINC000590786584 1050107864 /nfs/dbraw/zinc/10/78/64/1050107864.db2.gz HZPKYOBFCUWKCZ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000760803703 1050117183 /nfs/dbraw/zinc/11/71/83/1050117183.db2.gz IGANBJFVMSZGAT-GOSISDBHSA-N 2 1 323.484 4.131 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000760803703 1050117185 /nfs/dbraw/zinc/11/71/85/1050117185.db2.gz IGANBJFVMSZGAT-GOSISDBHSA-N 2 1 323.484 4.131 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000760803703 1050117187 /nfs/dbraw/zinc/11/71/87/1050117187.db2.gz IGANBJFVMSZGAT-GOSISDBHSA-N 2 1 323.484 4.131 20 0 DIADMP C[NH+](C)[C@@H]1CCOc2c(Nc3ccc4c[nH+]ccc4c3)cccc21 ZINC001210051638 1050130065 /nfs/dbraw/zinc/13/00/65/1050130065.db2.gz KJYKIIWXGLPJRW-LJQANCHMSA-N 2 1 319.408 4.364 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCCC23CCCCC3)cn1 ZINC000823677504 1050150249 /nfs/dbraw/zinc/15/02/49/1050150249.db2.gz VLQFDNAXUNZCCU-GOSISDBHSA-N 2 1 324.472 4.168 20 0 DIADMP CCC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)C1CCCC1 ZINC000823677277 1050150609 /nfs/dbraw/zinc/15/06/09/1050150609.db2.gz RDKKZGBTLWPBMF-SFHVURJKSA-N 2 1 312.461 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646118275 1050150573 /nfs/dbraw/zinc/15/05/73/1050150573.db2.gz HLELRXBAFHRTTM-FQEVSTJZSA-N 2 1 321.468 4.365 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646118275 1050150576 /nfs/dbraw/zinc/15/05/76/1050150576.db2.gz HLELRXBAFHRTTM-FQEVSTJZSA-N 2 1 321.468 4.365 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(Cl)cccc2C1 ZINC001171031034 1050154510 /nfs/dbraw/zinc/15/45/10/1050154510.db2.gz RKSNXFSRXDIOBA-BRWVUGGUSA-N 2 1 320.908 4.178 20 0 DIADMP CSC1(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)CC1 ZINC000347946640 1050162954 /nfs/dbraw/zinc/16/29/54/1050162954.db2.gz SBWOVKVCJPKFTL-MRXNPFEDSA-N 2 1 318.530 4.046 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000378880838 1050192719 /nfs/dbraw/zinc/19/27/19/1050192719.db2.gz GJFDKRWFRMLAGO-ZDUSSCGKSA-N 2 1 314.395 4.229 20 0 DIADMP Cc1ccc2c(C[N@H+](C)CC3CC[NH+](C(C)C)CC3)c[nH]c2c1 ZINC001136972819 1050265841 /nfs/dbraw/zinc/26/58/41/1050265841.db2.gz AMTNYQJWXQHZNX-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1cc2ccccc2o1)C(C)(C)C ZINC000498406870 1050267091 /nfs/dbraw/zinc/26/70/91/1050267091.db2.gz DHZLSJFTDBBKFP-GOSISDBHSA-N 2 1 311.429 4.315 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2cc(Cl)ccc2C1 ZINC001171096624 1050339125 /nfs/dbraw/zinc/33/91/25/1050339125.db2.gz UPUICNGJKDXDMN-KXBFYZLASA-N 2 1 320.908 4.051 20 0 DIADMP [NH3+]CCCCCCC[N@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000844220663 1050372333 /nfs/dbraw/zinc/37/23/33/1050372333.db2.gz JCKAETIKKIXXRN-MRXNPFEDSA-N 2 1 317.502 4.342 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000574204191 1050376029 /nfs/dbraw/zinc/37/60/29/1050376029.db2.gz UBGOKCKHXHXZGU-GUDVDZBRSA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000574204191 1050376040 /nfs/dbraw/zinc/37/60/40/1050376040.db2.gz UBGOKCKHXHXZGU-GUDVDZBRSA-N 2 1 317.521 4.126 20 0 DIADMP C[C@H](c1ccccc1)[N@H+](CCCc1c[nH+]cn1C)CC1CCC1 ZINC000574410315 1050456109 /nfs/dbraw/zinc/45/61/09/1050456109.db2.gz GKNCFWWBIOFLJS-QGZVFWFLSA-N 2 1 311.473 4.216 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+](CCCc1c[nH+]cn1C)CC1CCC1 ZINC000574410315 1050456114 /nfs/dbraw/zinc/45/61/14/1050456114.db2.gz GKNCFWWBIOFLJS-QGZVFWFLSA-N 2 1 311.473 4.216 20 0 DIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574690817 1050507542 /nfs/dbraw/zinc/50/75/42/1050507542.db2.gz KXNOKRPYHPPGBI-GUDVDZBRSA-N 2 1 316.464 4.054 20 0 DIADMP F[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000574690817 1050507552 /nfs/dbraw/zinc/50/75/52/1050507552.db2.gz KXNOKRPYHPPGBI-GUDVDZBRSA-N 2 1 316.464 4.054 20 0 DIADMP CCc1cccc(C[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)c1 ZINC001144326532 1050545034 /nfs/dbraw/zinc/54/50/34/1050545034.db2.gz DPTCQEVTNXYAAW-UHFFFAOYSA-N 2 1 305.425 4.067 20 0 DIADMP Cc1ccc([C@@H]([NH2+]CCc2c[nH+]cn2C)C2CCCCC2)cc1 ZINC000575041433 1050625783 /nfs/dbraw/zinc/62/57/83/1050625783.db2.gz LTOCDSHZAXPIBQ-FQEVSTJZSA-N 2 1 311.473 4.182 20 0 DIADMP CC(C)CCC[C@@H](C)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001170083734 1050662031 /nfs/dbraw/zinc/66/20/31/1050662031.db2.gz YWQZZWUYADNZAU-MSOLQXFVSA-N 2 1 324.553 4.213 20 0 DIADMP CC(C)CCC[C@H](C)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001170083737 1050662791 /nfs/dbraw/zinc/66/27/91/1050662791.db2.gz YWQZZWUYADNZAU-ZWKOTPCHSA-N 2 1 324.553 4.213 20 0 DIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000742375917 1050838143 /nfs/dbraw/zinc/83/81/43/1050838143.db2.gz XZVOPJMUPITOGX-MJGOQNOKSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@H]1CC[C@@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170117315 1050875814 /nfs/dbraw/zinc/87/58/14/1050875814.db2.gz JXAQKQVZSXRWDJ-UDTPNQRGSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170119498 1050882094 /nfs/dbraw/zinc/88/20/94/1050882094.db2.gz XLVPMVQRFMPFOR-DKIMLUQUSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170119500 1050882384 /nfs/dbraw/zinc/88/23/84/1050882384.db2.gz XLVPMVQRFMPFOR-VDHUWJSZSA-N 2 1 304.453 4.086 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1cccc(C)c1C ZINC000348190201 1051003239 /nfs/dbraw/zinc/00/32/39/1051003239.db2.gz QYURZIHBOICPSP-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1cccc(C)c1C ZINC000348190201 1051003245 /nfs/dbraw/zinc/00/32/45/1051003245.db2.gz QYURZIHBOICPSP-HXUWFJFHSA-N 2 1 311.473 4.426 20 0 DIADMP C[C@H]1CC[C@@H]([N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001170151285 1051038609 /nfs/dbraw/zinc/03/86/09/1051038609.db2.gz QLOUWWXWBLNKMA-FXAWDEMLSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170196597 1051153642 /nfs/dbraw/zinc/15/36/42/1051153642.db2.gz SFIARYFSEVVOKI-MUGJNUQGSA-N 2 1 322.537 4.096 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170196598 1051154292 /nfs/dbraw/zinc/15/42/92/1051154292.db2.gz SFIARYFSEVVOKI-UAFMIMERSA-N 2 1 322.537 4.096 20 0 DIADMP Cc1cccc2c1CC[C@@H]([N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171559056 1051166721 /nfs/dbraw/zinc/16/67/21/1051166721.db2.gz UQVPSTHSDJJPKZ-VAMGGRTRSA-N 2 1 314.517 4.080 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC001170250184 1051171717 /nfs/dbraw/zinc/17/17/17/1051171717.db2.gz HDONSUKWHNXTLB-CVEARBPZSA-N 2 1 308.897 4.125 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171631035 1051175615 /nfs/dbraw/zinc/17/56/15/1051175615.db2.gz UXBSQJJDYUGFCP-HNNXBMFYSA-N 2 1 318.505 4.387 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(Cl)c(F)c2)CC1(C)C ZINC001171614019 1051177193 /nfs/dbraw/zinc/17/71/93/1051177193.db2.gz TXLSBRTXJJQHNP-UHFFFAOYSA-N 2 1 312.860 4.220 20 0 DIADMP Cc1cccnc1[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)C1CC1 ZINC001171623438 1051179033 /nfs/dbraw/zinc/17/90/33/1051179033.db2.gz YRPRWIPADGJZAQ-SFHVURJKSA-N 2 1 315.505 4.082 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c(F)c1 ZINC001171623161 1051180084 /nfs/dbraw/zinc/18/00/84/1051180084.db2.gz MNGYEIZONFJYRJ-ZDUSSCGKSA-N 2 1 322.468 4.136 20 0 DIADMP COc1ccccc1C(C)(C)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171627557 1051181920 /nfs/dbraw/zinc/18/19/20/1051181920.db2.gz WMJNLQGFSQYZRM-UHFFFAOYSA-N 2 1 318.505 4.171 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]C2(c3cccc(F)c3)CCC2)CC1(C)C ZINC001171627659 1051181943 /nfs/dbraw/zinc/18/19/43/1051181943.db2.gz ZQUDJMXNCICTTG-UHFFFAOYSA-N 2 1 318.480 4.446 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC[C@H]2c2ccccc2)CC1(C)C ZINC001171636028 1051193396 /nfs/dbraw/zinc/19/33/96/1051193396.db2.gz CYCUPTYBHRJQNI-SFHVURJKSA-N 2 1 300.490 4.475 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171639781 1051194412 /nfs/dbraw/zinc/19/44/12/1051194412.db2.gz SWNHPGPTMUBJMW-HNNXBMFYSA-N 2 1 318.505 4.339 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCCC[C@H]2c2cccnc2)CC1(C)C ZINC001171638442 1051195618 /nfs/dbraw/zinc/19/56/18/1051195618.db2.gz YCCMSDGSUMONRI-SFHVURJKSA-N 2 1 315.505 4.260 20 0 DIADMP C[C@H]1C[C@H](NC(=[NH2+])C2CCCCCC2)C[N@@H+]1Cc1ccccc1 ZINC001171730870 1051202270 /nfs/dbraw/zinc/20/22/70/1051202270.db2.gz ZUGAKHRIEVZIHK-LPHOPBHVSA-N 2 1 313.489 4.187 20 0 DIADMP C[C@H]1C[C@H](NC(=[NH2+])C2CCCCCC2)C[N@H+]1Cc1ccccc1 ZINC001171730870 1051202288 /nfs/dbraw/zinc/20/22/88/1051202288.db2.gz ZUGAKHRIEVZIHK-LPHOPBHVSA-N 2 1 313.489 4.187 20 0 DIADMP CCC(CC)[N@@H+]([C@H]1Cc2cccc(F)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001171786165 1051219663 /nfs/dbraw/zinc/21/96/63/1051219663.db2.gz XNOFFGFQPGNBNG-SZMVWBNQSA-N 2 1 318.480 4.053 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@]1(C)Cc1ccccc1Cl ZINC001171900112 1051237216 /nfs/dbraw/zinc/23/72/16/1051237216.db2.gz HIIQSNAMORKZSY-IEBWSBKVSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@]1(C)Cc1ccccc1Cl ZINC001171900112 1051237228 /nfs/dbraw/zinc/23/72/28/1051237228.db2.gz HIIQSNAMORKZSY-IEBWSBKVSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@]1(C)Cc1ccccc1Cl ZINC001171900112 1051237238 /nfs/dbraw/zinc/23/72/38/1051237238.db2.gz HIIQSNAMORKZSY-IEBWSBKVSA-N 2 1 320.908 4.221 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171963049 1051245701 /nfs/dbraw/zinc/24/57/01/1051245701.db2.gz GOKQBUKJHSDXPM-IAGOWNOFSA-N 2 1 322.443 4.207 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171964223 1051249041 /nfs/dbraw/zinc/24/90/41/1051249041.db2.gz LBIDTHOBOKNHMB-GUDVDZBRSA-N 2 1 318.480 4.300 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C2CCC(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171966641 1051249367 /nfs/dbraw/zinc/24/93/67/1051249367.db2.gz VYFWSYVNIPPPSV-ACBHZAAOSA-N 2 1 318.480 4.300 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964150 1051250213 /nfs/dbraw/zinc/25/02/13/1051250213.db2.gz KRQJKIJKLXZPEP-QXAKKESOSA-N 2 1 300.490 4.208 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C[C@@H]2CC[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171963186 1051250471 /nfs/dbraw/zinc/25/04/71/1051250471.db2.gz GZYDGCJDXDWGRR-QRVBRYPASA-N 2 1 318.480 4.157 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2CC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171976095 1051264491 /nfs/dbraw/zinc/26/44/91/1051264491.db2.gz PJCRTPFNPWIXME-RTBURBONSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1C[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983927 1051266742 /nfs/dbraw/zinc/26/67/42/1051266742.db2.gz BAVJOLVRUYVVJY-MJGOQNOKSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1C[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983927 1051266756 /nfs/dbraw/zinc/26/67/56/1051266756.db2.gz BAVJOLVRUYVVJY-MJGOQNOKSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1C[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983927 1051266768 /nfs/dbraw/zinc/26/67/68/1051266768.db2.gz BAVJOLVRUYVVJY-MJGOQNOKSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1C[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983927 1051266780 /nfs/dbraw/zinc/26/67/80/1051266780.db2.gz BAVJOLVRUYVVJY-MJGOQNOKSA-N 2 1 312.501 4.304 20 0 DIADMP Cc1occc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984171 1051267737 /nfs/dbraw/zinc/26/77/37/1051267737.db2.gz SHTPWEAMDZSAEZ-IBGZPJMESA-N 2 1 312.457 4.121 20 0 DIADMP Cc1occc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984171 1051267749 /nfs/dbraw/zinc/26/77/49/1051267749.db2.gz SHTPWEAMDZSAEZ-IBGZPJMESA-N 2 1 312.457 4.121 20 0 DIADMP CC1(F)CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171978071 1051269507 /nfs/dbraw/zinc/26/95/07/1051269507.db2.gz WLKFGDKWOMYFRP-GOSISDBHSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@@H](CF)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988248 1051271590 /nfs/dbraw/zinc/27/15/90/1051271590.db2.gz QEFGPYRKMBRLBF-OALUTQOASA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@@H](CF)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988248 1051271596 /nfs/dbraw/zinc/27/15/96/1051271596.db2.gz QEFGPYRKMBRLBF-OALUTQOASA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988248 1051271611 /nfs/dbraw/zinc/27/16/11/1051271611.db2.gz QEFGPYRKMBRLBF-OALUTQOASA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988248 1051271626 /nfs/dbraw/zinc/27/16/26/1051271626.db2.gz QEFGPYRKMBRLBF-OALUTQOASA-N 2 1 318.480 4.111 20 0 DIADMP CC[C@H]1CCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985294 1051273145 /nfs/dbraw/zinc/27/31/45/1051273145.db2.gz VEZWMMIGABKSQR-OALUTQOASA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985294 1051273160 /nfs/dbraw/zinc/27/31/60/1051273160.db2.gz VEZWMMIGABKSQR-OALUTQOASA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985294 1051273171 /nfs/dbraw/zinc/27/31/71/1051273171.db2.gz VEZWMMIGABKSQR-OALUTQOASA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985294 1051273185 /nfs/dbraw/zinc/27/31/85/1051273185.db2.gz VEZWMMIGABKSQR-OALUTQOASA-N 2 1 300.490 4.304 20 0 DIADMP CCC[C@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070586 1051274365 /nfs/dbraw/zinc/27/43/65/1051274365.db2.gz PKZKOFNFFDLKEW-FFGOWVMKSA-N 2 1 300.490 4.350 20 0 DIADMP C[C@H]1CCCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075627 1051276657 /nfs/dbraw/zinc/27/66/57/1051276657.db2.gz COKVPGUTYFPSGJ-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075627 1051276661 /nfs/dbraw/zinc/27/66/61/1051276661.db2.gz COKVPGUTYFPSGJ-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172075627 1051276663 /nfs/dbraw/zinc/27/66/63/1051276663.db2.gz COKVPGUTYFPSGJ-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172075627 1051276670 /nfs/dbraw/zinc/27/66/70/1051276670.db2.gz COKVPGUTYFPSGJ-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCCCCC2)C3)cc1 ZINC001172080040 1051276982 /nfs/dbraw/zinc/27/69/82/1051276982.db2.gz SJROLCXWRQIATD-WKCHPHFGSA-N 2 1 312.501 4.448 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCCCCC2)C3)cc1 ZINC001172080040 1051276991 /nfs/dbraw/zinc/27/69/91/1051276991.db2.gz SJROLCXWRQIATD-WKCHPHFGSA-N 2 1 312.501 4.448 20 0 DIADMP CC(C)C[N@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079701 1051277118 /nfs/dbraw/zinc/27/71/18/1051277118.db2.gz PNICIPPWPCOECJ-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079701 1051277130 /nfs/dbraw/zinc/27/71/30/1051277130.db2.gz PNICIPPWPCOECJ-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172079701 1051277139 /nfs/dbraw/zinc/27/71/39/1051277139.db2.gz PNICIPPWPCOECJ-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172079701 1051277143 /nfs/dbraw/zinc/27/71/43/1051277143.db2.gz PNICIPPWPCOECJ-PMOLBWCYSA-N 2 1 300.490 4.160 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccccc1-c1ccccc1)C2 ZINC001172100844 1051285129 /nfs/dbraw/zinc/28/51/29/1051285129.db2.gz SUJLGNHVSDLKJK-MZADTFQBSA-N 2 1 320.480 4.459 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc(Cl)c1Cl)C2 ZINC001172100247 1051286894 /nfs/dbraw/zinc/28/68/94/1051286894.db2.gz BZWOMPGCRMVPII-ZSOGYDGISA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc(Cl)c1Cl)C2 ZINC001172100247 1051286906 /nfs/dbraw/zinc/28/69/06/1051286906.db2.gz BZWOMPGCRMVPII-ZSOGYDGISA-N 2 1 313.272 4.098 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129082 1051287485 /nfs/dbraw/zinc/28/74/85/1051287485.db2.gz WAOIOAKTFPBMCQ-NKGKWGDASA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129082 1051287494 /nfs/dbraw/zinc/28/74/94/1051287494.db2.gz WAOIOAKTFPBMCQ-NKGKWGDASA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172129082 1051287505 /nfs/dbraw/zinc/28/75/05/1051287505.db2.gz WAOIOAKTFPBMCQ-NKGKWGDASA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172129082 1051287515 /nfs/dbraw/zinc/28/75/15/1051287515.db2.gz WAOIOAKTFPBMCQ-NKGKWGDASA-N 2 1 306.881 4.348 20 0 DIADMP CCC1([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC001172067767 1051288609 /nfs/dbraw/zinc/28/86/09/1051288609.db2.gz SIEDXVJSYZRPLY-ACDBMABISA-N 2 1 312.501 4.494 20 0 DIADMP CCC1([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC001172067767 1051288623 /nfs/dbraw/zinc/28/86/23/1051288623.db2.gz SIEDXVJSYZRPLY-ACDBMABISA-N 2 1 312.501 4.494 20 0 DIADMP CCC1([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC001172067770 1051289066 /nfs/dbraw/zinc/28/90/66/1051289066.db2.gz SIEDXVJSYZRPLY-OWZKRDHZSA-N 2 1 312.501 4.494 20 0 DIADMP CCC1([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC001172067770 1051289076 /nfs/dbraw/zinc/28/90/76/1051289076.db2.gz SIEDXVJSYZRPLY-OWZKRDHZSA-N 2 1 312.501 4.494 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069380 1051289857 /nfs/dbraw/zinc/28/98/57/1051289857.db2.gz PNAGUUBCLMTEKL-YUBLJMCLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069380 1051289866 /nfs/dbraw/zinc/28/98/66/1051289866.db2.gz PNAGUUBCLMTEKL-YUBLJMCLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@@H+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069380 1051289877 /nfs/dbraw/zinc/28/98/77/1051289877.db2.gz PNAGUUBCLMTEKL-YUBLJMCLSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@H+]2C[C@@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172069380 1051289889 /nfs/dbraw/zinc/28/98/89/1051289889.db2.gz PNAGUUBCLMTEKL-YUBLJMCLSA-N 2 1 324.512 4.304 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccc(F)cc1F)C2 ZINC001172131233 1051291180 /nfs/dbraw/zinc/29/11/80/1051291180.db2.gz VIFMMRLWOZGZKJ-RCJHGTSTSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccc(F)cc1F)C2 ZINC001172131233 1051291187 /nfs/dbraw/zinc/29/11/87/1051291187.db2.gz VIFMMRLWOZGZKJ-RCJHGTSTSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccc(F)cc1F)C2 ZINC001172131233 1051291194 /nfs/dbraw/zinc/29/11/94/1051291194.db2.gz VIFMMRLWOZGZKJ-RCJHGTSTSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1cc(F)cc(F)c1)C2 ZINC001172133241 1051292115 /nfs/dbraw/zinc/29/21/15/1051292115.db2.gz QEQKXZUPKFEHLB-YDZRNGNQSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1cc(F)cc(F)c1)C2 ZINC001172133241 1051292130 /nfs/dbraw/zinc/29/21/30/1051292130.db2.gz QEQKXZUPKFEHLB-YDZRNGNQSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1cc(F)cc(F)c1)C2 ZINC001172133241 1051292150 /nfs/dbraw/zinc/29/21/50/1051292150.db2.gz QEQKXZUPKFEHLB-YDZRNGNQSA-N 2 1 320.427 4.117 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131098 1051293418 /nfs/dbraw/zinc/29/34/18/1051293418.db2.gz UWTBAPNXPYXKQV-LVQVYYBASA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131098 1051293430 /nfs/dbraw/zinc/29/34/30/1051293430.db2.gz UWTBAPNXPYXKQV-LVQVYYBASA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131098 1051293443 /nfs/dbraw/zinc/29/34/43/1051293443.db2.gz UWTBAPNXPYXKQV-LVQVYYBASA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131098 1051293455 /nfs/dbraw/zinc/29/34/55/1051293455.db2.gz UWTBAPNXPYXKQV-LVQVYYBASA-N 2 1 306.881 4.348 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccc(F)cc1F)C2 ZINC001172131232 1051294396 /nfs/dbraw/zinc/29/43/96/1051294396.db2.gz VIFMMRLWOZGZKJ-PASDCYSWSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccc(F)cc1F)C2 ZINC001172131232 1051294409 /nfs/dbraw/zinc/29/44/09/1051294409.db2.gz VIFMMRLWOZGZKJ-PASDCYSWSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccc(F)cc1F)C2 ZINC001172131232 1051294417 /nfs/dbraw/zinc/29/44/17/1051294417.db2.gz VIFMMRLWOZGZKJ-PASDCYSWSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C13CC4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172103473 1051296017 /nfs/dbraw/zinc/29/60/17/1051296017.db2.gz UTICVJWMLHPHHA-HGQHDLEGSA-N 2 1 316.533 4.340 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C13CC4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172103473 1051296027 /nfs/dbraw/zinc/29/60/27/1051296027.db2.gz UTICVJWMLHPHHA-HGQHDLEGSA-N 2 1 316.533 4.340 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C13CC4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172103474 1051296141 /nfs/dbraw/zinc/29/61/41/1051296141.db2.gz UTICVJWMLHPHHA-XCRWWZIASA-N 2 1 316.533 4.340 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C13CC4C[C@@](C)(C1)C[C@](C)(C4)C3)C2 ZINC001172103474 1051296152 /nfs/dbraw/zinc/29/61/52/1051296152.db2.gz UTICVJWMLHPHHA-XCRWWZIASA-N 2 1 316.533 4.340 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(C)(C)c1ccc(Cl)cc1)C2 ZINC001172104132 1051297483 /nfs/dbraw/zinc/29/74/83/1051297483.db2.gz DBSJSKMKRSBXDI-OSYLJGHBSA-N 2 1 306.881 4.180 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(C)(C)c1ccc(Cl)cc1)C2 ZINC001172104132 1051297491 /nfs/dbraw/zinc/29/74/91/1051297491.db2.gz DBSJSKMKRSBXDI-OSYLJGHBSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(Cl)c1 ZINC001172108046 1051297552 /nfs/dbraw/zinc/29/75/52/1051297552.db2.gz OJQBFEIMGVULMU-REBRKWNGSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(Cl)c1 ZINC001172108046 1051297560 /nfs/dbraw/zinc/29/75/60/1051297560.db2.gz OJQBFEIMGVULMU-REBRKWNGSA-N 2 1 310.844 4.145 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(F)c1 ZINC001172110856 1051299018 /nfs/dbraw/zinc/29/90/18/1051299018.db2.gz QCEOOIKHUQESBW-ZXFNITATSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(F)c1 ZINC001172110856 1051299029 /nfs/dbraw/zinc/29/90/29/1051299029.db2.gz QCEOOIKHUQESBW-ZXFNITATSA-N 2 1 308.416 4.021 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172111154 1051299076 /nfs/dbraw/zinc/29/90/76/1051299076.db2.gz QKRZEFKLZPIEJJ-OKYOBFRVSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172111154 1051299080 /nfs/dbraw/zinc/29/90/80/1051299080.db2.gz QKRZEFKLZPIEJJ-OKYOBFRVSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172109693 1051300703 /nfs/dbraw/zinc/30/07/03/1051300703.db2.gz JZASRAQQGVMMMB-OKYOBFRVSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172109693 1051300706 /nfs/dbraw/zinc/30/07/06/1051300706.db2.gz JZASRAQQGVMMMB-OKYOBFRVSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CC1)c1ccccc1F)C2 ZINC001172110191 1051301892 /nfs/dbraw/zinc/30/18/92/1051301892.db2.gz ISNYQGCKKVKQPG-PDOICOKGSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+](Cc1cccc2ccccc21)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172122895 1051304628 /nfs/dbraw/zinc/30/46/28/1051304628.db2.gz UZMGFCPUMKTISH-ACDBMABISA-N 2 1 308.469 4.287 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172122895 1051304630 /nfs/dbraw/zinc/30/46/30/1051304630.db2.gz UZMGFCPUMKTISH-ACDBMABISA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1cccc2ccccc21)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172122895 1051304633 /nfs/dbraw/zinc/30/46/33/1051304633.db2.gz UZMGFCPUMKTISH-ACDBMABISA-N 2 1 308.469 4.287 20 0 DIADMP C[NH+](Cc1cccc2ccccc21)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172122895 1051304634 /nfs/dbraw/zinc/30/46/34/1051304634.db2.gz UZMGFCPUMKTISH-ACDBMABISA-N 2 1 308.469 4.287 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3ccccc3F)CC1)C2 ZINC001172122903 1051305554 /nfs/dbraw/zinc/30/55/54/1051305554.db2.gz VKALARULQQUKRW-BCDXTJNWSA-N 2 1 316.464 4.020 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC(c3ccccc3F)CC1)C2 ZINC001172122903 1051305559 /nfs/dbraw/zinc/30/55/59/1051305559.db2.gz VKALARULQQUKRW-BCDXTJNWSA-N 2 1 316.464 4.020 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C[C@H]1C ZINC001172379408 1051354571 /nfs/dbraw/zinc/35/45/71/1051354571.db2.gz ODWCIHDMZBLXRQ-UKAVVXHISA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C[C@H]1C ZINC001172379408 1051354575 /nfs/dbraw/zinc/35/45/75/1051354575.db2.gz ODWCIHDMZBLXRQ-UKAVVXHISA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@H]1C ZINC001172379408 1051354580 /nfs/dbraw/zinc/35/45/80/1051354580.db2.gz ODWCIHDMZBLXRQ-UKAVVXHISA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C[C@@H]1C ZINC001172379406 1051355868 /nfs/dbraw/zinc/35/58/68/1051355868.db2.gz ODWCIHDMZBLXRQ-JYRKZWEQSA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC001172379406 1051355879 /nfs/dbraw/zinc/35/58/79/1051355879.db2.gz ODWCIHDMZBLXRQ-JYRKZWEQSA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC001172379406 1051355887 /nfs/dbraw/zinc/35/58/87/1051355887.db2.gz ODWCIHDMZBLXRQ-JYRKZWEQSA-N 2 1 314.517 4.265 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H]2CCSc3c(F)cccc32)CC1 ZINC000193023413 1051370893 /nfs/dbraw/zinc/37/08/93/1051370893.db2.gz NBHAUCLGVDDBEK-QGZVFWFLSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C[C@H]1C ZINC001172370950 1051377724 /nfs/dbraw/zinc/37/77/24/1051377724.db2.gz RPUWECGCHPXJJN-OAGGEKHMSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C[C@@H]1C ZINC001172370952 1051377953 /nfs/dbraw/zinc/37/79/53/1051377953.db2.gz RPUWECGCHPXJJN-PMPSAXMXSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C[C@H]1C ZINC001172369401 1051378523 /nfs/dbraw/zinc/37/85/23/1051378523.db2.gz LXEXAMRCLIGVNQ-RKVPGOIHSA-N 2 1 320.908 4.415 20 0 DIADMP CC[C@H](CC(C)C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172387936 1051392590 /nfs/dbraw/zinc/39/25/90/1051392590.db2.gz ZJPIIJCYYUDFOE-WOJBJXKFSA-N 2 1 302.506 4.313 20 0 DIADMP CC[C@@H](CC(C)C)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001172392313 1051393978 /nfs/dbraw/zinc/39/39/78/1051393978.db2.gz CRUNKFSTRWWIHQ-KRWDZBQOSA-N 2 1 308.897 4.415 20 0 DIADMP CCCCCC[C@H](CCC)[NH+]1CCC([NH3+])(c2cccnc2)CC1 ZINC001172391608 1051394050 /nfs/dbraw/zinc/39/40/50/1051394050.db2.gz RTELCZIUNKZICK-IBGZPJMESA-N 2 1 317.521 4.471 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001172400968 1051399689 /nfs/dbraw/zinc/39/96/89/1051399689.db2.gz LDZMFXKJECGPPX-SXLOBPIMSA-N 2 1 302.506 4.311 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001172400968 1051399701 /nfs/dbraw/zinc/39/97/01/1051399701.db2.gz LDZMFXKJECGPPX-SXLOBPIMSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)COCC[C@@H](C)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172474088 1051402543 /nfs/dbraw/zinc/40/25/43/1051402543.db2.gz XQFHYPNQVZJTMJ-MISYRCLQSA-N 2 1 324.553 4.200 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC001172550022 1051432062 /nfs/dbraw/zinc/43/20/62/1051432062.db2.gz AWEPJAXKUADXRO-SXLOBPIMSA-N 2 1 300.490 4.177 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CC[C@@H](c2ccccc2)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172556657 1051438180 /nfs/dbraw/zinc/43/81/80/1051438180.db2.gz MVOYZCZBQOSHFY-UAFMIMERSA-N 2 1 300.490 4.303 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172557198 1051438709 /nfs/dbraw/zinc/43/87/09/1051438709.db2.gz PAKVHJNCQGJKMQ-AFYVEPGGSA-N 2 1 300.490 4.031 20 0 DIADMP CCC[N@@H+](CCC[NH3+])[C@H](C)CCc1c(F)cc(Cl)cc1F ZINC001172567042 1051444964 /nfs/dbraw/zinc/44/49/64/1051444964.db2.gz BRQUHRZOOHBQOT-GFCCVEGCSA-N 2 1 318.839 4.000 20 0 DIADMP Cc1cc(C)c(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c(C)c1 ZINC001168825858 1051446142 /nfs/dbraw/zinc/44/61/42/1051446142.db2.gz MNZUKAUSGJSYQB-UHFFFAOYSA-N 2 1 310.485 4.305 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172723492 1051483834 /nfs/dbraw/zinc/48/38/34/1051483834.db2.gz SYXBPPZWNJMJBB-IBGZPJMESA-N 2 1 320.908 4.004 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(Oc3ccccc3)cc1)C2 ZINC001169092759 1051509888 /nfs/dbraw/zinc/50/98/88/1051509888.db2.gz CNAXJSLMDFDKTL-LDLYASANSA-N 2 1 322.452 4.194 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001169101633 1051511815 /nfs/dbraw/zinc/51/18/15/1051511815.db2.gz USCKXQJOSUXHQT-RCJHGTSTSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001169101633 1051511827 /nfs/dbraw/zinc/51/18/27/1051511827.db2.gz USCKXQJOSUXHQT-RCJHGTSTSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]C2CCC(Cc3ccccc3)CC2)C1 ZINC001172818685 1051512551 /nfs/dbraw/zinc/51/25/51/1051512551.db2.gz PPHYQJLQOROWAV-KBWCOIMZSA-N 2 1 314.517 4.109 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169125838 1051521851 /nfs/dbraw/zinc/52/18/51/1051521851.db2.gz MKDSXQLSFIGGMZ-WKCHPHFGSA-N 2 1 320.480 4.333 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169125838 1051521866 /nfs/dbraw/zinc/52/18/66/1051521866.db2.gz MKDSXQLSFIGGMZ-WKCHPHFGSA-N 2 1 320.480 4.333 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169125838 1051521883 /nfs/dbraw/zinc/52/18/83/1051521883.db2.gz MKDSXQLSFIGGMZ-WKCHPHFGSA-N 2 1 320.480 4.333 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169125287 1051523356 /nfs/dbraw/zinc/52/33/56/1051523356.db2.gz YHULBRNFUQCDNE-FCGDIQPGSA-N 2 1 318.892 4.048 20 0 DIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169129597 1051525649 /nfs/dbraw/zinc/52/56/49/1051525649.db2.gz JZIQLOJVLVCQDA-WDNDVIMCSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169129597 1051525659 /nfs/dbraw/zinc/52/56/59/1051525659.db2.gz JZIQLOJVLVCQDA-WDNDVIMCSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169129597 1051525666 /nfs/dbraw/zinc/52/56/66/1051525666.db2.gz JZIQLOJVLVCQDA-WDNDVIMCSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169129597 1051525672 /nfs/dbraw/zinc/52/56/72/1051525672.db2.gz JZIQLOJVLVCQDA-WDNDVIMCSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3cccc(F)c3)CCCCC1)C2 ZINC001169106981 1051528625 /nfs/dbraw/zinc/52/86/25/1051528625.db2.gz CABXDNKTPJTQRF-LDLYASANSA-N 2 1 316.464 4.200 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+](Cc1ccccc1)Cc1ccccc1)C2 ZINC001169147010 1051535131 /nfs/dbraw/zinc/53/51/31/1051535131.db2.gz RDMDOHXFODDOGO-KOUNCHBCSA-N 2 1 320.480 4.314 20 0 DIADMP CC1(C)C[C@@H](Nc2[nH+]ccc3cc(F)ccc32)C[C@@](C)(C[NH3+])C1 ZINC001169148596 1051535948 /nfs/dbraw/zinc/53/59/48/1051535948.db2.gz XQQLPEQFLXYNRB-DNVCBOLYSA-N 2 1 315.436 4.330 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001169155034 1051536855 /nfs/dbraw/zinc/53/68/55/1051536855.db2.gz WJZCLPLKOJIMQN-VSZNYVQBSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001169155034 1051536866 /nfs/dbraw/zinc/53/68/66/1051536866.db2.gz WJZCLPLKOJIMQN-VSZNYVQBSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001169155034 1051536876 /nfs/dbraw/zinc/53/68/76/1051536876.db2.gz WJZCLPLKOJIMQN-VSZNYVQBSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001169156222 1051540126 /nfs/dbraw/zinc/54/01/26/1051540126.db2.gz WJZCLPLKOJIMQN-MHORFTMASA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001169156222 1051540133 /nfs/dbraw/zinc/54/01/33/1051540133.db2.gz WJZCLPLKOJIMQN-MHORFTMASA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001169156222 1051540142 /nfs/dbraw/zinc/54/01/42/1051540142.db2.gz WJZCLPLKOJIMQN-MHORFTMASA-N 2 1 304.865 4.102 20 0 DIADMP CC[NH+]1CCC([NH2+]C2(c3ccccc3)CCCCCC2)CC1 ZINC001169225299 1051556333 /nfs/dbraw/zinc/55/63/33/1051556333.db2.gz RVCXLDHHEROPJK-UHFFFAOYSA-N 2 1 300.490 4.310 20 0 DIADMP CC[NH+]1CCC([N@H+](C)C(c2ccccc2)c2ccccc2)CC1 ZINC001169244158 1051561543 /nfs/dbraw/zinc/56/15/43/1051561543.db2.gz DRZARKKHMHTXAJ-UHFFFAOYSA-N 2 1 308.469 4.192 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)C(c2ccccc2)c2ccccc2)CC1 ZINC001169244158 1051561560 /nfs/dbraw/zinc/56/15/60/1051561560.db2.gz DRZARKKHMHTXAJ-UHFFFAOYSA-N 2 1 308.469 4.192 20 0 DIADMP CC[NH+]1CCC([NH2+]C2(CC(C)C)CCC(F)(F)CC2)CC1 ZINC001169238434 1051562991 /nfs/dbraw/zinc/56/29/91/1051562991.db2.gz IEKDYUIVOZHZLV-UHFFFAOYSA-N 2 1 302.453 4.055 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001169241003 1051563036 /nfs/dbraw/zinc/56/30/36/1051563036.db2.gz ORFOWEOGQIZPFW-LJQANCHMSA-N 2 1 304.453 4.131 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2cccc(Cl)c2)CC1 ZINC001173111641 1051610195 /nfs/dbraw/zinc/61/01/95/1051610195.db2.gz JFIRSBJBGUYZEZ-UHFFFAOYSA-N 2 1 308.897 4.425 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3ccccc3[C@@H]2C)CC1 ZINC001173108423 1051610259 /nfs/dbraw/zinc/61/02/59/1051610259.db2.gz JZHSYIPXYYOEOA-IVMQYODDSA-N 2 1 300.490 4.259 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+]2Cc3ccccc3[C@H](C)C2)CC1 ZINC001173109043 1051610615 /nfs/dbraw/zinc/61/06/15/1051610615.db2.gz VTQNQHGPSBEHAW-IPJUCJBFSA-N 2 1 300.490 4.259 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@@H](C)c2ccccc2OC)CC1 ZINC001173113368 1051611566 /nfs/dbraw/zinc/61/15/66/1051611566.db2.gz OIFALQKAYSDOFI-AOCRQIFASA-N 2 1 318.505 4.341 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2cccc(F)c2F)CC1 ZINC001173113890 1051611815 /nfs/dbraw/zinc/61/18/15/1051611815.db2.gz NXYFTFTVWUURBV-UHFFFAOYSA-N 2 1 310.432 4.050 20 0 DIADMP CCCOC1CCC([N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)CC1 ZINC001173099693 1051621567 /nfs/dbraw/zinc/62/15/67/1051621567.db2.gz PHRWXILTNNWHIZ-HDYDNRTBSA-N 2 1 322.537 4.065 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@H]1CC[N@@H+](C)C1 ZINC001173204821 1051643520 /nfs/dbraw/zinc/64/35/20/1051643520.db2.gz LNZGAOCJABOCSR-RBUKOAKNSA-N 2 1 322.496 4.138 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1CC[NH+](C)CC1 ZINC001173208875 1051647136 /nfs/dbraw/zinc/64/71/36/1051647136.db2.gz UKJBYCMXLPEXJG-SFHVURJKSA-N 2 1 322.496 4.281 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173265365 1051665906 /nfs/dbraw/zinc/66/59/06/1051665906.db2.gz SSLCWTOHNDBEMO-KPACCLEDSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001173270350 1051667180 /nfs/dbraw/zinc/66/71/80/1051667180.db2.gz NRFWOEPBLIWSMG-YOEHRIQHSA-N 2 1 306.881 4.169 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@H](C[NH3+])[C@H](C)C3)c(C)c12 ZINC001206014567 1051669156 /nfs/dbraw/zinc/66/91/56/1051669156.db2.gz XSNAVRNQCRNJII-BXUZGUMPSA-N 2 1 322.543 4.386 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001173241667 1051672881 /nfs/dbraw/zinc/67/28/81/1051672881.db2.gz AFRKRARAEZYYES-GOSISDBHSA-N 2 1 316.533 4.232 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001173292506 1051675852 /nfs/dbraw/zinc/67/58/52/1051675852.db2.gz GZINFETXHHBEMD-YZGWKJHDSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173292506 1051675857 /nfs/dbraw/zinc/67/58/57/1051675857.db2.gz GZINFETXHHBEMD-YZGWKJHDSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173292506 1051675862 /nfs/dbraw/zinc/67/58/62/1051675862.db2.gz GZINFETXHHBEMD-YZGWKJHDSA-N 2 1 300.490 4.019 20 0 DIADMP CCSC[C@@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001173296718 1051678615 /nfs/dbraw/zinc/67/86/15/1051678615.db2.gz VVJCLCWHLZGSKV-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP CCSC[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001173296718 1051678620 /nfs/dbraw/zinc/67/86/20/1051678620.db2.gz VVJCLCWHLZGSKV-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342444 1051701371 /nfs/dbraw/zinc/70/13/71/1051701371.db2.gz YHWUWQOWGBPIBN-CADBVGFASA-N 2 1 304.522 4.484 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342444 1051701384 /nfs/dbraw/zinc/70/13/84/1051701384.db2.gz YHWUWQOWGBPIBN-CADBVGFASA-N 2 1 304.522 4.484 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822115 1051707189 /nfs/dbraw/zinc/70/71/89/1051707189.db2.gz RGJFYYOSZZISPO-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822115 1051707198 /nfs/dbraw/zinc/70/71/98/1051707198.db2.gz RGJFYYOSZZISPO-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822115 1051707210 /nfs/dbraw/zinc/70/72/10/1051707210.db2.gz RGJFYYOSZZISPO-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822115 1051707222 /nfs/dbraw/zinc/70/72/22/1051707222.db2.gz RGJFYYOSZZISPO-ROUUACIJSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822116 1051707393 /nfs/dbraw/zinc/70/73/93/1051707393.db2.gz RGJFYYOSZZISPO-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822116 1051707408 /nfs/dbraw/zinc/70/74/08/1051707408.db2.gz RGJFYYOSZZISPO-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822116 1051707421 /nfs/dbraw/zinc/70/74/21/1051707421.db2.gz RGJFYYOSZZISPO-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822116 1051707434 /nfs/dbraw/zinc/70/74/34/1051707434.db2.gz RGJFYYOSZZISPO-ZWKOTPCHSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc(F)c1 ZINC000183185022 1051711033 /nfs/dbraw/zinc/71/10/33/1051711033.db2.gz UBSIFFWWGNISKC-YQQAZPJKSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183197183 1051712385 /nfs/dbraw/zinc/71/23/85/1051712385.db2.gz RXKDBAOHMMGUPE-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183197183 1051712398 /nfs/dbraw/zinc/71/23/98/1051712398.db2.gz RXKDBAOHMMGUPE-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP CCSc1cccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1 ZINC000185474527 1051769605 /nfs/dbraw/zinc/76/96/05/1051769605.db2.gz IBVOSIROEOZBSS-UHFFFAOYSA-N 2 1 306.519 4.151 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000185517911 1051770423 /nfs/dbraw/zinc/77/04/23/1051770423.db2.gz YWMJXNUGQWJBNU-PCKAHOCUSA-N 2 1 320.443 4.019 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000186357237 1051811216 /nfs/dbraw/zinc/81/12/16/1051811216.db2.gz IXHZZRGVKUZQGF-HFTRVMKXSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000186357237 1051811230 /nfs/dbraw/zinc/81/12/30/1051811230.db2.gz IXHZZRGVKUZQGF-HFTRVMKXSA-N 2 1 306.519 4.299 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000494460606 1051897597 /nfs/dbraw/zinc/89/75/97/1051897597.db2.gz ZYPAUZIIUWEUKB-KDOFPFPSSA-N 2 1 306.519 4.189 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000494482461 1051903427 /nfs/dbraw/zinc/90/34/27/1051903427.db2.gz FLAMDMBONKAALO-KDOFPFPSSA-N 2 1 306.519 4.189 20 0 DIADMP Cc1cccc(N2CCC([NH2+]CC[C@@H](C)c3ccccc3)CC2)[nH+]1 ZINC000191098163 1051961119 /nfs/dbraw/zinc/96/11/19/1051961119.db2.gz YQXNZNCLAKXQLS-QGZVFWFLSA-N 2 1 323.484 4.142 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000191268207 1051967697 /nfs/dbraw/zinc/96/76/97/1051967697.db2.gz DZMNORDPZFGKBQ-STQMWFEESA-N 2 1 300.899 4.173 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000191268207 1051967706 /nfs/dbraw/zinc/96/77/06/1051967706.db2.gz DZMNORDPZFGKBQ-STQMWFEESA-N 2 1 300.899 4.173 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(Cl)cs1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206635 1052034942 /nfs/dbraw/zinc/03/49/42/1052034942.db2.gz ADJKPMGGYUXKKA-OLZOCXBDSA-N 2 1 312.910 4.144 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000769473510 1052066779 /nfs/dbraw/zinc/06/67/79/1052066779.db2.gz OQLIPRXEAPIZGQ-IBGZPJMESA-N 2 1 320.480 4.271 20 0 DIADMP CCCCC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)C(C)(C)C ZINC000808696460 1052084388 /nfs/dbraw/zinc/08/43/88/1052084388.db2.gz UQYNAKBAGDNSCS-OALUTQOASA-N 2 1 324.553 4.214 20 0 DIADMP c1csc(C([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2cccs2)c1 ZINC000227321341 1052140516 /nfs/dbraw/zinc/14/05/16/1052140516.db2.gz LJRWLUGKJRTZSQ-KGLIPLIRSA-N 2 1 318.511 4.115 20 0 DIADMP c1csc(C([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2cccs2)c1 ZINC000227321341 1052140522 /nfs/dbraw/zinc/14/05/22/1052140522.db2.gz LJRWLUGKJRTZSQ-KGLIPLIRSA-N 2 1 318.511 4.115 20 0 DIADMP Cc1ccccc1[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000494919993 1052171066 /nfs/dbraw/zinc/17/10/66/1052171066.db2.gz FZKNFUPIUYJEAG-DYESRHJHSA-N 2 1 312.501 4.300 20 0 DIADMP CCC[C@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)[C@H](C)CC ZINC001218292279 1052217752 /nfs/dbraw/zinc/21/77/52/1052217752.db2.gz POBJXJLTQNKEQZ-UZLBHIALSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccccc1[C@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218295562 1052218762 /nfs/dbraw/zinc/21/87/62/1052218762.db2.gz OJEWIOSNOZEJRV-KRWDZBQOSA-N 2 1 324.468 4.058 20 0 DIADMP CC(C)C[C@@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)C(C)C ZINC001218295639 1052219576 /nfs/dbraw/zinc/21/95/76/1052219576.db2.gz HOCIYYRKCSHIJE-HXUWFJFHSA-N 2 1 318.505 4.059 20 0 DIADMP CC(C)CCC[C@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218311191 1052222753 /nfs/dbraw/zinc/22/27/53/1052222753.db2.gz OSPASUQWNSFNPK-KRWDZBQOSA-N 2 1 318.505 4.203 20 0 DIADMP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309671829 1052232416 /nfs/dbraw/zinc/23/24/16/1052232416.db2.gz TWMYTTMJEQYOJB-HOJAQTOUSA-N 2 1 314.517 4.313 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309716090 1052235719 /nfs/dbraw/zinc/23/57/19/1052235719.db2.gz KVDUGXHJARSGQP-YZGWKJHDSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309720347 1052235803 /nfs/dbraw/zinc/23/58/03/1052235803.db2.gz MCDYVACTNWIJOC-HMXCVIKNSA-N 2 1 314.517 4.457 20 0 DIADMP CCC[C@H](C)[C@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218439795 1052240261 /nfs/dbraw/zinc/24/02/61/1052240261.db2.gz WSYFMXXNIULCML-LPHOPBHVSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)C[C@@H](C)C[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309813021 1052251783 /nfs/dbraw/zinc/25/17/83/1052251783.db2.gz NFVBXTNRCWRFHN-QUCCMNQESA-N 2 1 302.506 4.170 20 0 DIADMP Cc1cc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc(C)[nH+]1 ZINC000310273574 1052262594 /nfs/dbraw/zinc/26/25/94/1052262594.db2.gz UGMSKGIKUMIMOT-SESVDKBCSA-N 2 1 321.468 4.021 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000310334133 1052264799 /nfs/dbraw/zinc/26/47/99/1052264799.db2.gz AUHLXJVYUYTKOE-OAQYLSRUSA-N 2 1 322.496 4.224 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000495409563 1052338108 /nfs/dbraw/zinc/33/81/08/1052338108.db2.gz OJWYBMHPMDVAQE-WSTZPKSXSA-N 2 1 314.517 4.108 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000237409000 1052440633 /nfs/dbraw/zinc/44/06/33/1052440633.db2.gz RYMNUSNPZLTGIO-LJQANCHMSA-N 2 1 322.496 4.353 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC000237541537 1052442773 /nfs/dbraw/zinc/44/27/73/1052442773.db2.gz DVOWEMRHWZRVLO-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+]C3CC[NH+](C4CC4)CC3)c2)cc1 ZINC000237732039 1052444029 /nfs/dbraw/zinc/44/40/29/1052444029.db2.gz FOHDCARYFWUCFU-UHFFFAOYSA-N 2 1 320.480 4.378 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cccc3cc[nH]c32)C1 ZINC000237680020 1052444478 /nfs/dbraw/zinc/44/44/78/1052444478.db2.gz JCOOWFLTQHJCFY-CALCHBBNSA-N 2 1 313.489 4.016 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CC[C@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222141138 1052449571 /nfs/dbraw/zinc/44/95/71/1052449571.db2.gz FSIXUUVEWQVVLL-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222141138 1052449578 /nfs/dbraw/zinc/44/95/78/1052449578.db2.gz FSIXUUVEWQVVLL-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC001222149027 1052450488 /nfs/dbraw/zinc/45/04/88/1052450488.db2.gz VENHXSCXRYXQGJ-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222148731 1052450608 /nfs/dbraw/zinc/45/06/08/1052450608.db2.gz SAXDIMXHMQCNIY-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222148993 1052450744 /nfs/dbraw/zinc/45/07/44/1052450744.db2.gz UAXGYXVVDFVXAY-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@@]4(C3)CCC[NH2+]C4)s2)c1 ZINC001222149397 1052451480 /nfs/dbraw/zinc/45/14/80/1052451480.db2.gz YHZMLICBPHOKSC-KRWDZBQOSA-N 2 1 318.511 4.052 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)s2)c1 ZINC001222149397 1052451481 /nfs/dbraw/zinc/45/14/81/1052451481.db2.gz YHZMLICBPHOKSC-KRWDZBQOSA-N 2 1 318.511 4.052 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@]4(C3)CCC[NH2+]C4)s2)c1 ZINC001222149403 1052451567 /nfs/dbraw/zinc/45/15/67/1052451567.db2.gz YHZMLICBPHOKSC-QGZVFWFLSA-N 2 1 318.511 4.052 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)s2)c1 ZINC001222149403 1052451569 /nfs/dbraw/zinc/45/15/69/1052451569.db2.gz YHZMLICBPHOKSC-QGZVFWFLSA-N 2 1 318.511 4.052 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)s1 ZINC001222167094 1052455280 /nfs/dbraw/zinc/45/52/80/1052455280.db2.gz HVJONTSXRDUDEF-KRWDZBQOSA-N 2 1 324.559 4.216 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)s1 ZINC001222167094 1052455286 /nfs/dbraw/zinc/45/52/86/1052455286.db2.gz HVJONTSXRDUDEF-KRWDZBQOSA-N 2 1 324.559 4.216 20 0 DIADMP c1ccc(-c2ccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]C4)cc2)cc1 ZINC001222237509 1052467180 /nfs/dbraw/zinc/46/71/80/1052467180.db2.gz LJLZVJMKMCKEMK-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]C4)cc2)cc1 ZINC001222237509 1052467182 /nfs/dbraw/zinc/46/71/82/1052467182.db2.gz LJLZVJMKMCKEMK-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP Fc1ccc(-c2cccc(C[N@@H+]3CCC[C@]34CCC[NH2+]C4)c2)cc1 ZINC001222243810 1052468031 /nfs/dbraw/zinc/46/80/31/1052468031.db2.gz OUYRAHCORAZQKH-NRFANRHFSA-N 2 1 324.443 4.211 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CCC[C@]34CCC[NH2+]C4)c2)cc1 ZINC001222243810 1052468033 /nfs/dbraw/zinc/46/80/33/1052468033.db2.gz OUYRAHCORAZQKH-NRFANRHFSA-N 2 1 324.443 4.211 20 0 DIADMP c1cc(-c2cccc(C[N@@H+]3CCC[C@]34CCC[NH2+]C4)c2)cs1 ZINC001222249593 1052469238 /nfs/dbraw/zinc/46/92/38/1052469238.db2.gz URUFBGKCXIMCRX-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP c1cc(-c2cccc(C[N@H+]3CCC[C@]34CCC[NH2+]C4)c2)cs1 ZINC001222249593 1052469244 /nfs/dbraw/zinc/46/92/44/1052469244.db2.gz URUFBGKCXIMCRX-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222248949 1052469360 /nfs/dbraw/zinc/46/93/60/1052469360.db2.gz OLCJFVUEWHMEOB-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001222248949 1052469362 /nfs/dbraw/zinc/46/93/62/1052469362.db2.gz OLCJFVUEWHMEOB-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001222259780 1052469775 /nfs/dbraw/zinc/46/97/75/1052469775.db2.gz ZCKTZWQSDRYKRI-PGRDOPGGSA-N 2 1 322.496 4.409 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222272236 1052471909 /nfs/dbraw/zinc/47/19/09/1052471909.db2.gz ORUQWBSYFRTELY-OAQYLSRUSA-N 2 1 308.469 4.114 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001168498577 1052475351 /nfs/dbraw/zinc/47/53/51/1052475351.db2.gz URCAVKRXBBBFAU-UXPWSPDFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001168498577 1052475353 /nfs/dbraw/zinc/47/53/53/1052475353.db2.gz URCAVKRXBBBFAU-UXPWSPDFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001168498577 1052475356 /nfs/dbraw/zinc/47/53/56/1052475356.db2.gz URCAVKRXBBBFAU-UXPWSPDFSA-N 2 1 318.480 4.096 20 0 DIADMP c1ccc(CCCCC[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001222310896 1052478809 /nfs/dbraw/zinc/47/88/09/1052478809.db2.gz XZYFNSCIDIRCQJ-HXUWFJFHSA-N 2 1 300.490 4.008 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)s1 ZINC001222314894 1052479875 /nfs/dbraw/zinc/47/98/75/1052479875.db2.gz KLDXVKRASSDASW-GOSISDBHSA-N 2 1 306.519 4.199 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320732 1052481835 /nfs/dbraw/zinc/48/18/35/1052481835.db2.gz LZBOFLMJQCBQBD-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222385932 1052494131 /nfs/dbraw/zinc/49/41/31/1052494131.db2.gz ZZFQAJGQAYCBRG-QUCCMNQESA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222385932 1052494137 /nfs/dbraw/zinc/49/41/37/1052494137.db2.gz ZZFQAJGQAYCBRG-QUCCMNQESA-N 2 1 324.553 4.216 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222395579 1052494971 /nfs/dbraw/zinc/49/49/71/1052494971.db2.gz LYCABASVHMQNSU-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222395579 1052494974 /nfs/dbraw/zinc/49/49/74/1052494974.db2.gz LYCABASVHMQNSU-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP c1ccc([C@@H]2C[N@H+](CCCC3CCCCC3)CC23C[NH2+]C3)cc1 ZINC001222595851 1052515414 /nfs/dbraw/zinc/51/54/14/1052515414.db2.gz KMBHNAASPBZRJS-FQEVSTJZSA-N 2 1 312.501 4.036 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@H]3C[NH2+]CC[C@H]32)c1 ZINC001222620448 1052518760 /nfs/dbraw/zinc/51/87/60/1052518760.db2.gz SOYRPNAYGKGNHS-LEWJYISDSA-N 2 1 320.480 4.154 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)c1 ZINC001222635429 1052521539 /nfs/dbraw/zinc/52/15/39/1052521539.db2.gz XIEXUGNZQOAWOU-HDICACEKSA-N 2 1 320.546 4.302 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC000320557748 1052531582 /nfs/dbraw/zinc/53/15/82/1052531582.db2.gz JQKZJNOVGIWZOH-WMZOPIPTSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C(C)(C)C ZINC000670267652 1052545111 /nfs/dbraw/zinc/54/51/11/1052545111.db2.gz NXTUHNZIAAKMAX-VYDXJSESSA-N 2 1 308.535 4.403 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C(C)(C)C ZINC000670267652 1052545115 /nfs/dbraw/zinc/54/51/15/1052545115.db2.gz NXTUHNZIAAKMAX-VYDXJSESSA-N 2 1 308.535 4.403 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)C(C)(C)C ZINC000670267650 1052545281 /nfs/dbraw/zinc/54/52/81/1052545281.db2.gz NXTUHNZIAAKMAX-HLLBOEOZSA-N 2 1 308.535 4.403 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C(C)(C)C ZINC000670267650 1052545287 /nfs/dbraw/zinc/54/52/87/1052545287.db2.gz NXTUHNZIAAKMAX-HLLBOEOZSA-N 2 1 308.535 4.403 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050980 1052563812 /nfs/dbraw/zinc/56/38/12/1052563812.db2.gz XOQITRKPQDLMHJ-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050980 1052563813 /nfs/dbraw/zinc/56/38/13/1052563813.db2.gz XOQITRKPQDLMHJ-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000398045953 1052564023 /nfs/dbraw/zinc/56/40/23/1052564023.db2.gz VSXISAMDUQXTHA-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398052615 1052564878 /nfs/dbraw/zinc/56/48/78/1052564878.db2.gz YJEFYBNNRCEKEY-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398052615 1052564884 /nfs/dbraw/zinc/56/48/84/1052564884.db2.gz YJEFYBNNRCEKEY-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP c1csc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCC2)c1 ZINC000037649473 1052627533 /nfs/dbraw/zinc/62/75/33/1052627533.db2.gz FOYAGXRYGRKXNG-KSSFIOAISA-N 2 1 304.503 4.053 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644331 1052628110 /nfs/dbraw/zinc/62/81/10/1052628110.db2.gz FVZFHIIJJQJGMC-WBMJQRKESA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644331 1052628114 /nfs/dbraw/zinc/62/81/14/1052628114.db2.gz FVZFHIIJJQJGMC-WBMJQRKESA-N 2 1 315.288 4.376 20 0 DIADMP COc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000125958558 1052658864 /nfs/dbraw/zinc/65/88/64/1052658864.db2.gz CQIICGVDYTXNBM-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000125958558 1052658869 /nfs/dbraw/zinc/65/88/69/1052658869.db2.gz CQIICGVDYTXNBM-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccs1 ZINC000126797334 1052678473 /nfs/dbraw/zinc/67/84/73/1052678473.db2.gz VDZDYDCDDAHTDK-LSDHHAIUSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccs1 ZINC000126797334 1052678481 /nfs/dbraw/zinc/67/84/81/1052678481.db2.gz VDZDYDCDDAHTDK-LSDHHAIUSA-N 2 1 320.527 4.372 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccccc1)c1ccc(C)cc1 ZINC000127415452 1052695612 /nfs/dbraw/zinc/69/56/12/1052695612.db2.gz COOMAZXFKAYURM-OAQYLSRUSA-N 2 1 319.452 4.269 20 0 DIADMP Cc1ccc(C)c([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000128114655 1052709651 /nfs/dbraw/zinc/70/96/51/1052709651.db2.gz RQXYNOFRKYFPDO-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129456168 1052790083 /nfs/dbraw/zinc/79/00/83/1052790083.db2.gz YAHRNOVUEBQUGZ-SJORKVTESA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129456168 1052790087 /nfs/dbraw/zinc/79/00/87/1052790087.db2.gz YAHRNOVUEBQUGZ-SJORKVTESA-N 2 1 314.498 4.311 20 0 DIADMP CCc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556093988 1052797400 /nfs/dbraw/zinc/79/74/00/1052797400.db2.gz NXIUUKJEKACCDQ-YADHBBJMSA-N 2 1 322.496 4.217 20 0 DIADMP CCc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000556093988 1052797405 /nfs/dbraw/zinc/79/74/05/1052797405.db2.gz NXIUUKJEKACCDQ-YADHBBJMSA-N 2 1 322.496 4.217 20 0 DIADMP CC(C)CC1(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000556117654 1052803177 /nfs/dbraw/zinc/80/31/77/1052803177.db2.gz FGJDRCJZZDFPAM-OALUTQOASA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)CC1(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000556117654 1052803183 /nfs/dbraw/zinc/80/31/83/1052803183.db2.gz FGJDRCJZZDFPAM-OALUTQOASA-N 2 1 300.490 4.238 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C[C@@H]1c1ccccc1 ZINC000556178511 1052817100 /nfs/dbraw/zinc/81/71/00/1052817100.db2.gz IVTMBPWIYSDJQE-BPQIPLTHSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCCC(F)(F)C2)C[C@@H]1c1ccccc1 ZINC000556178511 1052817102 /nfs/dbraw/zinc/81/71/02/1052817102.db2.gz IVTMBPWIYSDJQE-BPQIPLTHSA-N 2 1 322.443 4.237 20 0 DIADMP c1ccc([C@@H]2CCCC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000498374843 1052826378 /nfs/dbraw/zinc/82/63/78/1052826378.db2.gz NRNPGPKJRUGETJ-ANULTFPQSA-N 2 1 312.501 4.319 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)C2CC2)C[C@@H]1c1ccccc1 ZINC000556255053 1052827990 /nfs/dbraw/zinc/82/79/90/1052827990.db2.gz VFBUDGFGYZGCIF-RTBURBONSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCC(C)(C)C2CC2)C[C@@H]1c1ccccc1 ZINC000556255053 1052827994 /nfs/dbraw/zinc/82/79/94/1052827994.db2.gz VFBUDGFGYZGCIF-RTBURBONSA-N 2 1 300.490 4.238 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC000920181434 1052925597 /nfs/dbraw/zinc/92/55/97/1052925597.db2.gz ZFRPPNTWOKJPJG-GOSISDBHSA-N 2 1 308.469 4.175 20 0 DIADMP Fc1ccc(-c2ccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)cc2)cc1 ZINC001226785409 1052931197 /nfs/dbraw/zinc/93/11/97/1052931197.db2.gz SIUARUSUMKUEPV-UHFFFAOYSA-N 2 1 324.443 4.211 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)C[C@@H](c2ccccc2)C1 ZINC000323396913 1053052499 /nfs/dbraw/zinc/05/24/99/1053052499.db2.gz MEZCGHKUTLJRNO-BWUHRYBWSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)C[C@@H](c2ccccc2)C1 ZINC000323396913 1053052502 /nfs/dbraw/zinc/05/25/02/1053052502.db2.gz MEZCGHKUTLJRNO-BWUHRYBWSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)C[C@@H](c2ccccc2)C1 ZINC000323396916 1053053078 /nfs/dbraw/zinc/05/30/78/1053053078.db2.gz MEZCGHKUTLJRNO-OFOKGCAXSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)C[C@@H](c2ccccc2)C1 ZINC000323396916 1053053081 /nfs/dbraw/zinc/05/30/81/1053053081.db2.gz MEZCGHKUTLJRNO-OFOKGCAXSA-N 2 1 312.501 4.175 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000519435167 1053141688 /nfs/dbraw/zinc/14/16/88/1053141688.db2.gz JGIKZVRYRWPGSY-CMOCDZPBSA-N 2 1 320.480 4.215 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000519435167 1053141696 /nfs/dbraw/zinc/14/16/96/1053141696.db2.gz JGIKZVRYRWPGSY-CMOCDZPBSA-N 2 1 320.480 4.215 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC001319199011 1053226846 /nfs/dbraw/zinc/22/68/46/1053226846.db2.gz LSXLBOYEXKSXIR-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC001319935723 1053287152 /nfs/dbraw/zinc/28/71/52/1053287152.db2.gz XBAIRLYDMIBYGI-VQIMIIECSA-N 2 1 304.478 4.141 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001474744497 1053295601 /nfs/dbraw/zinc/29/56/01/1053295601.db2.gz IJAFCJTYGXJVJO-TYIUSFPZSA-N 2 1 314.517 4.311 20 0 DIADMP CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1cccc([C@H](C)[NH+](C)C)c1)C2 ZINC001229625580 1053368001 /nfs/dbraw/zinc/36/80/01/1053368001.db2.gz IBQSJJNSEHQMML-WOGUSJMUSA-N 2 1 316.489 4.092 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@H]1CCC[N@H+]1CC1CCCCC1 ZINC001200105898 1053387130 /nfs/dbraw/zinc/38/71/30/1053387130.db2.gz PMCNAEOSIOXWTN-QRQLOZEOSA-N 2 1 306.538 4.445 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(C)c1 ZINC001200255903 1053503809 /nfs/dbraw/zinc/50/38/09/1053503809.db2.gz RCDGSJDADHNVGW-ZGBFETHSSA-N 2 1 314.517 4.335 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634015 1053529212 /nfs/dbraw/zinc/52/92/12/1053529212.db2.gz PHQGCFUXIOLIND-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC001322634015 1053529224 /nfs/dbraw/zinc/52/92/24/1053529224.db2.gz PHQGCFUXIOLIND-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472775 1053582298 /nfs/dbraw/zinc/58/22/98/1053582298.db2.gz PIUKASJHJYUCAU-ZIAGYGMSSA-N 2 1 320.864 4.469 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472775 1053582306 /nfs/dbraw/zinc/58/23/06/1053582306.db2.gz PIUKASJHJYUCAU-ZIAGYGMSSA-N 2 1 320.864 4.469 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183196113 1053601709 /nfs/dbraw/zinc/60/17/09/1053601709.db2.gz ZUZYJKPMQYYOEH-BZUAXINKSA-N 2 1 312.567 4.149 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@H]1c1ccccc1 ZINC000414175719 1053674694 /nfs/dbraw/zinc/67/46/94/1053674694.db2.gz ZKYISRRBMBEQLH-YRLHULLVSA-N 2 1 324.443 4.107 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@H]1c1ccccc1 ZINC000414175719 1053674709 /nfs/dbraw/zinc/67/47/09/1053674709.db2.gz ZKYISRRBMBEQLH-YRLHULLVSA-N 2 1 324.443 4.107 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)C1 ZINC001324964001 1053690964 /nfs/dbraw/zinc/69/09/64/1053690964.db2.gz DOTDMLJJHWRRTN-HOTGVXAUSA-N 2 1 314.448 4.361 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC001325038761 1053698068 /nfs/dbraw/zinc/69/80/68/1053698068.db2.gz NFDNWAFJFLQFIS-MRXNPFEDSA-N 2 1 306.453 4.078 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC001325038761 1053698077 /nfs/dbraw/zinc/69/80/77/1053698077.db2.gz NFDNWAFJFLQFIS-MRXNPFEDSA-N 2 1 306.453 4.078 20 0 DIADMP C[NH2+][C@H](C)CC[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001326035937 1053744763 /nfs/dbraw/zinc/74/47/63/1053744763.db2.gz MSFHUULLRVKMDL-KDOFPFPSSA-N 2 1 302.849 4.017 20 0 DIADMP C[N@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC001231485842 1053765558 /nfs/dbraw/zinc/76/55/58/1053765558.db2.gz IQABFLKLWFOARN-CMDGGOBGSA-N 2 1 320.480 4.383 20 0 DIADMP C[N@@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC001231485842 1053765562 /nfs/dbraw/zinc/76/55/62/1053765562.db2.gz IQABFLKLWFOARN-CMDGGOBGSA-N 2 1 320.480 4.383 20 0 DIADMP Cc1cc(C)c(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)cc1C ZINC001231485758 1053766416 /nfs/dbraw/zinc/76/64/16/1053766416.db2.gz LYPNHJWGQANVMJ-UHFFFAOYSA-N 2 1 300.490 4.062 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3cccs3)CCCCC2)CC[N@H+]1C ZINC000155177619 1053766958 /nfs/dbraw/zinc/76/69/58/1053766958.db2.gz ORXMZOAGVQEWDI-HZPDHXFCSA-N 2 1 306.519 4.022 20 0 DIADMP C[N@@H+](C1CC1)C1CCN(Cc2cccc(-c3ccccc3)c2)CC1 ZINC001231511162 1053775623 /nfs/dbraw/zinc/77/56/23/1053775623.db2.gz JRLKLMQBRJHWKQ-UHFFFAOYSA-N 2 1 320.480 4.412 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2cccs2)cc1 ZINC000155588753 1053783961 /nfs/dbraw/zinc/78/39/61/1053783961.db2.gz GMRZNOCJMJKDLS-AWEZNQCLSA-N 2 1 311.454 4.136 20 0 DIADMP C[NH+]1CCC([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC1 ZINC000156729035 1053821784 /nfs/dbraw/zinc/82/17/84/1053821784.db2.gz ZVCQLPOUUIOANF-UHFFFAOYSA-N 2 1 312.482 4.022 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157152208 1053842072 /nfs/dbraw/zinc/84/20/72/1053842072.db2.gz LSVPRMSAUQUSGM-KRWDZBQOSA-N 2 1 314.498 4.352 20 0 DIADMP Cc1ccc2cc[nH+]c(NC3CCN(c4cc[nH+]cc4)CC3)c2c1 ZINC001354412089 1053858666 /nfs/dbraw/zinc/85/86/66/1053858666.db2.gz KVTXIEBDEFDMNE-UHFFFAOYSA-N 2 1 318.424 4.019 20 0 DIADMP C[NH+](C)[C@@H]1CCCC[C@@H]1Nc1cc[nH+]c2cc(Cl)ccc12 ZINC001327569891 1053864908 /nfs/dbraw/zinc/86/49/08/1053864908.db2.gz OUGRYRPGDRBSSY-DOTOQJQBSA-N 2 1 303.837 4.173 20 0 DIADMP C[NH+](C)C1CC[NH+](Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001231822394 1053874630 /nfs/dbraw/zinc/87/46/30/1053874630.db2.gz KKXFUHIXPJBIEG-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccccn1 ZINC000158648572 1053914104 /nfs/dbraw/zinc/91/41/04/1053914104.db2.gz AKSSKYADNILGMY-SFHVURJKSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC001200713674 1053917515 /nfs/dbraw/zinc/91/75/15/1053917515.db2.gz FOVWHJMAWCIOTA-PBHICJAKSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC001200713674 1053917529 /nfs/dbraw/zinc/91/75/29/1053917529.db2.gz FOVWHJMAWCIOTA-PBHICJAKSA-N 2 1 320.527 4.291 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@@H+](Cc2cc3c[nH+]ccc3[nH]2)C1 ZINC001232013941 1053939412 /nfs/dbraw/zinc/93/94/12/1053939412.db2.gz IEHDTMVEUROPAO-ZDUSSCGKSA-N 2 1 311.816 4.206 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232013745 1053940107 /nfs/dbraw/zinc/94/01/07/1053940107.db2.gz DOBHFDAYYZNYCW-LJQANCHMSA-N 2 1 309.388 4.429 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001232013745 1053940120 /nfs/dbraw/zinc/94/01/20/1053940120.db2.gz DOBHFDAYYZNYCW-LJQANCHMSA-N 2 1 309.388 4.429 20 0 DIADMP Clc1ccc([C@@H]2CC[N@@H+](Cc3cc4c[nH+]ccc4[nH]3)C2)cc1 ZINC001232016204 1053942310 /nfs/dbraw/zinc/94/23/10/1053942310.db2.gz URTIKUXDPBPFMC-CQSZACIVSA-N 2 1 311.816 4.206 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cc(F)cc(C[NH+](C)C)c2)Cc2ccccc21 ZINC001232145268 1053971073 /nfs/dbraw/zinc/97/10/73/1053971073.db2.gz ZWQJAPMGHKQHMD-OAHLLOKOSA-N 2 1 312.432 4.007 20 0 DIADMP CC[N@H+](Cc1cc(F)cc(C[NH+](C)C)c1)Cc1ccccc1F ZINC001232146408 1053971140 /nfs/dbraw/zinc/97/11/40/1053971140.db2.gz PYNBVFLSMAGMIG-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CC[N@@H+](Cc1cc(F)cc(C[NH+](C)C)c1)Cc1ccccc1F ZINC001232146408 1053971155 /nfs/dbraw/zinc/97/11/55/1053971155.db2.gz PYNBVFLSMAGMIG-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC001232145856 1053972287 /nfs/dbraw/zinc/97/22/87/1053972287.db2.gz CHEJQFUFRMPIEH-KRWDZBQOSA-N 2 1 318.461 4.286 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232144058 1053972890 /nfs/dbraw/zinc/97/28/90/1053972890.db2.gz JSTVBCPGFKUWPB-UHFFFAOYSA-N 2 1 314.448 4.298 20 0 DIADMP Cc1cccc(C[N@@H+](C(C)C)C2CCN(C)CC2)c1OC(C)C ZINC001232394617 1054037193 /nfs/dbraw/zinc/03/71/93/1054037193.db2.gz URPYDIDHFUWLQX-UHFFFAOYSA-N 2 1 318.505 4.087 20 0 DIADMP CS[C@@H]1CC[C@@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001200855329 1054042479 /nfs/dbraw/zinc/04/24/79/1054042479.db2.gz YJVLJKYSXICNQQ-QZTJIDSGSA-N 2 1 320.546 4.018 20 0 DIADMP CS[C@H]1CC[C@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001200855330 1054043004 /nfs/dbraw/zinc/04/30/04/1054043004.db2.gz YJVLJKYSXICNQQ-ROUUACIJSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)cc1 ZINC000163534001 1054044681 /nfs/dbraw/zinc/04/46/81/1054044681.db2.gz RFIHQYWAHQVCKM-QGZVFWFLSA-N 2 1 309.457 4.018 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000290287203 1054046892 /nfs/dbraw/zinc/04/68/92/1054046892.db2.gz XRCQPCCQJWGXCP-QUCCMNQESA-N 2 1 323.484 4.035 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CC(C)C)c1cccs1 ZINC000164664296 1054062223 /nfs/dbraw/zinc/06/22/23/1054062223.db2.gz UAUCECPCSICDMA-INIZCTEOSA-N 2 1 305.491 4.410 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000165604331 1054080061 /nfs/dbraw/zinc/08/00/61/1054080061.db2.gz VOAAREYYWDKMTD-HNNXBMFYSA-N 2 1 312.457 4.266 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421708 1054153689 /nfs/dbraw/zinc/15/36/89/1054153689.db2.gz MCLQHKDJEJGSKE-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421708 1054153696 /nfs/dbraw/zinc/15/36/96/1054153696.db2.gz MCLQHKDJEJGSKE-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP Cc1cccnc1CNCc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC001337565854 1054272495 /nfs/dbraw/zinc/27/24/95/1054272495.db2.gz DDKSIKUJMHTORD-GOSISDBHSA-N 2 1 323.484 4.054 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC001337565854 1054272507 /nfs/dbraw/zinc/27/25/07/1054272507.db2.gz DDKSIKUJMHTORD-GOSISDBHSA-N 2 1 323.484 4.054 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC001337565854 1054272512 /nfs/dbraw/zinc/27/25/12/1054272512.db2.gz DDKSIKUJMHTORD-GOSISDBHSA-N 2 1 323.484 4.054 20 0 DIADMP CC[C@@H](C)c1ccc(NC(=[NH2+])NCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000849062168 1054368904 /nfs/dbraw/zinc/36/89/04/1054368904.db2.gz JFNAJUGUXKLTBN-CVEARBPZSA-N 2 1 316.493 4.011 20 0 DIADMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1cccc(Cl)c1 ZINC000173441813 1054484788 /nfs/dbraw/zinc/48/47/88/1054484788.db2.gz JQYCODKLNCUEKJ-KRWDZBQOSA-N 2 1 305.853 4.366 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(-c2ccc(C)cc2)o1 ZINC000174453906 1054507388 /nfs/dbraw/zinc/50/73/88/1054507388.db2.gz ZXRUKIDXEIONRY-UHFFFAOYSA-N 2 1 323.440 4.330 20 0 DIADMP C[N@H+]1CC[C@@H](N[C@@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344394 1054565274 /nfs/dbraw/zinc/56/52/74/1054565274.db2.gz KRTMMDCRRMCKDR-UKRRQHHQSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344394 1054565301 /nfs/dbraw/zinc/56/53/01/1054565301.db2.gz KRTMMDCRRMCKDR-UKRRQHHQSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344394 1054565315 /nfs/dbraw/zinc/56/53/15/1054565315.db2.gz KRTMMDCRRMCKDR-UKRRQHHQSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(-c2cccnc2)cc1 ZINC000623439080 1054595898 /nfs/dbraw/zinc/59/58/98/1054595898.db2.gz VAIHHAORRBRFFE-OXQOHEQNSA-N 2 1 323.484 4.272 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485283 1054604262 /nfs/dbraw/zinc/60/42/62/1054604262.db2.gz USAMAMFLXRTOOX-XJKSGUPXSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1(C)C ZINC000623485283 1054604273 /nfs/dbraw/zinc/60/42/73/1054604273.db2.gz USAMAMFLXRTOOX-XJKSGUPXSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530673 1054614829 /nfs/dbraw/zinc/61/48/29/1054614829.db2.gz HXFYMOPNXXKODV-DGCLKSJQSA-N 2 1 312.910 4.241 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530673 1054614838 /nfs/dbraw/zinc/61/48/38/1054614838.db2.gz HXFYMOPNXXKODV-DGCLKSJQSA-N 2 1 312.910 4.241 20 0 DIADMP Clc1sc(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)c2ccccc12 ZINC001234996390 1054638211 /nfs/dbraw/zinc/63/82/11/1054638211.db2.gz AGNYXFRQNHUTGR-QGZVFWFLSA-N 2 1 320.889 4.130 20 0 DIADMP Clc1sc(C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)c2ccccc12 ZINC001234996390 1054638218 /nfs/dbraw/zinc/63/82/18/1054638218.db2.gz AGNYXFRQNHUTGR-QGZVFWFLSA-N 2 1 320.889 4.130 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CCC[C@@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001234995310 1054638627 /nfs/dbraw/zinc/63/86/27/1054638627.db2.gz ZOMQBTSJHRIXPZ-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001234995310 1054638633 /nfs/dbraw/zinc/63/86/33/1054638633.db2.gz ZOMQBTSJHRIXPZ-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc(C)c1Cl ZINC001235036774 1054644830 /nfs/dbraw/zinc/64/48/30/1054644830.db2.gz BKVHXYQYJNTDAY-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc(C)c1Cl ZINC001235036774 1054644837 /nfs/dbraw/zinc/64/48/37/1054644837.db2.gz BKVHXYQYJNTDAY-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235038419 1054644870 /nfs/dbraw/zinc/64/48/70/1054644870.db2.gz JAUSWELVRAPKSW-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)cc2)c1 ZINC001235092310 1054654767 /nfs/dbraw/zinc/65/47/67/1054654767.db2.gz LROSUZAINQVMOE-UHFFFAOYSA-N 2 1 320.480 4.238 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)c(C)c12 ZINC001235094547 1054656809 /nfs/dbraw/zinc/65/68/09/1054656809.db2.gz ZUTKZIIPEDPQNW-UHFFFAOYSA-N 2 1 320.527 4.155 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC001235095650 1054657224 /nfs/dbraw/zinc/65/72/24/1054657224.db2.gz VEAAAXLHJJQLDA-UHFFFAOYSA-N 2 1 312.501 4.310 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]Cc2c[nH+]ccc2N(C)C)c2ccccc21 ZINC000623706961 1054661896 /nfs/dbraw/zinc/66/18/96/1054661896.db2.gz UFCAAPBUUHNLGD-OALUTQOASA-N 2 1 309.457 4.122 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCCC34CC[NH2+]CC4)cc2)cc1 ZINC001235139798 1054664009 /nfs/dbraw/zinc/66/40/09/1054664009.db2.gz DIPWGABZSMCZPJ-UHFFFAOYSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(C(C[N@H+]2CCCC23CC[NH2+]CC3)c2ccccc2)cc1 ZINC001235140778 1054665269 /nfs/dbraw/zinc/66/52/69/1054665269.db2.gz NLFIQVFRVBJIAL-UHFFFAOYSA-N 2 1 320.480 4.037 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235159035 1054666672 /nfs/dbraw/zinc/66/66/72/1054666672.db2.gz UYVUKRWYGIJUKR-GOSISDBHSA-N 2 1 314.498 4.255 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)s1 ZINC001235155611 1054667060 /nfs/dbraw/zinc/66/70/60/1054667060.db2.gz MCAXUIFISKVCMI-GOSISDBHSA-N 2 1 314.498 4.255 20 0 DIADMP CC(C)(CC[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1)c1ccccc1 ZINC001235155029 1054667139 /nfs/dbraw/zinc/66/71/39/1054667139.db2.gz XPPYTRLCPPMKSD-FQEVSTJZSA-N 2 1 314.517 4.208 20 0 DIADMP c1ccc2cc(C[N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)ccc2c1 ZINC001235152532 1054667477 /nfs/dbraw/zinc/66/74/77/1054667477.db2.gz GKWTXEZNDWOWBJ-NRFANRHFSA-N 2 1 308.469 4.194 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235167294 1054670421 /nfs/dbraw/zinc/67/04/21/1054670421.db2.gz HOEDQRGIVBTTLE-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235167294 1054670427 /nfs/dbraw/zinc/67/04/27/1054670427.db2.gz HOEDQRGIVBTTLE-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190543 1054680220 /nfs/dbraw/zinc/68/02/20/1054680220.db2.gz ZNAQNVCPVXIQAJ-QGZVFWFLSA-N 2 1 318.511 4.004 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190543 1054680225 /nfs/dbraw/zinc/68/02/25/1054680225.db2.gz ZNAQNVCPVXIQAJ-QGZVFWFLSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190543 1054680229 /nfs/dbraw/zinc/68/02/29/1054680229.db2.gz ZNAQNVCPVXIQAJ-QGZVFWFLSA-N 2 1 318.511 4.004 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3cc(-c4ccsc4)cs3)C2)C1 ZINC001235190543 1054680236 /nfs/dbraw/zinc/68/02/36/1054680236.db2.gz ZNAQNVCPVXIQAJ-QGZVFWFLSA-N 2 1 318.511 4.004 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCCC23CC[NH2+]CC3)s1 ZINC001235192042 1054680486 /nfs/dbraw/zinc/68/04/86/1054680486.db2.gz VNVZVQFUZFXPLO-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)s1 ZINC001235266062 1054694075 /nfs/dbraw/zinc/69/40/75/1054694075.db2.gz XFIJKIOFTAORKY-YJBOKZPZSA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)s1 ZINC001235266062 1054694080 /nfs/dbraw/zinc/69/40/80/1054694080.db2.gz XFIJKIOFTAORKY-YJBOKZPZSA-N 2 1 306.519 4.055 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)cc12 ZINC001235274120 1054698288 /nfs/dbraw/zinc/69/82/88/1054698288.db2.gz UUZMJAGTTWBEIB-QAPCUYQASA-N 2 1 322.477 4.238 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@@H]4[NH2+]CC[C@@H]4C3)cc12 ZINC001235274120 1054698290 /nfs/dbraw/zinc/69/82/90/1054698290.db2.gz UUZMJAGTTWBEIB-QAPCUYQASA-N 2 1 322.477 4.238 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@H](C3C[NH2+]C3)C2)CC1 ZINC001235337917 1054702539 /nfs/dbraw/zinc/70/25/39/1054702539.db2.gz LXBJOOVGEQVOHQ-OALUTQOASA-N 2 1 302.506 4.001 20 0 DIADMP C[N@H+](Cc1c(Cl)ccc(Cl)c1Cl)CC1CC[NH2+]CC1 ZINC001235433775 1054717895 /nfs/dbraw/zinc/71/78/95/1054717895.db2.gz PQRLDFSJDSGJLS-UHFFFAOYSA-N 2 1 321.679 4.078 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)CC1CC[NH2+]CC1 ZINC001235433588 1054718540 /nfs/dbraw/zinc/71/85/40/1054718540.db2.gz FJZVBWAVVQKCCJ-QGZVFWFLSA-N 2 1 316.533 4.094 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1C ZINC001235427772 1054719849 /nfs/dbraw/zinc/71/98/49/1054719849.db2.gz OEMCENPMYFGDAL-AEFFLSMTSA-N 2 1 320.908 4.168 20 0 DIADMP C[N@@H+](CCC[NH3+])Cc1ccc(-c2ccc(C(F)(F)F)cc2)cc1 ZINC001235435320 1054722809 /nfs/dbraw/zinc/72/28/09/1054722809.db2.gz JCGALUVQSFFLLQ-UHFFFAOYSA-N 2 1 322.374 4.153 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+](C)C2CC[NH2+]CC2)c1 ZINC001235465957 1054729010 /nfs/dbraw/zinc/72/90/10/1054729010.db2.gz LXUNZEJJYKVVGW-UHFFFAOYSA-N 2 1 308.469 4.154 20 0 DIADMP CCCC[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccccc1 ZINC001235662877 1054765414 /nfs/dbraw/zinc/76/54/14/1054765414.db2.gz CNXXKAWBCROJLD-UHFFFAOYSA-N 2 1 314.498 4.196 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001235674469 1054769012 /nfs/dbraw/zinc/76/90/12/1054769012.db2.gz GHKRHFJMLLCBGP-MRXNPFEDSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)cc1 ZINC001235674787 1054769195 /nfs/dbraw/zinc/76/91/95/1054769195.db2.gz OYVAHUCAMRNOTA-SFHVURJKSA-N 2 1 300.833 4.136 20 0 DIADMP Cc1ccc([C@H]2CCC[N@H+]2Cc2cc3c(s2)C[NH2+]CC3)cc1 ZINC001235677290 1054770293 /nfs/dbraw/zinc/77/02/93/1054770293.db2.gz GGEZAGYWAOYJGC-GOSISDBHSA-N 2 1 312.482 4.039 20 0 DIADMP COc1ccc([C@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001235676630 1054770420 /nfs/dbraw/zinc/77/04/20/1054770420.db2.gz CGYOTCZHFBYGHE-HXUWFJFHSA-N 2 1 316.489 4.145 20 0 DIADMP C/C(=C\c1ccccc1)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000180784381 1054778646 /nfs/dbraw/zinc/77/86/46/1054778646.db2.gz ORGHDKXWYYXBHH-JLAJQXPRSA-N 2 1 310.485 4.039 20 0 DIADMP C/C(=C\c1ccccc1)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000180784381 1054778658 /nfs/dbraw/zinc/77/86/58/1054778658.db2.gz ORGHDKXWYYXBHH-JLAJQXPRSA-N 2 1 310.485 4.039 20 0 DIADMP C/C(=C\c1ccccc1)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000180784381 1054778674 /nfs/dbraw/zinc/77/86/74/1054778674.db2.gz ORGHDKXWYYXBHH-JLAJQXPRSA-N 2 1 310.485 4.039 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)cc1 ZINC001235695044 1054782043 /nfs/dbraw/zinc/78/20/43/1054782043.db2.gz YEXGMLOROFDFAR-GOSISDBHSA-N 2 1 300.833 4.136 20 0 DIADMP CCC[C@H]1CCCC[N@H+]1Cc1sc(C2CC[NH2+]CC2)nc1C ZINC001235694775 1054783592 /nfs/dbraw/zinc/78/35/92/1054783592.db2.gz UDVFWASIUBGAQL-INIZCTEOSA-N 2 1 321.534 4.073 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(Oc2ccccc2)cc1 ZINC001235713967 1054786640 /nfs/dbraw/zinc/78/66/40/1054786640.db2.gz IOZNHBIFMBSQGB-UHFFFAOYSA-N 2 1 324.468 4.300 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@@H+]2CCC[NH2+]C2CCCCC2)c1 ZINC001235713632 1054787049 /nfs/dbraw/zinc/78/70/49/1054787049.db2.gz DKJJGMLKJDPZQC-IBGZPJMESA-N 2 1 304.453 4.275 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)c1 ZINC001235713632 1054787063 /nfs/dbraw/zinc/78/70/63/1054787063.db2.gz DKJJGMLKJDPZQC-IBGZPJMESA-N 2 1 304.453 4.275 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1cccc(-c2ccccc2)c1 ZINC001235717651 1054789813 /nfs/dbraw/zinc/78/98/13/1054789813.db2.gz XILXNCVFBKRIDJ-UHFFFAOYSA-N 2 1 308.469 4.175 20 0 DIADMP Cc1csc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)n1 ZINC000623862489 1054792612 /nfs/dbraw/zinc/79/26/12/1054792612.db2.gz VKAAFXPFLGTUKN-HNNXBMFYSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1csc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)n1 ZINC000623862489 1054792624 /nfs/dbraw/zinc/79/26/24/1054792624.db2.gz VKAAFXPFLGTUKN-HNNXBMFYSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1csc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)n1 ZINC000623862490 1054792649 /nfs/dbraw/zinc/79/26/49/1054792649.db2.gz VKAAFXPFLGTUKN-OAHLLOKOSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1csc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)n1 ZINC000623862490 1054792660 /nfs/dbraw/zinc/79/26/60/1054792660.db2.gz VKAAFXPFLGTUKN-OAHLLOKOSA-N 2 1 317.502 4.143 20 0 DIADMP CC[N@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C1CC[NH2+]CC1 ZINC001235764437 1054801013 /nfs/dbraw/zinc/80/10/13/1054801013.db2.gz CPXVDCZAAUUVAB-UHFFFAOYSA-N 2 1 321.679 4.221 20 0 DIADMP CC[N@@H+](C[C@@H](C)Cc1ccc(C(C)(C)C)cc1)C1CC[NH2+]CC1 ZINC001235762146 1054799882 /nfs/dbraw/zinc/79/98/82/1054799882.db2.gz VIUHSFLDCSAWMU-KRWDZBQOSA-N 2 1 316.533 4.237 20 0 DIADMP CC[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)C1CC[NH2+]CC1 ZINC001235764437 1054801017 /nfs/dbraw/zinc/80/10/17/1054801017.db2.gz CPXVDCZAAUUVAB-UHFFFAOYSA-N 2 1 321.679 4.221 20 0 DIADMP CC[N@@H+](Cc1ccc(Oc2ccccc2)cc1)C1CC[NH2+]CC1 ZINC001235760727 1054801131 /nfs/dbraw/zinc/80/11/31/1054801131.db2.gz JGMOWCMLFJYNSA-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP CC[N@@H+](Cc1ccc(Oc2ccccc2)cc1C)C1CC[NH2+]CC1 ZINC001235764907 1054801434 /nfs/dbraw/zinc/80/14/34/1054801434.db2.gz QDJKQBNZBQDLBD-UHFFFAOYSA-N 2 1 324.468 4.361 20 0 DIADMP CC[N@@H+](Cc1cc(-c2ccsc2)cs1)C1CC[NH2+]CC1 ZINC001235759827 1054801897 /nfs/dbraw/zinc/80/18/97/1054801897.db2.gz AZFLHDUAMOFWAB-UHFFFAOYSA-N 2 1 306.500 4.051 20 0 DIADMP [NH3+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(/C=C/c2ccccc2)cc1 ZINC001235778568 1054803434 /nfs/dbraw/zinc/80/34/34/1054803434.db2.gz OYFXMCRVEGDNQC-LIHCMJDASA-N 2 1 318.464 4.311 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2ccc(/C=C/c3ccccc3)cc2)CC1 ZINC001235788570 1054805982 /nfs/dbraw/zinc/80/59/82/1054805982.db2.gz JIEMILRYULZGIW-BQYQJAHWSA-N 2 1 306.453 4.041 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)s1 ZINC001235808735 1054811753 /nfs/dbraw/zinc/81/17/53/1054811753.db2.gz FVJKASNRIFGSCS-MUJYYYPQSA-N 2 1 306.519 4.325 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)c1 ZINC001235839805 1054820511 /nfs/dbraw/zinc/82/05/11/1054820511.db2.gz YURAERZTUJCENK-CQSZACIVSA-N 2 1 306.862 4.197 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccccc1Cl)C[C@@H]1CC[NH2+]C1 ZINC001235843137 1054821615 /nfs/dbraw/zinc/82/16/15/1054821615.db2.gz WHIYVHSFIISUGG-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP C[N@H+](Cc1ccc2sc3ccccc3c2c1)C[C@@H]1CC[NH2+]C1 ZINC001235842228 1054822814 /nfs/dbraw/zinc/82/28/14/1054822814.db2.gz MSTOPEBNONSPGN-OAHLLOKOSA-N 2 1 310.466 4.096 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+](C)C[C@@H]2CC[NH2+]C2)c1 ZINC001235842968 1054823257 /nfs/dbraw/zinc/82/32/57/1054823257.db2.gz UOOYTTUKQFFZJF-LJQANCHMSA-N 2 1 308.469 4.012 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001235925136 1054848860 /nfs/dbraw/zinc/84/88/60/1054848860.db2.gz CHZDNQQTNRUWTJ-KRWDZBQOSA-N 2 1 314.860 4.320 20 0 DIADMP Cc1cccc(N(C)c2ccc(C[N@H+]3CCC[C@H]3CC[NH3+])cc2)c1 ZINC001235925881 1054849496 /nfs/dbraw/zinc/84/94/96/1054849496.db2.gz QLZLSYFWYGVRFV-FQEVSTJZSA-N 2 1 323.484 4.076 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2C[C@H]3CC[NH2+]C[C@H]3C2)c1 ZINC001235943874 1054861679 /nfs/dbraw/zinc/86/16/79/1054861679.db2.gz ZONFUKXHMXWKDH-RTWAWAEBSA-N 2 1 320.480 4.012 20 0 DIADMP C[N@@H+](CC[C@H]1CCC[NH2+]C1)Cc1sc2ccccc2c1Cl ZINC001235948343 1054864029 /nfs/dbraw/zinc/86/40/29/1054864029.db2.gz MDRUEXOJXVMOKI-CYBMUJFWSA-N 2 1 322.905 4.376 20 0 DIADMP C[N@@H+](Cc1sc2ccccc2c1Cl)CC1(C)CC[NH2+]CC1 ZINC001235947574 1054864123 /nfs/dbraw/zinc/86/41/23/1054864123.db2.gz FNVKUWVFKVTZEP-UHFFFAOYSA-N 2 1 322.905 4.376 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cc2c(s1)C[NH2+]CC2 ZINC001235952543 1054866050 /nfs/dbraw/zinc/86/60/50/1054866050.db2.gz ZFOOVDLENBZNHH-GFCCVEGCSA-N 2 1 320.889 4.240 20 0 DIADMP CCC[C@H](C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)OCC ZINC000624049277 1054866519 /nfs/dbraw/zinc/86/65/19/1054866519.db2.gz CTJCEEYICRHFMD-HNAYVOBHSA-N 2 1 315.461 4.037 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)CCC[NH2+]C2CCCCC2)cc1 ZINC001235950181 1054866892 /nfs/dbraw/zinc/86/68/92/1054866892.db2.gz TWVDPAWPUPDQFR-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001235950891 1054868057 /nfs/dbraw/zinc/86/80/57/1054868057.db2.gz OSLPUFFKTKYRCF-AWEZNQCLSA-N 2 1 314.860 4.179 20 0 DIADMP Cc1cc(C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)ccc1Oc1ccccc1 ZINC001235959476 1054870403 /nfs/dbraw/zinc/87/04/03/1054870403.db2.gz QCUWVJTYXIYYBB-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c1 ZINC001235960294 1054872294 /nfs/dbraw/zinc/87/22/94/1054872294.db2.gz TTWXZTHTFGRFDK-VTYHHJSWSA-N 2 1 320.480 4.140 20 0 DIADMP COc1ccccc1[C@@H](C)[N@H+](C)CCC[NH2+]C1CCCCC1 ZINC001235962240 1054872485 /nfs/dbraw/zinc/87/24/85/1054872485.db2.gz JHCXYBACJTYQGD-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP COc1ccccc1[C@@H](C)[N@@H+](C)CCC[NH2+]C1CCCCC1 ZINC001235962240 1054872491 /nfs/dbraw/zinc/87/24/91/1054872491.db2.gz JHCXYBACJTYQGD-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP CC[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccc(Cl)cc1 ZINC001235963071 1054875457 /nfs/dbraw/zinc/87/54/57/1054875457.db2.gz TXSSHPVKWXUFGD-UHFFFAOYSA-N 2 1 320.889 4.069 20 0 DIADMP C[N@@H+](CC[C@H]1CCC[NH2+]C1)Cc1ccccc1Oc1ccccc1 ZINC001235970111 1054877106 /nfs/dbraw/zinc/87/71/06/1054877106.db2.gz ZDCOVZIJGHHYRB-GOSISDBHSA-N 2 1 324.468 4.300 20 0 DIADMP c1ccc2c(c1)C[N@H+](CCC1CCCCC1)CC21CC[NH2+]CC1 ZINC001235973031 1054877339 /nfs/dbraw/zinc/87/73/39/1054877339.db2.gz KANLVCMEGYEXNI-UHFFFAOYSA-N 2 1 312.501 4.094 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)CC1 ZINC001235975811 1054878528 /nfs/dbraw/zinc/87/85/28/1054878528.db2.gz WZEYMVMYGPNDCP-RTBURBONSA-N 2 1 324.512 4.116 20 0 DIADMP C[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124070 1054884436 /nfs/dbraw/zinc/88/44/36/1054884436.db2.gz WJQGOMQOBFKLLA-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124070 1054884445 /nfs/dbraw/zinc/88/44/45/1054884445.db2.gz WJQGOMQOBFKLLA-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000624124070 1054884456 /nfs/dbraw/zinc/88/44/56/1054884456.db2.gz WJQGOMQOBFKLLA-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1cccc(F)c1)C(C)(C)C ZINC000181056848 1054900088 /nfs/dbraw/zinc/90/00/88/1054900088.db2.gz OYWMHZHVVDDVNX-SFHVURJKSA-N 2 1 317.452 4.488 20 0 DIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000181527449 1054919587 /nfs/dbraw/zinc/91/95/87/1054919587.db2.gz UUSQQUDIARSCOU-STQMWFEESA-N 2 1 306.837 4.079 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000181527449 1054919605 /nfs/dbraw/zinc/91/96/05/1054919605.db2.gz UUSQQUDIARSCOU-STQMWFEESA-N 2 1 306.837 4.079 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001236068456 1054924375 /nfs/dbraw/zinc/92/43/75/1054924375.db2.gz UAHPVGJWGLMRAM-HNNXBMFYSA-N 2 1 310.466 4.096 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000181809487 1054938737 /nfs/dbraw/zinc/93/87/37/1054938737.db2.gz BNVMQHKKXWGSNM-HXUWFJFHSA-N 2 1 311.473 4.493 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1CC[C@H]1CCCC[NH2+]1 ZINC001236108074 1054952542 /nfs/dbraw/zinc/95/25/42/1054952542.db2.gz IGLMHMRJCSCBAD-WBVHZDCISA-N 2 1 304.503 4.078 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)Cc1ccccc1 ZINC000182078533 1054958064 /nfs/dbraw/zinc/95/80/64/1054958064.db2.gz SOAFFUZRXIYMSS-CMKODMSKSA-N 2 1 314.517 4.108 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC001236152542 1054970340 /nfs/dbraw/zinc/97/03/40/1054970340.db2.gz RVJNMFFUZCUUBE-SFHVURJKSA-N 2 1 300.833 4.136 20 0 DIADMP CCC[N@@H+](Cc1ccc(-c2ccc(C)o2)cc1)C1CC[NH2+]CC1 ZINC001236181685 1054980442 /nfs/dbraw/zinc/98/04/42/1054980442.db2.gz ANZRKTIDOSDZHB-UHFFFAOYSA-N 2 1 312.457 4.219 20 0 DIADMP CCC[N@@H+](Cc1ccccc1-c1cccs1)C1CC[NH2+]CC1 ZINC001236181766 1054980838 /nfs/dbraw/zinc/98/08/38/1054980838.db2.gz FCFSLFDDWLXKTC-UHFFFAOYSA-N 2 1 314.498 4.379 20 0 DIADMP CCC[N@@H+](Cc1ccc(OC(C)C)c(Cl)c1)C1CC[NH2+]CC1 ZINC001236181753 1054981037 /nfs/dbraw/zinc/98/10/37/1054981037.db2.gz DEUQMOSOUHPYHO-UHFFFAOYSA-N 2 1 324.896 4.091 20 0 DIADMP CCC[N@@H+](Cc1sc2ccccc2c1C)C1CC[NH2+]CC1 ZINC001236183183 1054981790 /nfs/dbraw/zinc/98/17/90/1054981790.db2.gz WZNFUZZJQFIHPG-UHFFFAOYSA-N 2 1 302.487 4.174 20 0 DIADMP CCC[N@@H+](Cc1cc(Cl)c(Cl)cc1C)C1CC[NH2+]CC1 ZINC001236184724 1054983670 /nfs/dbraw/zinc/98/36/70/1054983670.db2.gz MNEMNBMPTFYRGB-UHFFFAOYSA-N 2 1 315.288 4.266 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001236196355 1054995230 /nfs/dbraw/zinc/99/52/30/1054995230.db2.gz YDBCSPDJPDUNOW-UHFFFAOYSA-N 2 1 314.860 4.008 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001236213310 1055000743 /nfs/dbraw/zinc/00/07/43/1055000743.db2.gz NYOXZNYUTCSLHQ-UHFFFAOYSA-N 2 1 324.468 4.441 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(C)c(Cl)c2Cl)CC1 ZINC001236214913 1055001013 /nfs/dbraw/zinc/00/10/13/1055001013.db2.gz KWCHGDCAPVWYGE-UHFFFAOYSA-N 2 1 315.288 4.264 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(Cl)cc(F)cc2Cl)CC1 ZINC001236214380 1055001404 /nfs/dbraw/zinc/00/14/04/1055001404.db2.gz CGIOCGUBTONWIP-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP C[N@H+](Cc1ccc(SC(F)(F)F)cc1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236211105 1055002161 /nfs/dbraw/zinc/00/21/61/1055002161.db2.gz GZGHASUISWLGRZ-KBPBESRZSA-N 2 1 318.408 4.000 20 0 DIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236211105 1055002177 /nfs/dbraw/zinc/00/21/77/1055002177.db2.gz GZGHASUISWLGRZ-KBPBESRZSA-N 2 1 318.408 4.000 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(C(C)C)c(OC)cc2C)CC1 ZINC001236214831 1055002237 /nfs/dbraw/zinc/00/22/37/1055002237.db2.gz HOXLAHFULQUEFI-UHFFFAOYSA-N 2 1 318.505 4.089 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(Cl)cccc2SC)CC1 ZINC001236216030 1055004746 /nfs/dbraw/zinc/00/47/46/1055004746.db2.gz VWZZNCZOHDDQQN-UHFFFAOYSA-N 2 1 312.910 4.024 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccs2)cc1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236219478 1055008275 /nfs/dbraw/zinc/00/82/75/1055008275.db2.gz WUDULGHFYNOPQT-IAGOWNOFSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccs2)cc1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236219478 1055008286 /nfs/dbraw/zinc/00/82/86/1055008286.db2.gz WUDULGHFYNOPQT-IAGOWNOFSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236219109 1055008448 /nfs/dbraw/zinc/00/84/48/1055008448.db2.gz ULTHBRUYULGZTL-SJLPKXTDSA-N 2 1 313.489 4.167 20 0 DIADMP C[N@@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236219109 1055008459 /nfs/dbraw/zinc/00/84/59/1055008459.db2.gz ULTHBRUYULGZTL-SJLPKXTDSA-N 2 1 313.489 4.167 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222145 1055011967 /nfs/dbraw/zinc/01/19/67/1055011967.db2.gz LIPIUSBCGAXYFZ-VDGAXYAQSA-N 2 1 316.533 4.364 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236221106 1055012485 /nfs/dbraw/zinc/01/24/85/1055012485.db2.gz ASYFQPLCYHOKDL-HDJSIYSDSA-N 2 1 320.786 4.061 20 0 DIADMP C[N@@H+](Cc1ccc(C(F)(F)F)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223327 1055014804 /nfs/dbraw/zinc/01/48/04/1055014804.db2.gz MRSSMRRXSVSHSH-JOCQHMNTSA-N 2 1 320.786 4.061 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)s1 ZINC001236227380 1055016479 /nfs/dbraw/zinc/01/64/79/1055016479.db2.gz DNVLYCFMRHKXME-UHFFFAOYSA-N 2 1 314.498 4.329 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccsc2)Cc2ccccc2)CC1 ZINC001236227730 1055016569 /nfs/dbraw/zinc/01/65/69/1055016569.db2.gz LACKXTAUKOMVBL-UHFFFAOYSA-N 2 1 300.471 4.020 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)CC1 ZINC001236227720 1055017414 /nfs/dbraw/zinc/01/74/14/1055017414.db2.gz KNDIFKLSZZVAGE-UHFFFAOYSA-N 2 1 312.432 4.098 20 0 DIADMP CNc1ccc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)cc1 ZINC001236230538 1055020265 /nfs/dbraw/zinc/02/02/65/1055020265.db2.gz MBNPGXFVFBELGK-UHFFFAOYSA-N 2 1 323.484 4.000 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2Cc2ccc(C[NH3+])cc2)cc1C ZINC001236243830 1055028593 /nfs/dbraw/zinc/02/85/93/1055028593.db2.gz GTSBPVTUTZFHRX-NRFANRHFSA-N 2 1 308.469 4.489 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2CC[C@H]2CCC[NH2+]C2)cc1C ZINC001236244773 1055029714 /nfs/dbraw/zinc/02/97/14/1055029714.db2.gz NBOPWIZCYUBWCH-QUCCMNQESA-N 2 1 300.490 4.220 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CC1 ZINC001236285244 1055048246 /nfs/dbraw/zinc/04/82/46/1055048246.db2.gz DTBYXRWROVNFHA-ICSRJNTNSA-N 2 1 312.501 4.233 20 0 DIADMP c1cc2cc(C[N@@H+](Cc3ccccc3)C3CC[NH2+]CC3)ccc2o1 ZINC001236299022 1055049132 /nfs/dbraw/zinc/04/91/32/1055049132.db2.gz AHCKFAZZONQDRK-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP c1cc2cc(C[N@H+](Cc3ccccc3)C3CC[NH2+]CC3)ccc2o1 ZINC001236299022 1055049151 /nfs/dbraw/zinc/04/91/51/1055049151.db2.gz AHCKFAZZONQDRK-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP c1cc2cccc(C[N@H+](Cc3ccccc3)C3CC[NH2+]CC3)c2o1 ZINC001236300913 1055049961 /nfs/dbraw/zinc/04/99/61/1055049961.db2.gz PXOAZGOEWGSDFY-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP CCCc1ccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1 ZINC001236300516 1055050590 /nfs/dbraw/zinc/05/05/90/1055050590.db2.gz PZXOLRRIJKRPGT-UHFFFAOYSA-N 2 1 322.496 4.393 20 0 DIADMP c1cc2c(cccc2C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)o1 ZINC001236300938 1055050792 /nfs/dbraw/zinc/05/07/92/1055050792.db2.gz QSYFDTMKKYZXTI-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP Cc1ccc([C@H](C)CC[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)o1 ZINC001236371233 1055076919 /nfs/dbraw/zinc/07/69/19/1055076919.db2.gz IICZYVFYJONOGK-SJLPKXTDSA-N 2 1 318.505 4.326 20 0 DIADMP Clc1ccc(CC[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236370456 1055077052 /nfs/dbraw/zinc/07/70/52/1055077052.db2.gz FYMJEXYWXBMSHP-KRWDZBQOSA-N 2 1 320.908 4.127 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)CC1 ZINC001236372589 1055079240 /nfs/dbraw/zinc/07/92/40/1055079240.db2.gz QPURLUCQEAZENY-GBESFXJTSA-N 2 1 304.522 4.223 20 0 DIADMP c1cc2cc(C[N@H+](C[C@@H]3CCC[NH2+]C3)C3CCCC3)ccc2o1 ZINC001236372807 1055079469 /nfs/dbraw/zinc/07/94/69/1055079469.db2.gz DQFFIHLAJMRIRN-QGZVFWFLSA-N 2 1 312.457 4.177 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374124 1055080003 /nfs/dbraw/zinc/08/00/03/1055080003.db2.gz PDZNHOLGPMLFCU-SFHVURJKSA-N 2 1 300.490 4.048 20 0 DIADMP FC(F)c1cccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374053 1055080663 /nfs/dbraw/zinc/08/06/63/1055080663.db2.gz OMLKWNIMLQDTAI-MRXNPFEDSA-N 2 1 322.443 4.368 20 0 DIADMP Fc1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(Cl)c1 ZINC001236373999 1055080867 /nfs/dbraw/zinc/08/08/67/1055080867.db2.gz NQGKFMVXIQPFOF-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(Cl)c1 ZINC001236373999 1055080878 /nfs/dbraw/zinc/08/08/78/1055080878.db2.gz NQGKFMVXIQPFOF-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376970 1055081524 /nfs/dbraw/zinc/08/15/24/1055081524.db2.gz WYWJHLLQRGFYRW-OAHLLOKOSA-N 2 1 322.443 4.017 20 0 DIADMP Cc1cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc(C)c1F ZINC001236376812 1055082805 /nfs/dbraw/zinc/08/28/05/1055082805.db2.gz UNYFSKCEUANBFN-KRWDZBQOSA-N 2 1 318.480 4.187 20 0 DIADMP CCC[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000184900466 1055082852 /nfs/dbraw/zinc/08/28/52/1055082852.db2.gz FXGNIVURZPTLHE-FQEVSTJZSA-N 2 1 311.473 4.035 20 0 DIADMP Clc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236374390 1055083260 /nfs/dbraw/zinc/08/32/60/1055083260.db2.gz QHXARGBVRGVAES-INIZCTEOSA-N 2 1 306.881 4.084 20 0 DIADMP Clc1csc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374593 1055083424 /nfs/dbraw/zinc/08/34/24/1055083424.db2.gz FNBMOORFAVGGEO-CYBMUJFWSA-N 2 1 312.910 4.146 20 0 DIADMP c1cc2cccc(C[N@H+](C[C@H]3CCC[NH2+]C3)C3CCCC3)c2o1 ZINC001236376523 1055083802 /nfs/dbraw/zinc/08/38/02/1055083802.db2.gz SWZLKKWTZBKVDS-INIZCTEOSA-N 2 1 312.457 4.177 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1F ZINC001236376882 1055083826 /nfs/dbraw/zinc/08/38/26/1055083826.db2.gz VMHVDWMFDKFRHG-HNNXBMFYSA-N 2 1 322.443 4.017 20 0 DIADMP CC(C)CSCCC[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185672823 1055095193 /nfs/dbraw/zinc/09/51/93/1055095193.db2.gz AZDJCKJOBYUJRC-SJORKVTESA-N 2 1 312.567 4.008 20 0 DIADMP CC(C)CSCCC[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185672787 1055095647 /nfs/dbraw/zinc/09/56/47/1055095647.db2.gz AZDJCKJOBYUJRC-IAGOWNOFSA-N 2 1 312.567 4.008 20 0 DIADMP C[C@H]([NH2+]CCCc1cccc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185755438 1055096767 /nfs/dbraw/zinc/09/67/67/1055096767.db2.gz PXVHMGZPXPNHIT-FUHWJXTLSA-N 2 1 318.480 4.001 20 0 DIADMP CC[N@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236407809 1055099358 /nfs/dbraw/zinc/09/93/58/1055099358.db2.gz HTHLGAPZGTXLEK-UVIRAJKCSA-N 2 1 320.480 4.288 20 0 DIADMP CC[N@H+](Cc1cccc2c3ccccc3sc21)C[C@@H]1CC[NH2+]C1 ZINC001236407428 1055099506 /nfs/dbraw/zinc/09/95/06/1055099506.db2.gz FHXJLRXFUDZXIE-OAHLLOKOSA-N 2 1 324.493 4.486 20 0 DIADMP CC[N@H+](Cc1cccc2c3ccccc3oc21)C[C@@H]1CC[NH2+]C1 ZINC001236410343 1055102454 /nfs/dbraw/zinc/10/24/54/1055102454.db2.gz YZANKUCFWMJAIO-OAHLLOKOSA-N 2 1 308.425 4.017 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236416329 1055104105 /nfs/dbraw/zinc/10/41/05/1055104105.db2.gz DHDJYEDWTRIXEP-OAHLLOKOSA-N 2 1 310.466 4.238 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236416329 1055104113 /nfs/dbraw/zinc/10/41/13/1055104113.db2.gz DHDJYEDWTRIXEP-OAHLLOKOSA-N 2 1 310.466 4.238 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420837 1055105464 /nfs/dbraw/zinc/10/54/64/1055105464.db2.gz ONNSMMPYTFVNNG-GUYCJALGSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420837 1055105468 /nfs/dbraw/zinc/10/54/68/1055105468.db2.gz ONNSMMPYTFVNNG-GUYCJALGSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420838 1055105644 /nfs/dbraw/zinc/10/56/44/1055105644.db2.gz ONNSMMPYTFVNNG-SUMWQHHRSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420838 1055105648 /nfs/dbraw/zinc/10/56/48/1055105648.db2.gz ONNSMMPYTFVNNG-SUMWQHHRSA-N 2 1 310.466 4.366 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@H]([NH3+])[C@H]2C)c1 ZINC001236423010 1055106916 /nfs/dbraw/zinc/10/69/16/1055106916.db2.gz ZDRQBAOSIUMKIL-XLIONFOSSA-N 2 1 308.469 4.282 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[C@H]([NH3+])[C@H]2C)c1 ZINC001236423010 1055106919 /nfs/dbraw/zinc/10/69/19/1055106919.db2.gz ZDRQBAOSIUMKIL-XLIONFOSSA-N 2 1 308.469 4.282 20 0 DIADMP CSC1(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)CCC1 ZINC000193808380 1055110444 /nfs/dbraw/zinc/11/04/44/1055110444.db2.gz VAGCNAJLLOBIII-CQSZACIVSA-N 2 1 315.486 4.117 20 0 DIADMP CCOC(=[NH2+])c1ccc(-c2ccc(C[NH2+]CC(C)C)cc2)cc1 ZINC001236448495 1055118899 /nfs/dbraw/zinc/11/88/99/1055118899.db2.gz SBZWUUCWBBPATK-UHFFFAOYSA-N 2 1 310.441 4.461 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccccc1C1CC1)C1CC[NH2+]CC1 ZINC001236456673 1055124018 /nfs/dbraw/zinc/12/40/18/1055124018.db2.gz DCURCRYQPWTAHM-UHFFFAOYSA-N 2 1 300.490 4.164 20 0 DIADMP Cc1ccc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c(Cl)c1 ZINC001236456648 1055124942 /nfs/dbraw/zinc/12/49/42/1055124942.db2.gz BRUUVIAGIOFKNJ-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c(Cl)c1 ZINC001236456648 1055124948 /nfs/dbraw/zinc/12/49/48/1055124948.db2.gz BRUUVIAGIOFKNJ-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP CC(C)(C)C[N@H+](Cc1sccc1Cl)C1CC[NH2+]CC1 ZINC001236457842 1055125252 /nfs/dbraw/zinc/12/52/52/1055125252.db2.gz ONFIMLBVWZXCIN-UHFFFAOYSA-N 2 1 300.899 4.002 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1sccc1Cl)C1CC[NH2+]CC1 ZINC001236457842 1055125255 /nfs/dbraw/zinc/12/52/55/1055125255.db2.gz ONFIMLBVWZXCIN-UHFFFAOYSA-N 2 1 300.899 4.002 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380908916 1055135957 /nfs/dbraw/zinc/13/59/57/1055135957.db2.gz JOJVBLZFPFALGC-YZGWKJHDSA-N 2 1 300.490 4.067 20 0 DIADMP COc1cc(C)[nH+]cc1C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001236477207 1055136596 /nfs/dbraw/zinc/13/65/96/1055136596.db2.gz XPPWBLXXUJPNRQ-MOPGFXCFSA-N 2 1 320.436 4.219 20 0 DIADMP COc1cc(C)[nH+]cc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001236477207 1055136603 /nfs/dbraw/zinc/13/66/03/1055136603.db2.gz XPPWBLXXUJPNRQ-MOPGFXCFSA-N 2 1 320.436 4.219 20 0 DIADMP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380927936 1055136936 /nfs/dbraw/zinc/13/69/36/1055136936.db2.gz DJDQQLYYGKXKDI-XUVXKRRUSA-N 2 1 300.490 4.067 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236533955 1055165222 /nfs/dbraw/zinc/16/52/22/1055165222.db2.gz LHUTZRAAKJLSBG-BSWVIFLNSA-N 2 1 304.453 4.254 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000381406407 1055166847 /nfs/dbraw/zinc/16/68/47/1055166847.db2.gz WRQGVVLUBYAGQU-FUHWJXTLSA-N 2 1 314.498 4.229 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCC2)CC2CCC(F)(F)CC2)CC1 ZINC001236539870 1055168486 /nfs/dbraw/zinc/16/84/86/1055168486.db2.gz CIATUYZWEYWEMJ-QAQDUYKDSA-N 2 1 314.464 4.184 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3ccoc32)CC2CCC2)CC1 ZINC001236540145 1055168675 /nfs/dbraw/zinc/16/86/75/1055168675.db2.gz INZLJPCHDYSSMB-WGSAOQKQSA-N 2 1 312.457 4.305 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3occc32)CC2CCC2)CC1 ZINC001236540096 1055168865 /nfs/dbraw/zinc/16/88/65/1055168865.db2.gz GORBKDZUYSWXMC-IYARVYRRSA-N 2 1 312.457 4.305 20 0 DIADMP Cc1cc(C)c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236541539 1055170245 /nfs/dbraw/zinc/17/02/45/1055170245.db2.gz LZLNLVPXBJYMGY-MXVIHJGJSA-N 2 1 314.517 4.484 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc(Cl)ccc2F)CC2CCC2)CC1 ZINC001236542154 1055170552 /nfs/dbraw/zinc/17/05/52/1055170552.db2.gz OOHQNNMJVMDBQY-QAQDUYKDSA-N 2 1 324.871 4.351 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc(F)cc(Cl)c2)CC2CCC2)CC1 ZINC001236540847 1055171003 /nfs/dbraw/zinc/17/10/03/1055171003.db2.gz DGYUNUWKBUMJPO-IYARVYRRSA-N 2 1 324.871 4.351 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cnc3ccccc3c2)CC2CCC2)CC1 ZINC001236542112 1055171246 /nfs/dbraw/zinc/17/12/46/1055171246.db2.gz OFLCQPPYROHZRY-MXVIHJGJSA-N 2 1 323.484 4.107 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236543045 1055172254 /nfs/dbraw/zinc/17/22/54/1055172254.db2.gz LXLRVQISXHYTFH-UAPYVXQJSA-N 2 1 317.521 4.184 20 0 DIADMP CC(C)C[N@@H+](CCCCc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236549926 1055177524 /nfs/dbraw/zinc/17/75/24/1055177524.db2.gz CUVMTHUXENYMNK-MXVIHJGJSA-N 2 1 302.506 4.237 20 0 DIADMP Cc1cccc(Cl)c1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550910 1055177693 /nfs/dbraw/zinc/17/76/93/1055177693.db2.gz OMJBNTJRWZITQK-WKILWMFISA-N 2 1 308.897 4.376 20 0 DIADMP Cc1ccc2[nH]c(C[N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)cc2c1 ZINC001236550209 1055178067 /nfs/dbraw/zinc/17/80/67/1055178067.db2.gz IPZZTNJZUSRPIE-UAPYVXQJSA-N 2 1 313.489 4.204 20 0 DIADMP CC(C)C[N@@H+](CCc1cccc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550404 1055178172 /nfs/dbraw/zinc/17/81/72/1055178172.db2.gz IATZQFIAVNOMMT-IYARVYRRSA-N 2 1 308.897 4.110 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551883 1055179974 /nfs/dbraw/zinc/17/99/74/1055179974.db2.gz NLISLKGEQKLDIJ-IYARVYRRSA-N 2 1 308.897 4.376 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccc(Cl)cc2)CC2CC2)CC1 ZINC001236551777 1055180099 /nfs/dbraw/zinc/18/00/99/1055180099.db2.gz NIYZIWAZMMKZJE-WGSAOQKQSA-N 2 1 320.908 4.255 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381791630 1055181054 /nfs/dbraw/zinc/18/10/54/1055181054.db2.gz LMDBSEMUXSPTMF-QXAKKESOSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1csc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236553232 1055181547 /nfs/dbraw/zinc/18/15/47/1055181547.db2.gz UWXQBPXOJVFYBD-HDJSIYSDSA-N 2 1 312.910 4.192 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc3ccccc3s2)CC2CC2)CC1 ZINC001236553201 1055181878 /nfs/dbraw/zinc/18/18/78/1055181878.db2.gz UJXLWKNXLIAHIJ-QAQDUYKDSA-N 2 1 314.498 4.383 20 0 DIADMP Cc1cc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc(C)c1F ZINC001236553249 1055182001 /nfs/dbraw/zinc/18/20/01/1055182001.db2.gz YVXWBGKRZPGRSG-IYARVYRRSA-N 2 1 306.469 4.170 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236553161 1055182289 /nfs/dbraw/zinc/18/22/89/1055182289.db2.gz XKTDWAPSPITFMW-WKILWMFISA-N 2 1 324.871 4.269 20 0 DIADMP Cc1ccccc1C[N@@H+](Cc1cccs1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236556177 1055183614 /nfs/dbraw/zinc/18/36/14/1055183614.db2.gz SBFSOFSBEBNNBW-IYARVYRRSA-N 2 1 314.498 4.329 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236565668 1055186326 /nfs/dbraw/zinc/18/63/26/1055186326.db2.gz LYKZPRQBGBCLML-JCNLHEQBSA-N 2 1 306.519 4.461 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cs1 ZINC001236566529 1055186498 /nfs/dbraw/zinc/18/64/98/1055186498.db2.gz WZIWKXYPXFOORG-SAABIXHNSA-N 2 1 306.519 4.461 20 0 DIADMP COC1CCC(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236565656 1055186692 /nfs/dbraw/zinc/18/66/92/1055186692.db2.gz LHWRMSVDHWMIAJ-SQQACZLQSA-N 2 1 322.537 4.096 20 0 DIADMP C[C@@H]1CC(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@@H](C)O1 ZINC001236565487 1055186763 /nfs/dbraw/zinc/18/67/63/1055186763.db2.gz HYABALSSSHXRQT-QQTQMKHKSA-N 2 1 322.537 4.095 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000381859780 1055187264 /nfs/dbraw/zinc/18/72/64/1055187264.db2.gz IJCYTRSVIDTDFG-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236566518 1055187748 /nfs/dbraw/zinc/18/77/48/1055187748.db2.gz JUGDWUKFSNZVHG-SAABIXHNSA-N 2 1 304.453 4.149 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccnc(Cl)c2)C2CCCCC2)CC1 ZINC001236566695 1055187798 /nfs/dbraw/zinc/18/77/98/1055187798.db2.gz BIRSOENILKYZRZ-JCNLHEQBSA-N 2 1 321.896 4.140 20 0 DIADMP CC(C)(C)c1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)[nH]1 ZINC001236566996 1055188471 /nfs/dbraw/zinc/18/84/71/1055188471.db2.gz QLWOIMFHJICIFP-RZDIXWSQSA-N 2 1 317.521 4.327 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1O ZINC001236567435 1055188590 /nfs/dbraw/zinc/18/85/90/1055188590.db2.gz MMYYTNMQFSWDGJ-UAPYVXQJSA-N 2 1 316.489 4.105 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3cc[nH]c3c2)C2CCCC2)CC1 ZINC001236566757 1055188682 /nfs/dbraw/zinc/18/86/82/1055188682.db2.gz LBGTWHRJSCVPBK-UAPYVXQJSA-N 2 1 311.473 4.182 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cccc(Cl)c2)C2CCC2)CC1 ZINC001236571894 1055193035 /nfs/dbraw/zinc/19/30/35/1055193035.db2.gz JNYMZXSTEDERMW-SAABIXHNSA-N 2 1 306.881 4.007 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)c(Cl)c2)C2CCC2)CC1 ZINC001236571923 1055193239 /nfs/dbraw/zinc/19/32/39/1055193239.db2.gz KFKABMCGTKITIQ-CTYIDZIISA-N 2 1 310.844 4.104 20 0 DIADMP COc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236572557 1055193963 /nfs/dbraw/zinc/19/39/63/1055193963.db2.gz ZUEQRVWIDBLLFZ-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP Cc1csc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236572481 1055193979 /nfs/dbraw/zinc/19/39/79/1055193979.db2.gz QASVGYMHVQQKAJ-MQMHXKEQSA-N 2 1 312.910 4.334 20 0 DIADMP C[C@H](CCCC(C)(C)O)CC[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236573250 1055195451 /nfs/dbraw/zinc/19/54/51/1055195451.db2.gz ZXMUDMBBKMLQEO-ZHALLVOQSA-N 2 1 324.553 4.078 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236576165 1055196917 /nfs/dbraw/zinc/19/69/17/1055196917.db2.gz CRZCRHXLCZSWFT-SAABIXHNSA-N 2 1 304.453 4.067 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C[C@@H]3CCC[NH2+]C3)C3CC3)cc2)o1 ZINC001236601146 1055200589 /nfs/dbraw/zinc/20/05/89/1055200589.db2.gz KXYIWAUXKXEUGY-GOSISDBHSA-N 2 1 324.468 4.219 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236599786 1055202427 /nfs/dbraw/zinc/20/24/27/1055202427.db2.gz CWSJRZJRQNJAKR-OAHLLOKOSA-N 2 1 314.498 4.174 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)cc1 ZINC001236598209 1055202675 /nfs/dbraw/zinc/20/26/75/1055202675.db2.gz ILBAHRVFEXZJDE-GOSISDBHSA-N 2 1 320.480 4.318 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236604851 1055203413 /nfs/dbraw/zinc/20/34/13/1055203413.db2.gz PWSCRPRWHRXCEX-IBGZPJMESA-N 2 1 314.860 4.178 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236604313 1055203761 /nfs/dbraw/zinc/20/37/61/1055203761.db2.gz LUTVLDQOXUANOK-IBGZPJMESA-N 2 1 310.466 4.225 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001236616464 1055205911 /nfs/dbraw/zinc/20/59/11/1055205911.db2.gz NRUCAKIPLDEXNL-IBGZPJMESA-N 2 1 314.860 4.178 20 0 DIADMP CCC(C)(C)c1ccc(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)cc1 ZINC001236636784 1055208907 /nfs/dbraw/zinc/20/89/07/1055208907.db2.gz IXQBTGULRVIBPR-UHFFFAOYSA-N 2 1 314.517 4.481 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)C[C@H]1CCC[NH2+]C1 ZINC001236661306 1055217536 /nfs/dbraw/zinc/21/75/36/1055217536.db2.gz BVQPSAYSCDWCNE-VQTJNVASSA-N 2 1 302.506 4.109 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2)CC2CCCCC2)CC1 ZINC001236681662 1055227511 /nfs/dbraw/zinc/22/75/11/1055227511.db2.gz INZXUWYFDHVWCM-MXVIHJGJSA-N 2 1 300.490 4.339 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2cccc3sccc32)CC1 ZINC001236680865 1055228540 /nfs/dbraw/zinc/22/85/40/1055228540.db2.gz DUNUVUAHXLHWLY-UHFFFAOYSA-N 2 1 314.498 4.352 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2cccc(F)c2)CC1 ZINC001236682242 1055230122 /nfs/dbraw/zinc/23/01/22/1055230122.db2.gz QLKDPNCPUABXQG-MXVIHJGJSA-N 2 1 312.432 4.098 20 0 DIADMP CNc1ccc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236694346 1055231383 /nfs/dbraw/zinc/23/13/83/1055231383.db2.gz MBNPGXFVFBELGK-XUTJKUGGSA-N 2 1 323.484 4.000 20 0 DIADMP COc1ccccc1C[N@@H+](CCCC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236700605 1055232539 /nfs/dbraw/zinc/23/25/39/1055232539.db2.gz MBRIHOLURXHNSF-WGSAOQKQSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1cccc(C[N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236727544 1055244608 /nfs/dbraw/zinc/24/46/08/1055244608.db2.gz VUBUYKOIZRZCRP-MXVIHJGJSA-N 2 1 300.490 4.257 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2ccsc2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236726672 1055244637 /nfs/dbraw/zinc/24/46/37/1055244637.db2.gz MWTZMSDIOXCOMD-WGSAOQKQSA-N 2 1 314.498 4.329 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc2occc21 ZINC001236739715 1055248145 /nfs/dbraw/zinc/24/81/45/1055248145.db2.gz OVJRBOQCVQEJOZ-ROUUACIJSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc2occc21 ZINC001236739715 1055248153 /nfs/dbraw/zinc/24/81/53/1055248153.db2.gz OVJRBOQCVQEJOZ-ROUUACIJSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc2occc21 ZINC001236739715 1055248162 /nfs/dbraw/zinc/24/81/62/1055248162.db2.gz OVJRBOQCVQEJOZ-ROUUACIJSA-N 2 1 312.457 4.272 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc2[nH]ccc21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236765978 1055250270 /nfs/dbraw/zinc/25/02/70/1055250270.db2.gz BUPCORJERSYQEM-QAQDUYKDSA-N 2 1 313.489 4.286 20 0 DIADMP Cc1csc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)n1 ZINC001236756375 1055250898 /nfs/dbraw/zinc/25/08/98/1055250898.db2.gz VLVODZFZIDUZAB-QAQDUYKDSA-N 2 1 321.534 4.104 20 0 DIADMP Cc1cncc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236754176 1055251220 /nfs/dbraw/zinc/25/12/20/1055251220.db2.gz DDOWPXUVWIYIQB-MXVIHJGJSA-N 2 1 315.505 4.042 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(F)c(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767803 1055251840 /nfs/dbraw/zinc/25/18/40/1055251840.db2.gz KDJAPCUUYPFIMJ-SHTZXODSSA-N 2 1 310.432 4.083 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(F)c2)CC2CCCCC2)CC1 ZINC001236756456 1055251979 /nfs/dbraw/zinc/25/19/79/1055251979.db2.gz WMMRUGWMAZAOMR-MXVIHJGJSA-N 2 1 318.480 4.478 20 0 DIADMP CS[C@@H](C)CC[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236755219 1055252283 /nfs/dbraw/zinc/25/22/83/1055252283.db2.gz MGGVKIBEIWUXCZ-SZMVWBNQSA-N 2 1 312.567 4.280 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236765902 1055252942 /nfs/dbraw/zinc/25/29/42/1055252942.db2.gz BLMDDWYCDDLYKE-SHTZXODSSA-N 2 1 324.459 4.391 20 0 DIADMP CCCCc1ncc(C[N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)[nH]1 ZINC001236781531 1055253944 /nfs/dbraw/zinc/25/39/44/1055253944.db2.gz FRBCZPNAUWVBTD-RZDIXWSQSA-N 2 1 320.525 4.013 20 0 DIADMP CCCCc1nc(C[N@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)c[nH]1 ZINC001236781531 1055253956 /nfs/dbraw/zinc/25/39/56/1055253956.db2.gz FRBCZPNAUWVBTD-RZDIXWSQSA-N 2 1 320.525 4.013 20 0 DIADMP CCCCc1nc(C[N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)c[nH]1 ZINC001236781531 1055253960 /nfs/dbraw/zinc/25/39/60/1055253960.db2.gz FRBCZPNAUWVBTD-RZDIXWSQSA-N 2 1 320.525 4.013 20 0 DIADMP CC(C)(C)C[N@@H+](CCc1cc(F)cc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768835 1055254151 /nfs/dbraw/zinc/25/41/51/1055254151.db2.gz QXULKQGXCYGXQC-IYARVYRRSA-N 2 1 324.459 4.125 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1c(F)cccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768083 1055254680 /nfs/dbraw/zinc/25/46/80/1055254680.db2.gz MLTMANUTSZBSJJ-HDJSIYSDSA-N 2 1 310.432 4.083 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(N(C)C)s1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781142 1055255053 /nfs/dbraw/zinc/25/50/53/1055255053.db2.gz AGYLOJZVUKYBQK-KOMQPUFPSA-N 2 1 323.550 4.075 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc2ccccc2[nH]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782099 1055257224 /nfs/dbraw/zinc/25/72/24/1055257224.db2.gz MOQBOGQVCBNCJC-RUCARUNLSA-N 2 1 313.489 4.428 20 0 DIADMP CCOc1ccccc1C[N@@H+](C(CC)CC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783622 1055257312 /nfs/dbraw/zinc/25/73/12/1055257312.db2.gz VXGKAIJYXOBHIV-UAPYVXQJSA-N 2 1 318.505 4.346 20 0 DIADMP Cc1nc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc1Cl ZINC001236782846 1055258044 /nfs/dbraw/zinc/25/80/44/1055258044.db2.gz LBBQXBSSTIWQMK-KOMQPUFPSA-N 2 1 323.912 4.161 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(F)ccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782981 1055258375 /nfs/dbraw/zinc/25/83/75/1055258375.db2.gz VXOWKNKJFGJTNX-SAABIXHNSA-N 2 1 322.468 4.095 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(SC(F)F)cc1 ZINC000764806679 1055264729 /nfs/dbraw/zinc/26/47/29/1055264729.db2.gz PKDAMIABGDUWQM-ZDUSSCGKSA-N 2 1 316.461 4.382 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(SC(F)F)cc1 ZINC000764806679 1055264748 /nfs/dbraw/zinc/26/47/48/1055264748.db2.gz PKDAMIABGDUWQM-ZDUSSCGKSA-N 2 1 316.461 4.382 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(Cl)c(C)n1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236798543 1055266784 /nfs/dbraw/zinc/26/67/84/1055266784.db2.gz MRFRYPQFMRPXQE-CZIWCDLHSA-N 2 1 323.912 4.304 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccc4sc5ccccc5c4c3)C[C@H]12 ZINC001236827867 1055280174 /nfs/dbraw/zinc/28/01/74/1055280174.db2.gz HCXKJVSXXSUTDG-JCGIZDLHSA-N 2 1 322.477 4.224 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc4sc5ccccc5c4c3)C[C@H]12 ZINC001236827865 1055280442 /nfs/dbraw/zinc/28/04/42/1055280442.db2.gz HCXKJVSXXSUTDG-FHLIZLRMSA-N 2 1 322.477 4.224 20 0 DIADMP CCCCCCc1csc(C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1 ZINC001236826989 1055281833 /nfs/dbraw/zinc/28/18/33/1055281833.db2.gz DNPXZOZCUDGQDQ-JQHSSLGASA-N 2 1 306.519 4.040 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2ccccc2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236834298 1055284611 /nfs/dbraw/zinc/28/46/11/1055284611.db2.gz GRXCSSLCIHEPGD-IBGZPJMESA-N 2 1 308.469 4.175 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2ccccc2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236834299 1055284980 /nfs/dbraw/zinc/28/49/80/1055284980.db2.gz GRXCSSLCIHEPGD-LJQANCHMSA-N 2 1 308.469 4.175 20 0 DIADMP CC(C)[N@@H+](Cc1ccc2c(c1)CC[NH2+]C2)[C@@H](C)c1ccccc1 ZINC001236858582 1055294335 /nfs/dbraw/zinc/29/43/35/1055294335.db2.gz DFPANBSUPMQBCK-KRWDZBQOSA-N 2 1 308.469 4.304 20 0 DIADMP CC(C)[N@@H+](Cc1ccc2c(c1)C[NH2+]CC2)[C@@H](C)c1ccccc1 ZINC001236858977 1055294422 /nfs/dbraw/zinc/29/44/22/1055294422.db2.gz GBOLIFXVLOAJLQ-KRWDZBQOSA-N 2 1 308.469 4.304 20 0 DIADMP CC[C@H]([NH3+])C[N@H+](C)Cc1ccccc1-c1ccccc1Cl ZINC001236868946 1055298742 /nfs/dbraw/zinc/29/87/42/1055298742.db2.gz SCJXSBHDCJOECR-HNNXBMFYSA-N 2 1 302.849 4.176 20 0 DIADMP CC[C@H]([NH3+])C[N@@H+](C)Cc1ccccc1-c1ccccc1Cl ZINC001236868946 1055298758 /nfs/dbraw/zinc/29/87/58/1055298758.db2.gz SCJXSBHDCJOECR-HNNXBMFYSA-N 2 1 302.849 4.176 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccnc(Cl)c1 ZINC000764969998 1055307159 /nfs/dbraw/zinc/30/71/59/1055307159.db2.gz DIJQEXOXUADZAP-OWCLPIDISA-N 2 1 323.912 4.144 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccc(-n3ccnc3)c(Cl)c2)CC1 ZINC001236909871 1055309294 /nfs/dbraw/zinc/30/92/94/1055309294.db2.gz YWFKTFNYRKMKHC-AWEZNQCLSA-N 2 1 303.837 4.148 20 0 DIADMP Clc1cc(-n2ccnc2)ccc1C[N@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001236915058 1055315779 /nfs/dbraw/zinc/31/57/79/1055315779.db2.gz BDBKFMRCALFJSH-GJZGRUSLSA-N 2 1 315.848 4.148 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001237059203 1055354008 /nfs/dbraw/zinc/35/40/08/1055354008.db2.gz RQMCIHPCMXVEED-FQEVSTJZSA-N 2 1 312.432 4.054 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001237057818 1055354125 /nfs/dbraw/zinc/35/41/25/1055354125.db2.gz NQWQBLBVXWXRTP-SFHVURJKSA-N 2 1 318.848 4.161 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@](C)(C[NH3+])C2)cc1 ZINC001237057840 1055355016 /nfs/dbraw/zinc/35/50/16/1055355016.db2.gz NUNXBEGMUIKUKV-FXAWDEMLSA-N 2 1 302.506 4.049 20 0 DIADMP CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCC[C@](C)(C[NH3+])C1 ZINC001237056036 1055355803 /nfs/dbraw/zinc/35/58/03/1055355803.db2.gz FUAMPSPHNNXKEU-HXUWFJFHSA-N 2 1 313.489 4.026 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@@](C)(C[NH3+])C2)cc1 ZINC001237058503 1055356844 /nfs/dbraw/zinc/35/68/44/1055356844.db2.gz QEEJXQSBVJPROL-FQEVSTJZSA-N 2 1 318.505 4.207 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1-c1ccc(F)cc1 ZINC001237082549 1055362203 /nfs/dbraw/zinc/36/22/03/1055362203.db2.gz RXRODVMEBJOABJ-DFVIVQSZSA-N 2 1 324.443 4.194 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(Oc2ccccc2)cc1 ZINC001237080189 1055364427 /nfs/dbraw/zinc/36/44/27/1055364427.db2.gz DOGWWQALBMEUJM-YQQQUEKLSA-N 2 1 322.452 4.181 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc2c3ccccc3oc21 ZINC001237080644 1055364562 /nfs/dbraw/zinc/36/45/62/1055364562.db2.gz ANVXZIQPFRIAAE-ZXFUBFMLSA-N 2 1 320.436 4.288 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@](C)(C[NH3+])C3)cc2)c1 ZINC001237080662 1055364844 /nfs/dbraw/zinc/36/48/44/1055364844.db2.gz HNRDMZDAYQLEQR-OAQYLSRUSA-N 2 1 308.469 4.223 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(F)c(-c3ccccc3)c2)C1 ZINC001237079703 1055365027 /nfs/dbraw/zinc/36/50/27/1055365027.db2.gz ABKIUOGOJMSIHY-HXUWFJFHSA-N 2 1 312.432 4.054 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2ccc(C3CCC3)cc2)CC1 ZINC001237109322 1055374432 /nfs/dbraw/zinc/37/44/32/1055374432.db2.gz ZCBMPMUQDXTLRL-UHFFFAOYSA-N 2 1 312.501 4.404 20 0 DIADMP CC(C)(C)Oc1ccc([C@@H]2CC[N@@H+](CCCCCC[NH3+])C2)cc1 ZINC001237262958 1055410824 /nfs/dbraw/zinc/41/08/24/1055410824.db2.gz AAPRFPMYFUZSNP-GOSISDBHSA-N 2 1 318.505 4.172 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](C1CCCC1)C1CCN(C)CC1 ZINC001237333491 1055431371 /nfs/dbraw/zinc/43/13/71/1055431371.db2.gz LFBVFHOYMLICBU-UHFFFAOYSA-N 2 1 318.480 4.281 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)s2)c1 ZINC001237389387 1055443993 /nfs/dbraw/zinc/44/39/93/1055443993.db2.gz FZUJQXGAQAWRLD-UKRRQHHQSA-N 2 1 318.511 4.051 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)s2)c1 ZINC001237389387 1055444002 /nfs/dbraw/zinc/44/40/02/1055444002.db2.gz FZUJQXGAQAWRLD-UKRRQHHQSA-N 2 1 318.511 4.051 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)c2)cc1 ZINC001237380203 1055444988 /nfs/dbraw/zinc/44/49/88/1055444988.db2.gz FYHHBLALAFFNMI-WIYYLYMNSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)c2)cc1 ZINC001237380203 1055444996 /nfs/dbraw/zinc/44/49/96/1055444996.db2.gz FYHHBLALAFFNMI-WIYYLYMNSA-N 2 1 322.452 4.053 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]C2CCC(C)CC2)C[N@H+]1Cc1ccccc1 ZINC001620864099 1055491623 /nfs/dbraw/zinc/49/16/23/1055491623.db2.gz ODNACEAUJFVPHN-WNKNEZEQSA-N 2 1 314.517 4.455 20 0 DIADMP C[NH+](C)CCC[N@H+](C)Cc1ccc(-c2ccc(F)cc2F)cc1 ZINC001237663666 1055497546 /nfs/dbraw/zinc/49/75/46/1055497546.db2.gz UTEKNWDOUXQISR-UHFFFAOYSA-N 2 1 318.411 4.015 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)Cc1ccc(-c2ccc(F)cc2F)cc1 ZINC001237663666 1055497556 /nfs/dbraw/zinc/49/75/56/1055497556.db2.gz UTEKNWDOUXQISR-UHFFFAOYSA-N 2 1 318.411 4.015 20 0 DIADMP Cc1cc(C[N@@H+](C)CC2CC[NH+](C)CC2)c(Cl)cc1Cl ZINC001237704471 1055510448 /nfs/dbraw/zinc/51/04/48/1055510448.db2.gz ZLKJXJJLYNQSFA-UHFFFAOYSA-N 2 1 315.288 4.075 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001620910972 1055534712 /nfs/dbraw/zinc/53/47/12/1055534712.db2.gz PCEMCDQOBVPXKF-SJLPKXTDSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001620910972 1055534726 /nfs/dbraw/zinc/53/47/26/1055534726.db2.gz PCEMCDQOBVPXKF-SJLPKXTDSA-N 2 1 314.517 4.311 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)CC1(C)C ZINC001620926645 1055545862 /nfs/dbraw/zinc/54/58/62/1055545862.db2.gz AAEQPPBYVPKUAQ-QRVBRYPASA-N 2 1 300.490 4.175 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CC[C@H]4CCC[C@H]4C3)cc21 ZINC001237875565 1055547409 /nfs/dbraw/zinc/54/74/09/1055547409.db2.gz APZDLNBREZTJRG-MJGOQNOKSA-N 2 1 310.485 4.310 20 0 DIADMP Cc1ccc(C[N@@H+](C)Cc2ccc3c(c2)C(C(C)C)=[NH+]CC3)cn1 ZINC001237889910 1055552209 /nfs/dbraw/zinc/55/22/09/1055552209.db2.gz QKSVPUNVGTYVNZ-UHFFFAOYSA-N 2 1 321.468 4.023 20 0 DIADMP Cc1ccc(C[N@H+](C)Cc2ccc3c(c2)C(C(C)C)=[NH+]CC3)cn1 ZINC001237889910 1055552216 /nfs/dbraw/zinc/55/22/16/1055552216.db2.gz QKSVPUNVGTYVNZ-UHFFFAOYSA-N 2 1 321.468 4.023 20 0 DIADMP CC(C)[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000387442296 1055584926 /nfs/dbraw/zinc/58/49/26/1055584926.db2.gz PFFIRWDSZLQEMF-HOCLYGCPSA-N 2 1 314.395 4.086 20 0 DIADMP CC(C)[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000387442296 1055584937 /nfs/dbraw/zinc/58/49/37/1055584937.db2.gz PFFIRWDSZLQEMF-HOCLYGCPSA-N 2 1 314.395 4.086 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@@H+]1Cc1cccc2c[nH+]cn21 ZINC001238111935 1055608309 /nfs/dbraw/zinc/60/83/09/1055608309.db2.gz ZDIJTUWKQOKNDE-GOSISDBHSA-N 2 1 323.465 4.393 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1Cc1cccc2c[nH+]cn21 ZINC001238111935 1055608316 /nfs/dbraw/zinc/60/83/16/1055608316.db2.gz ZDIJTUWKQOKNDE-GOSISDBHSA-N 2 1 323.465 4.393 20 0 DIADMP C[N@H+](Cc1cccc2ccccc21)Cc1cccc2c[nH+]cn21 ZINC001238112157 1055609079 /nfs/dbraw/zinc/60/90/79/1055609079.db2.gz BNGHYVFBLDDVQO-UHFFFAOYSA-N 2 1 301.393 4.120 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(F)c(C3CC3)c2)CC1 ZINC001238503254 1055673984 /nfs/dbraw/zinc/67/39/84/1055673984.db2.gz YXULKLPSZPABPX-UHFFFAOYSA-N 2 1 318.480 4.255 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC000058061041 1055794905 /nfs/dbraw/zinc/79/49/05/1055794905.db2.gz ULTVQZMGCOXJSE-LJQANCHMSA-N 2 1 308.469 4.174 20 0 DIADMP c1ccc(CC[N@H+]2CC[C@H](C[NH2+]CC3CCCCCC3)C2)cc1 ZINC001620770259 1055938062 /nfs/dbraw/zinc/93/80/62/1055938062.db2.gz HBVLEUJAXAOQKE-OAQYLSRUSA-N 2 1 314.517 4.111 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C/C=C\c2cccc(F)c2)c1 ZINC001620778447 1055946994 /nfs/dbraw/zinc/94/69/94/1055946994.db2.gz UQZFQNKEHPWBAA-POHAHGRESA-N 2 1 312.432 4.080 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@H]3[C@@H](CC[NH+]3C)C2)c(C(C)C)c1 ZINC001620506728 1055961990 /nfs/dbraw/zinc/96/19/90/1055961990.db2.gz MPGOIKMXGXJCDL-FPOVZHCZSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)c(C(C)C)c1 ZINC001620506728 1055962003 /nfs/dbraw/zinc/96/20/03/1055962003.db2.gz MPGOIKMXGXJCDL-FPOVZHCZSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c(C(C)C)c1 ZINC001620506728 1055962014 /nfs/dbraw/zinc/96/20/14/1055962014.db2.gz MPGOIKMXGXJCDL-FPOVZHCZSA-N 2 1 314.517 4.459 20 0 DIADMP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506605 1055962790 /nfs/dbraw/zinc/96/27/90/1055962790.db2.gz JMUZBJVNPQAWMB-NHCUHLMSSA-N 2 1 312.501 4.260 20 0 DIADMP C[N@H+]1CC[C@@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506605 1055962800 /nfs/dbraw/zinc/96/28/00/1055962800.db2.gz JMUZBJVNPQAWMB-NHCUHLMSSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506605 1055962808 /nfs/dbraw/zinc/96/28/08/1055962808.db2.gz JMUZBJVNPQAWMB-NHCUHLMSSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccc(C4CCCCC4)cc3)CC[C@H]21 ZINC001620506605 1055962818 /nfs/dbraw/zinc/96/28/18/1055962818.db2.gz JMUZBJVNPQAWMB-NHCUHLMSSA-N 2 1 312.501 4.260 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H]1CCC[C@@H](SC)C1)C1CCCCC1 ZINC001620997130 1055965247 /nfs/dbraw/zinc/96/52/47/1055965247.db2.gz XTDDAXJZKVSDOA-FUHWJXTLSA-N 2 1 312.567 4.295 20 0 DIADMP CC[N@@H+](CCCNCc1ccc(F)c(F)c1)C1CCCCC1 ZINC001620996164 1055965588 /nfs/dbraw/zinc/96/55/88/1055965588.db2.gz KTMYMHWWEZKQEV-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1ccc(F)c(F)c1)C1CCCCC1 ZINC001620996164 1055965597 /nfs/dbraw/zinc/96/55/97/1055965597.db2.gz KTMYMHWWEZKQEV-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1ccc(F)c(F)c1)C1CCCCC1 ZINC001620996164 1055965616 /nfs/dbraw/zinc/96/56/16/1055965616.db2.gz KTMYMHWWEZKQEV-UHFFFAOYSA-N 2 1 310.432 4.099 20 0 DIADMP C1CC(C2CCC([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)CC2)C1 ZINC001621011313 1055975667 /nfs/dbraw/zinc/97/56/67/1055975667.db2.gz BDHWCCCFAKRQHP-ACBHZAAOSA-N 2 1 304.522 4.342 20 0 DIADMP C1CC(C2CCC([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)CC2)C1 ZINC001621011313 1055975675 /nfs/dbraw/zinc/97/56/75/1055975675.db2.gz BDHWCCCFAKRQHP-ACBHZAAOSA-N 2 1 304.522 4.342 20 0 DIADMP C1CC(C2CCC([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)CC2)C1 ZINC001621011314 1055976691 /nfs/dbraw/zinc/97/66/91/1055976691.db2.gz BDHWCCCFAKRQHP-CTWPCTMYSA-N 2 1 304.522 4.342 20 0 DIADMP C1CC(C2CCC([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)CC2)C1 ZINC001621011314 1055976698 /nfs/dbraw/zinc/97/66/98/1055976698.db2.gz BDHWCCCFAKRQHP-CTWPCTMYSA-N 2 1 304.522 4.342 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC001621015833 1055982101 /nfs/dbraw/zinc/98/21/01/1055982101.db2.gz JYSVPOLDRGUJOJ-HSALFYBXSA-N 2 1 314.517 4.170 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621021022 1055986369 /nfs/dbraw/zinc/98/63/69/1055986369.db2.gz YDHOTIGPQGDRTI-FPOVZHCZSA-N 2 1 314.517 4.138 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H](C1CCCCC1)[NH+](C)C ZINC001620724576 1055986716 /nfs/dbraw/zinc/98/67/16/1055986716.db2.gz DFBDMAYAJSXDPX-NQIIRXRSSA-N 2 1 316.533 4.355 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+]CC[C@H](C)[NH+](C)C ZINC001621021630 1055986757 /nfs/dbraw/zinc/98/67/57/1055986757.db2.gz QYPPKROUTYBBBL-HNNXBMFYSA-N 2 1 302.462 4.205 20 0 DIADMP CC(C)[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1 ZINC001621021024 1055986826 /nfs/dbraw/zinc/98/68/26/1055986826.db2.gz YDHOTIGPQGDRTI-TZIWHRDSSA-N 2 1 314.517 4.138 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(F)cc2Cl)C1 ZINC001620724623 1055987048 /nfs/dbraw/zinc/98/70/48/1055987048.db2.gz FSGFLFGYHPPJOS-CQSZACIVSA-N 2 1 312.860 4.081 20 0 DIADMP CCCc1cccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC001620724945 1055987562 /nfs/dbraw/zinc/98/75/62/1055987562.db2.gz QIWLPSHFCISBCK-GOSISDBHSA-N 2 1 302.506 4.383 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)c1 ZINC001620808268 1056002188 /nfs/dbraw/zinc/00/21/88/1056002188.db2.gz HNGMMFQNXFGNQT-XEMDLRDOSA-N 2 1 300.490 4.195 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1(C)CC(F)(F)C1 ZINC001621048922 1056008137 /nfs/dbraw/zinc/00/81/37/1056008137.db2.gz DWBLOIDRUYVWOI-UHFFFAOYSA-N 2 1 324.459 4.170 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)cc1 ZINC000166377042 1056156508 /nfs/dbraw/zinc/15/65/08/1056156508.db2.gz ZMOXGXOGLCEUJI-XUVXKRRUSA-N 2 1 316.464 4.273 20 0 DIADMP C[C@@H]([NH2+]CC1([NH+](C)C)CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000474493465 1056318384 /nfs/dbraw/zinc/31/83/84/1056318384.db2.gz TZRWQQHUTWSBSC-WLYUNCDWSA-N 2 1 320.443 4.208 20 0 DIADMP CC[N@H+](CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)C(C)C ZINC000474600065 1056329523 /nfs/dbraw/zinc/32/95/23/1056329523.db2.gz MFQUBHVDKWDPPE-NFOMZHRRSA-N 2 1 308.432 4.064 20 0 DIADMP CC[N@@H+](CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1)C(C)C ZINC000474600065 1056329536 /nfs/dbraw/zinc/32/95/36/1056329536.db2.gz MFQUBHVDKWDPPE-NFOMZHRRSA-N 2 1 308.432 4.064 20 0 DIADMP COC1CC[NH+](C2(C[NH2+]C3CCCCCCC3)CCCC2)CC1 ZINC000765862645 1056346564 /nfs/dbraw/zinc/34/65/64/1056346564.db2.gz YIYHBMKBNONUCC-UHFFFAOYSA-N 2 1 322.537 4.113 20 0 DIADMP Cc1ccc(C2=CCC[N@@H+](Cc3ccccc3)C2)c(C[NH+](C)C)c1 ZINC001240388599 1056470692 /nfs/dbraw/zinc/47/06/92/1056470692.db2.gz HKXCOICFVRWCTQ-UHFFFAOYSA-N 2 1 320.480 4.346 20 0 DIADMP [NH3+]C1(c2ccc(C3=CCC[N@@H+](Cc4ccccc4)C3)cc2)CCC1 ZINC001240388305 1056470930 /nfs/dbraw/zinc/47/09/30/1056470930.db2.gz IIAPMXFARCNRIR-UHFFFAOYSA-N 2 1 318.464 4.314 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(F)ccc2C)CC1 ZINC001615200662 1056475398 /nfs/dbraw/zinc/47/53/98/1056475398.db2.gz HUSSSEGHVLZXTG-UHFFFAOYSA-N 2 1 306.469 4.078 20 0 DIADMP CCC[N@@H+](CCC[NH+]1CCCCC1)[C@@H]1CCc2ccccc2C1 ZINC001615255728 1056485056 /nfs/dbraw/zinc/48/50/56/1056485056.db2.gz HZJVOGHOXWWFGN-OAQYLSRUSA-N 2 1 314.517 4.132 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cs1 ZINC001615435541 1056511058 /nfs/dbraw/zinc/51/10/58/1056511058.db2.gz ACUUKTCFFVYQHF-KRWDZBQOSA-N 2 1 306.519 4.145 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cs1 ZINC001615435541 1056511068 /nfs/dbraw/zinc/51/10/68/1056511068.db2.gz ACUUKTCFFVYQHF-KRWDZBQOSA-N 2 1 306.519 4.145 20 0 DIADMP C[C@H]1SCC[N@H+](CCC[NH+]2CCCCC2)[C@H]1c1ccccc1 ZINC001615522887 1056527015 /nfs/dbraw/zinc/52/70/15/1056527015.db2.gz BORZGJHYRLYUKK-IEBWSBKVSA-N 2 1 318.530 4.041 20 0 DIADMP C[C@H]1SCC[N@@H+](CCC[NH+]2CCCCC2)[C@H]1c1ccccc1 ZINC001615522887 1056527023 /nfs/dbraw/zinc/52/70/23/1056527023.db2.gz BORZGJHYRLYUKK-IEBWSBKVSA-N 2 1 318.530 4.041 20 0 DIADMP CC1(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCC1 ZINC001615740944 1056572412 /nfs/dbraw/zinc/57/24/12/1056572412.db2.gz YGJBPRNFWPPEDL-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP CC1(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCC1 ZINC001615740944 1056572425 /nfs/dbraw/zinc/57/24/25/1056572425.db2.gz YGJBPRNFWPPEDL-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP CC1(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCC1 ZINC001615740944 1056572439 /nfs/dbraw/zinc/57/24/39/1056572439.db2.gz YGJBPRNFWPPEDL-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP C=C/C=C\CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615846786 1056584537 /nfs/dbraw/zinc/58/45/37/1056584537.db2.gz ONQAOYCLKHFOIZ-JLZAYFGNSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C\CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615846786 1056584555 /nfs/dbraw/zinc/58/45/55/1056584555.db2.gz ONQAOYCLKHFOIZ-JLZAYFGNSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C\CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615846786 1056584565 /nfs/dbraw/zinc/58/45/65/1056584565.db2.gz ONQAOYCLKHFOIZ-JLZAYFGNSA-N 2 1 310.485 4.105 20 0 DIADMP C[NH+](C)CC1(C[NH2+][C@@H]2CCSc3c(F)cccc32)CCCC1 ZINC000355052837 1056610635 /nfs/dbraw/zinc/61/06/35/1056610635.db2.gz ABCITJGSZOXFHO-MRXNPFEDSA-N 2 1 322.493 4.074 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000672605470 1056734874 /nfs/dbraw/zinc/73/48/74/1056734874.db2.gz LUVGVTYDMJPMKT-MDNKFWRPSA-N 2 1 300.490 4.065 20 0 DIADMP CCCCCC[NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001616999595 1056756905 /nfs/dbraw/zinc/75/69/05/1056756905.db2.gz YEWDMVMWIWLINO-RUYXUALKSA-N 2 1 302.506 4.313 20 0 DIADMP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC001617104846 1056777168 /nfs/dbraw/zinc/77/71/68/1056777168.db2.gz ZIJJNDJIWZEFTL-HKUYNNGSSA-N 2 1 300.490 4.046 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)c2ccccc21 ZINC000672806855 1056777320 /nfs/dbraw/zinc/77/73/20/1056777320.db2.gz AYIGFGPXILJGBP-ARFHVFGLSA-N 2 1 312.432 4.256 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC001617197886 1056790832 /nfs/dbraw/zinc/79/08/32/1056790832.db2.gz FXGPYKUDKGFUHX-VQIMIIECSA-N 2 1 302.506 4.461 20 0 DIADMP CC[C@@H](C[N@@H+](CC)CCC[NH+]1CCCCC1)c1ccccc1 ZINC001617352975 1056818932 /nfs/dbraw/zinc/81/89/32/1056818932.db2.gz ROYZLGABRXHYOJ-IBGZPJMESA-N 2 1 302.506 4.378 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682076053 1056886124 /nfs/dbraw/zinc/88/61/24/1056886124.db2.gz SOYZUPSFKDHYIW-ROUUACIJSA-N 2 1 318.505 4.037 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682076051 1056887227 /nfs/dbraw/zinc/88/72/27/1056887227.db2.gz SOYZUPSFKDHYIW-QZTJIDSGSA-N 2 1 318.505 4.037 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(CC[NH+]([C@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868192 1056892425 /nfs/dbraw/zinc/89/24/25/1056892425.db2.gz MMWCDZVJTWYFNO-FCHUYYIVSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+]([C@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868192 1056892429 /nfs/dbraw/zinc/89/24/29/1056892429.db2.gz MMWCDZVJTWYFNO-FCHUYYIVSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@H+]([C@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868192 1056892434 /nfs/dbraw/zinc/89/24/34/1056892434.db2.gz MMWCDZVJTWYFNO-FCHUYYIVSA-N 2 1 324.512 4.473 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001618048265 1056919069 /nfs/dbraw/zinc/91/90/69/1056919069.db2.gz KROQCOCRWXVEPE-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001618048265 1056919079 /nfs/dbraw/zinc/91/90/79/1056919079.db2.gz KROQCOCRWXVEPE-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001618048265 1056919086 /nfs/dbraw/zinc/91/90/86/1056919086.db2.gz KROQCOCRWXVEPE-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001618048265 1056919096 /nfs/dbraw/zinc/91/90/96/1056919096.db2.gz KROQCOCRWXVEPE-MSOLQXFVSA-N 2 1 306.881 4.209 20 0 DIADMP CC(C)C[N@@H+]([C@@H]1Cc2cccc(Cl)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168713579 1056977565 /nfs/dbraw/zinc/97/75/65/1056977565.db2.gz FOVQIDNWSGDIBJ-BRWVUGGUSA-N 2 1 320.908 4.035 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000480630532 1057010217 /nfs/dbraw/zinc/01/02/17/1057010217.db2.gz JWSLNBFWCNOOJP-DNVCBOLYSA-N 2 1 304.453 4.057 20 0 DIADMP Cc1cc(N(C)C)[nH+]cc1-c1ccc(C[NH+]2CCCCC2)cc1 ZINC001241388276 1057034743 /nfs/dbraw/zinc/03/47/43/1057034743.db2.gz FMJATNWDOYENKE-UHFFFAOYSA-N 2 1 309.457 4.109 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccn1 ZINC000675815950 1057418239 /nfs/dbraw/zinc/41/82/39/1057418239.db2.gz HTOXVVUAJJKXAG-FQEVSTJZSA-N 2 1 315.505 4.310 20 0 DIADMP Cc1nc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(C)s1 ZINC000676490323 1057479263 /nfs/dbraw/zinc/47/92/63/1057479263.db2.gz NINLMLZSHSVGBE-ZIAGYGMSSA-N 2 1 309.523 4.065 20 0 DIADMP CCC[N@H+]1CCCC[C@H]1c1ccc(-c2cccc(C[NH2+]C)c2)nc1 ZINC001242996279 1057540388 /nfs/dbraw/zinc/54/03/88/1057540388.db2.gz DFSYNRJNEIXNTC-NRFANRHFSA-N 2 1 323.484 4.405 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCC(F)(F)C1 ZINC000626062919 1057553980 /nfs/dbraw/zinc/55/39/80/1057553980.db2.gz LJIVJXRIGCPQHN-KRWDZBQOSA-N 2 1 310.432 4.006 20 0 DIADMP c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166479444 1057576055 /nfs/dbraw/zinc/57/60/55/1057576055.db2.gz RCEITCHBXXSCLL-BQJUDKOJSA-N 2 1 312.501 4.004 20 0 DIADMP CCCC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC)cc1 ZINC000166482339 1057583650 /nfs/dbraw/zinc/58/36/50/1057583650.db2.gz RVZXKFSKFWJTGN-GGPKGHCWSA-N 2 1 316.489 4.143 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)c1 ZINC000166833324 1057677972 /nfs/dbraw/zinc/67/79/72/1057677972.db2.gz UCSNPMGPBSPFNN-XUVXKRRUSA-N 2 1 316.464 4.273 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)c1 ZINC000166833107 1057678037 /nfs/dbraw/zinc/67/80/37/1057678037.db2.gz UCSNPMGPBSPFNN-VAMGGRTRSA-N 2 1 316.464 4.273 20 0 DIADMP C(=C/C1CC[NH2+]CC1)\c1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2 ZINC001243897055 1057801843 /nfs/dbraw/zinc/80/18/43/1057801843.db2.gz MYALLJMFAZRDTO-VOTSOKGWSA-N 2 1 318.464 4.215 20 0 DIADMP C[N@H+]1CCCC[C@H]1c1ccc(-c2ccc([C@@H]3CCC[NH2+]3)cc2)nc1 ZINC001245349453 1058149622 /nfs/dbraw/zinc/14/96/22/1058149622.db2.gz MNZULLFNIHIBAP-FPOVZHCZSA-N 2 1 321.468 4.330 20 0 DIADMP Cc1cccc(C2([NH2+][C@@H]3CC[C@@H](c4[nH+]ccn4C)C3)CCC2)c1 ZINC001550512051 1058342965 /nfs/dbraw/zinc/34/29/65/1058342965.db2.gz QCDOCKFRVZAXSU-SJLPKXTDSA-N 2 1 309.457 4.034 20 0 DIADMP Cc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1CC[C@@H](c2[nH+]ccn2C)C1 ZINC001550520309 1058344406 /nfs/dbraw/zinc/34/44/06/1058344406.db2.gz NJGZAPAZUUDBDO-MDZRGWNJSA-N 2 1 309.457 4.032 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001552080674 1058426239 /nfs/dbraw/zinc/42/62/39/1058426239.db2.gz AHQJXAFFNJMXTN-RUCRBOMBSA-N 2 1 320.480 4.324 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(-c2ccc(C(C)(C)[NH3+])cc2)nc1 ZINC001245906672 1058611209 /nfs/dbraw/zinc/61/12/09/1058611209.db2.gz JBESLBBEABJNMU-FQEVSTJZSA-N 2 1 323.484 4.489 20 0 DIADMP CCCCC[C@@H](O)C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246063668 1058659095 /nfs/dbraw/zinc/65/90/95/1058659095.db2.gz BQWFMXDCJQKEFU-VAMGGRTRSA-N 2 1 324.553 4.080 20 0 DIADMP Cc1cccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)c1 ZINC001246071191 1058664609 /nfs/dbraw/zinc/66/46/09/1058664609.db2.gz ITBDBOSIZMLSMH-ICSRJNTNSA-N 2 1 312.432 4.025 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076566 1058666611 /nfs/dbraw/zinc/66/66/11/1058666611.db2.gz PBXVPVGHLQFXGB-CVEARBPZSA-N 2 1 306.881 4.085 20 0 DIADMP Cc1csc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)c1 ZINC001246078299 1058671436 /nfs/dbraw/zinc/67/14/36/1058671436.db2.gz CGMIVFSLVAMBIV-YJBOKZPZSA-N 2 1 318.461 4.087 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)C[C@H](CC)[NH2+]1 ZINC001246078873 1058672151 /nfs/dbraw/zinc/67/21/51/1058672151.db2.gz XRSRVRNPETVOOE-BJWYYQGGSA-N 2 1 306.881 4.228 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246092047 1058675261 /nfs/dbraw/zinc/67/52/61/1058675261.db2.gz BXOGOUVNEFTTNZ-ODZKNYGOSA-N 2 1 318.480 4.343 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cccc(Cl)c1F ZINC001246101787 1058676898 /nfs/dbraw/zinc/67/68/98/1058676898.db2.gz AYTDDAKLUMGGQR-TYNCELHUSA-N 2 1 312.860 4.296 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1C[NH2+]CC[C@H]1C ZINC001246100884 1058677510 /nfs/dbraw/zinc/67/75/10/1058677510.db2.gz XYBUIWYEHOGWSK-HMFYCAOWSA-N 2 1 322.496 4.185 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](C)C2)CC[NH2+]1 ZINC001246115295 1058683547 /nfs/dbraw/zinc/68/35/47/1058683547.db2.gz HGWZQDNFEAWLSK-KUZCPNRJSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccs2)CC[NH2+]1 ZINC001246114552 1058684678 /nfs/dbraw/zinc/68/46/78/1058684678.db2.gz NNRWIRNLTUAKSM-QRTARXTBSA-N 2 1 318.461 4.340 20 0 DIADMP FC(F)c1cccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246124264 1058687292 /nfs/dbraw/zinc/68/72/92/1058687292.db2.gz DSUXAKGYZHAHBX-ROUUACIJSA-N 2 1 316.395 4.207 20 0 DIADMP Fc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)cc1Cl ZINC001246157382 1058701671 /nfs/dbraw/zinc/70/16/71/1058701671.db2.gz HRILEDKFMKWLGT-AWEZNQCLSA-N 2 1 310.844 4.024 20 0 DIADMP F[C@@]1(C[NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CCC[NH2+]C1 ZINC001246172561 1058714626 /nfs/dbraw/zinc/71/46/26/1058714626.db2.gz IABCCPGFKBGOFN-VJFUWPCTSA-N 2 1 324.871 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2)CC[NH2+]1 ZINC001246176790 1058720921 /nfs/dbraw/zinc/72/09/21/1058720921.db2.gz QHTDZJZVOHGYJR-MOXGXCLJSA-N 2 1 312.432 4.278 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC001246177756 1058721635 /nfs/dbraw/zinc/72/16/35/1058721635.db2.gz UASZMBPOKCGTSA-HKUYNNGSSA-N 2 1 304.453 4.097 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246179773 1058722149 /nfs/dbraw/zinc/72/21/49/1058722149.db2.gz RRWXPZVBKIYNPQ-AABGKKOBSA-N 2 1 312.432 4.360 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2Cl)C[C@H](CC)[NH2+]1 ZINC001246179208 1058722871 /nfs/dbraw/zinc/72/28/71/1058722871.db2.gz DHAYKIQSIGMMGF-QDMKHBRRSA-N 2 1 315.288 4.392 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC001246177759 1058723180 /nfs/dbraw/zinc/72/31/80/1058723180.db2.gz UASZMBPOKCGTSA-IEBWSBKVSA-N 2 1 304.453 4.097 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246195453 1058737690 /nfs/dbraw/zinc/73/76/90/1058737690.db2.gz OFPLYFVYQQLVBT-DOMZBBRYSA-N 2 1 315.288 4.250 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246196004 1058738130 /nfs/dbraw/zinc/73/81/30/1058738130.db2.gz CXOVGSIDXSNONJ-CJNGLKHVSA-N 2 1 315.288 4.168 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246196207 1058738338 /nfs/dbraw/zinc/73/83/38/1058738338.db2.gz RMDDIWDTCIGZKG-WDNDVIMCSA-N 2 1 315.288 4.392 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1Cl ZINC001246195799 1058739083 /nfs/dbraw/zinc/73/90/83/1058739083.db2.gz PVVUWWBQMTWTQM-HKUYNNGSSA-N 2 1 314.860 4.231 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246199393 1058740493 /nfs/dbraw/zinc/74/04/93/1058740493.db2.gz WESHHDGRZJEZDX-WDNDVIMCSA-N 2 1 313.272 4.065 20 0 DIADMP Cc1cc(F)cc(C)c1C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246201076 1058740848 /nfs/dbraw/zinc/74/08/48/1058740848.db2.gz UKLOTLWBZMTELK-UYAOXDASSA-N 2 1 312.432 4.025 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C2c3ccccc3-c3ccccc32)CC[NH2+]1 ZINC001246201447 1058741730 /nfs/dbraw/zinc/74/17/30/1058741730.db2.gz UZUYRNJDBFESKV-YWZLYKJASA-N 2 1 306.453 4.123 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)c(Cl)c2)CC[NH2+]1 ZINC001246211507 1058745754 /nfs/dbraw/zinc/74/57/54/1058745754.db2.gz KFPIFVQHCVLYSF-SNPRPXQTSA-N 2 1 312.860 4.441 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccc(Cl)c(F)c1 ZINC001246215656 1058747845 /nfs/dbraw/zinc/74/78/45/1058747845.db2.gz ZYDBCWRUNKFPFV-KFNAQCHYSA-N 2 1 312.860 4.296 20 0 DIADMP Clc1cccc(C2([NH2+][C@H]3CC[NH2+]C4(CCCCC4)C3)CC2)c1 ZINC001246237408 1058762089 /nfs/dbraw/zinc/76/20/89/1058762089.db2.gz NTSRNOGNQSSAMN-KRWDZBQOSA-N 2 1 318.892 4.374 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246251542 1058771831 /nfs/dbraw/zinc/77/18/31/1058771831.db2.gz DQQVWUBVYBDLGA-KNXALSJPSA-N 2 1 315.288 4.421 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]4CCCC[C@@H]43)CC[NH2+]2)cc1 ZINC001246254216 1058772746 /nfs/dbraw/zinc/77/27/46/1058772746.db2.gz GAAKMZDNTVRYJM-RQXATKFSSA-N 2 1 312.501 4.428 20 0 DIADMP CC(C)([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1Cl ZINC001246264558 1058779107 /nfs/dbraw/zinc/77/91/07/1058779107.db2.gz CGHYCWQSDKFACR-CLLJXQQHSA-N 2 1 313.272 4.101 20 0 DIADMP CC[C@H]1C[C@@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246266208 1058779928 /nfs/dbraw/zinc/77/99/28/1058779928.db2.gz FYVIRSCYLRAPJV-STQMWFEESA-N 2 1 315.288 4.349 20 0 DIADMP CC[C@H]1C[C@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC[NH2+]1 ZINC001246266203 1058780385 /nfs/dbraw/zinc/78/03/85/1058780385.db2.gz FYVIRSCYLRAPJV-QWHCGFSZSA-N 2 1 315.288 4.349 20 0 DIADMP [NH3+]C[C@@H](Cc1ccccc1)[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001246263363 1058781444 /nfs/dbraw/zinc/78/14/44/1058781444.db2.gz DHLMIPCUNFUCNG-RBUKOAKNSA-N 2 1 300.490 4.039 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccccc1F ZINC001246270292 1058784774 /nfs/dbraw/zinc/78/47/74/1058784774.db2.gz AHFXIDCIBYTLJQ-JLSDUUJJSA-N 2 1 306.469 4.279 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1F ZINC001246272154 1058788751 /nfs/dbraw/zinc/78/87/51/1058788751.db2.gz LEBIVDGWHQAQCT-QAPCUYQASA-N 2 1 304.453 4.177 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC001246273762 1058789437 /nfs/dbraw/zinc/78/94/37/1058789437.db2.gz VCWWLTPTAKCRKF-GFCCVEGCSA-N 2 1 315.288 4.349 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](c2ccccc2F)C(C)C)C[C@@H](CC)[NH2+]1 ZINC001246275452 1058790437 /nfs/dbraw/zinc/79/04/37/1058790437.db2.gz UPJQWSBPVLUMEI-CLCXKQKWSA-N 2 1 306.469 4.422 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C(C)C)C[C@H](CC)[NH2+]1 ZINC001246275454 1058792443 /nfs/dbraw/zinc/79/24/43/1058792443.db2.gz UPJQWSBPVLUMEI-PASDCYSWSA-N 2 1 306.469 4.422 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+]C(C)(C)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246281736 1058799505 /nfs/dbraw/zinc/79/95/05/1058799505.db2.gz UYHCDUPWJONXLA-SJORKVTESA-N 2 1 310.432 4.100 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC2(C)C)CC[NH2+]1 ZINC001246292592 1058804974 /nfs/dbraw/zinc/80/49/74/1058804974.db2.gz XUORLHYVUOUSDS-RYQLBKOJSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(C)cc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246297864 1058811364 /nfs/dbraw/zinc/81/13/64/1058811364.db2.gz QGRMPUHLNALICQ-DUXKGJEZSA-N 2 1 308.469 4.447 20 0 DIADMP [NH3+][C@H](C[NH2+][C@H]1CCCC2(CCCCC2)C1)Cc1ccccc1 ZINC001246300700 1058812689 /nfs/dbraw/zinc/81/26/89/1058812689.db2.gz UHABAKNFBQWCMK-OALUTQOASA-N 2 1 300.490 4.039 20 0 DIADMP Fc1ccccc1[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)C1CC1 ZINC001246305197 1058814686 /nfs/dbraw/zinc/81/46/86/1058814686.db2.gz HEXAWMODYWACEJ-VQIMIIECSA-N 2 1 316.464 4.321 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246307660 1058815582 /nfs/dbraw/zinc/81/55/82/1058815582.db2.gz NADLNIPUCIXZQF-BMGDILEWSA-N 2 1 304.453 4.033 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1ccccc1OC ZINC001246316573 1058824356 /nfs/dbraw/zinc/82/43/56/1058824356.db2.gz JNGPNMLMUKONLI-LHHMISFZSA-N 2 1 304.478 4.045 20 0 DIADMP CC[C@H]1CC([NH2+]C(C)(C)c2ccccc2Cl)C[C@H](CC)[NH2+]1 ZINC001246314264 1058824921 /nfs/dbraw/zinc/82/49/21/1058824921.db2.gz XCKZLUOUGCNMAA-KBPBESRZSA-N 2 1 308.897 4.474 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246328642 1058837743 /nfs/dbraw/zinc/83/77/43/1058837743.db2.gz YBALOINAFCGXKD-DFBGVHRSSA-N 2 1 315.288 4.045 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](CC(C)C)c2ccccn2)CC[NH2+]1 ZINC001246327843 1058838012 /nfs/dbraw/zinc/83/80/12/1058838012.db2.gz VXEBCNUEIQLBAZ-AOIWGVFYSA-N 2 1 303.494 4.069 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[C@H](C)[NH2+]C1 ZINC001246328648 1058838106 /nfs/dbraw/zinc/83/81/06/1058838106.db2.gz YBALOINAFCGXKD-NILFDRSVSA-N 2 1 315.288 4.045 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246330996 1058840968 /nfs/dbraw/zinc/84/09/68/1058840968.db2.gz AVEQQSJIVRYDMA-ZFKCKOODSA-N 2 1 304.453 4.096 20 0 DIADMP c1cc2ccc(C[NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)cc2o1 ZINC001246330868 1058842012 /nfs/dbraw/zinc/84/20/12/1058842012.db2.gz ZAFGTVDTPSTEKD-RBUKOAKNSA-N 2 1 306.409 4.016 20 0 DIADMP CCC(C)(C)C1CCC([NH2+][C@@H]2CC[NH2+]C[C@H]2C(F)(F)F)CC1 ZINC001246341891 1058851282 /nfs/dbraw/zinc/85/12/82/1058851282.db2.gz QEOKKKLSUCMVQJ-NEXFUWMNSA-N 2 1 320.443 4.111 20 0 DIADMP CCCCCC1CCC([NH2+][C@@H]2CC[NH2+]C[C@@H]2C(F)(F)F)CC1 ZINC001246341263 1058852836 /nfs/dbraw/zinc/85/28/36/1058852836.db2.gz OMNLIRJGTNGXCD-SSHXOBKSSA-N 2 1 320.443 4.256 20 0 DIADMP FC(F)(F)[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001246343017 1058853132 /nfs/dbraw/zinc/85/31/32/1058853132.db2.gz ULBQFYPIVKGFHN-RBSFLKMASA-N 2 1 318.427 4.010 20 0 DIADMP CCCCCC1CCC([NH2+][C@H]2CC[NH2+]C[C@@H]2C(F)(F)F)CC1 ZINC001246341260 1058854468 /nfs/dbraw/zinc/85/44/68/1058854468.db2.gz OMNLIRJGTNGXCD-CKUJCDMFSA-N 2 1 320.443 4.256 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1F ZINC001246349777 1058860344 /nfs/dbraw/zinc/86/03/44/1058860344.db2.gz OVIVHNWBUIIAKH-HNNXBMFYSA-N 2 1 304.453 4.105 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1F ZINC001246349780 1058861448 /nfs/dbraw/zinc/86/14/48/1058861448.db2.gz OVIVHNWBUIIAKH-OAHLLOKOSA-N 2 1 304.453 4.105 20 0 DIADMP Cc1ccc(F)cc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246347504 1058862568 /nfs/dbraw/zinc/86/25/68/1058862568.db2.gz HETVLSOTFCPMDX-QSFXBCCZSA-N 2 1 312.432 4.278 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246349710 1058862895 /nfs/dbraw/zinc/86/28/95/1058862895.db2.gz NYOYWEOCMOCUCK-RBUKOAKNSA-N 2 1 312.432 4.144 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](C)c2ccc(C)c(F)c2F)C[C@@H](CC)[NH2+]1 ZINC001246348277 1058862940 /nfs/dbraw/zinc/86/29/40/1058862940.db2.gz IZMVVQISPGHAIH-BFHYXJOUSA-N 2 1 310.432 4.233 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)c(F)c2F)C[C@H](CC)[NH2+]1 ZINC001246348298 1058862985 /nfs/dbraw/zinc/86/29/85/1058862985.db2.gz IZMVVQISPGHAIH-BYNSBNAKSA-N 2 1 310.432 4.233 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360312 1058869923 /nfs/dbraw/zinc/86/99/23/1058869923.db2.gz FFIXGEIEJPPTFP-WMLDXEAASA-N 2 1 306.881 4.085 20 0 DIADMP Cc1ccccc1CC(C)(C)[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246373933 1058881085 /nfs/dbraw/zinc/88/10/85/1058881085.db2.gz RXQUKUDVVFSPKJ-RTWAWAEBSA-N 2 1 322.496 4.399 20 0 DIADMP CCCC1([NH2+][C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CCC1 ZINC001246386802 1058892923 /nfs/dbraw/zinc/89/29/23/1058892923.db2.gz PJXPDDCPUKSBJQ-FUHWJXTLSA-N 2 1 304.453 4.240 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246391733 1058895508 /nfs/dbraw/zinc/89/55/08/1058895508.db2.gz GTWMTAQBQGMWNO-AYOQOUSVSA-N 2 1 304.453 4.033 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CCCCC2(C)C)CC[NH2+]1 ZINC001246392445 1058895647 /nfs/dbraw/zinc/89/56/47/1058895647.db2.gz DFQCIJAIKDPFRJ-WDSOQIARSA-N 2 1 318.480 4.486 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246390613 1058897185 /nfs/dbraw/zinc/89/71/85/1058897185.db2.gz FASJHVOIOAKNOZ-LZQZEXGQSA-N 2 1 318.480 4.423 20 0 DIADMP C[C@@H]1CC([NH2+][C@H](CC2CCC2)c2ccccc2F)C[C@@H](C)[NH2+]1 ZINC001246410238 1058911200 /nfs/dbraw/zinc/91/12/00/1058911200.db2.gz ZJQGKXUMWOXSCZ-PJIJBLCYSA-N 2 1 304.453 4.176 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C(C)(C)CC2CCC2)CC[NH2+]1 ZINC001246411800 1058915192 /nfs/dbraw/zinc/91/51/92/1058915192.db2.gz VZDSKHQBFSDIHO-IEBWSBKVSA-N 2 1 318.480 4.486 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]1 ZINC001246445614 1058937135 /nfs/dbraw/zinc/93/71/35/1058937135.db2.gz YBNJRZGYBVZRHQ-ZOCIIQOWSA-N 2 1 314.860 4.160 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2OCC)CC[NH2+]1 ZINC001246453262 1058942429 /nfs/dbraw/zinc/94/24/29/1058942429.db2.gz BGAIZYMGFKNDQX-GVDBMIGSSA-N 2 1 304.478 4.047 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H](CC)[NH2+][C@@H](CC)C1)c1cc(F)cc(F)c1 ZINC001246459477 1058943222 /nfs/dbraw/zinc/94/32/22/1058943222.db2.gz AKKPOSLUTCVMAH-XYJFISCASA-N 2 1 310.432 4.315 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C[NH2+]1 ZINC001246459554 1058945343 /nfs/dbraw/zinc/94/53/43/1058945343.db2.gz BAJPCOBQPNQACB-LSDHHAIUSA-N 3 1 300.471 4.186 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cn2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246462486 1058948045 /nfs/dbraw/zinc/94/80/45/1058948045.db2.gz ZKWDLZLRYIXWDO-MUQADHOPSA-N 2 1 321.896 4.085 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(Cl)cn2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246462482 1058948664 /nfs/dbraw/zinc/94/86/64/1058948664.db2.gz ZKWDLZLRYIXWDO-DFGXFYAUSA-N 2 1 321.896 4.085 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(Cl)cn2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246462484 1058949180 /nfs/dbraw/zinc/94/91/80/1058949180.db2.gz ZKWDLZLRYIXWDO-KYHPRHEASA-N 2 1 321.896 4.085 20 0 DIADMP Cc1cccc(C2([NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)c1 ZINC001246477964 1058963365 /nfs/dbraw/zinc/96/33/65/1058963365.db2.gz KYEWYHYGBOKTTN-VQTJNVASSA-N 2 1 306.453 4.067 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]CC[C@@H]2CC[NH2+]CC2(F)F)CC1 ZINC001246484682 1058963616 /nfs/dbraw/zinc/96/36/16/1058963616.db2.gz YPGBCEUNXCWQPM-PCKAHOCUSA-N 2 1 316.480 4.206 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](C)c2cc(F)cc(Cl)c2)C[C@@H](CC)[NH2+]1 ZINC001246489291 1058967567 /nfs/dbraw/zinc/96/75/67/1058967567.db2.gz MZFXPEOWKAJMGX-HFBAOOFYSA-N 2 1 312.860 4.439 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(Cl)ccn1 ZINC001246495354 1058969867 /nfs/dbraw/zinc/96/98/67/1058969867.db2.gz OPVVVIFGRDEPRY-OAHLLOKOSA-N 2 1 321.896 4.015 20 0 DIADMP Fc1cccc2c1CCC[C@H]2[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246500166 1058973148 /nfs/dbraw/zinc/97/31/48/1058973148.db2.gz PHRCZRKKBSFXBG-MAODMQOUSA-N 2 1 324.443 4.286 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H](C)Cc1c(F)cccc1Cl ZINC001246505196 1058976688 /nfs/dbraw/zinc/97/66/88/1058976688.db2.gz RFSLPESIDKFUHN-ZDUSSCGKSA-N 2 1 314.876 4.297 20 0 DIADMP CC(C)[N@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246520241 1058982680 /nfs/dbraw/zinc/98/26/80/1058982680.db2.gz SFBFGERDJWGOJE-RTWAWAEBSA-N 2 1 308.469 4.390 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246520241 1058982700 /nfs/dbraw/zinc/98/27/00/1058982700.db2.gz SFBFGERDJWGOJE-RTWAWAEBSA-N 2 1 308.469 4.390 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2[C@H](C)CCC[C@@H]2C)CC[NH2+]1 ZINC001246518558 1058984623 /nfs/dbraw/zinc/98/46/23/1058984623.db2.gz HGFMNOUAHQWNQN-GFIVTLFCSA-N 2 1 304.453 4.190 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2[C@H](C)CCC[C@@H]2C)CC[NH2+]1 ZINC001246518558 1058984632 /nfs/dbraw/zinc/98/46/32/1058984632.db2.gz HGFMNOUAHQWNQN-GFIVTLFCSA-N 2 1 304.453 4.190 20 0 DIADMP CC(C)(C)C1CC[NH+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246540608 1058995675 /nfs/dbraw/zinc/99/56/75/1058995675.db2.gz BQJYOTDNHGHXSW-OALUTQOASA-N 2 1 300.490 4.238 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+]([C@@H](C)CC(C)(C)SCc2ccco2)C1 ZINC001246546994 1058996489 /nfs/dbraw/zinc/99/64/89/1058996489.db2.gz FMYHYRWRTJTBNV-HOTGVXAUSA-N 2 1 324.534 4.001 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1[C@@H](C)CC[C@H]1CN ZINC001246549196 1058997753 /nfs/dbraw/zinc/99/77/53/1058997753.db2.gz VMARJHBAXOOYCV-DYEKYZERSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1[C@@H](C)CC[C@H]1C[NH3+] ZINC001246549196 1058997775 /nfs/dbraw/zinc/99/77/75/1058997775.db2.gz VMARJHBAXOOYCV-DYEKYZERSA-N 2 1 315.288 4.126 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001246548883 1058998293 /nfs/dbraw/zinc/99/82/93/1058998293.db2.gz IGBZPVRQVNKNTF-DMKPSLHHSA-N 2 1 320.908 4.298 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+]([C@H](C)CC(C)(C)SCc2ccco2)C1 ZINC001246546984 1058998558 /nfs/dbraw/zinc/99/85/58/1058998558.db2.gz FMYHYRWRTJTBNV-CVEARBPZSA-N 2 1 324.534 4.001 20 0 DIADMP C[C@H]1CC[N@H+](C2CCC(c3ccccc3)CC2)CC[C@H]1C[NH3+] ZINC001246557036 1059001223 /nfs/dbraw/zinc/00/12/23/1059001223.db2.gz JOCNWTZKFKRWRV-VHBXLISGSA-N 2 1 300.490 4.020 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246564069 1059002752 /nfs/dbraw/zinc/00/27/52/1059002752.db2.gz WRGFOFKRXVOCSB-OALUTQOASA-N 2 1 316.464 4.418 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246561223 1059006044 /nfs/dbraw/zinc/00/60/44/1059006044.db2.gz JMAPEFPRSRMLRT-KSZLIROESA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246562258 1059007670 /nfs/dbraw/zinc/00/76/70/1059007670.db2.gz XKLRZRPIHAPGBH-MOPGFXCFSA-N 2 1 302.506 4.311 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+](C2CCC(Cc3ccccc3)CC2)CC1 ZINC001246580390 1059008483 /nfs/dbraw/zinc/00/84/83/1059008483.db2.gz MIBOTVUMDRYXPZ-CBNMVNINSA-N 2 1 314.517 4.239 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC001246584613 1059008632 /nfs/dbraw/zinc/00/86/32/1059008632.db2.gz BROKJFXWOKESED-BJZITVGISA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC001246584613 1059008653 /nfs/dbraw/zinc/00/86/53/1059008653.db2.gz BROKJFXWOKESED-BJZITVGISA-N 2 1 304.453 4.049 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001246581148 1059010954 /nfs/dbraw/zinc/01/09/54/1059010954.db2.gz XYNIRYAMOLRCKW-WOJBJXKFSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@H+]([C@@H]2CCC[C@H](c3ccccc3)C2)C1 ZINC001246586203 1059012029 /nfs/dbraw/zinc/01/20/29/1059012029.db2.gz RNUWTWZPCWQCPF-XUVXKRRUSA-N 2 1 300.490 4.164 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001246574917 1059013569 /nfs/dbraw/zinc/01/35/69/1059013569.db2.gz JRRNTHRGELMOEM-AABGKKOBSA-N 2 1 300.490 4.164 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+]([C@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001246575554 1059013677 /nfs/dbraw/zinc/01/36/77/1059013677.db2.gz JRRNTHRGELMOEM-UFYCRDLUSA-N 2 1 300.490 4.164 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001246593422 1059015027 /nfs/dbraw/zinc/01/50/27/1059015027.db2.gz MUVZXMZIOLRUAK-PMACEKPBSA-N 2 1 302.506 4.250 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246589420 1059015255 /nfs/dbraw/zinc/01/52/55/1059015255.db2.gz DZTDEQNLCQOXTJ-HHXKTQCLSA-N 2 1 320.908 4.425 20 0 DIADMP C1CCC2(CC1)CCC([NH+]1CCC3(CCCC[NH2+]3)CC1)CC2 ZINC001246607474 1059021966 /nfs/dbraw/zinc/02/19/66/1059021966.db2.gz DXZBYIPPYKAOHF-UHFFFAOYSA-N 2 1 304.522 4.488 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246605470 1059024460 /nfs/dbraw/zinc/02/44/60/1059024460.db2.gz JWBMRATZCLOYRN-SFTDATJTSA-N 2 1 314.517 4.252 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CCC[C@]34CCC[NH2+]C4)CC2)cc1 ZINC001246610049 1059026364 /nfs/dbraw/zinc/02/63/64/1059026364.db2.gz NSFOFLAZPPPLQQ-CBNMVNINSA-N 2 1 312.501 4.006 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609625 1059027940 /nfs/dbraw/zinc/02/79/40/1059027940.db2.gz MARWMWJICIOYPU-RHSMWYFYSA-N 2 1 324.921 4.039 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609625 1059027964 /nfs/dbraw/zinc/02/79/64/1059027964.db2.gz MARWMWJICIOYPU-RHSMWYFYSA-N 2 1 324.921 4.039 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246609272 1059028460 /nfs/dbraw/zinc/02/84/60/1059028460.db2.gz MCKMRSGADHUSGM-XLIONFOSSA-N 2 1 318.480 4.003 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246610183 1059029218 /nfs/dbraw/zinc/02/92/18/1059029218.db2.gz QDMZERVCMFTBEC-FXAWDEMLSA-N 2 1 318.480 4.003 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001246616281 1059032970 /nfs/dbraw/zinc/03/29/70/1059032970.db2.gz GXMZNHMFKVINSE-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(CC2CCC([N@H+]3CC[C@@]4(C3)CCCC[NH2+]4)CC2)cc1 ZINC001246619954 1059034791 /nfs/dbraw/zinc/03/47/91/1059034791.db2.gz JMQROVLVKOTYIG-XVAXZDLZSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@H+]2CC[C@@]3(C2)CCCC[NH2+]3)CC1 ZINC001246628969 1059036464 /nfs/dbraw/zinc/03/64/64/1059036464.db2.gz ZGCWHYUVSKQFRV-KITAHSCOSA-N 2 1 324.512 4.031 20 0 DIADMP CCCCC[C@@H](CC)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625693 1059037605 /nfs/dbraw/zinc/03/76/05/1059037605.db2.gz RZJUREOZOOKECD-MOPGFXCFSA-N 2 1 300.490 4.034 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC001246630985 1059038154 /nfs/dbraw/zinc/03/81/54/1059038154.db2.gz NAANHGCAZSUTNA-NKELODKYSA-N 2 1 318.892 4.052 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246629340 1059038471 /nfs/dbraw/zinc/03/84/71/1059038471.db2.gz YWPHCZSXJZHJHJ-NLWGTHIKSA-N 2 1 314.517 4.136 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246634548 1059043383 /nfs/dbraw/zinc/04/33/83/1059043383.db2.gz OEOFUZHIYNYYBI-KSSFIOAISA-N 2 1 324.871 4.018 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001246646188 1059046815 /nfs/dbraw/zinc/04/68/15/1059046815.db2.gz OVZYGTZFJDJCDB-KXBFYZLASA-N 2 1 320.908 4.125 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001246641236 1059049632 /nfs/dbraw/zinc/04/96/32/1059049632.db2.gz CIXLZQSGGYSVMU-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246642920 1059051302 /nfs/dbraw/zinc/05/13/02/1059051302.db2.gz FQODWZSOKNQIOW-LEWJYISDSA-N 2 1 314.517 4.252 20 0 DIADMP CCc1ccc(C[C@H](C)[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001246657685 1059053084 /nfs/dbraw/zinc/05/30/84/1059053084.db2.gz PIIMPOLOUZVEKP-UWJYYQICSA-N 2 1 314.517 4.034 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)CC2)cc1 ZINC001246655820 1059053394 /nfs/dbraw/zinc/05/33/94/1059053394.db2.gz ATAWCUXZERWCKD-JZRYZNKLSA-N 2 1 318.892 4.050 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@@H]4[NH2+]CC[C@H]4C3)CC2)cc1 ZINC001246655820 1059053420 /nfs/dbraw/zinc/05/34/20/1059053420.db2.gz ATAWCUXZERWCKD-JZRYZNKLSA-N 2 1 318.892 4.050 20 0 DIADMP CCCCCC[C@@H](CCC)[N@H+]1C[C@@H]2C[NH2+]C[C@]2(C(F)(F)F)C1 ZINC001246658050 1059054388 /nfs/dbraw/zinc/05/43/88/1059054388.db2.gz SUQDPTSUJSTWAN-XHSDSOJGSA-N 2 1 320.443 4.209 20 0 DIADMP CCCCC[C@H](C)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246681813 1059061698 /nfs/dbraw/zinc/06/16/98/1059061698.db2.gz JEFDYKRXDPSAJY-DFQSSKMNSA-N 2 1 300.490 4.034 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2C)CC[NH2+]1 ZINC001246681373 1059062981 /nfs/dbraw/zinc/06/29/81/1059062981.db2.gz OBQOWYHEGKSHHT-GGPKGHCWSA-N 2 1 300.490 4.443 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2ccccc2C)C[C@@H](CC)[NH2+]1 ZINC001246682572 1059064523 /nfs/dbraw/zinc/06/45/23/1059064523.db2.gz WDOBBRCLISVURK-MBOZVWFJSA-N 2 1 300.490 4.441 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246680751 1059065564 /nfs/dbraw/zinc/06/55/64/1059065564.db2.gz KZIDPIJCQCPCJL-YTQUADARSA-N 2 1 300.490 4.299 20 0 DIADMP CCCCCC1CCC([N@H+]2C[C@@H](CF)[C@H](C3([NH3+])CC3)C2)CC1 ZINC001246698364 1059067197 /nfs/dbraw/zinc/06/71/97/1059067197.db2.gz XTAMOQGKCYPVFO-GPQLOAJWSA-N 2 1 310.501 4.134 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688366 1059067482 /nfs/dbraw/zinc/06/74/82/1059067482.db2.gz GTMGMQAKTQJMOZ-XJKSGUPXSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688366 1059067498 /nfs/dbraw/zinc/06/74/98/1059067498.db2.gz GTMGMQAKTQJMOZ-XJKSGUPXSA-N 2 1 315.288 4.202 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@@]3(C2)C[NH2+]CC[C@H]3F)CC1 ZINC001246687706 1059070126 /nfs/dbraw/zinc/07/01/26/1059070126.db2.gz DWNHXORARDGOAY-WXVPWVKJSA-N 2 1 310.501 4.005 20 0 DIADMP CCC[N@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246775516 1059071294 /nfs/dbraw/zinc/07/12/94/1059071294.db2.gz IXQDUSXHTOSYKD-SFTDATJTSA-N 2 1 308.469 4.392 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246775516 1059071310 /nfs/dbraw/zinc/07/13/10/1059071310.db2.gz IXQDUSXHTOSYKD-SFTDATJTSA-N 2 1 308.469 4.392 20 0 DIADMP CCC[N@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246775512 1059073262 /nfs/dbraw/zinc/07/32/62/1059073262.db2.gz IXQDUSXHTOSYKD-NHCUHLMSSA-N 2 1 308.469 4.392 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246775512 1059073278 /nfs/dbraw/zinc/07/32/78/1059073278.db2.gz IXQDUSXHTOSYKD-NHCUHLMSSA-N 2 1 308.469 4.392 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246769141 1059076025 /nfs/dbraw/zinc/07/60/25/1059076025.db2.gz ILUNZRNSAXIEPM-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2ccc(C)cc2)C[C@@H](CC)[NH2+]1 ZINC001246780986 1059077932 /nfs/dbraw/zinc/07/79/32/1059077932.db2.gz MPWSRLMATHRPMD-GGPKGHCWSA-N 2 1 300.490 4.441 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246775611 1059078273 /nfs/dbraw/zinc/07/82/73/1059078273.db2.gz IZQNTDAOIAMFLQ-QRVBRYPASA-N 2 1 300.490 4.033 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2ccc(OC)cc2)C[C@@H](CC)[NH2+]1 ZINC001246783157 1059079292 /nfs/dbraw/zinc/07/92/92/1059079292.db2.gz WSUSULINNXTGAM-MBOZVWFJSA-N 2 1 316.489 4.141 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246779303 1059081227 /nfs/dbraw/zinc/08/12/27/1059081227.db2.gz RTMXOXNCEWPCJF-PMACEKPBSA-N 2 1 312.501 4.321 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246775607 1059081386 /nfs/dbraw/zinc/08/13/86/1059081386.db2.gz IZQNTDAOIAMFLQ-OTWHNJEPSA-N 2 1 300.490 4.033 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001246784139 1059083316 /nfs/dbraw/zinc/08/33/16/1059083316.db2.gz FEHYXBZOVGJUGK-QZTJIDSGSA-N 2 1 318.892 4.399 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246783918 1059084122 /nfs/dbraw/zinc/08/41/22/1059084122.db2.gz RAVYYLTYRJJZPX-FUHWJXTLSA-N 2 1 304.453 4.049 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246789146 1059089524 /nfs/dbraw/zinc/08/95/24/1059089524.db2.gz JFNHZANANMJOBG-YOEHRIQHSA-N 2 1 304.865 4.152 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CCCC4(C[NH2+]C4)C3)CC2)cc1 ZINC001246789616 1059089734 /nfs/dbraw/zinc/08/97/34/1059089734.db2.gz CSZUJXNSNIUGDR-UHFFFAOYSA-N 2 1 318.892 4.052 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246791009 1059091984 /nfs/dbraw/zinc/09/19/84/1059091984.db2.gz XATKWMMWNXMTRV-QAPCUYQASA-N 2 1 302.437 4.027 20 0 DIADMP c1ccc(C[C@@H]2CC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246791532 1059093133 /nfs/dbraw/zinc/09/31/33/1059093133.db2.gz LBDKVMGXRNMWLZ-VQTJNVASSA-N 2 1 312.501 4.006 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2OC)C[C@H](CC)[NH2+]1 ZINC001246792528 1059094590 /nfs/dbraw/zinc/09/45/90/1059094590.db2.gz QLXBIEUVPPTQFA-ZMMAXQRCSA-N 2 1 316.489 4.141 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793659 1059095816 /nfs/dbraw/zinc/09/58/16/1059095816.db2.gz WAILJPZQLDHZQL-JLSDUUJJSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246793659 1059095838 /nfs/dbraw/zinc/09/58/38/1059095838.db2.gz WAILJPZQLDHZQL-JLSDUUJJSA-N 2 1 322.443 4.268 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792151 1059096526 /nfs/dbraw/zinc/09/65/26/1059096526.db2.gz OBVIZPPCRGLPKY-RCJHGTSTSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792151 1059096541 /nfs/dbraw/zinc/09/65/41/1059096541.db2.gz OBVIZPPCRGLPKY-RCJHGTSTSA-N 2 1 322.443 4.411 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246793634 1059097287 /nfs/dbraw/zinc/09/72/87/1059097287.db2.gz VAUAGRSWODSCOU-VAMGGRTRSA-N 2 1 300.490 4.004 20 0 DIADMP Fc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246796041 1059097806 /nfs/dbraw/zinc/09/78/06/1059097806.db2.gz KMZXGMUDALFIOX-VQIMIIECSA-N 2 1 316.464 4.418 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246794211 1059098447 /nfs/dbraw/zinc/09/84/47/1059098447.db2.gz XKGPKYQAAREALB-BASYENTBSA-N 2 1 304.865 4.150 20 0 DIADMP Fc1ccc(F)c([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c1 ZINC001246792505 1059099198 /nfs/dbraw/zinc/09/91/98/1059099198.db2.gz PRPBHTCGTNDWLX-OBONGRFPSA-N 2 1 320.427 4.024 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)C1CCC(Cc2ccccc2)CC1 ZINC001246797704 1059102844 /nfs/dbraw/zinc/10/28/44/1059102844.db2.gz PQWPHNROJOHGPF-UHFFFAOYSA-N 2 1 314.517 4.109 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246799922 1059103174 /nfs/dbraw/zinc/10/31/74/1059103174.db2.gz PJWHGMTXCBGECW-RBUKOAKNSA-N 2 1 316.464 4.418 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809214 1059104802 /nfs/dbraw/zinc/10/48/02/1059104802.db2.gz FYLQISZYYDWTGL-RKVPGOIHSA-N 2 1 320.908 4.296 20 0 DIADMP CC[C@@H]1CC([N@@H+](C)CCc2ccc(Cl)cc2)C[C@@H](CC)[NH2+]1 ZINC001246813006 1059105095 /nfs/dbraw/zinc/10/50/95/1059105095.db2.gz HHXBBJHDGRHOPN-IAGOWNOFSA-N 2 1 308.897 4.124 20 0 DIADMP Fc1ccccc1[C@H]1CC[N@H+]([C@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246809474 1059106412 /nfs/dbraw/zinc/10/64/12/1059106412.db2.gz WRLYTOJCAZYCRV-IRXDYDNUSA-N 2 1 316.464 4.070 20 0 DIADMP CC[C@H]1CC([N@@H+](C)CCc2ccc(Cl)cc2)C[C@H](CC)[NH2+]1 ZINC001246813007 1059106668 /nfs/dbraw/zinc/10/66/68/1059106668.db2.gz HHXBBJHDGRHOPN-IRXDYDNUSA-N 2 1 308.897 4.124 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@@H](C)C[C@H]2C)CC[NH2+]1 ZINC001246812400 1059106699 /nfs/dbraw/zinc/10/66/99/1059106699.db2.gz ZTZPXEDEIHDVHX-VWMOJTHMSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@@H](C)C[C@H]2C)CC[NH2+]1 ZINC001246812400 1059106705 /nfs/dbraw/zinc/10/67/05/1059106705.db2.gz ZTZPXEDEIHDVHX-VWMOJTHMSA-N 2 1 304.453 4.048 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809213 1059107007 /nfs/dbraw/zinc/10/70/07/1059107007.db2.gz FYLQISZYYDWTGL-MPGHIAIKSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)C[C@@H]1CC[NH2+]C1 ZINC001246815633 1059110102 /nfs/dbraw/zinc/11/01/02/1059110102.db2.gz ZSLKTKWIYKDCHU-RTBURBONSA-N 2 1 322.496 4.138 20 0 DIADMP C[N@@H+](CCc1ccc(Cl)cc1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246815607 1059110289 /nfs/dbraw/zinc/11/02/89/1059110289.db2.gz ZGGRSXCVAWDXFG-GOSISDBHSA-N 2 1 320.908 4.269 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@@H]([NH3+])CC[C@@H]1C ZINC001246818424 1059111405 /nfs/dbraw/zinc/11/14/05/1059111405.db2.gz BYJCSQSGOBORTL-DYEKYZERSA-N 2 1 315.288 4.126 20 0 DIADMP Fc1cccc([C@H]2CC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)c1 ZINC001246833543 1059113460 /nfs/dbraw/zinc/11/34/60/1059113460.db2.gz LSCZYJSCTJCRMS-PKOBYXMFSA-N 2 1 316.464 4.070 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246840368 1059117187 /nfs/dbraw/zinc/11/71/87/1059117187.db2.gz NLRBZXHVPOVPCQ-GOSISDBHSA-N 2 1 304.453 4.103 20 0 DIADMP CC[C@H]1CC([N@@H+]2CCc3c(Cl)cccc3C2)C[C@H](CC)[NH2+]1 ZINC001246839372 1059117379 /nfs/dbraw/zinc/11/73/79/1059117379.db2.gz AHGVDXLNXAAAHV-GJZGRUSLSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@H]1CC([N@H+]2CCc3c(Cl)cccc3C2)C[C@H](CC)[NH2+]1 ZINC001246839372 1059117391 /nfs/dbraw/zinc/11/73/91/1059117391.db2.gz AHGVDXLNXAAAHV-GJZGRUSLSA-N 2 1 306.881 4.007 20 0 DIADMP c1ccc(CC[N@@H+](Cc2ccccc2)[C@@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246841417 1059119149 /nfs/dbraw/zinc/11/91/49/1059119149.db2.gz RGOIZLXNAHGALO-KOUNCHBCSA-N 2 1 320.480 4.014 20 0 DIADMP CCc1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246845203 1059122212 /nfs/dbraw/zinc/12/22/12/1059122212.db2.gz LNGQNXAYUCBGBT-LEWJYISDSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246845203 1059122221 /nfs/dbraw/zinc/12/22/21/1059122221.db2.gz LNGQNXAYUCBGBT-LEWJYISDSA-N 2 1 308.469 4.174 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246845046 1059122508 /nfs/dbraw/zinc/12/25/08/1059122508.db2.gz KLYUVNGMXUGAPN-ZIFCJYIRSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246845046 1059122515 /nfs/dbraw/zinc/12/25/15/1059122515.db2.gz KLYUVNGMXUGAPN-ZIFCJYIRSA-N 2 1 304.453 4.192 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246843017 1059122700 /nfs/dbraw/zinc/12/27/00/1059122700.db2.gz HTJSZZRVPGTDRF-BWTSREIZSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246843017 1059122709 /nfs/dbraw/zinc/12/27/09/1059122709.db2.gz HTJSZZRVPGTDRF-BWTSREIZSA-N 2 1 322.452 4.194 20 0 DIADMP CCc1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246845205 1059123446 /nfs/dbraw/zinc/12/34/46/1059123446.db2.gz LNGQNXAYUCBGBT-NHCUHLMSSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246845205 1059123460 /nfs/dbraw/zinc/12/34/60/1059123460.db2.gz LNGQNXAYUCBGBT-NHCUHLMSSA-N 2 1 308.469 4.174 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246843020 1059123489 /nfs/dbraw/zinc/12/34/89/1059123489.db2.gz HTJSZZRVPGTDRF-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246843020 1059123494 /nfs/dbraw/zinc/12/34/94/1059123494.db2.gz HTJSZZRVPGTDRF-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246845031 1059123646 /nfs/dbraw/zinc/12/36/46/1059123646.db2.gz KLYUVNGMXUGAPN-AOIWGVFYSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246845031 1059123650 /nfs/dbraw/zinc/12/36/50/1059123650.db2.gz KLYUVNGMXUGAPN-AOIWGVFYSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845532 1059124953 /nfs/dbraw/zinc/12/49/53/1059124953.db2.gz OOUVPVULLSOYSJ-RTBURBONSA-N 2 1 324.468 4.441 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845532 1059124978 /nfs/dbraw/zinc/12/49/78/1059124978.db2.gz OOUVPVULLSOYSJ-RTBURBONSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246847484 1059126749 /nfs/dbraw/zinc/12/67/49/1059126749.db2.gz XQDIEMZJTLPIOY-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246847484 1059126762 /nfs/dbraw/zinc/12/67/62/1059126762.db2.gz XQDIEMZJTLPIOY-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP COc1ccc([C@@H](C)[N@@H+](C)C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246848731 1059127644 /nfs/dbraw/zinc/12/76/44/1059127644.db2.gz DHDXLVBIDOTPNT-MRXNPFEDSA-N 2 1 316.489 4.000 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(OC)c2)C[C@H](CC)[NH2+]1 ZINC001246849069 1059128901 /nfs/dbraw/zinc/12/89/01/1059128901.db2.gz PWPZPQYHOTWWDS-AJYBTWMASA-N 2 1 316.489 4.141 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246853014 1059131837 /nfs/dbraw/zinc/13/18/37/1059131837.db2.gz QGBURPQQCONATN-VQSBYGRUSA-N 2 1 316.489 4.000 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+]([C@H]3CCC4(C3)CC[NH2+]CC4)C2)c1 ZINC001246854397 1059132542 /nfs/dbraw/zinc/13/25/42/1059132542.db2.gz SZZQPLSZSAHDLF-AEFFLSMTSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+]([C@@H]3CCC4(C3)CC[NH2+]CC4)C2)c1 ZINC001246854401 1059132942 /nfs/dbraw/zinc/13/29/42/1059132942.db2.gz SZZQPLSZSAHDLF-SJLPKXTDSA-N 2 1 318.892 4.052 20 0 DIADMP F[C@@H]1CCC2(C1)CC[NH+]([C@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246851280 1059132960 /nfs/dbraw/zinc/13/29/60/1059132960.db2.gz FENXSYJERGCKBT-CEXWTWQISA-N 2 1 316.464 4.084 20 0 DIADMP FC1CC2(C1)CCC[N@@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246853463 1059133238 /nfs/dbraw/zinc/13/32/38/1059133238.db2.gz MAIBGPYZZCSCSO-LXPRWKDFSA-N 2 1 308.485 4.046 20 0 DIADMP FC1CC2(C1)CCC[N@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246853463 1059133248 /nfs/dbraw/zinc/13/32/48/1059133248.db2.gz MAIBGPYZZCSCSO-LXPRWKDFSA-N 2 1 308.485 4.046 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246860761 1059135773 /nfs/dbraw/zinc/13/57/73/1059135773.db2.gz AVFPPWWSSZDIEM-FKBYEOEOSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246860761 1059135781 /nfs/dbraw/zinc/13/57/81/1059135781.db2.gz AVFPPWWSSZDIEM-FKBYEOEOSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc(C[C@@H]2C[C@@H]([N@@H+](Cc3ccccc3)C3CC3)CC[NH2+]2)cc1 ZINC001246861085 1059135941 /nfs/dbraw/zinc/13/59/41/1059135941.db2.gz QIDQLRQAIUJOLD-IRLDBZIGSA-N 2 1 320.480 4.014 20 0 DIADMP CCC1CCC([N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)CC1 ZINC001246861203 1059136862 /nfs/dbraw/zinc/13/68/62/1059136862.db2.gz NYYRGZFGIFGWBN-UHFFFAOYSA-N 2 1 312.501 4.092 20 0 DIADMP C1C[C@@H](C2CCCCC2)[N@H+](C2CCC3(CCC[NH2+]C3)CC2)C1 ZINC001246867730 1059140826 /nfs/dbraw/zinc/14/08/26/1059140826.db2.gz ZGFRDFKQOABPGW-GPJFCIFZSA-N 2 1 304.522 4.344 20 0 DIADMP CC[C@@H]1C[C@H]([NH+]2CCC(c3ccccc3Cl)CC2)CC[NH2+]1 ZINC001246867779 1059141524 /nfs/dbraw/zinc/14/15/24/1059141524.db2.gz JEAQJMLIBSXQSK-HZPDHXFCSA-N 2 1 306.881 4.050 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246870578 1059142003 /nfs/dbraw/zinc/14/20/03/1059142003.db2.gz YMLKQOMQWFKXGE-BHIYHBOVSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3[C@@H]2CC)C[C@H](CC)[NH2+]1 ZINC001246868226 1059142524 /nfs/dbraw/zinc/14/25/24/1059142524.db2.gz RIEDDWLDQZMSCK-DMUMMCEESA-N 2 1 300.490 4.305 20 0 DIADMP CC1(C)C[N@H+](C2CCC3(CC[NH2+]CC3)CC2)Cc2ccccc21 ZINC001246871319 1059143056 /nfs/dbraw/zinc/14/30/56/1059143056.db2.gz PNOSBFQHCJJFBD-UHFFFAOYSA-N 2 1 312.501 4.092 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC[NH2+]1 ZINC001246871105 1059143125 /nfs/dbraw/zinc/14/31/25/1059143125.db2.gz NXVAYKVLLDHNHH-UCLAIMLFSA-N 2 1 320.908 4.078 20 0 DIADMP CC1(C)C[N@@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872671 1059143836 /nfs/dbraw/zinc/14/38/36/1059143836.db2.gz WXDOYUQCLAYRRE-TZIWHRDSSA-N 2 1 320.480 4.273 20 0 DIADMP CC1(C)C[N@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872671 1059143849 /nfs/dbraw/zinc/14/38/49/1059143849.db2.gz WXDOYUQCLAYRRE-TZIWHRDSSA-N 2 1 320.480 4.273 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246879877 1059146755 /nfs/dbraw/zinc/14/67/55/1059146755.db2.gz PXOFYWJCBKOVKG-KBXCAEBGSA-N 2 1 324.871 4.223 20 0 DIADMP CC[C@H]1CC([N@@H+]2CCc3cccc(Cl)c3C2)C[C@H](CC)[NH2+]1 ZINC001246876109 1059146879 /nfs/dbraw/zinc/14/68/79/1059146879.db2.gz YQOACUSXYZXVGW-GJZGRUSLSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@H]1CC([N@H+]2CCc3cccc(Cl)c3C2)C[C@H](CC)[NH2+]1 ZINC001246876109 1059146894 /nfs/dbraw/zinc/14/68/94/1059146894.db2.gz YQOACUSXYZXVGW-GJZGRUSLSA-N 2 1 306.881 4.007 20 0 DIADMP C[N@@H+](CCC(c1ccccc1)c1ccccc1)[C@@H]1CCC[NH2+]CC1 ZINC001246884746 1059149707 /nfs/dbraw/zinc/14/97/07/1059149707.db2.gz VDJNFQZOCACFMR-OAQYLSRUSA-N 2 1 322.496 4.283 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246892573 1059155847 /nfs/dbraw/zinc/15/58/47/1059155847.db2.gz FSXVOHQSZMQAHF-GBESFXJTSA-N 2 1 304.453 4.273 20 0 DIADMP CCC[N@@H+]([C@H](Cc1ccccc1)CC(C)C)C1CC[NH2+]CC1 ZINC001246892425 1059156432 /nfs/dbraw/zinc/15/64/32/1059156432.db2.gz CWDDYJJSCWLLJE-FQEVSTJZSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](C1CC[NH2+]CC1)C1CCC(Cc2ccccc2)CC1 ZINC001246894060 1059159360 /nfs/dbraw/zinc/15/93/60/1059159360.db2.gz NBKUFIIKHODENM-UHFFFAOYSA-N 2 1 314.517 4.252 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+]C2(CCCCC2)C1)C(C)(C)Cc1ccccc1 ZINC001246894294 1059160598 /nfs/dbraw/zinc/16/05/98/1059160598.db2.gz SUDNGZGHJARYOY-LJQANCHMSA-N 2 1 314.517 4.394 20 0 DIADMP Fc1cccc(F)c1[C@@H]1CCC[N@H+]1[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246902757 1059162845 /nfs/dbraw/zinc/16/28/45/1059162845.db2.gz UIDIRYKGOATXOK-FNHZYXHNSA-N 2 1 320.427 4.024 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246903014 1059162951 /nfs/dbraw/zinc/16/29/51/1059162951.db2.gz HIIACMCBBLFICQ-ZWKOTPCHSA-N 2 1 306.881 4.084 20 0 DIADMP CCCCCC[C@H](CCC)[N@H+]1CC[C@@H]([NH3+])[C@@H](C(F)(F)F)C1 ZINC001246941571 1059189258 /nfs/dbraw/zinc/18/92/58/1059189258.db2.gz WHCRDBNOWYYXTP-SOUVJXGZSA-N 2 1 308.432 4.337 20 0 DIADMP c1ccc2c(c1)C[N@@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)CCS2 ZINC001246905047 1059164632 /nfs/dbraw/zinc/16/46/32/1059164632.db2.gz KGBJPEOODQCGGQ-KRWDZBQOSA-N 2 1 316.514 4.049 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246907238 1059167487 /nfs/dbraw/zinc/16/74/87/1059167487.db2.gz UIIAPSOZDPCPIU-ACAXCVFMSA-N 2 1 300.490 4.337 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](CC)Cc2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC001246906982 1059167496 /nfs/dbraw/zinc/16/74/96/1059167496.db2.gz SZLFAFVZKBAVBP-CVEARBPZSA-N 2 1 314.395 4.058 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CCC3(CC[NH2+]CC3)CC2)cc1C ZINC001246905808 1059167645 /nfs/dbraw/zinc/16/76/45/1059167645.db2.gz BXCNKPLUQBWPFQ-UHFFFAOYSA-N 2 1 300.490 4.048 20 0 DIADMP C[N@H+](C1CCC2(CCc3ccccc32)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246910942 1059170639 /nfs/dbraw/zinc/17/06/39/1059170639.db2.gz NUKXWBXJYOHRER-SBHPSCBMSA-N 2 1 312.501 4.015 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246908752 1059171246 /nfs/dbraw/zinc/17/12/46/1059171246.db2.gz MIRDYSRYBDUMLN-FCHUYYIVSA-N 2 1 322.496 4.180 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246908758 1059171727 /nfs/dbraw/zinc/17/17/27/1059171727.db2.gz MIRDYSRYBDUMLN-YADHBBJMSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2[C@H]2CC[NH2+]C(C)(C)C2)cc1C ZINC001246908685 1059172127 /nfs/dbraw/zinc/17/21/27/1059172127.db2.gz MCDSJXKPBBZUMW-OALUTQOASA-N 2 1 300.490 4.361 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246912136 1059172234 /nfs/dbraw/zinc/17/22/34/1059172234.db2.gz DMGSUFYTPGPOJY-NRFANRHFSA-N 2 1 322.496 4.262 20 0 DIADMP FC(F)(F)c1ccc([C@H]2CCC[N@H+]2[C@@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246920262 1059176489 /nfs/dbraw/zinc/17/64/89/1059176489.db2.gz DJLMVAKVXNITEG-YYIAUSFCSA-N 2 1 324.390 4.125 20 0 DIADMP CCC1CCC([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)CC1 ZINC001246932818 1059179254 /nfs/dbraw/zinc/17/92/54/1059179254.db2.gz HMKWQVIGQZYDFS-UHFFFAOYSA-N 2 1 318.480 4.349 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932436 1059179901 /nfs/dbraw/zinc/17/99/01/1059179901.db2.gz AKKYKMWFULBBIK-IEBWSBKVSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+]2CCCC3(CCC3)C2)CC[NH2+]1 ZINC001246932436 1059179911 /nfs/dbraw/zinc/17/99/11/1059179911.db2.gz AKKYKMWFULBBIK-IEBWSBKVSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001246934032 1059183500 /nfs/dbraw/zinc/18/35/00/1059183500.db2.gz NBPZSKRREPPGAM-QUCCMNQESA-N 2 1 314.517 4.170 20 0 DIADMP CC1(C)CCC[C@@H]([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C1 ZINC001246933743 1059184019 /nfs/dbraw/zinc/18/40/19/1059184019.db2.gz BOOUQBBDGHGBSB-LJQANCHMSA-N 2 1 318.480 4.349 20 0 DIADMP CC[N@@H+](C[C@@H]1CC[NH2+]C1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246933683 1059184544 /nfs/dbraw/zinc/18/45/44/1059184544.db2.gz AQQUYMRNBGSOAK-LSJNQWAISA-N 2 1 320.908 4.298 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C[C@@H]1C ZINC001246936611 1059185678 /nfs/dbraw/zinc/18/56/78/1059185678.db2.gz WTNRNNIAWJDFMV-GJYPPUQNSA-N 2 1 318.480 4.204 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246937183 1059186219 /nfs/dbraw/zinc/18/62/19/1059186219.db2.gz ZVBCTIPQQANCAC-QGZVFWFLSA-N 2 1 306.469 4.349 20 0 DIADMP CCCCCC1CCC([N@H+]2CC[C@H]([NH3+])[C@H](C(F)(F)F)C2)CC1 ZINC001246933818 1059186289 /nfs/dbraw/zinc/18/62/89/1059186289.db2.gz JCNNCELZYMGECG-FJBKBRRZSA-N 2 1 320.443 4.337 20 0 DIADMP Fc1ccccc1C[N@@H+](C1CC[NH2+]CC1)C1CCCCCC1 ZINC001246935965 1059186418 /nfs/dbraw/zinc/18/64/18/1059186418.db2.gz UMORQSXUIUWZDR-UHFFFAOYSA-N 2 1 304.453 4.103 20 0 DIADMP CC(C)CC[C@H](C)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246934700 1059186571 /nfs/dbraw/zinc/18/65/71/1059186571.db2.gz PAQJFXFMVHAUKS-INIZCTEOSA-N 2 1 306.469 4.204 20 0 DIADMP Fc1ccc(C[N@@H+](CC2CC[NH2+]CC2)C2CCCCCC2)cc1 ZINC001246940430 1059186737 /nfs/dbraw/zinc/18/67/37/1059186737.db2.gz XJBPBWARHSSNFP-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001246944366 1059188483 /nfs/dbraw/zinc/18/84/83/1059188483.db2.gz AXCPVLWVQAHTQO-QGZVFWFLSA-N 2 1 308.897 4.473 20 0 DIADMP [NH3+][C@@H]1CC[N@H+](C2CCC3(CCCCC3)CC2)C[C@@H]1C(F)(F)F ZINC001246943231 1059189495 /nfs/dbraw/zinc/18/94/95/1059189495.db2.gz ZSGSBKSRGMXHLV-LSDHHAIUSA-N 2 1 318.427 4.091 20 0 DIADMP CC(C)CC[C@@H](C)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246944850 1059189598 /nfs/dbraw/zinc/18/95/98/1059189598.db2.gz VTJLBHRUOBRQCH-MRXNPFEDSA-N 2 1 306.469 4.204 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001246945575 1059190277 /nfs/dbraw/zinc/19/02/77/1059190277.db2.gz HBDSEFXMAKCHIC-OAHLLOKOSA-N 2 1 308.897 4.473 20 0 DIADMP C[C@@H]1CCC[C@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246941894 1059191114 /nfs/dbraw/zinc/19/11/14/1059191114.db2.gz IWOVEMWOWNNFKH-UZLBHIALSA-N 2 1 318.480 4.206 20 0 DIADMP C[C@H]1CCC[C@@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246941892 1059191395 /nfs/dbraw/zinc/19/13/95/1059191395.db2.gz IWOVEMWOWNNFKH-OXJNMPFZSA-N 2 1 318.480 4.206 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246943702 1059191459 /nfs/dbraw/zinc/19/14/59/1059191459.db2.gz SDBUWHLWFSGZGN-INIZCTEOSA-N 2 1 306.469 4.349 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246946273 1059193943 /nfs/dbraw/zinc/19/39/43/1059193943.db2.gz KQDMNPUKBBKQJS-GOSISDBHSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@H](CC1CC1)[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246949581 1059194557 /nfs/dbraw/zinc/19/45/57/1059194557.db2.gz ANJCMCFKDZRQCE-CQSZACIVSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@H](CC1CC1)[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246949581 1059194574 /nfs/dbraw/zinc/19/45/74/1059194574.db2.gz ANJCMCFKDZRQCE-CQSZACIVSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246948013 1059195219 /nfs/dbraw/zinc/19/52/19/1059195219.db2.gz ZNNUERXMRCLWMG-OAHLLOKOSA-N 2 1 322.924 4.371 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC[NH2+]1 ZINC001246946711 1059196107 /nfs/dbraw/zinc/19/61/07/1059196107.db2.gz HOTCNZPWJBPNQC-RCCFBDPRSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955958 1059197848 /nfs/dbraw/zinc/19/78/48/1059197848.db2.gz OQFPDDOGJBBANL-KBXCAEBGSA-N 2 1 322.443 4.098 20 0 DIADMP CCOCC[N@@H+](C1CC[NH2+]CC1)C1CCC(C(C)(C)CC)CC1 ZINC001246952578 1059199177 /nfs/dbraw/zinc/19/91/77/1059199177.db2.gz ZTTDAEQVISQNJN-UHFFFAOYSA-N 2 1 324.553 4.072 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001246955653 1059199946 /nfs/dbraw/zinc/19/99/46/1059199946.db2.gz MWCTUMFGXZHIMJ-KRWDZBQOSA-N 2 1 306.469 4.267 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246956396 1059200042 /nfs/dbraw/zinc/20/00/42/1059200042.db2.gz SJLCLHDWWAPKNQ-UHFFFAOYSA-N 2 1 324.459 4.488 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246954887 1059201558 /nfs/dbraw/zinc/20/15/58/1059201558.db2.gz JKTORGADKHBPGS-HNNXBMFYSA-N 2 1 310.432 4.098 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](Cc1ccc(OC)cc1)C1CC[NH2+]CC1 ZINC001246953160 1059201942 /nfs/dbraw/zinc/20/19/42/1059201942.db2.gz LXNLVCAUSHMJNR-GOSISDBHSA-N 2 1 318.505 4.074 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CC[NH2+]CC1)C1CCC(C)CC1 ZINC001246962415 1059203552 /nfs/dbraw/zinc/20/35/52/1059203552.db2.gz JNXVPCGDSFSEDZ-UHFFFAOYSA-N 2 1 318.480 4.267 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2cc(F)ccc2C)C2CC[NH2+]CC2)C1 ZINC001246961465 1059205368 /nfs/dbraw/zinc/20/53/68/1059205368.db2.gz FOCICISDCREXBI-OXJNMPFZSA-N 2 1 318.480 4.267 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246964067 1059206520 /nfs/dbraw/zinc/20/65/20/1059206520.db2.gz KRJRAVZRWSPDCB-BHIYHBOVSA-N 2 1 318.505 4.346 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CC[NH2+]CC1)C1CCC(C)CC1 ZINC001246958857 1059207229 /nfs/dbraw/zinc/20/72/29/1059207229.db2.gz IDNFZSDWDBAYKF-UHFFFAOYSA-N 2 1 318.480 4.267 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246956727 1059208364 /nfs/dbraw/zinc/20/83/64/1059208364.db2.gz ZYZKMVVSGUSMHO-QGZVFWFLSA-N 2 1 320.908 4.473 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2C)C2CC[NH2+]CC2)C1 ZINC001246963873 1059208527 /nfs/dbraw/zinc/20/85/27/1059208527.db2.gz ZUQUPPFBABLZIX-JXFKEZNVSA-N 2 1 318.480 4.267 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@H+]2CCCC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246968579 1059212016 /nfs/dbraw/zinc/21/20/16/1059212016.db2.gz RUMZSTRGWZKHKO-GBESFXJTSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1C ZINC001246965300 1059212207 /nfs/dbraw/zinc/21/22/07/1059212207.db2.gz HAMHQLPIFUAPKU-NHCUHLMSSA-N 2 1 312.501 4.190 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246974781 1059216174 /nfs/dbraw/zinc/21/61/74/1059216174.db2.gz QYPYJGLWWQZVON-YSIASYRMSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001246976234 1059216516 /nfs/dbraw/zinc/21/65/16/1059216516.db2.gz VUIHINPCICEDHR-TZIWHRDSSA-N 2 1 314.517 4.108 20 0 DIADMP CCCCCC(CCCCC)[N@H+]1CC[C@@H](N2CCC([NH3+])CC2)C1 ZINC001246972587 1059216930 /nfs/dbraw/zinc/21/69/30/1059216930.db2.gz CXGAQWLBISMOPP-HXUWFJFHSA-N 2 1 323.569 4.013 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](CCC)C[C@H]1CC[NH2+]C1 ZINC001246974638 1059217024 /nfs/dbraw/zinc/21/70/24/1059217024.db2.gz LDUKRKOZLPTEQS-PMACEKPBSA-N 2 1 302.506 4.109 20 0 DIADMP C([C@@H]1CCC[NH2+]C1)[N@@H+](C1CC1)[C@H]1CCCC2(CCCCC2)C1 ZINC001246971891 1059217165 /nfs/dbraw/zinc/21/71/65/1059217165.db2.gz ISVVNHHDBLVTLV-MJGOQNOKSA-N 2 1 304.522 4.344 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001246976223 1059217930 /nfs/dbraw/zinc/21/79/30/1059217930.db2.gz VUIHINPCICEDHR-CTNGQTDRSA-N 2 1 314.517 4.108 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001246971310 1059219062 /nfs/dbraw/zinc/21/90/62/1059219062.db2.gz FMMZRSOTWSGMIV-WOJBJXKFSA-N 2 1 314.517 4.252 20 0 DIADMP CCCCCC(CCCCC)[N@H+]1CC[C@H](N2CCC([NH3+])CC2)C1 ZINC001246972585 1059219627 /nfs/dbraw/zinc/21/96/27/1059219627.db2.gz CXGAQWLBISMOPP-FQEVSTJZSA-N 2 1 323.569 4.013 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246978861 1059220889 /nfs/dbraw/zinc/22/08/89/1059220889.db2.gz NBFOANZQTREMJM-MHTWAQMVSA-N 2 1 314.517 4.393 20 0 DIADMP CCC[N@@H+](C[C@@H]1CC[NH2+]C1)C1CCC(c2ccccc2)CC1 ZINC001246979623 1059221626 /nfs/dbraw/zinc/22/16/26/1059221626.db2.gz ZXPYEEDCMNMHOX-QHGAOEGBSA-N 2 1 300.490 4.034 20 0 DIADMP C1CC([N@@H+](C2CC[NH2+]CC2)C2CCC3(CCCCC3)CC2)C1 ZINC001246976347 1059222054 /nfs/dbraw/zinc/22/20/54/1059222054.db2.gz OEXQJENVBKKOBC-UHFFFAOYSA-N 2 1 304.522 4.486 20 0 DIADMP C[C@H]1c2ccccc2CC[N@@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246988867 1059227191 /nfs/dbraw/zinc/22/71/91/1059227191.db2.gz ZOLGGBYPYHCFBW-NBHGPNQESA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246988867 1059227211 /nfs/dbraw/zinc/22/72/11/1059227211.db2.gz ZOLGGBYPYHCFBW-NBHGPNQESA-N 2 1 306.453 4.099 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246983580 1059227651 /nfs/dbraw/zinc/22/76/51/1059227651.db2.gz CAIUCLZEQMAZRG-ZSHCYNCHSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246983580 1059227673 /nfs/dbraw/zinc/22/76/73/1059227673.db2.gz CAIUCLZEQMAZRG-ZSHCYNCHSA-N 2 1 313.272 4.098 20 0 DIADMP CCCCCC[C@H](C)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001246999796 1059229135 /nfs/dbraw/zinc/22/91/35/1059229135.db2.gz BTSYLYGZPNJENT-KRWDZBQOSA-N 2 1 300.490 4.440 20 0 DIADMP C[N@H+]([C@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246998852 1059230066 /nfs/dbraw/zinc/23/00/66/1059230066.db2.gz HDZNYLKDHMLLQE-GIVPXCGWSA-N 2 1 306.453 4.099 20 0 DIADMP C[N@@H+]([C@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246998852 1059230088 /nfs/dbraw/zinc/23/00/88/1059230088.db2.gz HDZNYLKDHMLLQE-GIVPXCGWSA-N 2 1 306.453 4.099 20 0 DIADMP CC(C)CCC[C@H](C)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247006117 1059232400 /nfs/dbraw/zinc/23/24/00/1059232400.db2.gz SSWVDEPZYDTHKI-SFHVURJKSA-N 2 1 314.517 4.338 20 0 DIADMP CC(C)=CCC[C@H](C)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247007543 1059233311 /nfs/dbraw/zinc/23/33/11/1059233311.db2.gz XRSQGLNNHNQJON-SFHVURJKSA-N 2 1 312.501 4.258 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001247001761 1059235664 /nfs/dbraw/zinc/23/56/64/1059235664.db2.gz KZIDPIJCQCPCJL-QXAKKESOSA-N 2 1 300.490 4.299 20 0 DIADMP CC(C)C1CCC([NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC1 ZINC001247013664 1059244483 /nfs/dbraw/zinc/24/44/83/1059244483.db2.gz HSIRESWBRLEYOM-UHFFFAOYSA-N 2 1 312.501 4.296 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247012417 1059244527 /nfs/dbraw/zinc/24/45/27/1059244527.db2.gz DJKBTXXIINKNIV-OAHLLOKOSA-N 2 1 318.530 4.001 20 0 DIADMP CC(C)CCC[C@H](C)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247016343 1059246283 /nfs/dbraw/zinc/24/62/83/1059246283.db2.gz TYQVFEWWHLZRLN-KRWDZBQOSA-N 2 1 300.490 4.296 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001559524830 1059320259 /nfs/dbraw/zinc/32/02/59/1059320259.db2.gz RNMIFPCLJNKMKG-IAGOWNOFSA-N 2 1 316.480 4.256 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H]2CCC3(CCCCCC3)O2)C[C@H]1C ZINC001559584682 1059417894 /nfs/dbraw/zinc/41/78/94/1059417894.db2.gz UMVOPAMFQWGWRI-CEXWTWQISA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@H]2CCC3(CCCCCC3)O2)C[C@H]1C ZINC001559584682 1059417905 /nfs/dbraw/zinc/41/79/05/1059417905.db2.gz UMVOPAMFQWGWRI-CEXWTWQISA-N 2 1 322.537 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@H]2CCC3(CCCCCC3)O2)C[C@H]1C ZINC001559584682 1059417914 /nfs/dbraw/zinc/41/79/14/1059417914.db2.gz UMVOPAMFQWGWRI-CEXWTWQISA-N 2 1 322.537 4.063 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC001559594116 1059428203 /nfs/dbraw/zinc/42/82/03/1059428203.db2.gz JKNMWNGOGKIIGM-KNQAVFIVSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC001559594116 1059428208 /nfs/dbraw/zinc/42/82/08/1059428208.db2.gz JKNMWNGOGKIIGM-KNQAVFIVSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC001559594116 1059428219 /nfs/dbraw/zinc/42/82/19/1059428219.db2.gz JKNMWNGOGKIIGM-KNQAVFIVSA-N 2 1 322.496 4.318 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+](CC4CCCC4)CC[C@@H]32)cc1 ZINC001559594756 1059429317 /nfs/dbraw/zinc/42/93/17/1059429317.db2.gz TVRDHPIFMPZJNT-RTWAWAEBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+](CC4CCCC4)CC[C@@H]32)cc1 ZINC001559594756 1059429326 /nfs/dbraw/zinc/42/93/26/1059429326.db2.gz TVRDHPIFMPZJNT-RTWAWAEBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+](CC4CCCC4)CC[C@@H]32)cc1 ZINC001559594756 1059429331 /nfs/dbraw/zinc/42/93/31/1059429331.db2.gz TVRDHPIFMPZJNT-RTWAWAEBSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001559718112 1059545308 /nfs/dbraw/zinc/54/53/08/1059545308.db2.gz JFGSCAITAZDUMB-GOSISDBHSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)CC(C)(C)C ZINC001559793217 1059628701 /nfs/dbraw/zinc/62/87/01/1059628701.db2.gz HQNJAZPMFRSPSW-MRXNPFEDSA-N 2 1 317.521 4.471 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@H+](CC4CCCCC4)C3)C2)cc1 ZINC001559829571 1059662320 /nfs/dbraw/zinc/66/23/20/1059662320.db2.gz WZIXSRJCJJRTGB-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(CC[NH+](CC4CCCCC4)C3)C2)cc1 ZINC001559829571 1059662326 /nfs/dbraw/zinc/66/23/26/1059662326.db2.gz WZIXSRJCJJRTGB-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](CC4CCCCC4)C3)C2)cc1 ZINC001559829571 1059662332 /nfs/dbraw/zinc/66/23/32/1059662332.db2.gz WZIXSRJCJJRTGB-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP FCC[C@@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001559998420 1059803566 /nfs/dbraw/zinc/80/35/66/1059803566.db2.gz CLZLKIAVCGKZAZ-SFHVURJKSA-N 2 1 318.480 4.244 20 0 DIADMP CC[N@@H+](CCC1=CCCCC1)Cc1ccc(C[NH+](C)C)cc1 ZINC001560043182 1059854679 /nfs/dbraw/zinc/85/46/79/1059854679.db2.gz PYWVDLHLIDPMOU-UHFFFAOYSA-N 2 1 300.490 4.461 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC(C)([NH+](C)C)CC1 ZINC001560071379 1059887596 /nfs/dbraw/zinc/88/75/96/1059887596.db2.gz GHHGIYNDVQKFQW-MRXNPFEDSA-N 2 1 302.506 4.461 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@H]2[C@H](CC[NH+]2C)C1 ZINC001560077684 1059894979 /nfs/dbraw/zinc/89/49/79/1059894979.db2.gz UJIJPZDKVNCVAP-SUMDDJOVSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@H]2[C@H](CC[N@@H+]2C)C1 ZINC001560077684 1059894997 /nfs/dbraw/zinc/89/49/97/1059894997.db2.gz UJIJPZDKVNCVAP-SUMDDJOVSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC001560077684 1059895018 /nfs/dbraw/zinc/89/50/18/1059895018.db2.gz UJIJPZDKVNCVAP-SUMDDJOVSA-N 2 1 300.490 4.071 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)[C@H]1CCc2ccc(F)cc21 ZINC001560100375 1059908345 /nfs/dbraw/zinc/90/83/45/1059908345.db2.gz JXWODTNTNXSCDB-IBGZPJMESA-N 2 1 304.453 4.011 20 0 DIADMP CC(C)CCC[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC001560266096 1060036682 /nfs/dbraw/zinc/03/66/82/1060036682.db2.gz PJRFSMKUOLMRIA-GOSISDBHSA-N 2 1 302.506 4.444 20 0 DIADMP Cc1cc2cc(C[NH2+]C[C@H](C)C[NH+]3CCCCC3)oc2cc1C ZINC001560282977 1060062048 /nfs/dbraw/zinc/06/20/48/1060062048.db2.gz QATSCXANPJTYBH-HNNXBMFYSA-N 2 1 314.473 4.261 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC001560349502 1060135238 /nfs/dbraw/zinc/13/52/38/1060135238.db2.gz NCCGAWDNHGUZBP-IEBWSBKVSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC001560349502 1060135250 /nfs/dbraw/zinc/13/52/50/1060135250.db2.gz NCCGAWDNHGUZBP-IEBWSBKVSA-N 2 1 314.498 4.229 20 0 DIADMP CC[N@@H+](Cc1sc(Cl)c2ccccc21)C1CCN(C)CC1 ZINC001249068374 1060141555 /nfs/dbraw/zinc/14/15/55/1060141555.db2.gz TWMLLPLZCQRUTC-UHFFFAOYSA-N 2 1 322.905 4.471 20 0 DIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1sc(Cl)c2ccccc21 ZINC001249068087 1060141694 /nfs/dbraw/zinc/14/16/94/1060141694.db2.gz RJIVQGCMXHYFJC-UHFFFAOYSA-N 2 1 322.905 4.472 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1sc(Cl)c2ccccc21 ZINC001249068087 1060141703 /nfs/dbraw/zinc/14/17/03/1060141703.db2.gz RJIVQGCMXHYFJC-UHFFFAOYSA-N 2 1 322.905 4.472 20 0 DIADMP CCC(C)(C)c1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC001560411042 1060195205 /nfs/dbraw/zinc/19/52/05/1060195205.db2.gz QSQFEJDKFXOWLZ-OALUTQOASA-N 2 1 300.490 4.091 20 0 DIADMP CCC(C)(C)c1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC001560411046 1060195724 /nfs/dbraw/zinc/19/57/24/1060195724.db2.gz QSQFEJDKFXOWLZ-RTBURBONSA-N 2 1 300.490 4.091 20 0 DIADMP C[C@@H](CC[NH2+]Cc1cccc(C(F)(F)F)c1)[NH+]1CCCCC1 ZINC001560436538 1060224376 /nfs/dbraw/zinc/22/43/76/1060224376.db2.gz IXXRYHQLZDXPDH-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccc(-c3ccc(C)cc3)c2)C1 ZINC000470021647 1060260697 /nfs/dbraw/zinc/26/06/97/1060260697.db2.gz ZPFPOTKQUQSEHV-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]CCCC[N@H+](C)C3CC3)o2)cc1 ZINC001560495814 1060291218 /nfs/dbraw/zinc/29/12/18/1060291218.db2.gz NPAWROPWPGHTJL-UHFFFAOYSA-N 2 1 312.457 4.219 20 0 DIADMP Fc1ccccc1CN1CCC[C@]2(CC[N@H+](C3CCCC3)C2)C1 ZINC001278524253 1060344549 /nfs/dbraw/zinc/34/45/49/1060344549.db2.gz AXOBYCVCXSJCRP-FQEVSTJZSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@H](CC1CCC1)[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001560548791 1060357926 /nfs/dbraw/zinc/35/79/26/1060357926.db2.gz BMFVTXUFPUXLJO-QGZVFWFLSA-N 2 1 302.506 4.313 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCCc3ccc(Cl)cc32)CC1(C)C ZINC001560549836 1060361294 /nfs/dbraw/zinc/36/12/94/1060361294.db2.gz SUVHALRYJDLXLD-NVXWUHKLSA-N 2 1 306.881 4.180 20 0 DIADMP Cc1cc(Nc2ccnc3cc(C(F)(F)F)ccc32)c[nH+]c1N ZINC001249781678 1060398336 /nfs/dbraw/zinc/39/83/36/1060398336.db2.gz KILQVJBQAFROQZ-UHFFFAOYSA-N 2 1 318.302 4.283 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560610176 1060424514 /nfs/dbraw/zinc/42/45/14/1060424514.db2.gz MCXNJTYHFPQNFM-AEFFLSMTSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560610176 1060424523 /nfs/dbraw/zinc/42/45/23/1060424523.db2.gz MCXNJTYHFPQNFM-AEFFLSMTSA-N 2 1 314.517 4.454 20 0 DIADMP c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC001560615791 1060428941 /nfs/dbraw/zinc/42/89/41/1060428941.db2.gz ATOXHVWUXLTRMN-BHIFYINESA-N 2 1 320.480 4.077 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001560616183 1060430299 /nfs/dbraw/zinc/43/02/99/1060430299.db2.gz RUWMFANQANKZJG-QHAWAJNXSA-N 2 1 314.517 4.313 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC001560640481 1060460717 /nfs/dbraw/zinc/46/07/17/1060460717.db2.gz RCPLMDNTDTXPCE-SDVBZNEUSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)CC1 ZINC001560640481 1060460725 /nfs/dbraw/zinc/46/07/25/1060460725.db2.gz RCPLMDNTDTXPCE-SDVBZNEUSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)CC1 ZINC001560640481 1060460741 /nfs/dbraw/zinc/46/07/41/1060460741.db2.gz RCPLMDNTDTXPCE-SDVBZNEUSA-N 2 1 318.549 4.398 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)CC1 ZINC001560670387 1060502965 /nfs/dbraw/zinc/50/29/65/1060502965.db2.gz CAECFEGBULJOPM-LEWJYISDSA-N 2 1 312.501 4.120 20 0 DIADMP C[C@H]([NH2+]C1CC2(C1)CCCC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001560711942 1060568902 /nfs/dbraw/zinc/56/89/02/1060568902.db2.gz XNTSTYZSLGPWKG-PKOBYXMFSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]([NH2+]C1CC2(C1)CCCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001560711941 1060569962 /nfs/dbraw/zinc/56/99/62/1060569962.db2.gz XNTSTYZSLGPWKG-MJGOQNOKSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001560749507 1060616240 /nfs/dbraw/zinc/61/62/40/1060616240.db2.gz HRKOZYBALRDYBT-NSHGMRRFSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@@H]1CC[C@@H]1[NH2+]C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001560820954 1060679414 /nfs/dbraw/zinc/67/94/14/1060679414.db2.gz ZWRAMUBINMOPLK-LMNJBCLMSA-N 2 1 314.517 4.313 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001560834679 1060690995 /nfs/dbraw/zinc/69/09/95/1060690995.db2.gz ABZGNDVBJQZUTA-YHELAOLJSA-N 2 1 312.501 4.236 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001560834679 1060690999 /nfs/dbraw/zinc/69/09/99/1060690999.db2.gz ABZGNDVBJQZUTA-YHELAOLJSA-N 2 1 312.501 4.236 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](CC3CCC4(CCCCC4)CC3)C2)C1 ZINC001560853612 1060712640 /nfs/dbraw/zinc/71/26/40/1060712640.db2.gz CDCCZDVSOJIWSZ-HXUWFJFHSA-N 2 1 304.522 4.155 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](CC3CCC4(CCCCC4)CC3)C2)C1 ZINC001560853612 1060712656 /nfs/dbraw/zinc/71/26/56/1060712656.db2.gz CDCCZDVSOJIWSZ-HXUWFJFHSA-N 2 1 304.522 4.155 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](CC3CCC4(CCCCC4)CC3)C2)C1 ZINC001560853612 1060712670 /nfs/dbraw/zinc/71/26/70/1060712670.db2.gz CDCCZDVSOJIWSZ-HXUWFJFHSA-N 2 1 304.522 4.155 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001560861089 1060719646 /nfs/dbraw/zinc/71/96/46/1060719646.db2.gz DNMCQKMZYKWLFM-QGZVFWFLSA-N 2 1 304.522 4.237 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001560861089 1060719661 /nfs/dbraw/zinc/71/96/61/1060719661.db2.gz DNMCQKMZYKWLFM-QGZVFWFLSA-N 2 1 304.522 4.237 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H](C)Cc1ccccc1SC ZINC001560869701 1060731075 /nfs/dbraw/zinc/73/10/75/1060731075.db2.gz OGVCLQZZUDBPKO-CVEARBPZSA-N 2 1 308.535 4.050 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H](C)Cc1ccccc1SC ZINC001560869701 1060731087 /nfs/dbraw/zinc/73/10/87/1060731087.db2.gz OGVCLQZZUDBPKO-CVEARBPZSA-N 2 1 308.535 4.050 20 0 DIADMP C[C@H](CCC1CCCC1)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560900787 1060761888 /nfs/dbraw/zinc/76/18/88/1060761888.db2.gz ILTJXKNHVXPOLV-UIFIKXQLSA-N 2 1 314.517 4.280 20 0 DIADMP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CCC[N@@H+](C)CC(C)C ZINC001560916501 1060776370 /nfs/dbraw/zinc/77/63/70/1060776370.db2.gz OZBPIZOIXTXIFB-SFHVURJKSA-N 2 1 310.913 4.229 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CC[C@H]2[C@@H](CC[N@@H+]2C)C1 ZINC001560972102 1060834302 /nfs/dbraw/zinc/83/43/02/1060834302.db2.gz CUGPDBFQINBTMI-UGKGYDQZSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H]2[C@@H](CC[NH+]2C)C1 ZINC001560972102 1060834315 /nfs/dbraw/zinc/83/43/15/1060834315.db2.gz CUGPDBFQINBTMI-UGKGYDQZSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@H]2[C@@H](CC[NH+]2C)C1 ZINC001560972102 1060834326 /nfs/dbraw/zinc/83/43/26/1060834326.db2.gz CUGPDBFQINBTMI-UGKGYDQZSA-N 2 1 320.480 4.188 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001560980032 1060845841 /nfs/dbraw/zinc/84/58/41/1060845841.db2.gz WJVHTDTZUBUIFZ-UHFFFAOYSA-N 2 1 322.924 4.448 20 0 DIADMP CC(C)C([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C(C)C ZINC001561048809 1060898168 /nfs/dbraw/zinc/89/81/68/1060898168.db2.gz FPFXKSDGUDEPOB-UFYCRDLUSA-N 2 1 314.517 4.310 20 0 DIADMP C[N@@H+](CC1CC2(CCC2)C1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001473190134 1060942303 /nfs/dbraw/zinc/94/23/03/1060942303.db2.gz LXXMSZJOFJOAQP-IBGZPJMESA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](CC1CC2(CCC2)C1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001473190134 1060942327 /nfs/dbraw/zinc/94/23/27/1060942327.db2.gz LXXMSZJOFJOAQP-IBGZPJMESA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](CC1CC2(CCC2)C1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001473190134 1060942340 /nfs/dbraw/zinc/94/23/40/1060942340.db2.gz LXXMSZJOFJOAQP-IBGZPJMESA-N 2 1 312.501 4.021 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@H]1C ZINC001473211380 1060982899 /nfs/dbraw/zinc/98/28/99/1060982899.db2.gz YUJYIQKTESWJGG-UKAVVXHISA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@H]1C ZINC001473211380 1060982927 /nfs/dbraw/zinc/98/29/27/1060982927.db2.gz YUJYIQKTESWJGG-UKAVVXHISA-N 2 1 314.517 4.375 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)C[C@H]1C ZINC001473211380 1060982948 /nfs/dbraw/zinc/98/29/48/1060982948.db2.gz YUJYIQKTESWJGG-UKAVVXHISA-N 2 1 314.517 4.375 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](CC3CCC(C(C)(C)C)CC3)CC[C@H]21 ZINC001473219455 1060998601 /nfs/dbraw/zinc/99/86/01/1060998601.db2.gz HRMITUMOAZZBFC-VLOYRQLPSA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](CC3CCC(C(C)(C)C)CC3)CC[C@H]21 ZINC001473219455 1060998619 /nfs/dbraw/zinc/99/86/19/1060998619.db2.gz HRMITUMOAZZBFC-VLOYRQLPSA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](CC3CCC(C(C)(C)C)CC3)CC[C@H]21 ZINC001473219455 1060998639 /nfs/dbraw/zinc/99/86/39/1060998639.db2.gz HRMITUMOAZZBFC-VLOYRQLPSA-N 2 1 306.538 4.255 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl ZINC001462189486 1061012220 /nfs/dbraw/zinc/01/22/20/1061012220.db2.gz IUXKXKSCGUZCHX-HFTRVMKXSA-N 2 1 308.897 4.296 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1)C1CC1 ZINC001462310020 1061095858 /nfs/dbraw/zinc/09/58/58/1061095858.db2.gz MEDKQQVMXCZKJD-WOJBJXKFSA-N 2 1 300.490 4.177 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1)C1CC1 ZINC001462311128 1061098158 /nfs/dbraw/zinc/09/81/58/1061098158.db2.gz QJMOFHIZHDRPEW-MOPGFXCFSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1)C1CC1 ZINC001462311134 1061099460 /nfs/dbraw/zinc/09/94/60/1061099460.db2.gz QJMOFHIZHDRPEW-RBUKOAKNSA-N 2 1 320.908 4.440 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(F)ccc2Cl)cc1 ZINC001473341676 1061099817 /nfs/dbraw/zinc/09/98/17/1061099817.db2.gz CHSQPVZVDSLLIB-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(F)ccc2Cl)cc1 ZINC001473341676 1061099828 /nfs/dbraw/zinc/09/98/28/1061099828.db2.gz CHSQPVZVDSLLIB-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP CC1(C)CCC[N@@H+]1CC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001462331315 1061108099 /nfs/dbraw/zinc/10/80/99/1061108099.db2.gz ARWQCARKENWPQR-LJQANCHMSA-N 2 1 316.464 4.226 20 0 DIADMP CC1(C)CCC[N@H+]1CC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001462331315 1061108110 /nfs/dbraw/zinc/10/81/10/1061108110.db2.gz ARWQCARKENWPQR-LJQANCHMSA-N 2 1 316.464 4.226 20 0 DIADMP COc1ccc(C)cc1[C@H](C)[NH2+]C1CC[NH+](CCC(C)C)CC1 ZINC001462333885 1061111042 /nfs/dbraw/zinc/11/10/42/1061111042.db2.gz PEBMBEPCQNTLQE-KRWDZBQOSA-N 2 1 318.505 4.165 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001473368827 1061115729 /nfs/dbraw/zinc/11/57/29/1061115729.db2.gz BMFFTTGEAASQGE-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP CCCc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001473369603 1061116278 /nfs/dbraw/zinc/11/62/78/1061116278.db2.gz HIXTZTWOJJWQAW-YLJYHZDGSA-N 2 1 314.517 4.382 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001473368829 1061116436 /nfs/dbraw/zinc/11/64/36/1061116436.db2.gz BMFFTTGEAASQGE-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@H+](Cc2cc(Cl)cc3ccccc32)CC1 ZINC001473381067 1061124383 /nfs/dbraw/zinc/12/43/83/1061124383.db2.gz XERDQLRBXGJTME-GOSISDBHSA-N 2 1 316.876 4.409 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc3ccccc32)CC1 ZINC001473381067 1061124390 /nfs/dbraw/zinc/12/43/90/1061124390.db2.gz XERDQLRBXGJTME-GOSISDBHSA-N 2 1 316.876 4.409 20 0 DIADMP CCc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC001473410297 1061146368 /nfs/dbraw/zinc/14/63/68/1061146368.db2.gz WTWNZYLGRWKQOA-AVRDEDQJSA-N 2 1 322.496 4.249 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462485278 1061202755 /nfs/dbraw/zinc/20/27/55/1061202755.db2.gz HURHGZXNCBLZFQ-GSEOLPGOSA-N 2 1 316.464 4.225 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462485278 1061202770 /nfs/dbraw/zinc/20/27/70/1061202770.db2.gz HURHGZXNCBLZFQ-GSEOLPGOSA-N 2 1 316.464 4.225 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)cc1 ZINC001462520458 1061230199 /nfs/dbraw/zinc/23/01/99/1061230199.db2.gz WCNXAGSAMVCIDP-WIYYLYMNSA-N 2 1 314.517 4.485 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)cc1 ZINC001462520458 1061230222 /nfs/dbraw/zinc/23/02/22/1061230222.db2.gz WCNXAGSAMVCIDP-WIYYLYMNSA-N 2 1 314.517 4.485 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@H](CC[NH+](C)C)c1cccnc1 ZINC001462587153 1061282721 /nfs/dbraw/zinc/28/27/21/1061282721.db2.gz FNDSTBMQNRDZTC-YQVWRLOYSA-N 2 1 305.510 4.125 20 0 DIADMP Fc1ccccc1C[C@H]1CCCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001473619779 1061293839 /nfs/dbraw/zinc/29/38/39/1061293839.db2.gz NFRGSPWNBZBUIK-LJQANCHMSA-N 2 1 318.480 4.099 20 0 DIADMP Fc1ccccc1C[C@@H]1CCCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001473619778 1061295081 /nfs/dbraw/zinc/29/50/81/1061295081.db2.gz NFRGSPWNBZBUIK-IBGZPJMESA-N 2 1 318.480 4.099 20 0 DIADMP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ccsc1Cl ZINC001473749334 1061390327 /nfs/dbraw/zinc/39/03/27/1061390327.db2.gz LKOWOMBAVYWDBR-UHFFFAOYSA-N 2 1 300.899 4.099 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccsc1Cl ZINC001473749334 1061390340 /nfs/dbraw/zinc/39/03/40/1061390340.db2.gz LKOWOMBAVYWDBR-UHFFFAOYSA-N 2 1 300.899 4.099 20 0 DIADMP COc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)cc1Cl ZINC001473748749 1061391203 /nfs/dbraw/zinc/39/12/03/1061391203.db2.gz AWKMEGBMYMCTDY-UHFFFAOYSA-N 2 1 324.896 4.047 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+](Cc2cccc(C(C)C)c2)CC1 ZINC001473806186 1061416047 /nfs/dbraw/zinc/41/60/47/1061416047.db2.gz REZPQAUAILYGRJ-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP Cc1cc2cc(C[NH2+]C3CC[NH+](CC(C)C)CC3)oc2cc1C ZINC001473925207 1061473623 /nfs/dbraw/zinc/47/36/23/1061473623.db2.gz WHSQBSVYXDJECA-UHFFFAOYSA-N 2 1 314.473 4.260 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C/C=C\c2ccccc2)cc1F ZINC001473954874 1061497158 /nfs/dbraw/zinc/49/71/58/1061497158.db2.gz JKVBOKJZYGVIHZ-YVMONPNESA-N 2 1 321.399 4.123 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001473957436 1061499175 /nfs/dbraw/zinc/49/91/75/1061499175.db2.gz PAZPZHQCEXTVAH-YLJYHZDGSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001473957436 1061499186 /nfs/dbraw/zinc/49/91/86/1061499186.db2.gz PAZPZHQCEXTVAH-YLJYHZDGSA-N 2 1 314.517 4.034 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC001473957220 1061499624 /nfs/dbraw/zinc/49/96/24/1061499624.db2.gz MZHMHMOZAJPPTJ-GIVPXCGWSA-N 2 1 314.517 4.424 20 0 DIADMP CCC[C@@H](C[NH2+]CC[N@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962529 1061503143 /nfs/dbraw/zinc/50/31/43/1061503143.db2.gz LBRLHCIEJJZSKO-IBGZPJMESA-N 2 1 302.506 4.424 20 0 DIADMP CCC[C@@H](C[NH2+]CC[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC001473962529 1061503161 /nfs/dbraw/zinc/50/31/61/1061503161.db2.gz LBRLHCIEJJZSKO-IBGZPJMESA-N 2 1 302.506 4.424 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]C2CCC(C3CCCCC3)CC2)C1 ZINC001473964836 1061506805 /nfs/dbraw/zinc/50/68/05/1061506805.db2.gz OFLFDEBWTNFKJU-KKXNLOMOSA-N 2 1 306.538 4.447 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC001473980197 1061524210 /nfs/dbraw/zinc/52/42/10/1061524210.db2.gz RHPMBJQUQNFBLU-WOJBJXKFSA-N 2 1 314.517 4.109 20 0 DIADMP Clc1ccc(-c2ccc(C[NH2+]CCC[NH+]3CCC3)s2)cc1 ZINC001474099299 1061645214 /nfs/dbraw/zinc/64/52/14/1061645214.db2.gz KUJXDGLEEKUFNC-UHFFFAOYSA-N 2 1 320.889 4.254 20 0 DIADMP CC(C)COc1ccccc1C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001474108764 1061658921 /nfs/dbraw/zinc/65/89/21/1061658921.db2.gz GBLJQKXMOMLPFB-SFHVURJKSA-N 2 1 318.505 4.076 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)C1(c2ccccc2)CCCC1 ZINC001474116442 1061666702 /nfs/dbraw/zinc/66/67/02/1061666702.db2.gz UJOPPKMMLOEJJJ-IEBWSBKVSA-N 2 1 314.517 4.349 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cccc(Oc3ccccc3)c2)C1 ZINC001474174062 1061719284 /nfs/dbraw/zinc/71/92/84/1061719284.db2.gz KGOZTJGHOGPJGV-GOSISDBHSA-N 2 1 324.468 4.300 20 0 DIADMP CC(C)CC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001474217684 1061774925 /nfs/dbraw/zinc/77/49/25/1061774925.db2.gz ITRUUDVDFOAMJE-HKUYNNGSSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001474217684 1061774947 /nfs/dbraw/zinc/77/49/47/1061774947.db2.gz ITRUUDVDFOAMJE-HKUYNNGSSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](CC[NH2+]Cc1cccc(Oc2ccc(F)cc2)c1)[NH+](C)C ZINC001474223660 1061783917 /nfs/dbraw/zinc/78/39/17/1061783917.db2.gz QNZIRXOZTWRPQW-OAHLLOKOSA-N 2 1 316.420 4.048 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3C[C@@H]3C3CCCC3)CC2)cc1 ZINC001474301251 1061870548 /nfs/dbraw/zinc/87/05/48/1061870548.db2.gz IIAPFNZYBRSMAP-PZJWPPBQSA-N 2 1 312.501 4.067 20 0 DIADMP C[N@@H+](C[C@]1(C(C)(C)C)CC[NH+](Cc2ccccc2)C1)C1CCC1 ZINC001474355348 1061966630 /nfs/dbraw/zinc/96/66/30/1061966630.db2.gz KPRGLKLDRAKCKY-OAQYLSRUSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1)C1CCC1 ZINC001474355348 1061966648 /nfs/dbraw/zinc/96/66/48/1061966648.db2.gz KPRGLKLDRAKCKY-OAQYLSRUSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC001474355348 1061966661 /nfs/dbraw/zinc/96/66/61/1061966661.db2.gz KPRGLKLDRAKCKY-OAQYLSRUSA-N 2 1 314.517 4.409 20 0 DIADMP CCC(CC)[N@H+](C1CCC(F)(F)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001254214524 1062051304 /nfs/dbraw/zinc/05/13/04/1062051304.db2.gz VLQMUGMDZWAIMU-CTYIDZIISA-N 2 1 302.453 4.325 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC001254225332 1062056096 /nfs/dbraw/zinc/05/60/96/1062056096.db2.gz RRPSHDSWYBQIOH-KRWDZBQOSA-N 2 1 322.443 4.018 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC001254225332 1062056116 /nfs/dbraw/zinc/05/61/16/1062056116.db2.gz RRPSHDSWYBQIOH-KRWDZBQOSA-N 2 1 322.443 4.018 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001474418389 1062086551 /nfs/dbraw/zinc/08/65/51/1062086551.db2.gz DHXJEMNIYZUOCP-FPOVZHCZSA-N 2 1 312.501 4.163 20 0 DIADMP [NH3+]C1(c2ccccc2Cl)CC[NH+](C2CCC3(CC3)CC2)CC1 ZINC001254438222 1062103060 /nfs/dbraw/zinc/10/30/60/1062103060.db2.gz RGYMSFDVZBNTLK-UHFFFAOYSA-N 2 1 318.892 4.313 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CCC2(CC2)CC1 ZINC001254445491 1062107108 /nfs/dbraw/zinc/10/71/08/1062107108.db2.gz OBZLKEHKTQGCPL-LJQANCHMSA-N 2 1 312.501 4.163 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC2(CC2)CC1 ZINC001254445491 1062107126 /nfs/dbraw/zinc/10/71/26/1062107126.db2.gz OBZLKEHKTQGCPL-LJQANCHMSA-N 2 1 312.501 4.163 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC2(CC2)CC1 ZINC001254445491 1062107153 /nfs/dbraw/zinc/10/71/53/1062107153.db2.gz OBZLKEHKTQGCPL-LJQANCHMSA-N 2 1 312.501 4.163 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001474439997 1062118121 /nfs/dbraw/zinc/11/81/21/1062118121.db2.gz DAYMVCAGMHGVIJ-HKUYNNGSSA-N 2 1 300.490 4.380 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001474439997 1062118132 /nfs/dbraw/zinc/11/81/32/1062118132.db2.gz DAYMVCAGMHGVIJ-HKUYNNGSSA-N 2 1 300.490 4.380 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001254497421 1062137449 /nfs/dbraw/zinc/13/74/49/1062137449.db2.gz CGOBCRBXSAZEAC-HBMCJLEFSA-N 2 1 314.517 4.062 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH+]1C[C@H]2C[N@@H+](CCC)C[C@H]2C1 ZINC001254497421 1062137465 /nfs/dbraw/zinc/13/74/65/1062137465.db2.gz CGOBCRBXSAZEAC-HBMCJLEFSA-N 2 1 314.517 4.062 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH+]1C[C@H]2C[N@H+](CCC)C[C@H]2C1 ZINC001254497421 1062137474 /nfs/dbraw/zinc/13/74/74/1062137474.db2.gz CGOBCRBXSAZEAC-HBMCJLEFSA-N 2 1 314.517 4.062 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001254494174 1062139109 /nfs/dbraw/zinc/13/91/09/1062139109.db2.gz KACZLDJZVJLYIP-HXUWFJFHSA-N 2 1 302.506 4.062 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]CCc2cccc(Oc3ccccc3)c2)CC1 ZINC001254499659 1062143149 /nfs/dbraw/zinc/14/31/49/1062143149.db2.gz MDJKVKUBGHKGQQ-IBGZPJMESA-N 2 1 324.468 4.095 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]CCC(c2ccccc2)c2ccccc2)CC1 ZINC001254504081 1062145411 /nfs/dbraw/zinc/14/54/11/1062145411.db2.gz SHZQBCKEWDSRJQ-OAQYLSRUSA-N 2 1 322.496 4.283 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@H]1CCC[NH+](C)CC1 ZINC001254515862 1062157445 /nfs/dbraw/zinc/15/74/45/1062157445.db2.gz FLTKPQJHVLDKMN-FQEVSTJZSA-N 2 1 308.469 4.192 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@H]1CCC[N@H+](C)CC1 ZINC001254515862 1062157450 /nfs/dbraw/zinc/15/74/50/1062157450.db2.gz FLTKPQJHVLDKMN-FQEVSTJZSA-N 2 1 308.469 4.192 20 0 DIADMP C[NH+](C(c1ccccc1)c1ccccc1)[C@H]1CCC[N@@H+](C)CC1 ZINC001254515862 1062157459 /nfs/dbraw/zinc/15/74/59/1062157459.db2.gz FLTKPQJHVLDKMN-FQEVSTJZSA-N 2 1 308.469 4.192 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001254526716 1062159481 /nfs/dbraw/zinc/15/94/81/1062159481.db2.gz TZBRUKBRPIBEGA-IRLDBZIGSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@@H]([N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001254526716 1062159490 /nfs/dbraw/zinc/15/94/90/1062159490.db2.gz TZBRUKBRPIBEGA-IRLDBZIGSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC1 ZINC001254526716 1062159501 /nfs/dbraw/zinc/15/95/01/1062159501.db2.gz TZBRUKBRPIBEGA-IRLDBZIGSA-N 2 1 320.480 4.118 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CCC[NH+](C)CC1 ZINC001254524974 1062159692 /nfs/dbraw/zinc/15/96/92/1062159692.db2.gz FKZCOALFPTYPIA-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CCC[N@H+](C)CC1 ZINC001254524974 1062159714 /nfs/dbraw/zinc/15/97/14/1062159714.db2.gz FKZCOALFPTYPIA-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CCC[N@@H+](C)CC1 ZINC001254524974 1062159724 /nfs/dbraw/zinc/15/97/24/1062159724.db2.gz FKZCOALFPTYPIA-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP c1ccc2c(c1)CC[C@H]2C[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001474481097 1062161016 /nfs/dbraw/zinc/16/10/16/1062161016.db2.gz VYEIGDRDFXKSKX-AZUAARDMSA-N 2 1 312.501 4.103 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001474499000 1062179049 /nfs/dbraw/zinc/17/90/49/1062179049.db2.gz GBYZUYZPHISIHC-GOSISDBHSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001474499001 1062180235 /nfs/dbraw/zinc/18/02/35/1062180235.db2.gz GBYZUYZPHISIHC-SFHVURJKSA-N 2 1 300.490 4.164 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCC[NH+]1C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001459557224 1062210105 /nfs/dbraw/zinc/21/01/05/1062210105.db2.gz GBSHCMCSZGUPFB-PMACEKPBSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@@H+]1C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001459557224 1062210122 /nfs/dbraw/zinc/21/01/22/1062210122.db2.gz GBSHCMCSZGUPFB-PMACEKPBSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@H+]1C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001459557224 1062210126 /nfs/dbraw/zinc/21/01/26/1062210126.db2.gz GBSHCMCSZGUPFB-PMACEKPBSA-N 2 1 320.496 4.199 20 0 DIADMP Cc1cccc(C[C@@H](C)[NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)c1 ZINC001474538189 1062224983 /nfs/dbraw/zinc/22/49/83/1062224983.db2.gz RVQOMLIOQNFIHD-QUCCMNQESA-N 2 1 302.506 4.026 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)CCc1ccccc1 ZINC001474538536 1062226045 /nfs/dbraw/zinc/22/60/45/1062226045.db2.gz VCIMAMNOHQEHJX-QUCCMNQESA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CCN1C ZINC001459617675 1062249697 /nfs/dbraw/zinc/24/96/97/1062249697.db2.gz XQBIZNCOGGSRHX-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@@H+]1C ZINC001459617675 1062249720 /nfs/dbraw/zinc/24/97/20/1062249720.db2.gz XQBIZNCOGGSRHX-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCCc2cccc(Cl)c2)CC[N@H+]1C ZINC001459617675 1062249747 /nfs/dbraw/zinc/24/97/47/1062249747.db2.gz XQBIZNCOGGSRHX-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617675 1062249767 /nfs/dbraw/zinc/24/97/67/1062249767.db2.gz XQBIZNCOGGSRHX-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCCc2cccc(Cl)c2)CC[NH+]1C ZINC001459617675 1062249781 /nfs/dbraw/zinc/24/97/81/1062249781.db2.gz XQBIZNCOGGSRHX-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP CC(C)Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC001459617967 1062250331 /nfs/dbraw/zinc/25/03/31/1062250331.db2.gz AKEFAWVPQRAJSG-NRFANRHFSA-N 2 1 314.517 4.049 20 0 DIADMP C[C@H]([N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1)C1(C)CC1 ZINC001459632406 1062267980 /nfs/dbraw/zinc/26/79/80/1062267980.db2.gz YNYOWOHVZBTVBZ-KRWDZBQOSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001255099709 1062314887 /nfs/dbraw/zinc/31/48/87/1062314887.db2.gz RQZHWLDTCKDNRQ-JXFKEZNVSA-N 2 1 319.452 4.108 20 0 DIADMP C[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129900 1062321794 /nfs/dbraw/zinc/32/17/94/1062321794.db2.gz NCWAYSYTEHBHBI-QLIIJSOBSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129900 1062321819 /nfs/dbraw/zinc/32/18/19/1062321819.db2.gz NCWAYSYTEHBHBI-QLIIJSOBSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129900 1062321841 /nfs/dbraw/zinc/32/18/41/1062321841.db2.gz NCWAYSYTEHBHBI-QLIIJSOBSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@@H]1CCCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255135357 1062331539 /nfs/dbraw/zinc/33/15/39/1062331539.db2.gz ALKNQHLLJLNFIK-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255135357 1062331559 /nfs/dbraw/zinc/33/15/59/1062331559.db2.gz ALKNQHLLJLNFIK-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255135357 1062331588 /nfs/dbraw/zinc/33/15/88/1062331588.db2.gz ALKNQHLLJLNFIK-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[C@@H](C)C[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146433 1062333803 /nfs/dbraw/zinc/33/38/03/1062333803.db2.gz GPFKHWBXLKYUEM-YCXYWVQESA-N 2 1 312.501 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H]1C ZINC001255143025 1062334380 /nfs/dbraw/zinc/33/43/80/1062334380.db2.gz IVUFSZGVWDFFQL-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H]1C ZINC001255143025 1062334396 /nfs/dbraw/zinc/33/43/96/1062334396.db2.gz IVUFSZGVWDFFQL-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H]1C ZINC001255143025 1062334414 /nfs/dbraw/zinc/33/44/14/1062334414.db2.gz IVUFSZGVWDFFQL-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@H]1C ZINC001255143025 1062334426 /nfs/dbraw/zinc/33/44/26/1062334426.db2.gz IVUFSZGVWDFFQL-LXDWIVHCSA-N 2 1 312.501 4.302 20 0 DIADMP CC[C@H](C)c1ccc([C@@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC001459730090 1062340129 /nfs/dbraw/zinc/34/01/29/1062340129.db2.gz KDAJQJHPDCGVAP-JXFKEZNVSA-N 2 1 313.489 4.463 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC24CCCC4)C3)cc1 ZINC001255142115 1062340748 /nfs/dbraw/zinc/34/07/48/1062340748.db2.gz PLZUYQWOJLXHAX-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC24CCCC4)C3)cc1 ZINC001255142115 1062340773 /nfs/dbraw/zinc/34/07/73/1062340773.db2.gz PLZUYQWOJLXHAX-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+]2CCC24CCCC4)C3)cc1 ZINC001255142115 1062340799 /nfs/dbraw/zinc/34/07/99/1062340799.db2.gz PLZUYQWOJLXHAX-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+]2CCC24CCCC4)C3)cc1 ZINC001255142115 1062340822 /nfs/dbraw/zinc/34/08/22/1062340822.db2.gz PLZUYQWOJLXHAX-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCCCC24CC4)C3)cc1 ZINC001255148493 1062340915 /nfs/dbraw/zinc/34/09/15/1062340915.db2.gz VOIGJZPLXVKYID-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCCCC24CC4)C3)cc1 ZINC001255148493 1062340940 /nfs/dbraw/zinc/34/09/40/1062340940.db2.gz VOIGJZPLXVKYID-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+]2CCCCC24CC4)C3)cc1 ZINC001255148493 1062340964 /nfs/dbraw/zinc/34/09/64/1062340964.db2.gz VOIGJZPLXVKYID-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+]2CCCCC24CC4)C3)cc1 ZINC001255148493 1062340989 /nfs/dbraw/zinc/34/09/89/1062340989.db2.gz VOIGJZPLXVKYID-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001474634017 1062357916 /nfs/dbraw/zinc/35/79/16/1062357916.db2.gz OBQANPFCWNWSAR-MJGOQNOKSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001474634017 1062357938 /nfs/dbraw/zinc/35/79/38/1062357938.db2.gz OBQANPFCWNWSAR-MJGOQNOKSA-N 2 1 300.490 4.004 20 0 DIADMP CCSc1cccc(C[N@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)c1 ZINC001474646017 1062373115 /nfs/dbraw/zinc/37/31/15/1062373115.db2.gz APSIBTSXABVMCY-APWZRJJASA-N 2 1 320.546 4.351 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C[C@@H]1C ZINC001459762664 1062373385 /nfs/dbraw/zinc/37/33/85/1062373385.db2.gz IIXQCWGWEDNJFD-MSOLQXFVSA-N 2 1 300.490 4.150 20 0 DIADMP Cc1oc2ccccc2c1C[N@@H+]1CCCC[C@@H]1[C@@H](C)C[NH+](C)C ZINC001474646987 1062373886 /nfs/dbraw/zinc/37/38/86/1062373886.db2.gz JQHPSCNYWFHOGG-HNAYVOBHSA-N 2 1 314.473 4.293 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255320334 1062399766 /nfs/dbraw/zinc/39/97/66/1062399766.db2.gz NTTYZTAUJDVOHU-SNRMKQJTSA-N 2 1 306.469 4.476 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671694 1062403373 /nfs/dbraw/zinc/40/33/73/1062403373.db2.gz XQMQVXAPCJHVIW-YLJYHZDGSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671694 1062403379 /nfs/dbraw/zinc/40/33/79/1062403379.db2.gz XQMQVXAPCJHVIW-YLJYHZDGSA-N 2 1 300.490 4.177 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccc2occc2c1 ZINC001474682359 1062413386 /nfs/dbraw/zinc/41/33/86/1062413386.db2.gz WRHQYUGMSZARFF-UHFFFAOYSA-N 2 1 300.446 4.131 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+]C3CCCCCC3)CC2)cc1 ZINC001255378216 1062422088 /nfs/dbraw/zinc/42/20/88/1062422088.db2.gz NCTKUERQUKXPFJ-FQEVSTJZSA-N 2 1 300.490 4.354 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255384003 1062422844 /nfs/dbraw/zinc/42/28/44/1062422844.db2.gz RFLANRPQDBTMKP-QFIPXVFZSA-N 2 1 322.496 4.448 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]([NH2+]CC3CCCCC3)CC2)cc1 ZINC001255378765 1062423056 /nfs/dbraw/zinc/42/30/56/1062423056.db2.gz PFQWZCTWHOGTDT-HXUWFJFHSA-N 2 1 300.490 4.211 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccc1 ZINC001255384089 1062423487 /nfs/dbraw/zinc/42/34/87/1062423487.db2.gz SVRMWCHNXKXDEU-WIYYLYMNSA-N 2 1 308.469 4.392 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255384002 1062424034 /nfs/dbraw/zinc/42/40/34/1062424034.db2.gz RFLANRPQDBTMKP-JOCHJYFZSA-N 2 1 322.496 4.448 20 0 DIADMP C(=C/c1ccccc1)\C[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255384036 1062424406 /nfs/dbraw/zinc/42/44/06/1062424406.db2.gz RROGRJOILPWQBW-PTHHNIJRSA-N 2 1 320.480 4.344 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccs1 ZINC001255376936 1062424491 /nfs/dbraw/zinc/42/44/91/1062424491.db2.gz CZHZXSHNAVKSOX-SJLPKXTDSA-N 2 1 314.498 4.453 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccs1 ZINC001255376939 1062424560 /nfs/dbraw/zinc/42/45/60/1062424560.db2.gz CZHZXSHNAVKSOX-WMZOPIPTSA-N 2 1 314.498 4.453 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccc(O)cc1 ZINC001255384990 1062424963 /nfs/dbraw/zinc/42/49/63/1062424963.db2.gz DEUMUKGJLXHRTL-PXNSSMCTSA-N 2 1 324.468 4.098 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CCC[N@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393220 1062428356 /nfs/dbraw/zinc/42/83/56/1062428356.db2.gz MMQCMHYOQUMUPL-UXHICEINSA-N 2 1 323.484 4.177 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393220 1062428360 /nfs/dbraw/zinc/42/83/60/1062428360.db2.gz MMQCMHYOQUMUPL-UXHICEINSA-N 2 1 323.484 4.177 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255391457 1062428548 /nfs/dbraw/zinc/42/85/48/1062428548.db2.gz QGKHYGQNVDNMCX-YSIASYRMSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255392555 1062428753 /nfs/dbraw/zinc/42/87/53/1062428753.db2.gz GPSGMLAPJDYFMO-CMKODMSKSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255388806 1062428864 /nfs/dbraw/zinc/42/88/64/1062428864.db2.gz IBJOWMPGCBDDNO-YSIASYRMSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)CCC[C@H]1[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386766 1062429076 /nfs/dbraw/zinc/42/90/76/1062429076.db2.gz BKEWVWFXNRFHQU-RBUKOAKNSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccncc1 ZINC001255392491 1062429963 /nfs/dbraw/zinc/42/99/63/1062429963.db2.gz FMRABEGNBSRIAD-LEWJYISDSA-N 2 1 323.484 4.177 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3C[C@@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001255399762 1062431398 /nfs/dbraw/zinc/43/13/98/1062431398.db2.gz ZCIHBHQWZUSSFT-QHAWAJNXSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@H+]3C[C@@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001255399762 1062431407 /nfs/dbraw/zinc/43/14/07/1062431407.db2.gz ZCIHBHQWZUSSFT-QHAWAJNXSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@@H+]3C[C@@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001255399762 1062431420 /nfs/dbraw/zinc/43/14/20/1062431420.db2.gz ZCIHBHQWZUSSFT-QHAWAJNXSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccnc1 ZINC001255394547 1062432183 /nfs/dbraw/zinc/43/21/83/1062432183.db2.gz VUWQYJPSQXGAMP-RTWAWAEBSA-N 2 1 323.484 4.177 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255397073 1062432573 /nfs/dbraw/zinc/43/25/73/1062432573.db2.gz DPUMOJVSMCRGFY-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255397073 1062432585 /nfs/dbraw/zinc/43/25/85/1062432585.db2.gz DPUMOJVSMCRGFY-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255397073 1062432602 /nfs/dbraw/zinc/43/26/02/1062432602.db2.gz DPUMOJVSMCRGFY-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255399185 1062432977 /nfs/dbraw/zinc/43/29/77/1062432977.db2.gz OHSGFFKZGUHYKJ-QWFCFKBJSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255399185 1062432985 /nfs/dbraw/zinc/43/29/85/1062432985.db2.gz OHSGFFKZGUHYKJ-QWFCFKBJSA-N 2 1 300.490 4.304 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCC34CCCCC4)CC2)cc1 ZINC001255400717 1062433421 /nfs/dbraw/zinc/43/34/21/1062433421.db2.gz MZJDHQCXCGEEJS-FQEVSTJZSA-N 2 1 312.501 4.450 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCC34CCCCC4)CC2)cc1 ZINC001255400717 1062433434 /nfs/dbraw/zinc/43/34/34/1062433434.db2.gz MZJDHQCXCGEEJS-FQEVSTJZSA-N 2 1 312.501 4.450 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCC34CCCCC4)CC2)cc1 ZINC001255400717 1062433451 /nfs/dbraw/zinc/43/34/51/1062433451.db2.gz MZJDHQCXCGEEJS-FQEVSTJZSA-N 2 1 312.501 4.450 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCC4(CCC4)CC3)CC2)cc1 ZINC001255396961 1062434045 /nfs/dbraw/zinc/43/40/45/1062434045.db2.gz CGZADQLAZSUHNN-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCC4(CCC4)CC3)CC2)cc1 ZINC001255396961 1062434051 /nfs/dbraw/zinc/43/40/51/1062434051.db2.gz CGZADQLAZSUHNN-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255399186 1062434075 /nfs/dbraw/zinc/43/40/75/1062434075.db2.gz OHSGFFKZGUHYKJ-WSTZPKSXSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255399186 1062434079 /nfs/dbraw/zinc/43/40/79/1062434079.db2.gz OHSGFFKZGUHYKJ-WSTZPKSXSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255399186 1062434084 /nfs/dbraw/zinc/43/40/84/1062434084.db2.gz OHSGFFKZGUHYKJ-WSTZPKSXSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255399186 1062434091 /nfs/dbraw/zinc/43/40/91/1062434091.db2.gz OHSGFFKZGUHYKJ-WSTZPKSXSA-N 2 1 300.490 4.304 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCC[C@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406427 1062438952 /nfs/dbraw/zinc/43/89/52/1062438952.db2.gz SECADTOPSXUCLP-HKBOAZHASA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCC[C@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406427 1062438962 /nfs/dbraw/zinc/43/89/62/1062438962.db2.gz SECADTOPSXUCLP-HKBOAZHASA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCC[C@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406427 1062438975 /nfs/dbraw/zinc/43/89/75/1062438975.db2.gz SECADTOPSXUCLP-HKBOAZHASA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCC[C@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406427 1062438983 /nfs/dbraw/zinc/43/89/83/1062438983.db2.gz SECADTOPSXUCLP-HKBOAZHASA-N 2 1 312.501 4.306 20 0 DIADMP CC(C)CCCC[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001474714197 1062439274 /nfs/dbraw/zinc/43/92/74/1062439274.db2.gz YRKJXARMEJWCQT-NHCUHLMSSA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)CCCC[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001474714197 1062439285 /nfs/dbraw/zinc/43/92/85/1062439285.db2.gz YRKJXARMEJWCQT-NHCUHLMSSA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)CCCC[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001474714197 1062439293 /nfs/dbraw/zinc/43/92/93/1062439293.db2.gz YRKJXARMEJWCQT-NHCUHLMSSA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408380 1062439909 /nfs/dbraw/zinc/43/99/09/1062439909.db2.gz KWFCAWFGQMZBPR-UXHICEINSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408380 1062439923 /nfs/dbraw/zinc/43/99/23/1062439923.db2.gz KWFCAWFGQMZBPR-UXHICEINSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408380 1062439933 /nfs/dbraw/zinc/43/99/33/1062439933.db2.gz KWFCAWFGQMZBPR-UXHICEINSA-N 2 1 300.490 4.162 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255405063 1062440125 /nfs/dbraw/zinc/44/01/25/1062440125.db2.gz VSOKGNXIWYJGPM-SFHVURJKSA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1cccs1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255405063 1062440135 /nfs/dbraw/zinc/44/01/35/1062440135.db2.gz VSOKGNXIWYJGPM-SFHVURJKSA-N 2 1 314.498 4.235 20 0 DIADMP C[NH+](Cc1cccs1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255405063 1062440144 /nfs/dbraw/zinc/44/01/44/1062440144.db2.gz VSOKGNXIWYJGPM-SFHVURJKSA-N 2 1 314.498 4.235 20 0 DIADMP CC[C@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255408459 1062441640 /nfs/dbraw/zinc/44/16/40/1062441640.db2.gz MSLRNTYDEWWXPC-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255408459 1062441651 /nfs/dbraw/zinc/44/16/51/1062441651.db2.gz MSLRNTYDEWWXPC-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255408459 1062441660 /nfs/dbraw/zinc/44/16/60/1062441660.db2.gz MSLRNTYDEWWXPC-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255405486 1062442751 /nfs/dbraw/zinc/44/27/51/1062442751.db2.gz NOBSAXOFUHNQDW-NSHGMRRFSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255405486 1062442764 /nfs/dbraw/zinc/44/27/64/1062442764.db2.gz NOBSAXOFUHNQDW-NSHGMRRFSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255405486 1062442777 /nfs/dbraw/zinc/44/27/77/1062442777.db2.gz NOBSAXOFUHNQDW-NSHGMRRFSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255408462 1062443234 /nfs/dbraw/zinc/44/32/34/1062443234.db2.gz MSLRNTYDEWWXPC-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255408462 1062443241 /nfs/dbraw/zinc/44/32/41/1062443241.db2.gz MSLRNTYDEWWXPC-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255408462 1062443252 /nfs/dbraw/zinc/44/32/52/1062443252.db2.gz MSLRNTYDEWWXPC-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCC[C@@H](C[NH+]2C[C@@]34C[N@H+](C)C[C@]3(C2)CCCC4)C1 ZINC001474757003 1062465177 /nfs/dbraw/zinc/46/51/77/1062465177.db2.gz GSTYXQXXCZBXBW-WTGUMLROSA-N 2 1 304.522 4.011 20 0 DIADMP CC[C@@H]1CCC[C@@H](C[NH+]2C[C@@]34C[N@@H+](C)C[C@]3(C2)CCCC4)C1 ZINC001474757003 1062465188 /nfs/dbraw/zinc/46/51/88/1062465188.db2.gz GSTYXQXXCZBXBW-WTGUMLROSA-N 2 1 304.522 4.011 20 0 DIADMP C[C@H](CC(F)(F)F)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255643177 1062494158 /nfs/dbraw/zinc/49/41/58/1062494158.db2.gz LRZNIZBNNBTIRG-FVQBIDKESA-N 2 1 320.443 4.480 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925807 1062499558 /nfs/dbraw/zinc/49/95/58/1062499558.db2.gz SXJPUGXUPJGFBK-RDJZCZTQSA-N 2 1 320.908 4.391 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001255668009 1062505810 /nfs/dbraw/zinc/50/58/10/1062505810.db2.gz CRCPVDJAYMXLFZ-IPQPSQTFSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001255668009 1062505835 /nfs/dbraw/zinc/50/58/35/1062505835.db2.gz CRCPVDJAYMXLFZ-IPQPSQTFSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C)c1 ZINC001255676415 1062510726 /nfs/dbraw/zinc/51/07/26/1062510726.db2.gz MNXUOHVGIYQRIV-RAFMOHDBSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1 ZINC001255676415 1062510744 /nfs/dbraw/zinc/51/07/44/1062510744.db2.gz MNXUOHVGIYQRIV-RAFMOHDBSA-N 2 1 300.490 4.441 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(C)c1 ZINC001255675025 1062512467 /nfs/dbraw/zinc/51/24/67/1062512467.db2.gz BGLMSPHUFMLNIQ-PHSGOXPASA-N 2 1 304.453 4.190 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(C)c1 ZINC001255675025 1062512484 /nfs/dbraw/zinc/51/24/84/1062512484.db2.gz BGLMSPHUFMLNIQ-PHSGOXPASA-N 2 1 304.453 4.190 20 0 DIADMP Cc1cccc(C[NH+](C2CC2)C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1C ZINC001255684315 1062513908 /nfs/dbraw/zinc/51/39/08/1062513908.db2.gz YIDMSGNXCFHQTK-WCRBZPEASA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[NH+](C2CC2)C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1C ZINC001255684315 1062513926 /nfs/dbraw/zinc/51/39/26/1062513926.db2.gz YIDMSGNXCFHQTK-WCRBZPEASA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[N@H+](C2CC2)C2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1C ZINC001255684315 1062513946 /nfs/dbraw/zinc/51/39/46/1062513946.db2.gz YIDMSGNXCFHQTK-WCRBZPEASA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)C2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1C ZINC001255684315 1062513968 /nfs/dbraw/zinc/51/39/68/1062513968.db2.gz YIDMSGNXCFHQTK-WCRBZPEASA-N 2 1 312.501 4.283 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1 ZINC001459954088 1062521551 /nfs/dbraw/zinc/52/15/51/1062521551.db2.gz UZYJUIRMYAOJEI-IBGZPJMESA-N 2 1 310.485 4.373 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1 ZINC001459954090 1062523881 /nfs/dbraw/zinc/52/38/81/1062523881.db2.gz UZYJUIRMYAOJEI-LJQANCHMSA-N 2 1 310.485 4.373 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255702086 1062530357 /nfs/dbraw/zinc/53/03/57/1062530357.db2.gz XEZLCHRFMMDGQC-VGWMRTNUSA-N 2 1 318.427 4.089 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255711967 1062534195 /nfs/dbraw/zinc/53/41/95/1062534195.db2.gz GJGCMGZYVQYMOM-HOTGVXAUSA-N 2 1 320.443 4.160 20 0 DIADMP CC(C)[N@@H+]([C@H](C)CSc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255733248 1062554692 /nfs/dbraw/zinc/55/46/92/1062554692.db2.gz KBXUAXMSLSPCEL-DJIMGWMZSA-N 2 1 324.509 4.287 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001255757179 1062578175 /nfs/dbraw/zinc/57/81/75/1062578175.db2.gz WCOWLBCXKWVEOK-TVFCKZIOSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001255757179 1062578194 /nfs/dbraw/zinc/57/81/94/1062578194.db2.gz WCOWLBCXKWVEOK-TVFCKZIOSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(C[C@H](C)[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255784832 1062605984 /nfs/dbraw/zinc/60/59/84/1062605984.db2.gz WTHHWXHQQZJGMR-IHPCNDPISA-N 2 1 302.506 4.154 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255838195 1062624192 /nfs/dbraw/zinc/62/41/92/1062624192.db2.gz LSAZJICWPPMTDJ-IEZWGBDMSA-N 2 1 318.480 4.271 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001255855347 1062630778 /nfs/dbraw/zinc/63/07/78/1062630778.db2.gz WOHBLGUZWDRVAI-WDSOQIARSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255855347 1062630792 /nfs/dbraw/zinc/63/07/92/1062630792.db2.gz WOHBLGUZWDRVAI-WDSOQIARSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001255855347 1062630808 /nfs/dbraw/zinc/63/08/08/1062630808.db2.gz WOHBLGUZWDRVAI-WDSOQIARSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001255872370 1062647300 /nfs/dbraw/zinc/64/73/00/1062647300.db2.gz IIQJPGWVBFTBGY-YLJYHZDGSA-N 2 1 318.480 4.097 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001255878197 1062652780 /nfs/dbraw/zinc/65/27/80/1062652780.db2.gz MTAKZYMMEIQGEI-LSTHTHJFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255878197 1062652788 /nfs/dbraw/zinc/65/27/88/1062652788.db2.gz MTAKZYMMEIQGEI-LSTHTHJFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001255878197 1062652795 /nfs/dbraw/zinc/65/27/95/1062652795.db2.gz MTAKZYMMEIQGEI-LSTHTHJFSA-N 2 1 318.480 4.096 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]C(c1ccccc1)c1ccccc1 ZINC001255940321 1062664859 /nfs/dbraw/zinc/66/48/59/1062664859.db2.gz XGMVJVQWDIDSSQ-GOSISDBHSA-N 2 1 310.485 4.486 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cccc(OCC2CCC2)c1 ZINC001255950495 1062668990 /nfs/dbraw/zinc/66/89/90/1062668990.db2.gz IHGHYJXOQWGTOD-QGZVFWFLSA-N 2 1 318.505 4.076 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H]1CCCc2c(F)cc(F)cc21 ZINC001255954908 1062670196 /nfs/dbraw/zinc/67/01/96/1062670196.db2.gz KLSPWAXORDGGSL-SCLBCKFNSA-N 2 1 310.432 4.052 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cccc(OC(C)(C)C)c1 ZINC001255953355 1062670447 /nfs/dbraw/zinc/67/04/47/1062670447.db2.gz ZXQMGWOTJVUTMR-INIZCTEOSA-N 2 1 306.494 4.074 20 0 DIADMP CCOc1ccc([C@H]2CCC[N@H+]2[C@H](C)CC[NH+](CC)CC)cc1 ZINC001255963375 1062672681 /nfs/dbraw/zinc/67/26/81/1062672681.db2.gz HBYIPSMAZXIIAE-YLJYHZDGSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CCCC[C@H]1c1cccc(OC)c1 ZINC001255964760 1062674091 /nfs/dbraw/zinc/67/40/91/1062674091.db2.gz SOLQCBPAVDGASC-XLIONFOSSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CCCC[C@H]1c1cccc(OC)c1 ZINC001255964760 1062674101 /nfs/dbraw/zinc/67/41/01/1062674101.db2.gz SOLQCBPAVDGASC-XLIONFOSSA-N 2 1 318.505 4.343 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)CC[NH+](CC)CC)cc1 ZINC001255963373 1062674160 /nfs/dbraw/zinc/67/41/60/1062674160.db2.gz HBYIPSMAZXIIAE-PXNSSMCTSA-N 2 1 318.505 4.343 20 0 DIADMP CC1CC(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC001460172988 1062678903 /nfs/dbraw/zinc/67/89/03/1062678903.db2.gz SNNXKKVMFIPLFR-UHFFFAOYSA-N 2 1 312.501 4.021 20 0 DIADMP Clc1ccc([C@H](C[NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC001256074353 1062694389 /nfs/dbraw/zinc/69/43/89/1062694389.db2.gz UMEMERQURZEDCN-LJQANCHMSA-N 2 1 318.892 4.050 20 0 DIADMP Fc1cccc(C2([NH2+]C3CC[NH+](C4CC4)CC3)CCCCC2)c1 ZINC001256070744 1062694414 /nfs/dbraw/zinc/69/44/14/1062694414.db2.gz FFKCIMFFTDOAHT-UHFFFAOYSA-N 2 1 316.464 4.202 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(F)c1 ZINC001256069679 1062695601 /nfs/dbraw/zinc/69/56/01/1062695601.db2.gz MCZIQGFAMXRCFL-IBGZPJMESA-N 2 1 304.453 4.129 20 0 DIADMP Fc1ccc([C@@H](CC2CCC2)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC001256071774 1062695825 /nfs/dbraw/zinc/69/58/25/1062695825.db2.gz OLEQAQWWINVASI-HXUWFJFHSA-N 2 1 316.464 4.273 20 0 DIADMP C[C@@H]1CCC(C)(C)[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001460231299 1062715985 /nfs/dbraw/zinc/71/59/85/1062715985.db2.gz OEBIJAPWZIWPIY-QGZVFWFLSA-N 2 1 300.490 4.435 20 0 DIADMP c1ccc([C@H]2CCC[C@@H]([NH+]3CC4(C3)CC[N@@H+](CC3CC3)C4)C2)cc1 ZINC001256114500 1062718233 /nfs/dbraw/zinc/71/82/33/1062718233.db2.gz DYFJSDUGGDXDRO-LEWJYISDSA-N 2 1 324.512 4.131 20 0 DIADMP c1ccc([C@H]2CCC[C@@H]([NH+]3CC4(C3)CC[N@H+](CC3CC3)C4)C2)cc1 ZINC001256114500 1062718255 /nfs/dbraw/zinc/71/82/55/1062718255.db2.gz DYFJSDUGGDXDRO-LEWJYISDSA-N 2 1 324.512 4.131 20 0 DIADMP Cc1ccc(C2([NH2+]C3CC[NH+](C)CC3)CCC(F)(F)CC2)cc1 ZINC001256201983 1062747222 /nfs/dbraw/zinc/74/72/22/1062747222.db2.gz VLPZKSDFZWCFNL-UHFFFAOYSA-N 2 1 322.443 4.083 20 0 DIADMP CC(C)CC[C@H](C)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001256371587 1062795550 /nfs/dbraw/zinc/79/55/50/1062795550.db2.gz RCXIBOOPZITCBA-ICSRJNTNSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@H](C)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001256371587 1062795573 /nfs/dbraw/zinc/79/55/73/1062795573.db2.gz RCXIBOOPZITCBA-ICSRJNTNSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@H](C)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001256371587 1062795594 /nfs/dbraw/zinc/79/55/94/1062795594.db2.gz RCXIBOOPZITCBA-ICSRJNTNSA-N 2 1 302.506 4.265 20 0 DIADMP Cc1csc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256520480 1062842377 /nfs/dbraw/zinc/84/23/77/1062842377.db2.gz PPPWXBVOESDHQK-FUHWJXTLSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1csc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256520480 1062842396 /nfs/dbraw/zinc/84/23/96/1062842396.db2.gz PPPWXBVOESDHQK-FUHWJXTLSA-N 2 1 314.498 4.199 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256525364 1062845891 /nfs/dbraw/zinc/84/58/91/1062845891.db2.gz BZKCHQGGRLDMAV-CIQXWFTPSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256525364 1062845905 /nfs/dbraw/zinc/84/59/05/1062845905.db2.gz BZKCHQGGRLDMAV-CIQXWFTPSA-N 2 1 320.480 4.185 20 0 DIADMP C=Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001256527185 1062848674 /nfs/dbraw/zinc/84/86/74/1062848674.db2.gz QQOREEMCGAWGGK-XMSQKQJNSA-N 2 1 320.480 4.472 20 0 DIADMP C=Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001256527185 1062848697 /nfs/dbraw/zinc/84/86/97/1062848697.db2.gz QQOREEMCGAWGGK-XMSQKQJNSA-N 2 1 320.480 4.472 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256525493 1062849821 /nfs/dbraw/zinc/84/98/21/1062849821.db2.gz BZKCHQGGRLDMAV-YCZSINBZSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256525493 1062849844 /nfs/dbraw/zinc/84/98/44/1062849844.db2.gz BZKCHQGGRLDMAV-YCZSINBZSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256529375 1062851306 /nfs/dbraw/zinc/85/13/06/1062851306.db2.gz TVSLXEURTJDKPT-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256529375 1062851323 /nfs/dbraw/zinc/85/13/23/1062851323.db2.gz TVSLXEURTJDKPT-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256529449 1062851421 /nfs/dbraw/zinc/85/14/21/1062851421.db2.gz BZKCHQGGRLDMAV-KVJIRVJXSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256529449 1062851439 /nfs/dbraw/zinc/85/14/39/1062851439.db2.gz BZKCHQGGRLDMAV-KVJIRVJXSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256528409 1062854402 /nfs/dbraw/zinc/85/44/02/1062854402.db2.gz FBDVJWMAZBOWSF-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256528409 1062854427 /nfs/dbraw/zinc/85/44/27/1062854427.db2.gz FBDVJWMAZBOWSF-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@@H]3CCC[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256535864 1062854916 /nfs/dbraw/zinc/85/49/16/1062854916.db2.gz BBDIMPUGBYAADB-BVOGOJNSSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CC[C@@H]3CCC[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535864 1062854941 /nfs/dbraw/zinc/85/49/41/1062854941.db2.gz BBDIMPUGBYAADB-BVOGOJNSSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CC[C@@H]3CCC[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256535864 1062854965 /nfs/dbraw/zinc/85/49/65/1062854965.db2.gz BBDIMPUGBYAADB-BVOGOJNSSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@](C)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536784 1062857236 /nfs/dbraw/zinc/85/72/36/1062857236.db2.gz FUWSAOWHRUPILU-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@@](C)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536784 1062857261 /nfs/dbraw/zinc/85/72/61/1062857261.db2.gz FUWSAOWHRUPILU-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536784 1062857281 /nfs/dbraw/zinc/85/72/81/1062857281.db2.gz FUWSAOWHRUPILU-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536784 1062857302 /nfs/dbraw/zinc/85/73/02/1062857302.db2.gz FUWSAOWHRUPILU-YZGWKJHDSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256535766 1062857766 /nfs/dbraw/zinc/85/77/66/1062857766.db2.gz CWHAGEIYKLKWSM-SOAMZJECSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256535766 1062857774 /nfs/dbraw/zinc/85/77/74/1062857774.db2.gz CWHAGEIYKLKWSM-SOAMZJECSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCC[C@@H]2C)CC[N@@H+]1Cc1ccccc1 ZINC001256548162 1062868785 /nfs/dbraw/zinc/86/87/85/1062868785.db2.gz AMRLEMRIKFDNLZ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCC[C@@H]2C)CC[N@H+]1Cc1ccccc1 ZINC001256548162 1062868804 /nfs/dbraw/zinc/86/88/04/1062868804.db2.gz AMRLEMRIKFDNLZ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548162 1062868817 /nfs/dbraw/zinc/86/88/17/1062868817.db2.gz AMRLEMRIKFDNLZ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548162 1062868833 /nfs/dbraw/zinc/86/88/33/1062868833.db2.gz AMRLEMRIKFDNLZ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+]CCC1C2CC3CC(C2)CC1C3 ZINC001460491306 1062881149 /nfs/dbraw/zinc/88/11/49/1062881149.db2.gz SFXIEMVYFBNYRT-UHFFFAOYSA-N 2 1 306.538 4.159 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]CCC1C2CC3CC(C2)CC1C3 ZINC001460491306 1062881157 /nfs/dbraw/zinc/88/11/57/1062881157.db2.gz SFXIEMVYFBNYRT-UHFFFAOYSA-N 2 1 306.538 4.159 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559844 1062884885 /nfs/dbraw/zinc/88/48/85/1062884885.db2.gz NTXSPXCRYBWPAC-YSIASYRMSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559844 1062884906 /nfs/dbraw/zinc/88/49/06/1062884906.db2.gz NTXSPXCRYBWPAC-YSIASYRMSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559844 1062884920 /nfs/dbraw/zinc/88/49/20/1062884920.db2.gz NTXSPXCRYBWPAC-YSIASYRMSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559844 1062884937 /nfs/dbraw/zinc/88/49/37/1062884937.db2.gz NTXSPXCRYBWPAC-YSIASYRMSA-N 2 1 300.490 4.304 20 0 DIADMP CC(C)(C)Oc1cccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1 ZINC001256566833 1062888176 /nfs/dbraw/zinc/88/81/76/1062888176.db2.gz ZKEVXVOOZWIMSE-UHFFFAOYSA-N 2 1 318.505 4.216 20 0 DIADMP C[N@@H+](C1CC[NH+](C(C)(C)C)CC1)C(C)(C)Cc1ccccc1 ZINC001256576943 1062897362 /nfs/dbraw/zinc/89/73/62/1062897362.db2.gz WFFVSDUFEIKWFL-UHFFFAOYSA-N 2 1 302.506 4.202 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccccc2F)CC1 ZINC001256573280 1062899185 /nfs/dbraw/zinc/89/91/85/1062899185.db2.gz GDYCNAYMHZNPFA-SFHVURJKSA-N 2 1 304.453 4.226 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CCC[C@H]2c2ccccc2F)CC1 ZINC001256573280 1062899202 /nfs/dbraw/zinc/89/92/02/1062899202.db2.gz GDYCNAYMHZNPFA-SFHVURJKSA-N 2 1 304.453 4.226 20 0 DIADMP COc1ccccc1[C@@H]1CCC[N@@H+]1C1CC[NH+](C(C)(C)C)CC1 ZINC001256574207 1062900844 /nfs/dbraw/zinc/90/08/44/1062900844.db2.gz WKBKLOPYGCJBNV-SFHVURJKSA-N 2 1 316.489 4.095 20 0 DIADMP COc1ccccc1[C@@H]1CCC[N@H+]1C1CC[NH+](C(C)(C)C)CC1 ZINC001256574207 1062900854 /nfs/dbraw/zinc/90/08/54/1062900854.db2.gz WKBKLOPYGCJBNV-SFHVURJKSA-N 2 1 316.489 4.095 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]CC3(CC4CCC4)CC3)CC2)cc1 ZINC001256600629 1062909617 /nfs/dbraw/zinc/90/96/17/1062909617.db2.gz IEZINUKNFFNIBE-UHFFFAOYSA-N 2 1 312.501 4.211 20 0 DIADMP Cc1ccc(C(C)(C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001256599468 1062911043 /nfs/dbraw/zinc/91/10/43/1062911043.db2.gz RYNKDWVTEIKQFR-UHFFFAOYSA-N 2 1 322.496 4.484 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)[C@H]1C=CCCCCC1 ZINC001460565327 1062914796 /nfs/dbraw/zinc/91/47/96/1062914796.db2.gz DYVYLXJMROJEHB-FQEVSTJZSA-N 2 1 300.490 4.459 20 0 DIADMP C[C@H]1C[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)Cc2ccccc21 ZINC001256604691 1062916554 /nfs/dbraw/zinc/91/65/54/1062916554.db2.gz VFOXMPYLTAKTHF-SFHVURJKSA-N 2 1 320.480 4.270 20 0 DIADMP C[C@H]1C[N@H+](C2CC[NH+](Cc3ccccc3)CC2)Cc2ccccc21 ZINC001256604691 1062916578 /nfs/dbraw/zinc/91/65/78/1062916578.db2.gz VFOXMPYLTAKTHF-SFHVURJKSA-N 2 1 320.480 4.270 20 0 DIADMP c1ccc(C[NH+]2CCC([NH+]3CCCCCCCC3)CC2)cc1 ZINC001256613909 1062919598 /nfs/dbraw/zinc/91/95/98/1062919598.db2.gz ZBHLHOPCWXKQGS-UHFFFAOYSA-N 2 1 300.490 4.307 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256629717 1062922267 /nfs/dbraw/zinc/92/22/67/1062922267.db2.gz QMUGCZMNKIXGGG-YJJAZYOBSA-N 2 1 308.469 4.458 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001256629717 1062922282 /nfs/dbraw/zinc/92/22/82/1062922282.db2.gz QMUGCZMNKIXGGG-YJJAZYOBSA-N 2 1 308.469 4.458 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001256629717 1062922304 /nfs/dbraw/zinc/92/23/04/1062922304.db2.gz QMUGCZMNKIXGGG-YJJAZYOBSA-N 2 1 308.469 4.458 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001256629848 1062922683 /nfs/dbraw/zinc/92/26/83/1062922683.db2.gz UDCOQLOMXPTCAR-ONYGOOLBSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001256629848 1062922709 /nfs/dbraw/zinc/92/27/09/1062922709.db2.gz UDCOQLOMXPTCAR-ONYGOOLBSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001256629848 1062922733 /nfs/dbraw/zinc/92/27/33/1062922733.db2.gz UDCOQLOMXPTCAR-ONYGOOLBSA-N 2 1 316.514 4.171 20 0 DIADMP Cc1cc(C)cc(C[N@@H+]2CCC[C@H]2CC[NH+]2CCC(C)CC2)c1 ZINC001460624264 1062943196 /nfs/dbraw/zinc/94/31/96/1062943196.db2.gz AGLFHZWIPXHFSD-NRFANRHFSA-N 2 1 314.517 4.390 20 0 DIADMP CCc1ccc(CC[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)cc1 ZINC001460673832 1062980928 /nfs/dbraw/zinc/98/09/28/1062980928.db2.gz ZUNKMSQTIHPNLL-UHFFFAOYSA-N 2 1 316.533 4.091 20 0 DIADMP Cc1cccc([C@H]2CCC[N@H+]2C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC001256855150 1063020642 /nfs/dbraw/zinc/02/06/42/1063020642.db2.gz FWUPVKBFRQXXKC-OAQYLSRUSA-N 2 1 321.468 4.196 20 0 DIADMP CCC1CCC([NH+]2C[C@H]3C[NH+](Cc4cccs4)C[C@@H]3C2)CC1 ZINC001256871079 1063027774 /nfs/dbraw/zinc/02/77/74/1063027774.db2.gz IKNUBHCWABIBCB-QLOLRVAOSA-N 2 1 318.530 4.081 20 0 DIADMP C[C@@H]([NH3+])c1cn([C@@H]2CCC[N@H+](C3CCCC3)C2)c2ccccc12 ZINC001256909959 1063047009 /nfs/dbraw/zinc/04/70/09/1063047009.db2.gz VIYXEGLFCHWXBR-NVXWUHKLSA-N 2 1 311.473 4.241 20 0 DIADMP COc1cccc([C@H]2CCCC[N@@H+]2C2CC[NH+](C(C)C)CC2)c1 ZINC001257217520 1063143981 /nfs/dbraw/zinc/14/39/81/1063143981.db2.gz NXUXITWCVMYSNO-HXUWFJFHSA-N 2 1 316.489 4.095 20 0 DIADMP COc1cccc([C@H]2CCCC[N@H+]2C2CC[NH+](C(C)C)CC2)c1 ZINC001257217520 1063143989 /nfs/dbraw/zinc/14/39/89/1063143989.db2.gz NXUXITWCVMYSNO-HXUWFJFHSA-N 2 1 316.489 4.095 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H](CCc3ccccc3)C2)CC1 ZINC001257223652 1063147764 /nfs/dbraw/zinc/14/77/64/1063147764.db2.gz UOHDGTOGLGCICR-HXUWFJFHSA-N 2 1 314.517 4.204 20 0 DIADMP Cc1cccc(C[N@H+](C2CC2)C2CC[NH+](C(C)C)CC2)c1C ZINC001257223458 1063148759 /nfs/dbraw/zinc/14/87/59/1063148759.db2.gz QEXFJJPYGOFKSV-UHFFFAOYSA-N 2 1 300.490 4.141 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)C2CC[NH+](C(C)C)CC2)c1C ZINC001257223458 1063148769 /nfs/dbraw/zinc/14/87/69/1063148769.db2.gz QEXFJJPYGOFKSV-UHFFFAOYSA-N 2 1 300.490 4.141 20 0 DIADMP CCC[C@H](CC)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001257255152 1063162524 /nfs/dbraw/zinc/16/25/24/1063162524.db2.gz YTXZMQXVTVMENU-HOJAQTOUSA-N 2 1 302.506 4.313 20 0 DIADMP CCC[C@@H](CC)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001257265908 1063168772 /nfs/dbraw/zinc/16/87/72/1063168772.db2.gz KWNIDIZNEDXRKY-LJQANCHMSA-N 2 1 300.490 4.088 20 0 DIADMP CCC[C@@H](CC)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001257265908 1063168789 /nfs/dbraw/zinc/16/87/89/1063168789.db2.gz KWNIDIZNEDXRKY-LJQANCHMSA-N 2 1 300.490 4.088 20 0 DIADMP CCC[C@H](CC)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257264629 1063171146 /nfs/dbraw/zinc/17/11/46/1063171146.db2.gz PLJSQKFVANYKKV-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1cccc2ccoc21)Cc1ccccc1 ZINC001461006714 1063182962 /nfs/dbraw/zinc/18/29/62/1063182962.db2.gz RGAJJIYOLKNOOB-UHFFFAOYSA-N 2 1 308.425 4.045 20 0 DIADMP CCC(CC)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001257303378 1063190883 /nfs/dbraw/zinc/19/08/83/1063190883.db2.gz OJRJUAXRUYNRDZ-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP CCC(CC)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001257303378 1063190892 /nfs/dbraw/zinc/19/08/92/1063190892.db2.gz OJRJUAXRUYNRDZ-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP CCC(CC)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001257303897 1063191169 /nfs/dbraw/zinc/19/11/69/1063191169.db2.gz VCHZVTACZMAWRR-UHFFFAOYSA-N 2 1 308.897 4.425 20 0 DIADMP CCC(CC)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001257303897 1063191192 /nfs/dbraw/zinc/19/11/92/1063191192.db2.gz VCHZVTACZMAWRR-UHFFFAOYSA-N 2 1 308.897 4.425 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@H](C(C)C)[NH+]1CCCC1 ZINC001461030039 1063199004 /nfs/dbraw/zinc/19/90/04/1063199004.db2.gz LHUKXPQERYIHQD-KVVHSQDJSA-N 2 1 320.908 4.453 20 0 DIADMP CC[NH+](CC)[C@H](C[NH2+][C@@H]1CCOC2(CCCCC2)C1)CC(C)C ZINC001461029113 1063199233 /nfs/dbraw/zinc/19/92/33/1063199233.db2.gz IZCMFSFRMFBSQJ-MOPGFXCFSA-N 2 1 324.553 4.214 20 0 DIADMP CC[NH+](CC)[C@H](C[NH2+][C@H]1CCOC2(CCCCC2)C1)CC(C)C ZINC001461029116 1063200480 /nfs/dbraw/zinc/20/04/80/1063200480.db2.gz IZCMFSFRMFBSQJ-OALUTQOASA-N 2 1 324.553 4.214 20 0 DIADMP CCC[C@@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001257321852 1063201732 /nfs/dbraw/zinc/20/17/32/1063201732.db2.gz YFAJMKJCMMVFGA-TTYHFUOFSA-N 2 1 300.490 4.286 20 0 DIADMP CCC[C@H](C)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257324570 1063206123 /nfs/dbraw/zinc/20/61/23/1063206123.db2.gz PMXGCSLTMCDJGO-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001257324570 1063206139 /nfs/dbraw/zinc/20/61/39/1063206139.db2.gz PMXGCSLTMCDJGO-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001257324570 1063206155 /nfs/dbraw/zinc/20/61/55/1063206155.db2.gz PMXGCSLTMCDJGO-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001257323411 1063207050 /nfs/dbraw/zinc/20/70/50/1063207050.db2.gz BEFZAEOGQGEYKN-HNNXBMFYSA-N 2 1 308.897 4.425 20 0 DIADMP CCC[C@H](C)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001257323411 1063207073 /nfs/dbraw/zinc/20/70/73/1063207073.db2.gz BEFZAEOGQGEYKN-HNNXBMFYSA-N 2 1 308.897 4.425 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001257328686 1063209001 /nfs/dbraw/zinc/20/90/01/1063209001.db2.gz SPSZWCFZHCAHFF-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257328686 1063209015 /nfs/dbraw/zinc/20/90/15/1063209015.db2.gz SPSZWCFZHCAHFF-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001257328686 1063209036 /nfs/dbraw/zinc/20/90/36/1063209036.db2.gz SPSZWCFZHCAHFF-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2ccc3c(c2)CCCC3)C1 ZINC001461046890 1063212197 /nfs/dbraw/zinc/21/21/97/1063212197.db2.gz MUSMGSVBYNLBLJ-HDICACEKSA-N 2 1 314.517 4.023 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]C/C=C/c2ccc(F)cc2)C1 ZINC001461046860 1063212674 /nfs/dbraw/zinc/21/26/74/1063212674.db2.gz LQCRVWVBWSNFOX-FBLDJFESSA-N 2 1 318.480 4.187 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@H]2[C@H](CCN2Cc2nccs2)C1 ZINC001257337154 1063216254 /nfs/dbraw/zinc/21/62/54/1063216254.db2.gz RYHNAZBNQFEPNW-WBVHZDCISA-N 2 1 321.534 4.008 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001461051714 1063219319 /nfs/dbraw/zinc/21/93/19/1063219319.db2.gz LQZKYFLEEJGFTK-NQIIRXRSSA-N 2 1 314.517 4.036 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC001461057572 1063225770 /nfs/dbraw/zinc/22/57/70/1063225770.db2.gz HDYVUDSUHLLNMX-FGZHOGPDSA-N 2 1 320.480 4.378 20 0 DIADMP CCCCCC[C@H](C)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001257356820 1063225958 /nfs/dbraw/zinc/22/59/58/1063225958.db2.gz BBGSAMJKXSMCDI-KRWDZBQOSA-N 2 1 318.505 4.304 20 0 DIADMP CCCCCC[C@@H](C)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001257371536 1063237896 /nfs/dbraw/zinc/23/78/96/1063237896.db2.gz HZJVTJKMJRKDDU-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccc(Cl)cc2)CC1(C)C ZINC001461087039 1063244521 /nfs/dbraw/zinc/24/45/21/1063244521.db2.gz XLHCVIVZZRMJTH-INIZCTEOSA-N 2 1 308.897 4.080 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257416195 1063266602 /nfs/dbraw/zinc/26/66/02/1063266602.db2.gz FEYGCAGHMSSMME-WDSOQIARSA-N 2 1 303.494 4.122 20 0 DIADMP CCCC[C@@H](CC)[N@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257421177 1063269739 /nfs/dbraw/zinc/26/97/39/1063269739.db2.gz UGXLEYWSQJMNCW-IXDOHACOSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[C@@H](CC)[N@@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257421177 1063269762 /nfs/dbraw/zinc/26/97/62/1063269762.db2.gz UGXLEYWSQJMNCW-IXDOHACOSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[C@@H](CC)[NH+]1C[C@H]2C[N@@H+](Cc3cccs3)C[C@H]2C1 ZINC001257421177 1063269775 /nfs/dbraw/zinc/26/97/75/1063269775.db2.gz UGXLEYWSQJMNCW-IXDOHACOSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[C@@H](CC)[NH+]1C[C@H]2C[N@H+](Cc3cccs3)C[C@H]2C1 ZINC001257421177 1063269793 /nfs/dbraw/zinc/26/97/93/1063269793.db2.gz UGXLEYWSQJMNCW-IXDOHACOSA-N 2 1 306.519 4.081 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]3C[NH+](C4CCCCC4)CC[C@H]3C2)cc1 ZINC001257466745 1063291858 /nfs/dbraw/zinc/29/18/58/1063291858.db2.gz PAQWTKUKAKOCJV-PMACEKPBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](C4CCCCC4)CC[C@H]3C2)cc1 ZINC001257466745 1063291876 /nfs/dbraw/zinc/29/18/76/1063291876.db2.gz PAQWTKUKAKOCJV-PMACEKPBSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@H+](C4CCCCC4)CC[C@H]3C2)cc1 ZINC001257466745 1063291885 /nfs/dbraw/zinc/29/18/85/1063291885.db2.gz PAQWTKUKAKOCJV-PMACEKPBSA-N 2 1 312.501 4.163 20 0 DIADMP CCC[C@H](C)CC[C@@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001257481334 1063305917 /nfs/dbraw/zinc/30/59/17/1063305917.db2.gz JXBHBONQGFZTQL-ZWKOTPCHSA-N 2 1 324.553 4.167 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC001461168385 1063306028 /nfs/dbraw/zinc/30/60/28/1063306028.db2.gz BJHIWVKMJABIIW-FQEVSTJZSA-N 2 1 302.506 4.095 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001461173091 1063309130 /nfs/dbraw/zinc/30/91/30/1063309130.db2.gz WBZCMQSLPTWCGB-RTWAWAEBSA-N 2 1 314.517 4.178 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001461173091 1063309148 /nfs/dbraw/zinc/30/91/48/1063309148.db2.gz WBZCMQSLPTWCGB-RTWAWAEBSA-N 2 1 314.517 4.178 20 0 DIADMP CCCCC[C@H](C)N[C@@H](C[NH3+])c1ccc(Br)cc1 ZINC001257501536 1063311877 /nfs/dbraw/zinc/31/18/77/1063311877.db2.gz BKIVENPUXMTACZ-WFASDCNBSA-N 2 1 313.283 4.007 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)[C@H]1c1cccs1 ZINC001461229064 1063349805 /nfs/dbraw/zinc/34/98/05/1063349805.db2.gz GGNABBKXVDPJRL-BCDMZGRMSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)[C@H]1c1cccs1 ZINC001461229064 1063349821 /nfs/dbraw/zinc/34/98/21/1063349821.db2.gz GGNABBKXVDPJRL-BCDMZGRMSA-N 2 1 318.530 4.299 20 0 DIADMP CC(C)C[C@@H]1CCC[C@@H]([NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)C1 ZINC001461234708 1063355440 /nfs/dbraw/zinc/35/54/40/1063355440.db2.gz UFBAQFZIXJFKGK-ZGXWSNOMSA-N 2 1 324.553 4.070 20 0 DIADMP CCC(CC)C[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001461356250 1063440198 /nfs/dbraw/zinc/44/01/98/1063440198.db2.gz FZEYKRHQVKWBLH-PXNSSMCTSA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C[C@H](c2ccccc2)C(C)C)C1 ZINC001461373843 1063455248 /nfs/dbraw/zinc/45/52/48/1063455248.db2.gz VAHZPFVFOFFCBI-CTNGQTDRSA-N 2 1 316.533 4.384 20 0 DIADMP c1ccc(C2CCC([NH+]3CC4(C3)CC[N@@H+](CC3CC3)C4)CC2)cc1 ZINC001257998568 1063455289 /nfs/dbraw/zinc/45/52/89/1063455289.db2.gz ZZYULOADIFENBC-UHFFFAOYSA-N 2 1 324.512 4.131 20 0 DIADMP c1ccc(C2CCC([NH+]3CC4(C3)CC[N@H+](CC3CC3)C4)CC2)cc1 ZINC001257998568 1063455295 /nfs/dbraw/zinc/45/52/95/1063455295.db2.gz ZZYULOADIFENBC-UHFFFAOYSA-N 2 1 324.512 4.131 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](CC2CC2)c2ccccc2F)CC1 ZINC001258007947 1063461072 /nfs/dbraw/zinc/46/10/72/1063461072.db2.gz XQTFMWNXZYLIFW-HXUWFJFHSA-N 2 1 318.480 4.377 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+]Cc2cccc(OC(C)(C)C)c2)CC1 ZINC001258008070 1063462596 /nfs/dbraw/zinc/46/25/96/1063462596.db2.gz CFTQRUOTEOVROW-UHFFFAOYSA-N 2 1 318.505 4.074 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC001258017226 1063465624 /nfs/dbraw/zinc/46/56/24/1063465624.db2.gz XFIDAYJWXGESKR-QGZVFWFLSA-N 2 1 320.908 4.250 20 0 DIADMP CCSc1ccccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001473176171 1063482952 /nfs/dbraw/zinc/48/29/52/1063482952.db2.gz TVBCCLNRTOTMSD-GOSISDBHSA-N 2 1 318.530 4.249 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001473176171 1063482963 /nfs/dbraw/zinc/48/29/63/1063482963.db2.gz TVBCCLNRTOTMSD-GOSISDBHSA-N 2 1 318.530 4.249 20 0 DIADMP Clc1ccccc1-c1ccc(C[NH2+]CCC[NH+]2CCC2)s1 ZINC001461414410 1063484214 /nfs/dbraw/zinc/48/42/14/1063484214.db2.gz RQKSUUWQKHHLHF-UHFFFAOYSA-N 2 1 320.889 4.254 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@@H](C)C[C@H](C)CC(C)C)CC1 ZINC001258055776 1063488578 /nfs/dbraw/zinc/48/85/78/1063488578.db2.gz MUICWHSLSUGEID-AEFFLSMTSA-N 2 1 317.521 4.409 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@@H](C)C[C@@H](C)CC(C)C)CC1 ZINC001258061920 1063490035 /nfs/dbraw/zinc/49/00/35/1063490035.db2.gz AMIWCHMQNUEWFG-IRXDYDNUSA-N 2 1 317.521 4.390 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 ZINC001473184173 1063493891 /nfs/dbraw/zinc/49/38/91/1063493891.db2.gz CMTYFINQFGJTBC-AZUAARDMSA-N 2 1 302.506 4.500 20 0 DIADMP CC(C)C[C@@H](C)C[C@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001258074007 1063499725 /nfs/dbraw/zinc/49/97/25/1063499725.db2.gz HJRJYUHWMGPYKF-MSOLQXFVSA-N 2 1 324.553 4.022 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258093616 1063514273 /nfs/dbraw/zinc/51/42/73/1063514273.db2.gz SIEQYLXFCLTKGP-QZTJIDSGSA-N 2 1 322.537 4.133 20 0 DIADMP CC(C)=CCC[C@H](C)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258092545 1063515240 /nfs/dbraw/zinc/51/52/40/1063515240.db2.gz IVVCZOOKHRNMCL-INIZCTEOSA-N 2 1 301.478 4.064 20 0 DIADMP C[C@@H](Cc1ccco1)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258182192 1063549033 /nfs/dbraw/zinc/54/90/33/1063549033.db2.gz LHUUNOSKFSUBNI-WDSOQIARSA-N 2 1 318.505 4.363 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC001461518592 1063551117 /nfs/dbraw/zinc/55/11/17/1063551117.db2.gz BGNUZHKZVXXXMX-OSJSJHBBSA-N 2 1 322.443 4.078 20 0 DIADMP CSCC[C@H](C)[N@@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258213236 1063562171 /nfs/dbraw/zinc/56/21/71/1063562171.db2.gz YWPOQKCASBOQGF-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+]C2CCCCCCC2)CC1 ZINC001258234393 1063573515 /nfs/dbraw/zinc/57/35/15/1063573515.db2.gz ZGLFZMRLUNSTFW-UHFFFAOYSA-N 2 1 301.478 4.061 20 0 DIADMP [NH3+]C1(c2ccccc2F)CC[NH+](C2CCCCCCC2)CC1 ZINC001258237940 1063576066 /nfs/dbraw/zinc/57/60/66/1063576066.db2.gz YJAPCSOBMDNJKS-UHFFFAOYSA-N 2 1 304.453 4.188 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccncc2)C2CCCCCCC2)CC1 ZINC001258237553 1063576385 /nfs/dbraw/zinc/57/63/85/1063576385.db2.gz OYKPCLWCVYILTK-KESTWPANSA-N 2 1 315.505 4.266 20 0 DIADMP CC(C)(C)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C1CCCCCCC1 ZINC001258240962 1063580061 /nfs/dbraw/zinc/58/00/61/1063580061.db2.gz VUCAIWXRCIGKKD-GOSISDBHSA-N 2 1 322.537 4.111 20 0 DIADMP CC1(C)CCC[C@@H]([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)C1 ZINC001258280479 1063583737 /nfs/dbraw/zinc/58/37/37/1063583737.db2.gz WDIIZOIBLJVAPH-QGZVFWFLSA-N 2 1 304.453 4.044 20 0 DIADMP CC1(C)CCC[C@@H]([N@@H+](Cc2cccnc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258281075 1063583790 /nfs/dbraw/zinc/58/37/90/1063583790.db2.gz BXVWEBYSVKLBBH-GUDVDZBRSA-N 2 1 315.505 4.122 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)CC(C)(C)SCc2ccco2)CC1 ZINC001258295899 1063594136 /nfs/dbraw/zinc/59/41/36/1063594136.db2.gz SCIMJBYCNOPEEJ-OAHLLOKOSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1CCN(C)CC1 ZINC001258304374 1063601266 /nfs/dbraw/zinc/60/12/66/1063601266.db2.gz HONYFQRIDQLPGD-OAHLLOKOSA-N 2 1 324.534 4.096 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+](C)C1CC[NH+](C)CC1 ZINC001258304374 1063601270 /nfs/dbraw/zinc/60/12/70/1063601270.db2.gz HONYFQRIDQLPGD-OAHLLOKOSA-N 2 1 324.534 4.096 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1CC[NH+](C)CC1 ZINC001258304374 1063601273 /nfs/dbraw/zinc/60/12/73/1063601273.db2.gz HONYFQRIDQLPGD-OAHLLOKOSA-N 2 1 324.534 4.096 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH2+][C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC001258327689 1063612342 /nfs/dbraw/zinc/61/23/42/1063612342.db2.gz OYYNMPNLOWHKKB-WBVHZDCISA-N 2 1 312.567 4.151 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH2+][C@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC001258327689 1063612351 /nfs/dbraw/zinc/61/23/51/1063612351.db2.gz OYYNMPNLOWHKKB-WBVHZDCISA-N 2 1 312.567 4.151 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1cc(C)ccc1OC)C1CCCCC1 ZINC001461616578 1063614514 /nfs/dbraw/zinc/61/45/14/1063614514.db2.gz QJBMLIRAJUBBCR-UHFFFAOYSA-N 2 1 318.505 4.138 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cc(C)ccc1OC)C1CCCCC1 ZINC001461616578 1063614520 /nfs/dbraw/zinc/61/45/20/1063614520.db2.gz QJBMLIRAJUBBCR-UHFFFAOYSA-N 2 1 318.505 4.138 20 0 DIADMP C[C@H](CC1CC1)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258455973 1063663519 /nfs/dbraw/zinc/66/35/19/1063663519.db2.gz GEZTZZVEYIJOHR-NIKGAXFTSA-N 2 1 304.453 4.086 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H](C)CC2CC2)CC1 ZINC001258461712 1063664306 /nfs/dbraw/zinc/66/43/06/1063664306.db2.gz DYYDCWKPJJFDHS-QGZVFWFLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001258462945 1063665319 /nfs/dbraw/zinc/66/53/19/1063665319.db2.gz UFBDTMWQOXBAJD-MRXNPFEDSA-N 2 1 318.530 4.225 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001279101642 1063666322 /nfs/dbraw/zinc/66/63/22/1063666322.db2.gz VRGCXASOZLIMQO-OAQYLSRUSA-N 2 1 308.469 4.066 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@]1(C)CC1(C)C ZINC001461725383 1063679453 /nfs/dbraw/zinc/67/94/53/1063679453.db2.gz DUTLLRZXAINWHT-HXUWFJFHSA-N 2 1 302.506 4.170 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H]2CCC(C)(C)C2)CC1 ZINC001258604915 1063704545 /nfs/dbraw/zinc/70/45/45/1063704545.db2.gz MAPLQCVMWXWUGO-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP CN1CCC([N@@H+](Cc2ccc(F)cc2)[C@H]2CCC(C)(C)C2)CC1 ZINC001258608597 1063708919 /nfs/dbraw/zinc/70/89/19/1063708919.db2.gz LRIDKKNZIMXOBF-IBGZPJMESA-N 2 1 318.480 4.301 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001258659947 1063730088 /nfs/dbraw/zinc/73/00/88/1063730088.db2.gz WMXULEGIKJIYNP-NRFANRHFSA-N 2 1 316.533 4.450 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC001461864108 1063757521 /nfs/dbraw/zinc/75/75/21/1063757521.db2.gz KAWOSKHUIWHSFQ-PXNSSMCTSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC001461864108 1063757532 /nfs/dbraw/zinc/75/75/32/1063757532.db2.gz KAWOSKHUIWHSFQ-PXNSSMCTSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC001461864108 1063757540 /nfs/dbraw/zinc/75/75/40/1063757540.db2.gz KAWOSKHUIWHSFQ-PXNSSMCTSA-N 2 1 302.506 4.015 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@@H]3CC[N@@H+](CC)[C@@H](C)C3)oc21 ZINC001461861957 1063757597 /nfs/dbraw/zinc/75/75/97/1063757597.db2.gz RNMNXEUFQMAFDK-MAUKXSAKSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[NH+](C)[C@@H]3CC[N@H+](CC)[C@@H](C)C3)oc21 ZINC001461861957 1063757604 /nfs/dbraw/zinc/75/76/04/1063757604.db2.gz RNMNXEUFQMAFDK-MAUKXSAKSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@@H+](C)[C@@H]3CC[NH+](CC)[C@@H](C)C3)oc21 ZINC001461861957 1063757613 /nfs/dbraw/zinc/75/76/13/1063757613.db2.gz RNMNXEUFQMAFDK-MAUKXSAKSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@H+](C)[C@@H]3CC[NH+](CC)[C@@H](C)C3)oc21 ZINC001461861957 1063757624 /nfs/dbraw/zinc/75/76/24/1063757624.db2.gz RNMNXEUFQMAFDK-MAUKXSAKSA-N 2 1 314.473 4.300 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001258706569 1063763881 /nfs/dbraw/zinc/76/38/81/1063763881.db2.gz SOMROJNIJSWLMJ-IBGZPJMESA-N 2 1 300.490 4.004 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258740856 1063791449 /nfs/dbraw/zinc/79/14/49/1063791449.db2.gz BKTVPTOIDYHOMK-JVPBZIDWSA-N 2 1 320.908 4.253 20 0 DIADMP CCCC[C@H](CCC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258755974 1063803064 /nfs/dbraw/zinc/80/30/64/1063803064.db2.gz FAHOXGXYCVYZNA-KRWDZBQOSA-N 2 1 318.505 4.304 20 0 DIADMP CCCC[C@H](CCC)N(c1cc(C)[nH+]c(C)n1)C1CC[NH2+]CC1 ZINC001258763823 1063809975 /nfs/dbraw/zinc/80/99/75/1063809975.db2.gz DRWGSUQLXDXRSX-KRWDZBQOSA-N 2 1 318.509 4.011 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccc(OCC)cc2)CC1 ZINC001258775443 1063814757 /nfs/dbraw/zinc/81/47/57/1063814757.db2.gz PFJVPVNAEASHQZ-HXUWFJFHSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccc(OCC)cc2)CC1 ZINC001258775443 1063814773 /nfs/dbraw/zinc/81/47/73/1063814773.db2.gz PFJVPVNAEASHQZ-HXUWFJFHSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC1 ZINC001258776153 1063815196 /nfs/dbraw/zinc/81/51/96/1063815196.db2.gz VSQXJSGEHXXEGG-HNNXBMFYSA-N 2 1 320.908 4.176 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC001258776257 1063815462 /nfs/dbraw/zinc/81/54/62/1063815462.db2.gz ZUTVVLYXSPKSHU-LJQANCHMSA-N 2 1 300.490 4.131 20 0 DIADMP CCC[NH+]1CCC([N@H+](Cc2cccc(C)c2C)C2CC2)CC1 ZINC001258777532 1063819620 /nfs/dbraw/zinc/81/96/20/1063819620.db2.gz XBPUNRALXIQJJE-UHFFFAOYSA-N 2 1 300.490 4.142 20 0 DIADMP CCC[NH+]1CCC([N@@H+](Cc2cccc(C)c2C)C2CC2)CC1 ZINC001258777532 1063819633 /nfs/dbraw/zinc/81/96/33/1063819633.db2.gz XBPUNRALXIQJJE-UHFFFAOYSA-N 2 1 300.490 4.142 20 0 DIADMP CC(C)C1CCC([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC1 ZINC001258801994 1063836464 /nfs/dbraw/zinc/83/64/64/1063836464.db2.gz GCFRJLAOLBBVBR-UHFFFAOYSA-N 2 1 318.480 4.290 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814397 1063844561 /nfs/dbraw/zinc/84/45/61/1063844561.db2.gz OSDDWADHKFHWSY-FRYIKTPZSA-N 2 1 300.490 4.337 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@@]2(C)CCCS2)CC1 ZINC001461966313 1063847042 /nfs/dbraw/zinc/84/70/42/1063847042.db2.gz QBJFUJULRMKQCW-PKOBYXMFSA-N 2 1 324.578 4.249 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828384 1063854037 /nfs/dbraw/zinc/85/40/37/1063854037.db2.gz MHJXQTRMDVJHFO-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828384 1063854040 /nfs/dbraw/zinc/85/40/40/1063854040.db2.gz MHJXQTRMDVJHFO-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC001258907137 1063878381 /nfs/dbraw/zinc/87/83/81/1063878381.db2.gz GJQVNEFLCDIGLA-OAHLLOKOSA-N 2 1 319.518 4.239 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001258907286 1063878532 /nfs/dbraw/zinc/87/85/32/1063878532.db2.gz HMGVCDHWHRIBTJ-APWZRJJASA-N 2 1 306.469 4.473 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(O)cc1 ZINC000379632712 1063984266 /nfs/dbraw/zinc/98/42/66/1063984266.db2.gz NXWSTYVOOKDHRQ-FUHIMQAGSA-N 2 1 324.468 4.096 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc(O)cc1 ZINC000379632712 1063984269 /nfs/dbraw/zinc/98/42/69/1063984269.db2.gz NXWSTYVOOKDHRQ-FUHIMQAGSA-N 2 1 324.468 4.096 20 0 DIADMP Cc1ccc(F)cc1C[NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000379632504 1063984344 /nfs/dbraw/zinc/98/43/44/1063984344.db2.gz NTFMNXKGXROQKW-QGZVFWFLSA-N 2 1 314.448 4.134 20 0 DIADMP Cc1ccc(F)cc1C[NH2+]CC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000379632504 1063984349 /nfs/dbraw/zinc/98/43/49/1063984349.db2.gz NTFMNXKGXROQKW-QGZVFWFLSA-N 2 1 314.448 4.134 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379633483 1063985617 /nfs/dbraw/zinc/98/56/17/1063985617.db2.gz OUBQSUQFVMAFIQ-NSHGMRRFSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379633483 1063985621 /nfs/dbraw/zinc/98/56/21/1063985621.db2.gz OUBQSUQFVMAFIQ-NSHGMRRFSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(Cl)s1)[N@H+](C)Cc1ccccc1 ZINC000379618947 1063985691 /nfs/dbraw/zinc/98/56/91/1063985691.db2.gz AYBPSMXWLSKAJM-CQSZACIVSA-N 2 1 322.905 4.402 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(Cl)s1)[N@@H+](C)Cc1ccccc1 ZINC000379618947 1063985696 /nfs/dbraw/zinc/98/56/96/1063985696.db2.gz AYBPSMXWLSKAJM-CQSZACIVSA-N 2 1 322.905 4.402 20 0 DIADMP Cc1ccc(F)cc1C[NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000379632503 1063985749 /nfs/dbraw/zinc/98/57/49/1063985749.db2.gz NTFMNXKGXROQKW-KRWDZBQOSA-N 2 1 314.448 4.134 20 0 DIADMP Cc1ccc(F)cc1C[NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000379632503 1063985755 /nfs/dbraw/zinc/98/57/55/1063985755.db2.gz NTFMNXKGXROQKW-KRWDZBQOSA-N 2 1 314.448 4.134 20 0 DIADMP Cc1cc(F)ccc1C[NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000379615848 1063986147 /nfs/dbraw/zinc/98/61/47/1063986147.db2.gz BHPXZESBPZEOIJ-KRWDZBQOSA-N 2 1 314.448 4.134 20 0 DIADMP C[C@H](CC[NH2+][C@H]1C[C@H](C)C[C@H](C)C1)[N@@H+](C)Cc1ccccc1 ZINC000379641170 1063986250 /nfs/dbraw/zinc/98/62/50/1063986250.db2.gz CUILQDOWKUXLHS-RMJJICAUSA-N 2 1 302.506 4.311 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379656433 1063987299 /nfs/dbraw/zinc/98/72/99/1063987299.db2.gz OZUFXCNRZOBBDH-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379656433 1063987310 /nfs/dbraw/zinc/98/73/10/1063987310.db2.gz OZUFXCNRZOBBDH-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379656434 1063988053 /nfs/dbraw/zinc/98/80/53/1063988053.db2.gz OZUFXCNRZOBBDH-KVPLUYHFSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379656434 1063988055 /nfs/dbraw/zinc/98/80/55/1063988055.db2.gz OZUFXCNRZOBBDH-KVPLUYHFSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379656432 1063988104 /nfs/dbraw/zinc/98/81/04/1063988104.db2.gz OZUFXCNRZOBBDH-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379656432 1063988108 /nfs/dbraw/zinc/98/81/08/1063988108.db2.gz OZUFXCNRZOBBDH-IZBJGVDFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000381025449 1063990679 /nfs/dbraw/zinc/99/06/79/1063990679.db2.gz XVOOBYVOOULOAO-JYRKZWEQSA-N 2 1 314.517 4.313 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)CC1 ZINC000381776104 1063992311 /nfs/dbraw/zinc/99/23/11/1063992311.db2.gz CYABKXIPQZSVFI-VOUWZBHPSA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382073447 1063997472 /nfs/dbraw/zinc/99/74/72/1063997472.db2.gz SWSHGJQDTHRKOC-NLWGTHIKSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@]1(C[NH2+]C/C=C/c2ccccc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000383360912 1064002647 /nfs/dbraw/zinc/00/26/47/1064002647.db2.gz SRQZMWMUIOLKCD-MKGTUJQCSA-N 2 1 320.480 4.202 20 0 DIADMP CSC(C)(C)CC[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000385253580 1064009925 /nfs/dbraw/zinc/00/99/25/1064009925.db2.gz SVTWJGKCYRSHLM-LJQANCHMSA-N 2 1 320.546 4.020 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390669538 1064166013 /nfs/dbraw/zinc/16/60/13/1064166013.db2.gz NMTVMYNBURENDX-RBUKOAKNSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390669538 1064166018 /nfs/dbraw/zinc/16/60/18/1064166018.db2.gz NMTVMYNBURENDX-RBUKOAKNSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@@H]1CCC[C@@H](C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390772162 1064169435 /nfs/dbraw/zinc/16/94/35/1064169435.db2.gz KGEAWOAINWKFHL-NRSPTQNISA-N 2 1 314.517 4.315 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000390811818 1064170535 /nfs/dbraw/zinc/17/05/35/1064170535.db2.gz WHNMPOJXTWOHBH-SDZDHKAXSA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000393946112 1064312475 /nfs/dbraw/zinc/31/24/75/1064312475.db2.gz FYLLLRXBIDTOMQ-BJLQDIEVSA-N 2 1 302.506 4.313 20 0 DIADMP c1cc2c(cccc2C[N@@H+]2CCCC3(C[NH+](C4CCCC4)C3)C2)[nH]1 ZINC001279368947 1064346888 /nfs/dbraw/zinc/34/68/88/1064346888.db2.gz HYGJTURUDFODBF-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCC3(C[NH+](C4CCCC4)C3)C2)[nH]1 ZINC001279368947 1064346903 /nfs/dbraw/zinc/34/69/03/1064346903.db2.gz HYGJTURUDFODBF-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[NH+]2CC3(C2)CC[N@@H+](C)C3)CC1 ZINC001279472974 1064351330 /nfs/dbraw/zinc/35/13/30/1064351330.db2.gz RMEPXWHUAXOGAS-IBGZPJMESA-N 2 1 302.506 4.097 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[NH+]2CC3(C2)CC[N@H+](C)C3)CC1 ZINC001279472974 1064351336 /nfs/dbraw/zinc/35/13/36/1064351336.db2.gz RMEPXWHUAXOGAS-IBGZPJMESA-N 2 1 302.506 4.097 20 0 DIADMP CC/C=C\CCC[NH+]1CCC2(CC[N@@H+](Cc3ccc[nH]3)C2)CC1 ZINC001279486074 1064354071 /nfs/dbraw/zinc/35/40/71/1064354071.db2.gz HNVJDHJFZXATDW-ARJAWSKDSA-N 2 1 315.505 4.049 20 0 DIADMP Cc1cccc(N2CCC3(CCC[N@@H+](C4CCCC4)C3)CC2)[nH+]1 ZINC001279752505 1064365672 /nfs/dbraw/zinc/36/56/72/1064365672.db2.gz MSAUYFPJPNJDHT-UHFFFAOYSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cccc(N2CCC3(CCC[N@H+](C4CCCC4)C3)CC2)[nH+]1 ZINC001279752505 1064365685 /nfs/dbraw/zinc/36/56/85/1064365685.db2.gz MSAUYFPJPNJDHT-UHFFFAOYSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cc(N2CCC[C@@]3(CCC[N@H+](C4CCCC4)C3)C2)cc[nH+]1 ZINC001279787557 1064366705 /nfs/dbraw/zinc/36/67/05/1064366705.db2.gz POUSMULXDLSPFS-HXUWFJFHSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cc[nH+]c(N2CCC[C@@]3(CCC[N@@H+](C4CCCC4)C3)C2)c1 ZINC001280090001 1064380287 /nfs/dbraw/zinc/38/02/87/1064380287.db2.gz JYMBLKRDLLYUAY-HXUWFJFHSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cc[nH+]c(N2CCC[C@@]3(CCC[N@H+](C4CCCC4)C3)C2)c1 ZINC001280090001 1064380293 /nfs/dbraw/zinc/38/02/93/1064380293.db2.gz JYMBLKRDLLYUAY-HXUWFJFHSA-N 2 1 313.489 4.015 20 0 DIADMP c1ccc(CCCC[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000643458365 1064412483 /nfs/dbraw/zinc/41/24/83/1064412483.db2.gz QVVAOWFAMZOOPO-NHCUHLMSSA-N 2 1 308.469 4.092 20 0 DIADMP Cc1ccc(C[N@@H+](CCC[NH+]2CCCCC2)C2CC2)cc1C ZINC001307491061 1065435409 /nfs/dbraw/zinc/43/54/09/1065435409.db2.gz QZVHQPVEGZXACT-UHFFFAOYSA-N 2 1 300.490 4.144 20 0 DIADMP CC(C)Cc1ccccc1C[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001307498766 1065441217 /nfs/dbraw/zinc/44/12/17/1065441217.db2.gz IPBWGDZFPIUABV-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccccc1C[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC001307498766 1065441224 /nfs/dbraw/zinc/44/12/24/1065441224.db2.gz IPBWGDZFPIUABV-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccccc1C[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC001307498766 1065441232 /nfs/dbraw/zinc/44/12/32/1065441232.db2.gz IPBWGDZFPIUABV-FQEVSTJZSA-N 2 1 302.506 4.191 20 0 DIADMP C[C@@H]1[C@@H](C)CC[N@H+]1CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001307524425 1065461194 /nfs/dbraw/zinc/46/11/94/1065461194.db2.gz UFXLNAUTUWEIFD-RBUKOAKNSA-N 2 1 314.517 4.062 20 0 DIADMP C[C@@H]1CC[N@@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)[C@@H]1C ZINC001307524426 1065461704 /nfs/dbraw/zinc/46/17/04/1065461704.db2.gz UFXLNAUTUWEIFD-RTBURBONSA-N 2 1 314.517 4.062 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CCC([NH2+]C(C)C)CC2)cc1 ZINC001307575550 1065489530 /nfs/dbraw/zinc/48/95/30/1065489530.db2.gz BOPOFHWYVCXLTF-UHFFFAOYSA-N 2 1 302.506 4.337 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@H]1CCCc1ccccc1 ZINC001307581459 1065495983 /nfs/dbraw/zinc/49/59/83/1065495983.db2.gz UDZCVDFUNXOYFI-HXUWFJFHSA-N 2 1 302.506 4.206 20 0 DIADMP CC[C@@H]1C[C@H]1C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001307802911 1065630214 /nfs/dbraw/zinc/63/02/14/1065630214.db2.gz MZVNCPXZNOKCQB-UXHICEINSA-N 2 1 312.501 4.021 20 0 DIADMP CC[N@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001307825356 1065639890 /nfs/dbraw/zinc/63/98/90/1065639890.db2.gz HWXQSTBRVXJIBU-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP FCC[C@H]1CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001307932187 1065686077 /nfs/dbraw/zinc/68/60/77/1065686077.db2.gz VOIAGGMWFAYUCY-GOSISDBHSA-N 2 1 318.480 4.244 20 0 DIADMP CCC[N@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001307968306 1065705205 /nfs/dbraw/zinc/70/52/05/1065705205.db2.gz NYJWHALZSMHGFR-IBGZPJMESA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001307980954 1065709475 /nfs/dbraw/zinc/70/94/75/1065709475.db2.gz ALKOAGOOSDABAU-KRWDZBQOSA-N 2 1 312.501 4.187 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001308009090 1065723783 /nfs/dbraw/zinc/72/37/83/1065723783.db2.gz PLLGXGSLDSYBRK-FMWKFLBASA-N 2 1 314.517 4.265 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC[C@@H](c2ccc(Cl)cc2)C1(C)C ZINC001308098785 1065762864 /nfs/dbraw/zinc/76/28/64/1065762864.db2.gz RNPDGXGMCUJVAL-ROUUACIJSA-N 2 1 320.908 4.392 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1ccc2occc2c1)C1CCCCC1 ZINC001308180044 1065792148 /nfs/dbraw/zinc/79/21/48/1065792148.db2.gz GNMICKKKCWXDLA-UHFFFAOYSA-N 2 1 300.446 4.177 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1ccc2occc2c1)C1CCCCC1 ZINC001308180044 1065792156 /nfs/dbraw/zinc/79/21/56/1065792156.db2.gz GNMICKKKCWXDLA-UHFFFAOYSA-N 2 1 300.446 4.177 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182568 1065793227 /nfs/dbraw/zinc/79/32/27/1065793227.db2.gz ZPHUCELUIOLSPJ-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182568 1065793235 /nfs/dbraw/zinc/79/32/35/1065793235.db2.gz ZPHUCELUIOLSPJ-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+]CCC[N@@H+](C)Cc1ccccc1 ZINC001308187089 1065797023 /nfs/dbraw/zinc/79/70/23/1065797023.db2.gz QNJWAZCZQVYTAN-AZUAARDMSA-N 2 1 300.490 4.091 20 0 DIADMP CC[NH+](CC)[C@@H](C[NH2+]C[C@@H]1C[C@H]1c1ccccc1)CC(C)C ZINC001308194344 1065802917 /nfs/dbraw/zinc/80/29/17/1065802917.db2.gz VWCJBYOGOOQKQP-ZCNNSNEGSA-N 2 1 302.506 4.136 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1cccc(F)c1 ZINC001308203146 1065812622 /nfs/dbraw/zinc/81/26/22/1065812622.db2.gz LZLUALMKAIGBIZ-JEJOPICUSA-N 2 1 304.453 4.083 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC001308203151 1065812788 /nfs/dbraw/zinc/81/27/88/1065812788.db2.gz MBLVTEFCIIBPKP-INIZCTEOSA-N 2 1 320.521 4.487 20 0 DIADMP CC(C)c1ccc(C[C@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001308333281 1065920367 /nfs/dbraw/zinc/92/03/67/1065920367.db2.gz MHCHKDLYTYHCSU-QFBILLFUSA-N 2 1 302.506 4.203 20 0 DIADMP Cc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC001308368377 1065944989 /nfs/dbraw/zinc/94/49/89/1065944989.db2.gz SJMRHAMTWKILFK-NVXWUHKLSA-N 2 1 320.908 4.391 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(C2CC2)c(C2CC2)c1)C1CC1 ZINC001308428015 1065980995 /nfs/dbraw/zinc/98/09/95/1065980995.db2.gz RRYRPZKNWSNUEP-UHFFFAOYSA-N 2 1 312.501 4.405 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@@H]3CCCC[N@@H+](C)C3)o2)cc1 ZINC001308464560 1066006214 /nfs/dbraw/zinc/00/62/14/1066006214.db2.gz JEXGSFQTQKZUAP-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@@H]3CCCC[N@H+](C)C3)o2)cc1 ZINC001308464560 1066006225 /nfs/dbraw/zinc/00/62/25/1066006225.db2.gz JEXGSFQTQKZUAP-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP C1CCC2(C1)CCC([NH2+][C@H]1CC[N@@H+](C3CCCCC3)C1)CC2 ZINC001308469804 1066009992 /nfs/dbraw/zinc/00/99/92/1066009992.db2.gz WCJNHVPVCUQQNQ-SFHVURJKSA-N 2 1 304.522 4.486 20 0 DIADMP C1CCC2(C1)CCC([NH2+][C@H]1CC[N@H+](C3CCCCC3)C1)CC2 ZINC001308469804 1066010001 /nfs/dbraw/zinc/01/00/01/1066010001.db2.gz WCJNHVPVCUQQNQ-SFHVURJKSA-N 2 1 304.522 4.486 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562134 1066072691 /nfs/dbraw/zinc/07/26/91/1066072691.db2.gz BOWIDGFSEXIOGQ-ROUKRRSUSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562134 1066072698 /nfs/dbraw/zinc/07/26/98/1066072698.db2.gz BOWIDGFSEXIOGQ-ROUKRRSUSA-N 2 1 312.501 4.043 20 0 DIADMP CC[NH+]1CCC(C[N@H+](Cc2ccccc2F)CC(C)C)CC1 ZINC001308581296 1066097321 /nfs/dbraw/zinc/09/73/21/1066097321.db2.gz JLZNIFQKTYSZQC-UHFFFAOYSA-N 2 1 306.469 4.016 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001308592985 1066105744 /nfs/dbraw/zinc/10/57/44/1066105744.db2.gz YIEJLLGSEKHVSC-FQEVSTJZSA-N 2 1 312.501 4.187 20 0 DIADMP CCCc1cccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC001308612664 1066117912 /nfs/dbraw/zinc/11/79/12/1066117912.db2.gz QUFRTDWDEXWVJQ-UHFFFAOYSA-N 2 1 302.506 4.191 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]C4CCCCC4)[C@H]3C2)cc1 ZINC001308636364 1066131825 /nfs/dbraw/zinc/13/18/25/1066131825.db2.gz ZRLGMWZMVCKNMO-SESVDKBCSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001308721523 1066198601 /nfs/dbraw/zinc/19/86/01/1066198601.db2.gz CNGHBYNENJHQAV-RXVVDRJESA-N 2 1 314.517 4.485 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1 ZINC001308744805 1066218955 /nfs/dbraw/zinc/21/89/55/1066218955.db2.gz YOYVNKAMGHGYQZ-NRFANRHFSA-N 2 1 314.517 4.016 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC001308790835 1066266437 /nfs/dbraw/zinc/26/64/37/1066266437.db2.gz AYFNEWVMRVILBX-RLLQIKCJSA-N 2 1 302.506 4.423 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CCCC[C@@H]1c1ccccc1 ZINC001308790835 1066266448 /nfs/dbraw/zinc/26/64/48/1066266448.db2.gz AYFNEWVMRVILBX-RLLQIKCJSA-N 2 1 302.506 4.423 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC001308803215 1066280448 /nfs/dbraw/zinc/28/04/48/1066280448.db2.gz XTBFGZIOLQBJEG-SJORKVTESA-N 2 1 315.505 4.199 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC001308803215 1066280461 /nfs/dbraw/zinc/28/04/61/1066280461.db2.gz XTBFGZIOLQBJEG-SJORKVTESA-N 2 1 315.505 4.199 20 0 DIADMP C[N@H+]1C[C@@H](C[NH2+][C@@H]2CCCC23CCCC3)[C@H](c2ccccc2)C1 ZINC001308831552 1066307689 /nfs/dbraw/zinc/30/76/89/1066307689.db2.gz IWPREQSLDZWKHY-HSALFYBXSA-N 2 1 312.501 4.034 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC001308863903 1066344498 /nfs/dbraw/zinc/34/44/98/1066344498.db2.gz ODCOYFDWBVPELX-RLLQIKCJSA-N 2 1 300.490 4.034 20 0 DIADMP c1cc(C[N@@H+]2CCC[C@@H](C3CCCCC3)C2)n(-c2cc[nH+]cc2)n1 ZINC001308878328 1066358834 /nfs/dbraw/zinc/35/88/34/1066358834.db2.gz ISATXIZHJSGSGP-GOSISDBHSA-N 2 1 324.472 4.060 20 0 DIADMP c1cc(C[N@H+]2CCC[C@@H](C3CCCCC3)C2)n(-c2cc[nH+]cc2)n1 ZINC001308878328 1066358850 /nfs/dbraw/zinc/35/88/50/1066358850.db2.gz ISATXIZHJSGSGP-GOSISDBHSA-N 2 1 324.472 4.060 20 0 DIADMP CC[C@H](CC1CCCCC1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308882898 1066364116 /nfs/dbraw/zinc/36/41/16/1066364116.db2.gz BYPGSOJFPFLPPS-VQTJNVASSA-N 2 1 306.538 4.447 20 0 DIADMP CC(C)C[N@H+](Cc1ncc(C(C)C)s1)CC1CC[NH+](C)CC1 ZINC001308910085 1066387662 /nfs/dbraw/zinc/38/76/62/1066387662.db2.gz MYGQDIYQOUXYMD-UHFFFAOYSA-N 2 1 323.550 4.066 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccs1 ZINC000236996821 202115448 /nfs/dbraw/zinc/11/54/48/202115448.db2.gz SHTZFGSTLWYKNA-GOSISDBHSA-N 2 1 314.498 4.453 20 0 DIADMP C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccnc1Cl ZINC000272635154 130047814 /nfs/dbraw/zinc/04/78/14/130047814.db2.gz BOBPLZXAOYYMED-KKUMJFAQSA-N 2 1 321.896 4.039 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCSc2cc(C)c(C)cc21 ZINC000275399096 130315656 /nfs/dbraw/zinc/31/56/56/130315656.db2.gz ZLUKEBJBFKEXTG-QGZVFWFLSA-N 2 1 315.486 4.025 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccccc2Cl)C1 ZINC000518266214 332003033 /nfs/dbraw/zinc/00/30/33/332003033.db2.gz QLAMPTIRKGSEMG-IYBDPMFKSA-N 2 1 308.897 4.188 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)c2ccsc2S1 ZINC000130251171 332023758 /nfs/dbraw/zinc/02/37/58/332023758.db2.gz OCOADFDDTOEWPT-DZGCQCFKSA-N 2 1 310.532 4.139 20 0 DIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CCCc2sc(Cl)cc21 ZINC000426303127 332038821 /nfs/dbraw/zinc/03/88/21/332038821.db2.gz LJIGHHPMFOCYHJ-RFHZTLPTSA-N 2 1 312.910 4.097 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CCCc2sc(Cl)cc21 ZINC000426303127 332038822 /nfs/dbraw/zinc/03/88/22/332038822.db2.gz LJIGHHPMFOCYHJ-RFHZTLPTSA-N 2 1 312.910 4.097 20 0 DIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc2ccccc2o1 ZINC000215642805 332193060 /nfs/dbraw/zinc/19/30/60/332193060.db2.gz KRJOQMCWLHHDCH-ZDUSSCGKSA-N 2 1 300.446 4.393 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)CCC2 ZINC000536423686 332242189 /nfs/dbraw/zinc/24/21/89/332242189.db2.gz GAKJEVVANMSAKE-XFQXTVEOSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)CCC2 ZINC000536423686 332242190 /nfs/dbraw/zinc/24/21/90/332242190.db2.gz GAKJEVVANMSAKE-XFQXTVEOSA-N 2 1 300.490 4.260 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000559741919 332278173 /nfs/dbraw/zinc/27/81/73/332278173.db2.gz XFGWEKVAYVWWEO-NBHGPNQESA-N 2 1 324.468 4.181 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000559741919 332278176 /nfs/dbraw/zinc/27/81/76/332278176.db2.gz XFGWEKVAYVWWEO-NBHGPNQESA-N 2 1 324.468 4.181 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767181 332280171 /nfs/dbraw/zinc/28/01/71/332280171.db2.gz OXHYSULDDAYULZ-SOUVJXGZSA-N 2 1 300.421 4.112 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767181 332280172 /nfs/dbraw/zinc/28/01/72/332280172.db2.gz OXHYSULDDAYULZ-SOUVJXGZSA-N 2 1 300.421 4.112 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000559767085 332280216 /nfs/dbraw/zinc/28/02/16/332280216.db2.gz PBECISNODSINGW-WJFTUGDTSA-N 2 1 318.530 4.086 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000559767085 332280217 /nfs/dbraw/zinc/28/02/17/332280217.db2.gz PBECISNODSINGW-WJFTUGDTSA-N 2 1 318.530 4.086 20 0 DIADMP CC1=CC[C@H]([NH2+][C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000559913323 332292331 /nfs/dbraw/zinc/29/23/31/332292331.db2.gz IIXFGKRRBSGGAI-IZZBFERCSA-N 2 1 312.501 4.231 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CCCCc2ccc(Cl)s2)[C@H](C)C1 ZINC000560235935 332321062 /nfs/dbraw/zinc/32/10/62/332321062.db2.gz MIIXJXVQWTVWSW-UKRRQHHQSA-N 2 1 314.926 4.044 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCC2(C)C)C[N@H+]1Cc1ccccc1 ZINC000560244836 332322916 /nfs/dbraw/zinc/32/29/16/332322916.db2.gz OYSKWAIXCGXWGP-NZSAHSFTSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(C)C)c(Cl)c2)C1 ZINC000560247871 332323461 /nfs/dbraw/zinc/32/34/61/332323461.db2.gz GIOANAMGFGYWLA-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000442775996 335101089 /nfs/dbraw/zinc/10/10/89/335101089.db2.gz HBXORUMEOWQWRN-CQSZACIVSA-N 2 1 304.503 4.076 20 0 DIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000560579484 332363991 /nfs/dbraw/zinc/36/39/91/332363991.db2.gz ABHYXGQQHGZHFU-OLMNPRSZSA-N 2 1 308.897 4.152 20 0 DIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000560579485 332364077 /nfs/dbraw/zinc/36/40/77/332364077.db2.gz ABHYXGQQHGZHFU-QGTPRVQTSA-N 2 1 308.897 4.152 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccc(C)cc1)C1CCC1 ZINC000427703494 332493094 /nfs/dbraw/zinc/49/30/94/332493094.db2.gz FRUXLQDSENELRJ-JXFKEZNVSA-N 2 1 311.473 4.267 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180113897 333027220 /nfs/dbraw/zinc/02/72/20/333027220.db2.gz DSQACTBMAPFPTC-XBPNIJIESA-N 2 1 300.490 4.206 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000378902531 333061948 /nfs/dbraw/zinc/06/19/48/333061948.db2.gz XPWMONWWBJSRPU-UFYCRDLUSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056695 333096605 /nfs/dbraw/zinc/09/66/05/333096605.db2.gz QXVFWRSPQIPELH-DCKQQPRJSA-N 2 1 318.892 4.017 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056695 333096606 /nfs/dbraw/zinc/09/66/06/333096606.db2.gz QXVFWRSPQIPELH-DCKQQPRJSA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056695 333096607 /nfs/dbraw/zinc/09/66/07/333096607.db2.gz QXVFWRSPQIPELH-DCKQQPRJSA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000526056695 333096609 /nfs/dbraw/zinc/09/66/09/333096609.db2.gz QXVFWRSPQIPELH-DCKQQPRJSA-N 2 1 318.892 4.017 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)C1 ZINC000320684165 335123715 /nfs/dbraw/zinc/12/37/15/335123715.db2.gz PHGUAZHIAKMYSN-ZWKOTPCHSA-N 2 1 308.469 4.346 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000582130297 333132356 /nfs/dbraw/zinc/13/23/56/333132356.db2.gz YWPBBSSQMKZMJR-AWEZNQCLSA-N 2 1 317.864 4.232 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000582130297 333132358 /nfs/dbraw/zinc/13/23/58/333132358.db2.gz YWPBBSSQMKZMJR-AWEZNQCLSA-N 2 1 317.864 4.232 20 0 DIADMP CC(C)CC1(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC000391855956 335125833 /nfs/dbraw/zinc/12/58/33/335125833.db2.gz LZMPSOKDRNVNFF-UHFFFAOYSA-N 2 1 314.517 4.109 20 0 DIADMP CC(C)c1ccc(C[C@@H]2CC[NH+](CC[C@H]3CCC[N@H+]3C)C2)cc1 ZINC000460986008 333177789 /nfs/dbraw/zinc/17/77/89/333177789.db2.gz YZOBISKPSQUIGN-PZJWPPBQSA-N 2 1 314.517 4.159 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccnc1 ZINC000185634194 333210979 /nfs/dbraw/zinc/21/09/79/333210979.db2.gz YPVCHPCDPPJRFB-FQEVSTJZSA-N 2 1 315.505 4.310 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCc2occc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310166070 333221445 /nfs/dbraw/zinc/22/14/45/333221445.db2.gz SFHCPDBUJUPSHQ-XKGZKEIXSA-N 2 1 324.468 4.157 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000514084972 333235307 /nfs/dbraw/zinc/23/53/07/333235307.db2.gz UXUQGIMESBEWII-UHFFFAOYSA-N 2 1 308.469 4.238 20 0 DIADMP CC(C)[C@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000319030685 333245947 /nfs/dbraw/zinc/24/59/47/333245947.db2.gz IOONCQCIVUQGHQ-NXEWRWPSSA-N 2 1 300.490 4.031 20 0 DIADMP Cc1ccnc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000514085406 333249520 /nfs/dbraw/zinc/24/95/20/333249520.db2.gz VLKHGQLVURSOOR-SFHVURJKSA-N 2 1 323.484 4.227 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000497829236 333297286 /nfs/dbraw/zinc/29/72/86/333297286.db2.gz RBONCHHGSWMTFL-DNVCBOLYSA-N 2 1 314.473 4.451 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594421 333305064 /nfs/dbraw/zinc/30/50/64/333305064.db2.gz HAIOQRIHOJEBKE-RTBURBONSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594421 333305066 /nfs/dbraw/zinc/30/50/66/333305066.db2.gz HAIOQRIHOJEBKE-RTBURBONSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCCCC1 ZINC000390625120 333307895 /nfs/dbraw/zinc/30/78/95/333307895.db2.gz HVSWPVOUQMLILS-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCCCC1 ZINC000390625120 333307896 /nfs/dbraw/zinc/30/78/96/333307896.db2.gz HVSWPVOUQMLILS-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccs1 ZINC000390644871 333310342 /nfs/dbraw/zinc/31/03/42/333310342.db2.gz IDHKWHFBSBCHBW-SFHVURJKSA-N 2 1 314.498 4.138 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccs1 ZINC000390644871 333310343 /nfs/dbraw/zinc/31/03/43/333310343.db2.gz IDHKWHFBSBCHBW-SFHVURJKSA-N 2 1 314.498 4.138 20 0 DIADMP Cc1ccccc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744236 333322830 /nfs/dbraw/zinc/32/28/30/333322830.db2.gz OPZOMDAFODOUSB-AZUAARDMSA-N 2 1 308.469 4.168 20 0 DIADMP CC[NH+]1CCC([N@H+](C)CCCc2cccc3ccccc32)CC1 ZINC000531382158 333347892 /nfs/dbraw/zinc/34/78/92/333347892.db2.gz RMJUJCCMZWELGW-UHFFFAOYSA-N 2 1 310.485 4.189 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)CCCc2cccc3ccccc32)CC1 ZINC000531382158 333347894 /nfs/dbraw/zinc/34/78/94/333347894.db2.gz RMJUJCCMZWELGW-UHFFFAOYSA-N 2 1 310.485 4.189 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)CC1 ZINC000186946926 333382085 /nfs/dbraw/zinc/38/20/85/333382085.db2.gz UOSDNJHINDZQFK-NRFANRHFSA-N 2 1 306.453 4.025 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCC1(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390794907 333393969 /nfs/dbraw/zinc/39/39/69/333393969.db2.gz HRWCHUNBZAMPIY-YTQUADARSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]CCC1CCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390801616 333394371 /nfs/dbraw/zinc/39/43/71/333394371.db2.gz PMCRZYSUKQPQLW-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+]CCC[NH+]3CCCC3)c2)cc1 ZINC000320079886 333423958 /nfs/dbraw/zinc/42/39/58/333423958.db2.gz VUPSTTHWZHPQEI-UHFFFAOYSA-N 2 1 310.441 4.054 20 0 DIADMP C[C@@H](C[NH2+]C1c2ccccc2-c2ccccc21)C[NH+]1CCCC1 ZINC000320786016 335141727 /nfs/dbraw/zinc/14/17/27/335141727.db2.gz WBFWDXOSDYPQJR-INIZCTEOSA-N 2 1 306.453 4.078 20 0 DIADMP CCC(CC)[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1cccs1 ZINC000563355848 333595421 /nfs/dbraw/zinc/59/54/21/333595421.db2.gz WMMXPXWJXURUIB-QGZVFWFLSA-N 2 1 305.491 4.181 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C[C@@H](c2ccccc2)C1 ZINC000392003953 335149931 /nfs/dbraw/zinc/14/99/31/335149931.db2.gz RGMMSTLUDPSMOY-JBINPLMMSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414672787 334065384 /nfs/dbraw/zinc/06/53/84/334065384.db2.gz HXZTXCDPNZJAPI-RDBSUJKOSA-N 2 1 314.395 4.086 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)[C@H]1CCC[NH2+]C1 ZINC000415082618 334272204 /nfs/dbraw/zinc/27/22/04/334272204.db2.gz DFDUIRHMFDEKIB-WOPDTQHZSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000415082245 334273266 /nfs/dbraw/zinc/27/32/66/334273266.db2.gz CWXDBZIYJDLZIK-AWEZNQCLSA-N 2 1 314.404 4.021 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C[C@H]1CC[N@H+](C(C)C)C1 ZINC000582149473 334273732 /nfs/dbraw/zinc/27/37/32/334273732.db2.gz NAVVYHVBBJFKSU-WOJBJXKFSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC000187644200 334266414 /nfs/dbraw/zinc/26/64/14/334266414.db2.gz DWXIGQZEYMVZCM-LOWVWBTDSA-N 2 1 301.261 4.127 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccs1 ZINC000415079914 334269561 /nfs/dbraw/zinc/26/95/61/334269561.db2.gz ITCIJXUWMNIZJG-ULQDDVLXSA-N 2 1 300.471 4.282 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)[C@H]1CCC[NH2+]C1 ZINC000415097307 334280968 /nfs/dbraw/zinc/28/09/68/334280968.db2.gz CRBVSKDEXZRETL-VWYCJHECSA-N 2 1 319.251 4.171 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC000415097812 334281399 /nfs/dbraw/zinc/28/13/99/334281399.db2.gz DNVUOXWTVCEBMD-NRSPTQNISA-N 2 1 306.453 4.147 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117065 334284029 /nfs/dbraw/zinc/28/40/29/334284029.db2.gz FWALRRLGILVVJB-CCKFTAQKSA-N 2 1 314.860 4.484 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC000531957755 334314090 /nfs/dbraw/zinc/31/40/90/334314090.db2.gz FDXDLQVMZOMESF-AZUAARDMSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000303783109 334330600 /nfs/dbraw/zinc/33/06/00/334330600.db2.gz SVEJBGBEKWJULW-WIYYLYMNSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000303783109 334330601 /nfs/dbraw/zinc/33/06/01/334330601.db2.gz SVEJBGBEKWJULW-WIYYLYMNSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783109 334330602 /nfs/dbraw/zinc/33/06/02/334330602.db2.gz SVEJBGBEKWJULW-WIYYLYMNSA-N 2 1 308.469 4.172 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2)CC[NH+]1Cc1ccccc1 ZINC000303783109 334330603 /nfs/dbraw/zinc/33/06/03/334330603.db2.gz SVEJBGBEKWJULW-WIYYLYMNSA-N 2 1 308.469 4.172 20 0 DIADMP CC(C)CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972603 334336634 /nfs/dbraw/zinc/33/66/34/334336634.db2.gz ZSWWJTYCZTZFHX-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP CC(C)CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972605 334336940 /nfs/dbraw/zinc/33/69/40/334336940.db2.gz ZSWWJTYCZTZFHX-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1nccn1CCC[N@H+](C)Cc1ccccc1-c1ccccc1 ZINC000534955041 334352420 /nfs/dbraw/zinc/35/24/20/334352420.db2.gz GNIJXJDPXFWSAA-UHFFFAOYSA-N 2 1 319.452 4.381 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000534955041 334352421 /nfs/dbraw/zinc/35/24/21/334352421.db2.gz GNIJXJDPXFWSAA-UHFFFAOYSA-N 2 1 319.452 4.381 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccccc1-c1ccccc1 ZINC000534955041 334352422 /nfs/dbraw/zinc/35/24/22/334352422.db2.gz GNIJXJDPXFWSAA-UHFFFAOYSA-N 2 1 319.452 4.381 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2csc3ccccc23)CC1 ZINC000535082058 334366265 /nfs/dbraw/zinc/36/62/65/334366265.db2.gz NMYBMVLFCQHDED-UHFFFAOYSA-N 2 1 316.514 4.454 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000112223602 334372596 /nfs/dbraw/zinc/37/25/96/334372596.db2.gz JBPMXFDZOMOIGF-MRXNPFEDSA-N 2 1 314.498 4.372 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000344187406 335228585 /nfs/dbraw/zinc/22/85/85/335228585.db2.gz GTMQYYASRMWETF-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000345286922 335313912 /nfs/dbraw/zinc/31/39/12/335313912.db2.gz FOGGYSSSTMOHHQ-GOSISDBHSA-N 2 1 304.865 4.033 20 0 DIADMP Cc1nccn1CC[N@H+](C)[C@@H](c1ccccc1Cl)C(C)C ZINC000346314602 335399242 /nfs/dbraw/zinc/39/92/42/335399242.db2.gz SBZGJQUHKDMILF-QGZVFWFLSA-N 2 1 305.853 4.174 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](C)[C@@H](c1ccccc1Cl)C(C)C ZINC000346314602 335399243 /nfs/dbraw/zinc/39/92/43/335399243.db2.gz SBZGJQUHKDMILF-QGZVFWFLSA-N 2 1 305.853 4.174 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000346318248 335399556 /nfs/dbraw/zinc/39/95/56/335399556.db2.gz XCWOEQOKIPSQCT-UHFFFAOYSA-N 2 1 305.425 4.009 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000346318248 335399558 /nfs/dbraw/zinc/39/95/58/335399558.db2.gz XCWOEQOKIPSQCT-UHFFFAOYSA-N 2 1 305.425 4.009 20 0 DIADMP CCCC[C@@H](COC)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348033549 335546838 /nfs/dbraw/zinc/54/68/38/335546838.db2.gz ARGLXVYLXCBJHD-YJBOKZPZSA-N 2 1 315.461 4.037 20 0 DIADMP CCC[C@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000520660111 336002891 /nfs/dbraw/zinc/00/28/91/336002891.db2.gz DWNJMAPPUUFXGY-WRURNZQNSA-N 2 1 300.490 4.127 20 0 DIADMP CCC[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000520660111 336002892 /nfs/dbraw/zinc/00/28/92/336002892.db2.gz DWNJMAPPUUFXGY-WRURNZQNSA-N 2 1 300.490 4.127 20 0 DIADMP CCC[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000520660111 336002893 /nfs/dbraw/zinc/00/28/93/336002893.db2.gz DWNJMAPPUUFXGY-WRURNZQNSA-N 2 1 300.490 4.127 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2cc(C)ccc2C)C1 ZINC000324089839 336079727 /nfs/dbraw/zinc/07/97/27/336079727.db2.gz JCNZAESMXZYPIE-UGKGYDQZSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+]([C@@H](C)CCc2ccccc2)CC1 ZINC000352349781 336213549 /nfs/dbraw/zinc/21/35/49/336213549.db2.gz MVHLOGOIFLERSF-SFHVURJKSA-N 2 1 324.468 4.255 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+]([C@H]2CCCc3ccccc32)CC1 ZINC000352364926 336214395 /nfs/dbraw/zinc/21/43/95/336214395.db2.gz KQLQOGWNLPVDHG-FQEVSTJZSA-N 2 1 322.452 4.311 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000352604375 336226494 /nfs/dbraw/zinc/22/64/94/336226494.db2.gz WKSCIXWXOVADOW-UHFFFAOYSA-N 2 1 317.864 4.161 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000532494010 336250865 /nfs/dbraw/zinc/25/08/65/336250865.db2.gz BJPZZFYPQPGSEK-JZXOWHBKSA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000532494010 336250866 /nfs/dbraw/zinc/25/08/66/336250866.db2.gz BJPZZFYPQPGSEK-JZXOWHBKSA-N 2 1 306.519 4.128 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](CC)c2ccccc2OC)CC1 ZINC000193023337 336287177 /nfs/dbraw/zinc/28/71/77/336287177.db2.gz ZRRCHNGXUHMSHV-SFHVURJKSA-N 2 1 304.478 4.000 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN(c2ccnc3ccc(Cl)cc32)C1 ZINC000301456865 336307983 /nfs/dbraw/zinc/30/79/83/336307983.db2.gz HUHYHEQRGXHUAQ-CQSZACIVSA-N 2 1 317.864 4.056 20 0 DIADMP CCC[N@H+](C)C[C@H]1CCN(c2cc[nH+]c3ccc(Cl)cc32)C1 ZINC000301456865 336307984 /nfs/dbraw/zinc/30/79/84/336307984.db2.gz HUHYHEQRGXHUAQ-CQSZACIVSA-N 2 1 317.864 4.056 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN(c2cc[nH+]c3ccc(Cl)cc32)C1 ZINC000301456865 336307985 /nfs/dbraw/zinc/30/79/85/336307985.db2.gz HUHYHEQRGXHUAQ-CQSZACIVSA-N 2 1 317.864 4.056 20 0 DIADMP CC[NH+](CC)Cc1ccc(CNc2cc[nH+]cc2Cl)cc1 ZINC000301600728 336317652 /nfs/dbraw/zinc/31/76/52/336317652.db2.gz VBXLVSQLPCUZBO-UHFFFAOYSA-N 2 1 303.837 4.189 20 0 DIADMP CC[NH+]1CCC(Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC1 ZINC000301764863 336328421 /nfs/dbraw/zinc/32/84/21/336328421.db2.gz CRWWLDSHCNAREH-UHFFFAOYSA-N 2 1 323.362 4.150 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000514100252 336332149 /nfs/dbraw/zinc/33/21/49/336332149.db2.gz URYANVYHCKICLF-PWIZWCRZSA-N 2 1 300.490 4.163 20 0 DIADMP CC[N@@H+](C)Cc1cccc(CNc2cc(C(F)(F)F)ccn2)c1 ZINC000301977146 336340972 /nfs/dbraw/zinc/34/09/72/336340972.db2.gz FLKXPWOCANUMJS-UHFFFAOYSA-N 2 1 323.362 4.164 20 0 DIADMP CCCc1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c2ccccc2[nH+]1 ZINC000301989627 336341725 /nfs/dbraw/zinc/34/17/25/336341725.db2.gz OORZNDYAOGZRBM-HNNXBMFYSA-N 2 1 320.440 4.294 20 0 DIADMP Fc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000563957684 336388329 /nfs/dbraw/zinc/38/83/29/336388329.db2.gz QTFFAIGAJRYKEW-FQEVSTJZSA-N 2 1 324.443 4.113 20 0 DIADMP Fc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000563957684 336388330 /nfs/dbraw/zinc/38/83/30/336388330.db2.gz QTFFAIGAJRYKEW-FQEVSTJZSA-N 2 1 324.443 4.113 20 0 DIADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1cccc(Cl)c1Cl ZINC000565159208 336400731 /nfs/dbraw/zinc/40/07/31/336400731.db2.gz WNAYGJSWALCAII-LLVKDONJSA-N 2 1 312.244 4.010 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1C[C@@H](C)Sc2sccc21 ZINC000358088211 336611039 /nfs/dbraw/zinc/61/10/39/336611039.db2.gz AFPJBXIFWIDWNI-LALPHHSUSA-N 2 1 321.515 4.104 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCCc4occc43)CC2)C1 ZINC000359113968 336658520 /nfs/dbraw/zinc/65/85/20/336658520.db2.gz JLBVPNJZZVAYLO-SUMDDJOVSA-N 2 1 316.489 4.290 20 0 DIADMP CC[C@@H]([NH2+]CCn1cc[nH+]c1C)c1ccc2cc(OC)ccc2c1 ZINC000360942748 336728600 /nfs/dbraw/zinc/72/86/00/336728600.db2.gz QHXPKQCMDHXQHT-HXUWFJFHSA-N 2 1 323.440 4.094 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000361973928 336780668 /nfs/dbraw/zinc/78/06/68/336780668.db2.gz ZOTMTXKJWDBXEG-IIAWOOMASA-N 2 1 324.921 4.339 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@]2(C)CCCS2)cc1 ZINC000120450137 336912206 /nfs/dbraw/zinc/91/22/06/336912206.db2.gz ISHDICGGZZIICJ-KBXCAEBGSA-N 2 1 315.486 4.117 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccccc2)cc1F ZINC000173350746 337134803 /nfs/dbraw/zinc/13/48/03/337134803.db2.gz QVAQYLVXKFSUGV-CQSZACIVSA-N 2 1 309.388 4.171 20 0 DIADMP CC[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000183190172 337190260 /nfs/dbraw/zinc/19/02/60/337190260.db2.gz RWEBBSUFGBSQKJ-YVWKXTFCSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000183190914 337190308 /nfs/dbraw/zinc/19/03/08/337190308.db2.gz LIQDORYVKOIOSF-DVOMOZLQSA-N 2 1 321.534 4.064 20 0 DIADMP Cc1cncc([C@H](C)[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1 ZINC000184359374 337198030 /nfs/dbraw/zinc/19/80/30/337198030.db2.gz BOJKLUJXMUCKAI-ROUUACIJSA-N 2 1 323.484 4.266 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCC1CCCC1 ZINC000398181622 337309120 /nfs/dbraw/zinc/30/91/20/337309120.db2.gz XDCNRFRWVDBHIW-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCC1CCCC1 ZINC000398181622 337309121 /nfs/dbraw/zinc/30/91/21/337309121.db2.gz XDCNRFRWVDBHIW-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCC1CCCC1 ZINC000398181625 337309157 /nfs/dbraw/zinc/30/91/57/337309157.db2.gz XDCNRFRWVDBHIW-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCC1CCCC1 ZINC000398181625 337309158 /nfs/dbraw/zinc/30/91/58/337309158.db2.gz XDCNRFRWVDBHIW-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP FC1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000583812101 337336543 /nfs/dbraw/zinc/33/65/43/337336543.db2.gz QXUVUKMFMJZABB-SFHVURJKSA-N 2 1 316.464 4.056 20 0 DIADMP FC1(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000583812101 337336544 /nfs/dbraw/zinc/33/65/44/337336544.db2.gz QXUVUKMFMJZABB-SFHVURJKSA-N 2 1 316.464 4.056 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000131188431 337436677 /nfs/dbraw/zinc/43/66/77/337436677.db2.gz SBKLYVDYMCWPPU-BBRMVZONSA-N 2 1 324.559 4.384 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC000422792530 337686948 /nfs/dbraw/zinc/68/69/48/337686948.db2.gz ZKJMTLRSMFNPSW-WMQCIHAUSA-N 2 1 308.469 4.447 20 0 DIADMP c1ccc(Sc2ccccc2C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422892664 337690351 /nfs/dbraw/zinc/69/03/51/337690351.db2.gz ZBDNIHJMPAFQSK-JWTNVVGKSA-N 2 1 324.493 4.210 20 0 DIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](c1cc2ccccc2o1)c1ccccc1 ZINC000422930438 337692089 /nfs/dbraw/zinc/69/20/89/337692089.db2.gz UKFUPWPZQPZJDH-BXTJHSDWSA-N 2 1 308.425 4.238 20 0 DIADMP c1ccc([C@H]([NH2+]C2CC[NH2+]CC2)c2cccc3ccccc32)cc1 ZINC000422901089 337693303 /nfs/dbraw/zinc/69/33/03/337693303.db2.gz BJNOWVUBDSUART-QFIPXVFZSA-N 2 1 316.448 4.271 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC000422968490 337695217 /nfs/dbraw/zinc/69/52/17/337695217.db2.gz RGHYHOIBAWXKFW-FNAHDJPLSA-N 2 1 320.480 4.406 20 0 DIADMP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423053936 337697317 /nfs/dbraw/zinc/69/73/17/337697317.db2.gz BGZJOKQDRLMADD-IRXDYDNUSA-N 2 1 320.358 4.248 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423063006 337697868 /nfs/dbraw/zinc/69/78/68/337697868.db2.gz OEDHYEXLQJJXTH-BBWFWOEESA-N 2 1 320.358 4.067 20 0 DIADMP C[C@@]1(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000423140197 337701381 /nfs/dbraw/zinc/70/13/81/337701381.db2.gz XRYUZMKDVISRDR-KJJMTIBFSA-N 2 1 320.480 4.263 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C3CCc4ccccc4CC3)CC[NH2+]2)cc1 ZINC000423155463 337702048 /nfs/dbraw/zinc/70/20/48/337702048.db2.gz LDTBQJDAZZYCKQ-VXKWHMMOSA-N 2 1 320.480 4.017 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423189318 337703009 /nfs/dbraw/zinc/70/30/09/337703009.db2.gz PCPGPOVHOBMVAT-KRWDZBQOSA-N 2 1 311.473 4.036 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000423329556 337712283 /nfs/dbraw/zinc/71/22/83/337712283.db2.gz MVQRAPAMOVSRBW-NHYWBVRUSA-N 2 1 301.261 4.034 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119684086 337864326 /nfs/dbraw/zinc/86/43/26/337864326.db2.gz XNYSQTCZFNYPER-GOSISDBHSA-N 2 1 300.490 4.004 20 0 DIADMP CC[C@H](C)[C@@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000537113195 337890974 /nfs/dbraw/zinc/89/09/74/337890974.db2.gz BQRDUVCDXUGHNQ-SUMWQHHRSA-N 2 1 305.853 4.222 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000315017360 337979223 /nfs/dbraw/zinc/97/92/23/337979223.db2.gz KTMRRMOTEISDTA-UONOGXRCSA-N 2 1 323.550 4.132 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@H](C)C1 ZINC000426290780 338024776 /nfs/dbraw/zinc/02/47/76/338024776.db2.gz KJLOYXVEPBDNDQ-KWCYVHTRSA-N 2 1 312.910 4.099 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@H](C)C1 ZINC000426290780 338024777 /nfs/dbraw/zinc/02/47/77/338024777.db2.gz KJLOYXVEPBDNDQ-KWCYVHTRSA-N 2 1 312.910 4.099 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@@H]2CCC[C@@H]21 ZINC000426312703 338026351 /nfs/dbraw/zinc/02/63/51/338026351.db2.gz KFXAGATVGZTMNN-ATGSNQNLSA-N 2 1 324.921 4.241 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCCc1cccc(C)c1 ZINC000429260437 338075262 /nfs/dbraw/zinc/07/52/62/338075262.db2.gz MYQIEZHLAAUMEN-UHFFFAOYSA-N 2 1 313.489 4.099 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCCc1cccc(C)c1 ZINC000429260437 338075263 /nfs/dbraw/zinc/07/52/63/338075263.db2.gz MYQIEZHLAAUMEN-UHFFFAOYSA-N 2 1 313.489 4.099 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000429555188 338083900 /nfs/dbraw/zinc/08/39/00/338083900.db2.gz VQTMCXWNBDEQGQ-NRFANRHFSA-N 2 1 308.469 4.270 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000431332102 338128221 /nfs/dbraw/zinc/12/82/21/338128221.db2.gz IWEKAGSNLZHFSO-BXWFABGCSA-N 2 1 316.489 4.096 20 0 DIADMP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000431332102 338128222 /nfs/dbraw/zinc/12/82/22/338128222.db2.gz IWEKAGSNLZHFSO-BXWFABGCSA-N 2 1 316.489 4.096 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1csc(Cl)c1Cl ZINC000432243192 338150216 /nfs/dbraw/zinc/15/02/16/338150216.db2.gz SVOUFXXUTLABIJ-UHFFFAOYSA-N 2 1 318.273 4.130 20 0 DIADMP CCCC[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccccc1 ZINC000432441061 338156522 /nfs/dbraw/zinc/15/65/22/338156522.db2.gz JJMAJOSMEQCGLJ-QUCCMNQESA-N 2 1 318.505 4.008 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)CCC2)cc1C ZINC000433084990 338180905 /nfs/dbraw/zinc/18/09/05/338180905.db2.gz UXYJDIDONAHFAN-CMKODMSKSA-N 2 1 314.517 4.043 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC(C)(C)C1 ZINC000433262135 338188635 /nfs/dbraw/zinc/18/86/35/338188635.db2.gz PGFXCYCBXQHYPH-UHFFFAOYSA-N 2 1 312.457 4.190 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]C2CC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000433300956 338190304 /nfs/dbraw/zinc/19/03/04/338190304.db2.gz UPEYWXXCCYHGAI-WMZOPIPTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]C2CC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000433300954 338190385 /nfs/dbraw/zinc/19/03/85/338190385.db2.gz UPEYWXXCCYHGAI-SJLPKXTDSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434611997 338221159 /nfs/dbraw/zinc/22/11/59/338221159.db2.gz MYTFZCIFAQBMAX-IBGZPJMESA-N 2 1 317.452 4.440 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434611997 338221160 /nfs/dbraw/zinc/22/11/60/338221160.db2.gz MYTFZCIFAQBMAX-IBGZPJMESA-N 2 1 317.452 4.440 20 0 DIADMP Cc1ccccc1[C@H](C)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434672944 338222984 /nfs/dbraw/zinc/22/29/84/338222984.db2.gz OLEGNPWSCRKHLA-KRWDZBQOSA-N 2 1 323.484 4.468 20 0 DIADMP Cc1cccc([C@H](C)[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434686810 338223480 /nfs/dbraw/zinc/22/34/80/338223480.db2.gz VLJFSWFGOHJDFD-KRWDZBQOSA-N 2 1 323.484 4.468 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436295607 338267018 /nfs/dbraw/zinc/26/70/18/338267018.db2.gz PUXWIQRLMHLMDI-HOCLYGCPSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CCC[C@H](N3CCCC3)C2)C1 ZINC000437583448 338314721 /nfs/dbraw/zinc/31/47/21/338314721.db2.gz SRPOGRXBZSZGOF-ACRUOGEOSA-N 2 1 312.501 4.057 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@H](N2CCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000437583448 338314722 /nfs/dbraw/zinc/31/47/22/338314722.db2.gz SRPOGRXBZSZGOF-ACRUOGEOSA-N 2 1 312.501 4.057 20 0 DIADMP C[NH+](C)[C@H](C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)C1CCCCC1 ZINC000438075899 338330078 /nfs/dbraw/zinc/33/00/78/338330078.db2.gz CACZIVZYACGPIZ-HRCADAONSA-N 2 1 320.443 4.208 20 0 DIADMP C[NH+](C)[C@H](C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)C1CCCCC1 ZINC000438075897 338330105 /nfs/dbraw/zinc/33/01/05/338330105.db2.gz CACZIVZYACGPIZ-BZUAXINKSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438079958 338330247 /nfs/dbraw/zinc/33/02/47/338330247.db2.gz ZXIBYVAAIRVZRM-QXSJWSMHSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000438089944 338330759 /nfs/dbraw/zinc/33/07/59/338330759.db2.gz XWIJEJLGJKHANH-DLBZAZTESA-N 2 1 306.469 4.001 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000438844989 338353594 /nfs/dbraw/zinc/35/35/94/338353594.db2.gz XJWYMZLSVXVBEU-SLFFLAALSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000438844989 338353595 /nfs/dbraw/zinc/35/35/95/338353595.db2.gz XJWYMZLSVXVBEU-SLFFLAALSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439313831 338366828 /nfs/dbraw/zinc/36/68/28/338366828.db2.gz DXOLNCZBKWKNDC-XLIONFOSSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439313831 338366829 /nfs/dbraw/zinc/36/68/29/338366829.db2.gz DXOLNCZBKWKNDC-XLIONFOSSA-N 2 1 311.473 4.240 20 0 DIADMP C[C@H](Cc1ccoc1)[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000449149485 338597060 /nfs/dbraw/zinc/59/70/60/338597060.db2.gz NUBSPSJIOCKBHH-IAGOWNOFSA-N 2 1 312.457 4.026 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000451353812 338730885 /nfs/dbraw/zinc/73/08/85/338730885.db2.gz LJNRLLAIMJVWMV-QGZVFWFLSA-N 2 1 321.827 4.115 20 0 DIADMP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)C(C)(C)C ZINC000459430395 339028868 /nfs/dbraw/zinc/02/88/68/339028868.db2.gz QMVBUZNRWHNXPA-LJQANCHMSA-N 2 1 300.490 4.299 20 0 DIADMP Clc1cccc([C@H]2CC[C@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)c1 ZINC000459563494 339035945 /nfs/dbraw/zinc/03/59/45/339035945.db2.gz QOOSEDLORGQCBZ-YJBOKZPZSA-N 2 1 318.892 4.193 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000459689521 339043181 /nfs/dbraw/zinc/04/31/81/339043181.db2.gz GLJRKEYLNJWGJI-VQTJNVASSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000459689521 339043182 /nfs/dbraw/zinc/04/31/82/339043182.db2.gz GLJRKEYLNJWGJI-VQTJNVASSA-N 2 1 311.473 4.240 20 0 DIADMP C[C@@H](CCc1ccc(Cl)s1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459723574 339044351 /nfs/dbraw/zinc/04/43/51/339044351.db2.gz AECILRUJFIDFOA-KBPBESRZSA-N 2 1 314.926 4.044 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccccc1C(F)(F)F ZINC000459736633 339045316 /nfs/dbraw/zinc/04/53/16/339045316.db2.gz QCDWSLJCGQSORF-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP CC1CC[NH+](CCCCNc2cc[nH+]c3ccsc32)CC1 ZINC000462780271 339088245 /nfs/dbraw/zinc/08/82/45/339088245.db2.gz QNYSHVHYITVPOQ-UHFFFAOYSA-N 2 1 303.475 4.220 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462837012 339093443 /nfs/dbraw/zinc/09/34/43/339093443.db2.gz VJMHPEDTPCVCBB-ZNWBIBPKSA-N 2 1 300.490 4.018 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462837012 339093444 /nfs/dbraw/zinc/09/34/44/339093444.db2.gz VJMHPEDTPCVCBB-ZNWBIBPKSA-N 2 1 300.490 4.018 20 0 DIADMP C[C@@H](CNc1cc[nH+]c2ccsc21)[N@H+](C)Cc1ccccc1 ZINC000462839592 339093537 /nfs/dbraw/zinc/09/35/37/339093537.db2.gz NOLYUMTVYNVPOM-AWEZNQCLSA-N 2 1 311.454 4.229 20 0 DIADMP C[C@@H](CNc1cc[nH+]c2ccsc21)[N@@H+](C)Cc1ccccc1 ZINC000462839592 339093538 /nfs/dbraw/zinc/09/35/38/339093538.db2.gz NOLYUMTVYNVPOM-AWEZNQCLSA-N 2 1 311.454 4.229 20 0 DIADMP c1cc2[nH+]ccc(NCCCCC[NH+]3CCCCC3)c2s1 ZINC000462837668 339093556 /nfs/dbraw/zinc/09/35/56/339093556.db2.gz HRSQHBGGXWHBET-UHFFFAOYSA-N 2 1 303.475 4.364 20 0 DIADMP C[NH+](C)[C@H](CNc1cc[nH+]c2ccsc21)c1cccc(F)c1 ZINC000462917438 339098003 /nfs/dbraw/zinc/09/80/03/339098003.db2.gz SYVBUIOQZKIZEU-MRXNPFEDSA-N 2 1 315.417 4.150 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463117790 339106386 /nfs/dbraw/zinc/10/63/86/339106386.db2.gz VBIAJRSOUXEDHD-SIKLNZKXSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000463117790 339106387 /nfs/dbraw/zinc/10/63/87/339106387.db2.gz VBIAJRSOUXEDHD-SIKLNZKXSA-N 2 1 322.496 4.180 20 0 DIADMP CC[C@@H](C)C[C@@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463193132 339108719 /nfs/dbraw/zinc/10/87/19/339108719.db2.gz URXPLVMRJJGXPD-IAGOWNOFSA-N 2 1 320.496 4.247 20 0 DIADMP C[NH+](C)C1(C[NH2+]CC2CCC(C(F)(F)F)CC2)CCCCC1 ZINC000466459227 339205845 /nfs/dbraw/zinc/20/58/45/339205845.db2.gz YZVBRWSQCCPJLZ-UHFFFAOYSA-N 2 1 320.443 4.209 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1Cc1cccc2nccn21 ZINC000467550618 339242120 /nfs/dbraw/zinc/24/21/20/339242120.db2.gz LXARIXHXCHMAQJ-WMZOPIPTSA-N 2 1 305.425 4.102 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1ccccc1C(F)(F)F)C(C)C ZINC000467763237 339246146 /nfs/dbraw/zinc/24/61/46/339246146.db2.gz HNKVMGLMJJINKN-UHFFFAOYSA-N 2 1 316.411 4.304 20 0 DIADMP CC(C)Oc1ccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)cc1 ZINC000467766138 339246263 /nfs/dbraw/zinc/24/62/63/339246263.db2.gz BXBCVSLIVVMTGV-UHFFFAOYSA-N 2 1 306.494 4.072 20 0 DIADMP c1ccc(CC[C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000468357029 339260517 /nfs/dbraw/zinc/26/05/17/339260517.db2.gz ODVPOGKOOWAOIX-TUFLPTIASA-N 2 1 312.501 4.004 20 0 DIADMP CCCCOc1ccccc1C[N@H+](C)[C@@H]1CC[NH+](CC)C[C@H]1C ZINC000468392423 339261460 /nfs/dbraw/zinc/26/14/60/339261460.db2.gz LGWMMFDTJFIKTJ-IEBWSBKVSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[N@@H+](C)[C@@H]1CC[NH+](CC)C[C@H]1C ZINC000468392423 339261461 /nfs/dbraw/zinc/26/14/61/339261461.db2.gz LGWMMFDTJFIKTJ-IEBWSBKVSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@@H]1CC[N@H+](CC)C[C@H]1C ZINC000468392423 339261462 /nfs/dbraw/zinc/26/14/62/339261462.db2.gz LGWMMFDTJFIKTJ-IEBWSBKVSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@@H]1CC[N@@H+](CC)C[C@H]1C ZINC000468392423 339261463 /nfs/dbraw/zinc/26/14/63/339261463.db2.gz LGWMMFDTJFIKTJ-IEBWSBKVSA-N 2 1 318.505 4.028 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1csc(Cl)c1 ZINC000468794944 339270994 /nfs/dbraw/zinc/27/09/94/339270994.db2.gz CGDFXDHAMMRIEW-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)C1 ZINC000469126572 339280886 /nfs/dbraw/zinc/28/08/86/339280886.db2.gz XYGXWFNNZFLEFU-YJBOKZPZSA-N 2 1 306.881 4.113 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469741827 339297555 /nfs/dbraw/zinc/29/75/55/339297555.db2.gz MMBDRXCVFJQYKW-DOMZBBRYSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469741827 339297556 /nfs/dbraw/zinc/29/75/56/339297556.db2.gz MMBDRXCVFJQYKW-DOMZBBRYSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000469847655 339302516 /nfs/dbraw/zinc/30/25/16/339302516.db2.gz ZKQDMQOCISUIDP-QWHCGFSZSA-N 2 1 320.889 4.238 20 0 DIADMP C[C@@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000469867348 339303270 /nfs/dbraw/zinc/30/32/70/339303270.db2.gz VIYFXMVVXFPBES-OLZOCXBDSA-N 2 1 320.889 4.238 20 0 DIADMP C[N@@H+](Cc1cc(-c2ccccc2)cs1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000469989036 339307202 /nfs/dbraw/zinc/30/72/02/339307202.db2.gz FEGJEFUOGABAEJ-JWTNVVGKSA-N 2 1 312.482 4.130 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)CC[C@H]1[NH3+] ZINC000469995417 339307609 /nfs/dbraw/zinc/30/76/09/339307609.db2.gz AHQYCJBISQFOBM-BLLLJJGKSA-N 2 1 320.889 4.238 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470956882 339332903 /nfs/dbraw/zinc/33/29/03/339332903.db2.gz FCJMJCJTEAZYIO-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470956882 339332904 /nfs/dbraw/zinc/33/29/04/339332904.db2.gz FCJMJCJTEAZYIO-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470956882 339332905 /nfs/dbraw/zinc/33/29/05/339332905.db2.gz FCJMJCJTEAZYIO-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470956882 339332906 /nfs/dbraw/zinc/33/29/06/339332906.db2.gz FCJMJCJTEAZYIO-HOCLYGCPSA-N 2 1 306.881 4.065 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000472727390 339376550 /nfs/dbraw/zinc/37/65/50/339376550.db2.gz GFGFJFCQMBSSFV-WMZOPIPTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000472727390 339376551 /nfs/dbraw/zinc/37/65/51/339376551.db2.gz GFGFJFCQMBSSFV-WMZOPIPTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000472727390 339376552 /nfs/dbraw/zinc/37/65/52/339376552.db2.gz GFGFJFCQMBSSFV-WMZOPIPTSA-N 2 1 306.881 4.004 20 0 DIADMP CCSc1cccc(C[N@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000473148182 339382798 /nfs/dbraw/zinc/38/27/98/339382798.db2.gz QSJFIPRBGBOPKV-DOTOQJQBSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000473148182 339382799 /nfs/dbraw/zinc/38/27/99/339382799.db2.gz QSJFIPRBGBOPKV-DOTOQJQBSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)c1 ZINC000473148182 339382800 /nfs/dbraw/zinc/38/28/00/339382800.db2.gz QSJFIPRBGBOPKV-DOTOQJQBSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)c1 ZINC000473148182 339382801 /nfs/dbraw/zinc/38/28/01/339382801.db2.gz QSJFIPRBGBOPKV-DOTOQJQBSA-N 2 1 306.519 4.103 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)C1CCC(F)(F)CC1 ZINC000474037902 339398197 /nfs/dbraw/zinc/39/81/97/339398197.db2.gz BLCFAVLEYYDTSP-INIZCTEOSA-N 2 1 324.459 4.312 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC12CCCC2 ZINC000474040103 339398403 /nfs/dbraw/zinc/39/84/03/339398403.db2.gz UIYJKHLZWWAVFI-LJQANCHMSA-N 2 1 300.490 4.339 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1CC[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000474055433 339399727 /nfs/dbraw/zinc/39/97/27/339399727.db2.gz LBGUGXCGNIFNBC-GDBMZVCRSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1CC[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000474055433 339399728 /nfs/dbraw/zinc/39/97/28/339399728.db2.gz LBGUGXCGNIFNBC-GDBMZVCRSA-N 2 1 302.453 4.055 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCC[C@@H](C(C)C)C3)CC2)[nH+]1 ZINC000474725303 339424127 /nfs/dbraw/zinc/42/41/27/339424127.db2.gz LYTYCJIRXITKJC-IEBWSBKVSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000474727664 339424347 /nfs/dbraw/zinc/42/43/47/339424347.db2.gz KXLHGGYODOVFCS-IRXDYDNUSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)C(C)C ZINC000483867975 339677334 /nfs/dbraw/zinc/67/73/34/339677334.db2.gz FWIYWROAJBOQOE-ZDUSSCGKSA-N 2 1 316.411 4.263 20 0 DIADMP CCC[C@@H](C)[C@@H](CC)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000484147371 339682019 /nfs/dbraw/zinc/68/20/19/339682019.db2.gz RXLMHDWNBOAJNQ-SJLPKXTDSA-N 2 1 303.494 4.163 20 0 DIADMP CCC(CC)([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000499052673 340028653 /nfs/dbraw/zinc/02/86/53/340028653.db2.gz JUFSYLUNHSJCHV-UHFFFAOYSA-N 2 1 305.853 4.150 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC2(C4CC4)CCC2)C3)cc1 ZINC000499165044 340031481 /nfs/dbraw/zinc/03/14/81/340031481.db2.gz ADTFLRQKODWUJS-WKCHPHFGSA-N 2 1 324.512 4.352 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000501070218 340073657 /nfs/dbraw/zinc/07/36/57/340073657.db2.gz RVKYQULOZSWWFL-UHFFFAOYSA-N 2 1 323.484 4.047 20 0 DIADMP CCC(C)(C)CC[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501076944 340073907 /nfs/dbraw/zinc/07/39/07/340073907.db2.gz HQAXTPXSNFRALC-UHFFFAOYSA-N 2 1 303.494 4.056 20 0 DIADMP C[C@]12C[C@H]1CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000502257898 340098037 /nfs/dbraw/zinc/09/80/37/340098037.db2.gz TUCUPTNXVPAZAQ-FKSWHDMKSA-N 2 1 324.512 4.350 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)oc1C ZINC000502458312 340104533 /nfs/dbraw/zinc/10/45/33/340104533.db2.gz CLXYJJRXZCEOBP-QFBILLFUSA-N 2 1 312.457 4.069 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)oc1C ZINC000502458312 340104534 /nfs/dbraw/zinc/10/45/34/340104534.db2.gz CLXYJJRXZCEOBP-QFBILLFUSA-N 2 1 312.457 4.069 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CC[C@H]1CCC[NH+]1C ZINC000502691102 340110795 /nfs/dbraw/zinc/11/07/95/340110795.db2.gz GHJLAHBZFWINEM-CZUORRHYSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@H]1CCC[NH+]1C ZINC000502691102 340110796 /nfs/dbraw/zinc/11/07/96/340110796.db2.gz GHJLAHBZFWINEM-CZUORRHYSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@H]1CCC[N@@H+]1C ZINC000502691102 340110797 /nfs/dbraw/zinc/11/07/97/340110797.db2.gz GHJLAHBZFWINEM-CZUORRHYSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[NH+](C)CC[C@H]1CCC[N@H+]1C ZINC000502691102 340110798 /nfs/dbraw/zinc/11/07/98/340110798.db2.gz GHJLAHBZFWINEM-CZUORRHYSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H]1CC[N@H+](Cc2ccc(Cl)c(Cl)c2)C[C@@H]1n1ccnc1 ZINC000503063487 340119961 /nfs/dbraw/zinc/11/99/61/340119961.db2.gz MVUHJHPGPQHIGX-LRDDRELGSA-N 2 1 324.255 4.273 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C[C@@H]1n1ccnc1 ZINC000503063487 340119962 /nfs/dbraw/zinc/11/99/62/340119962.db2.gz MVUHJHPGPQHIGX-LRDDRELGSA-N 2 1 324.255 4.273 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccccc1)C1CCCC1 ZINC000503075108 340120263 /nfs/dbraw/zinc/12/02/63/340120263.db2.gz NKUXQVTZEUPLSL-FQEVSTJZSA-N 2 1 311.473 4.493 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@H+](CC)CCCCn1cc[nH+]c1C ZINC000503075549 340120287 /nfs/dbraw/zinc/12/02/87/340120287.db2.gz NFYDUYZZSZWMGI-HXUWFJFHSA-N 2 1 313.489 4.315 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](CC)CCCCn1cc[nH+]c1C ZINC000503075549 340120288 /nfs/dbraw/zinc/12/02/88/340120288.db2.gz NFYDUYZZSZWMGI-HXUWFJFHSA-N 2 1 313.489 4.315 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CCCc1cccc2ccccc21 ZINC000503077443 340120418 /nfs/dbraw/zinc/12/04/18/340120418.db2.gz YMIWNBOAXAZBOP-UHFFFAOYSA-N 2 1 321.468 4.299 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)CCCc1cccc2ccccc21 ZINC000503077443 340120419 /nfs/dbraw/zinc/12/04/19/340120419.db2.gz YMIWNBOAXAZBOP-UHFFFAOYSA-N 2 1 321.468 4.299 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C/C=C\c2ccccc2)C1 ZINC000506564012 340196768 /nfs/dbraw/zinc/19/67/68/340196768.db2.gz GXOPLCMQMYJURM-FEVYJVEVSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C/C=C\c2ccccc2)C1 ZINC000506564012 340196769 /nfs/dbraw/zinc/19/67/69/340196769.db2.gz GXOPLCMQMYJURM-FEVYJVEVSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C/C=C\c2ccccc2)C1 ZINC000506564012 340196770 /nfs/dbraw/zinc/19/67/70/340196770.db2.gz GXOPLCMQMYJURM-FEVYJVEVSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1 ZINC000506564012 340196771 /nfs/dbraw/zinc/19/67/71/340196771.db2.gz GXOPLCMQMYJURM-FEVYJVEVSA-N 2 1 312.501 4.286 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000506862367 340202921 /nfs/dbraw/zinc/20/29/21/340202921.db2.gz PPLXTMISXUMSHD-LEWJYISDSA-N 2 1 314.517 4.234 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000506862368 340202991 /nfs/dbraw/zinc/20/29/91/340202991.db2.gz PPLXTMISXUMSHD-NHCUHLMSSA-N 2 1 314.517 4.234 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000507834631 340233551 /nfs/dbraw/zinc/23/35/51/340233551.db2.gz VBUGLMGXTGMPLV-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000507834631 340233552 /nfs/dbraw/zinc/23/35/52/340233552.db2.gz VBUGLMGXTGMPLV-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000507834631 340233553 /nfs/dbraw/zinc/23/35/53/340233553.db2.gz VBUGLMGXTGMPLV-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000507834631 340233554 /nfs/dbraw/zinc/23/35/54/340233554.db2.gz VBUGLMGXTGMPLV-NVXWUHKLSA-N 2 1 306.519 4.143 20 0 DIADMP CCCC1(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000508694118 340250903 /nfs/dbraw/zinc/25/09/03/340250903.db2.gz FCKWORVDOXGGSE-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000302988953 340292553 /nfs/dbraw/zinc/29/25/53/340292553.db2.gz FNFGXFQHOUTYMJ-RTBURBONSA-N 2 1 300.490 4.192 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000303161454 340307604 /nfs/dbraw/zinc/30/76/04/340307604.db2.gz HDBIHFYEIDZCAE-OALUTQOASA-N 2 1 300.490 4.336 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303161458 340307623 /nfs/dbraw/zinc/30/76/23/340307623.db2.gz HDBIHFYEIDZCAE-RTBURBONSA-N 2 1 300.490 4.336 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000510737013 340308855 /nfs/dbraw/zinc/30/88/55/340308855.db2.gz QYIFPUXPBQJAHX-VQTJNVASSA-N 2 1 300.490 4.195 20 0 DIADMP CC(C)[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000303219324 340313402 /nfs/dbraw/zinc/31/34/02/340313402.db2.gz ADRBJOWIZUTCFD-PZJWPPBQSA-N 2 1 314.517 4.455 20 0 DIADMP CC(C)[C@H]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000303219323 340313458 /nfs/dbraw/zinc/31/34/58/340313458.db2.gz ADRBJOWIZUTCFD-FPOVZHCZSA-N 2 1 314.517 4.455 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(C)cc1)C1CCCC1 ZINC000510929665 340315229 /nfs/dbraw/zinc/31/52/29/340315229.db2.gz DWDPOVCEVMNOSJ-FQEVSTJZSA-N 2 1 311.473 4.411 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000510958501 340316170 /nfs/dbraw/zinc/31/61/70/340316170.db2.gz LUOSNUUFMULHIR-KGLIPLIRSA-N 2 1 305.853 4.017 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000510962486 340316462 /nfs/dbraw/zinc/31/64/62/340316462.db2.gz QZTNEBDLCSKAJO-KRWDZBQOSA-N 2 1 305.853 4.222 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000510962028 340316468 /nfs/dbraw/zinc/31/64/68/340316468.db2.gz YJZYVFPBBYJBGQ-RTBURBONSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000510962028 340316469 /nfs/dbraw/zinc/31/64/69/340316469.db2.gz YJZYVFPBBYJBGQ-RTBURBONSA-N 2 1 312.501 4.209 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111618 340321118 /nfs/dbraw/zinc/32/11/18/340321118.db2.gz QGESKGYXPUCQGE-GOSISDBHSA-N 2 1 320.546 4.351 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111618 340321119 /nfs/dbraw/zinc/32/11/19/340321119.db2.gz QGESKGYXPUCQGE-GOSISDBHSA-N 2 1 320.546 4.351 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111618 340321120 /nfs/dbraw/zinc/32/11/20/340321120.db2.gz QGESKGYXPUCQGE-GOSISDBHSA-N 2 1 320.546 4.351 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111618 340321121 /nfs/dbraw/zinc/32/11/21/340321121.db2.gz QGESKGYXPUCQGE-GOSISDBHSA-N 2 1 320.546 4.351 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000511149263 340322403 /nfs/dbraw/zinc/32/24/03/340322403.db2.gz FQNSVWKAHGALOL-WBVHZDCISA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000511149263 340322404 /nfs/dbraw/zinc/32/24/04/340322404.db2.gz FQNSVWKAHGALOL-WBVHZDCISA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000511149263 340322405 /nfs/dbraw/zinc/32/24/05/340322405.db2.gz FQNSVWKAHGALOL-WBVHZDCISA-N 2 1 306.519 4.102 20 0 DIADMP Cc1ccccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000303517668 340329691 /nfs/dbraw/zinc/32/96/91/340329691.db2.gz CHIUWIDINQHZHU-RBUKOAKNSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000303517668 340329692 /nfs/dbraw/zinc/32/96/92/340329692.db2.gz CHIUWIDINQHZHU-RBUKOAKNSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000303517668 340329693 /nfs/dbraw/zinc/32/96/93/340329693.db2.gz CHIUWIDINQHZHU-RBUKOAKNSA-N 2 1 300.490 4.081 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C/C=C/c2ccccc2)C1 ZINC000303528992 340330557 /nfs/dbraw/zinc/33/05/57/340330557.db2.gz GXOPLCMQMYJURM-VHQYGCCJSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C/C=C/c2ccccc2)C1 ZINC000303528992 340330558 /nfs/dbraw/zinc/33/05/58/340330558.db2.gz GXOPLCMQMYJURM-VHQYGCCJSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C/C=C/c2ccccc2)C1 ZINC000303528992 340330559 /nfs/dbraw/zinc/33/05/59/340330559.db2.gz GXOPLCMQMYJURM-VHQYGCCJSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C/C=C/c2ccccc2)C1 ZINC000303528992 340330560 /nfs/dbraw/zinc/33/05/60/340330560.db2.gz GXOPLCMQMYJURM-VHQYGCCJSA-N 2 1 312.501 4.286 20 0 DIADMP c1ccc2cc(CC[NH+]3CCC([NH+]4CCCCC4)CC3)ccc2c1 ZINC000511598401 340331908 /nfs/dbraw/zinc/33/19/08/340331908.db2.gz PSZDSLOARMPWEU-UHFFFAOYSA-N 2 1 322.496 4.333 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C/C=C/c2ccc(F)c(F)c2)C1 ZINC000512145341 340349934 /nfs/dbraw/zinc/34/99/34/340349934.db2.gz MZZRPPTZFYFZEV-RRGWEWPQSA-N 2 1 322.443 4.080 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cc(F)ccc2F)C1 ZINC000512196198 340351836 /nfs/dbraw/zinc/35/18/36/340351836.db2.gz NMQNKPOMYSLSOV-HOTGVXAUSA-N 2 1 322.443 4.051 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512316492 340356566 /nfs/dbraw/zinc/35/65/66/340356566.db2.gz ZKKPTLDHDPZVAK-WWMYMODYSA-N 2 1 312.501 4.225 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C3CCC3)C1)CC2 ZINC000512317531 340356815 /nfs/dbraw/zinc/35/68/15/340356815.db2.gz CPZPGAMVEBNJFP-PLMTUMEDSA-N 2 1 312.501 4.225 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C3CCC3)C1)CC2 ZINC000512317529 340356825 /nfs/dbraw/zinc/35/68/25/340356825.db2.gz CPZPGAMVEBNJFP-DJPFJPOOSA-N 2 1 312.501 4.225 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512377706 340359312 /nfs/dbraw/zinc/35/93/12/340359312.db2.gz JXORJGPUKFKCJN-ZBFHGGJFSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512396212 340360502 /nfs/dbraw/zinc/36/05/02/340360502.db2.gz JUDRVGUNMAKQLP-HOCLYGCPSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512396212 340360503 /nfs/dbraw/zinc/36/05/03/340360503.db2.gz JUDRVGUNMAKQLP-HOCLYGCPSA-N 2 1 306.881 4.083 20 0 DIADMP CCCOc1cccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC000512830287 340379761 /nfs/dbraw/zinc/37/97/61/340379761.db2.gz XPYVGYUCJBCBJE-GOSISDBHSA-N 2 1 318.505 4.077 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccccc1 ZINC000174158366 340383210 /nfs/dbraw/zinc/38/32/10/340383210.db2.gz AREWONJBHYDDJX-IEZWGBDMSA-N 2 1 314.498 4.482 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccccc1 ZINC000174158366 340383211 /nfs/dbraw/zinc/38/32/11/340383211.db2.gz AREWONJBHYDDJX-IEZWGBDMSA-N 2 1 314.498 4.482 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2ccc(Cl)cc2)C1 ZINC000513003893 340387816 /nfs/dbraw/zinc/38/78/16/340387816.db2.gz LLVOUCVJOJJARX-GSPCDJLXSA-N 2 1 306.881 4.065 20 0 DIADMP CSc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000513077635 340392353 /nfs/dbraw/zinc/39/23/53/340392353.db2.gz RLYAESVYURKBDD-UHFFFAOYSA-N 2 1 318.530 4.295 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@H](C)C[NH+]3CCCC3)o2)cc1 ZINC000513092760 340392934 /nfs/dbraw/zinc/39/29/34/340392934.db2.gz RDHKJFFRLSBFKV-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP CCCCC/C(=C\c1ccccc1)C[NH2+]CCn1cc[nH+]c1C ZINC000517546198 340471712 /nfs/dbraw/zinc/47/17/12/340471712.db2.gz WQQDJZIWNZYSDC-CAPFRKAQSA-N 2 1 311.473 4.445 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)[NH+](C)C ZINC000222422574 340536414 /nfs/dbraw/zinc/53/64/14/340536414.db2.gz LPUORHMELGBLAM-KFWWJZLASA-N 2 1 308.432 4.064 20 0 DIADMP CC(C)C[NH+]1CCC(Nc2cc[nH+]c3ccc(Cl)cc23)CC1 ZINC000303575966 340637995 /nfs/dbraw/zinc/63/79/95/340637995.db2.gz NRXCCVNTGYPUPL-UHFFFAOYSA-N 2 1 317.864 4.421 20 0 DIADMP CC1(C)CC([NH2+]Cc2ccc(-c3ccccc3)o2)CC(C)(C)[NH2+]1 ZINC000236739200 340664408 /nfs/dbraw/zinc/66/44/08/340664408.db2.gz RNBPYPHVOLZZRC-UHFFFAOYSA-N 2 1 312.457 4.345 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@@H](C)c2ccccc2)CC1 ZINC000237515861 340671716 /nfs/dbraw/zinc/67/17/16/340671716.db2.gz GFKDJONOLMTRER-LJQANCHMSA-N 2 1 322.496 4.353 20 0 DIADMP C[C@H](C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1 ZINC000237515210 340671755 /nfs/dbraw/zinc/67/17/55/340671755.db2.gz VJJWCPUEAJAQPU-LJQANCHMSA-N 2 1 322.496 4.087 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000127415692 340850704 /nfs/dbraw/zinc/85/07/04/340850704.db2.gz COOMAZXFKAYURM-NRFANRHFSA-N 2 1 319.452 4.269 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1oc2ccccc2c1C)C(C)C ZINC000539260138 340878751 /nfs/dbraw/zinc/87/87/51/340878751.db2.gz MJTKKPWHMVZJHF-SFHVURJKSA-N 2 1 311.429 4.233 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](CC(C)C)c1cccs1 ZINC000540167824 340919880 /nfs/dbraw/zinc/91/98/80/340919880.db2.gz XJXZXEFFBHSEFF-GDBMZVCRSA-N 2 1 305.491 4.266 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000542264900 341002590 /nfs/dbraw/zinc/00/25/90/341002590.db2.gz ATMKOAPBPRWZND-QGZVFWFLSA-N 2 1 308.469 4.461 20 0 DIADMP CCc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)o1 ZINC000130201310 341006291 /nfs/dbraw/zinc/00/62/91/341006291.db2.gz KLZZXRVNILLQPX-UHFFFAOYSA-N 2 1 312.457 4.118 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000542534202 341012568 /nfs/dbraw/zinc/01/25/68/341012568.db2.gz YOMUSFQZDJDBTA-ZWKOTPCHSA-N 2 1 300.490 4.046 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)c1ccc(Cl)s1)[NH+]1CCCCC1 ZINC000543417416 341043501 /nfs/dbraw/zinc/04/35/01/341043501.db2.gz KMSLGQFTJRSLAJ-CHWSQXEVSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)CC[N@@H+]1C ZINC000543591388 341049671 /nfs/dbraw/zinc/04/96/71/341049671.db2.gz HLDOSFPUJPCMIW-GZOSKZMVSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)CC[N@H+]1C ZINC000543591388 341049672 /nfs/dbraw/zinc/04/96/72/341049672.db2.gz HLDOSFPUJPCMIW-GZOSKZMVSA-N 2 1 306.881 4.048 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)s2)C1 ZINC000543600116 341050619 /nfs/dbraw/zinc/05/06/19/341050619.db2.gz BKPQJXRMJQJSMD-HZPDHXFCSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccccc2)s1 ZINC000543626606 341051713 /nfs/dbraw/zinc/05/17/13/341051713.db2.gz FSCMXIWSQAQRIB-OAHLLOKOSA-N 2 1 312.482 4.328 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000131173951 341063692 /nfs/dbraw/zinc/06/36/92/341063692.db2.gz OCCUKQZSTPHAQG-AWEZNQCLSA-N 2 1 323.550 4.346 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)Cc2ccsc2)CC1 ZINC000543988596 341065255 /nfs/dbraw/zinc/06/52/55/341065255.db2.gz DCVIUBVYWSCZDW-MRXNPFEDSA-N 2 1 308.535 4.123 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CCC(F)(F)F)c1 ZINC000544372220 341078834 /nfs/dbraw/zinc/07/88/34/341078834.db2.gz ZORFNIIBWXKPKU-CQSZACIVSA-N 2 1 316.411 4.347 20 0 DIADMP Cc1ccc(CCC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000544423940 341081619 /nfs/dbraw/zinc/08/16/19/341081619.db2.gz IMTPTRXIUBIGIT-AZUAARDMSA-N 2 1 314.517 4.170 20 0 DIADMP Cc1ccc(CCC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000544423947 341081651 /nfs/dbraw/zinc/08/16/51/341081651.db2.gz IMTPTRXIUBIGIT-QUCCMNQESA-N 2 1 314.517 4.170 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCCc2c(Cl)cccc21 ZINC000544569493 341086142 /nfs/dbraw/zinc/08/61/42/341086142.db2.gz HBXOYADBMWRRDW-SFHVURJKSA-N 2 1 317.864 4.292 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578315 341086943 /nfs/dbraw/zinc/08/69/43/341086943.db2.gz ZNYLXUROAACWQL-CVEARBPZSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578315 341086944 /nfs/dbraw/zinc/08/69/44/341086944.db2.gz ZNYLXUROAACWQL-CVEARBPZSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(-c2ccccc2)s1 ZINC000544581426 341087262 /nfs/dbraw/zinc/08/72/62/341087262.db2.gz IUGUWUZVABUAIB-CQSZACIVSA-N 2 1 300.471 4.160 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@H+](C)C[C@@H]3C)cc2)c1 ZINC000544825687 341094949 /nfs/dbraw/zinc/09/49/49/341094949.db2.gz OPAWGDFPHJYASX-UWJYYQICSA-N 2 1 308.469 4.092 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)cc2)c1 ZINC000546164585 341155307 /nfs/dbraw/zinc/15/53/07/341155307.db2.gz FKKZPDJUOOESGZ-UTKZUKDTSA-N 2 1 308.469 4.234 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)c1 ZINC000546164584 341155369 /nfs/dbraw/zinc/15/53/69/341155369.db2.gz FKKZPDJUOOESGZ-LAUBAEHRSA-N 2 1 308.469 4.234 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)C1 ZINC000564319773 341211278 /nfs/dbraw/zinc/21/12/78/341211278.db2.gz YUTARVFEIUWENL-HHXXYDBFSA-N 2 1 320.908 4.296 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548156340 341250056 /nfs/dbraw/zinc/25/00/56/341250056.db2.gz JDOZQQGUWZSSRQ-YQVWRLOYSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000136294999 341256321 /nfs/dbraw/zinc/25/63/21/341256321.db2.gz LBWXMENVVUTZDS-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000136294999 341256322 /nfs/dbraw/zinc/25/63/22/341256322.db2.gz LBWXMENVVUTZDS-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP CC(C)(C)C1CC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000549860139 341305398 /nfs/dbraw/zinc/30/53/98/341305398.db2.gz BAJOFAPDWFJCCY-UHFFFAOYSA-N 2 1 300.490 4.065 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000550587807 341318823 /nfs/dbraw/zinc/31/88/23/341318823.db2.gz GCDWQSLVBBSDNI-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2cccc(Cl)c2)C[C@H]1c1ccccc1 ZINC000550587807 341318824 /nfs/dbraw/zinc/31/88/24/341318824.db2.gz GCDWQSLVBBSDNI-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000550587809 341318947 /nfs/dbraw/zinc/31/89/47/341318947.db2.gz GCDWQSLVBBSDNI-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cccc(Cl)c2)C[C@@H]1c1ccccc1 ZINC000550587809 341318948 /nfs/dbraw/zinc/31/89/48/341318948.db2.gz GCDWQSLVBBSDNI-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000245940652 341319001 /nfs/dbraw/zinc/31/90/01/341319001.db2.gz UUSQQUDIARSCOU-OLZOCXBDSA-N 2 1 306.837 4.079 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000245940652 341319002 /nfs/dbraw/zinc/31/90/02/341319002.db2.gz UUSQQUDIARSCOU-OLZOCXBDSA-N 2 1 306.837 4.079 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000550621991 341319845 /nfs/dbraw/zinc/31/98/45/341319845.db2.gz HWESMMOHZCXGDE-BWPNAZKDSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000550621991 341319846 /nfs/dbraw/zinc/31/98/46/341319846.db2.gz HWESMMOHZCXGDE-BWPNAZKDSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665984 341321072 /nfs/dbraw/zinc/32/10/72/341321072.db2.gz SOUZWXKIRGRMHA-KRFUXDQASA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C[C@@H](C)C1 ZINC000550665984 341321073 /nfs/dbraw/zinc/32/10/73/341321073.db2.gz SOUZWXKIRGRMHA-KRFUXDQASA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCCC2(C)C)C[C@H]1c1ccccc1 ZINC000550679877 341321313 /nfs/dbraw/zinc/32/13/13/341321313.db2.gz ARAYANNDYIVCJV-GBESFXJTSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCCC2(C)C)C[C@H]1c1ccccc1 ZINC000550679877 341321314 /nfs/dbraw/zinc/32/13/14/341321314.db2.gz ARAYANNDYIVCJV-GBESFXJTSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000550679878 341321354 /nfs/dbraw/zinc/32/13/54/341321354.db2.gz ARAYANNDYIVCJV-IPMKNSEASA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000550679878 341321355 /nfs/dbraw/zinc/32/13/55/341321355.db2.gz ARAYANNDYIVCJV-IPMKNSEASA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H](F)CC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000550881969 341325373 /nfs/dbraw/zinc/32/53/73/341325373.db2.gz FIFRVERLMQAJJA-OJAHFUOMSA-N 2 1 318.480 4.015 20 0 DIADMP CC1=CC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931761 341327154 /nfs/dbraw/zinc/32/71/54/341327154.db2.gz UUHILTRPIGJGDA-WOJBJXKFSA-N 2 1 312.501 4.376 20 0 DIADMP CC1=CC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000550931761 341327155 /nfs/dbraw/zinc/32/71/55/341327155.db2.gz UUHILTRPIGJGDA-WOJBJXKFSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550997993 341328719 /nfs/dbraw/zinc/32/87/19/341328719.db2.gz VRCZRTBXTJUJIP-IMFGXOCKSA-N 2 1 312.457 4.026 20 0 DIADMP C[C@H](CCc1ccco1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550997993 341328720 /nfs/dbraw/zinc/32/87/20/341328720.db2.gz VRCZRTBXTJUJIP-IMFGXOCKSA-N 2 1 312.457 4.026 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(C3CC3)c2)C1 ZINC000551030148 341329623 /nfs/dbraw/zinc/32/96/23/341329623.db2.gz YHTYDGUWUKKAFE-SJORKVTESA-N 2 1 300.490 4.335 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000551062943 341330742 /nfs/dbraw/zinc/33/07/42/341330742.db2.gz GFNZPVUFXOAWPC-RBUKOAKNSA-N 2 1 300.490 4.382 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000551062943 341330743 /nfs/dbraw/zinc/33/07/43/341330743.db2.gz GFNZPVUFXOAWPC-RBUKOAKNSA-N 2 1 300.490 4.382 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000551086194 341331238 /nfs/dbraw/zinc/33/12/38/341331238.db2.gz NDVGKVCWDKAETA-MOPGFXCFSA-N 2 1 300.490 4.382 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCC1 ZINC000551086194 341331239 /nfs/dbraw/zinc/33/12/39/341331239.db2.gz NDVGKVCWDKAETA-MOPGFXCFSA-N 2 1 300.490 4.382 20 0 DIADMP CC(C)[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(C(C)(C)C)cc1 ZINC000551517204 341343515 /nfs/dbraw/zinc/34/35/15/341343515.db2.gz IXGYHIZUOFQEAG-IBGZPJMESA-N 2 1 313.489 4.247 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)CC[NH+](C)C)cc1Cl ZINC000551529471 341343958 /nfs/dbraw/zinc/34/39/58/341343958.db2.gz CAZFSWPWIBUKEL-KGLIPLIRSA-N 2 1 312.885 4.118 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC000551833021 341353250 /nfs/dbraw/zinc/35/32/50/341353250.db2.gz FXRVMJWAEKMSBZ-GIVPXCGWSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000246895061 341358277 /nfs/dbraw/zinc/35/82/77/341358277.db2.gz FOIMJJRCTJCUHZ-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3ccccc3s2)C[C@H]1C ZINC000552071413 341367448 /nfs/dbraw/zinc/36/74/48/341367448.db2.gz CWLKLCHGZIYRRO-GDBMZVCRSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3ccccc3s2)C[C@H]1C ZINC000552071413 341367449 /nfs/dbraw/zinc/36/74/49/341367449.db2.gz CWLKLCHGZIYRRO-GDBMZVCRSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3ccccc3s2)C[C@H]1C ZINC000552071413 341367450 /nfs/dbraw/zinc/36/74/50/341367450.db2.gz CWLKLCHGZIYRRO-GDBMZVCRSA-N 2 1 302.487 4.206 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc2ccccc2n1 ZINC000248052089 341372671 /nfs/dbraw/zinc/37/26/71/341372671.db2.gz WOYAMCCBIGKPFZ-DLBZAZTESA-N 2 1 311.473 4.150 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc2ccccc2n1 ZINC000248052089 341372672 /nfs/dbraw/zinc/37/26/72/341372672.db2.gz WOYAMCCBIGKPFZ-DLBZAZTESA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000248403590 341376673 /nfs/dbraw/zinc/37/66/73/341376673.db2.gz OTJCAUJIKPCPJO-ZOBUZTSGSA-N 2 1 304.453 4.129 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000248407240 341376723 /nfs/dbraw/zinc/37/67/23/341376723.db2.gz UDQGIPUKWJDVFG-LNLFQRSKSA-N 2 1 300.490 4.299 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000552224340 341379425 /nfs/dbraw/zinc/37/94/25/341379425.db2.gz UGLJKCMMPNZHFQ-FUHWJXTLSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)Cc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000552224341 341379542 /nfs/dbraw/zinc/37/95/42/341379542.db2.gz UGLJKCMMPNZHFQ-SJLPKXTDSA-N 2 1 300.490 4.020 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3CC[C@H](C[NH+](C)C)C3)c2)cc1 ZINC000552256621 341381956 /nfs/dbraw/zinc/38/19/56/341381956.db2.gz UMEZUHHZILKFNU-LJQANCHMSA-N 2 1 308.469 4.046 20 0 DIADMP C[C@H](C1CC1)[NH+](C)Cc1ccc(C[N@H+](C)[C@@H](C)C2CC2)cc1 ZINC000552493845 341396307 /nfs/dbraw/zinc/39/63/07/341396307.db2.gz MLNCAJYCCSYEKR-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP C[C@H](C1CC1)[N@@H+](C)Cc1ccc(C[NH+](C)[C@@H](C)C2CC2)cc1 ZINC000552493845 341396308 /nfs/dbraw/zinc/39/63/08/341396308.db2.gz MLNCAJYCCSYEKR-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP C[C@H](C1CC1)[N@H+](C)Cc1ccc(C[NH+](C)[C@@H](C)C2CC2)cc1 ZINC000552493845 341396309 /nfs/dbraw/zinc/39/63/09/341396309.db2.gz MLNCAJYCCSYEKR-IYBDPMFKSA-N 2 1 300.490 4.147 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1 ZINC000566415378 341557160 /nfs/dbraw/zinc/55/71/60/341557160.db2.gz CZUKIZGWUSLQEL-LJQANCHMSA-N 2 1 315.436 4.013 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2cccc(C)c2)cc1F ZINC000153731544 341577927 /nfs/dbraw/zinc/57/79/27/341577927.db2.gz AVYBOICCEAXLHW-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)o1 ZINC000192710301 341883071 /nfs/dbraw/zinc/88/30/71/341883071.db2.gz WRAUAARUSKCDKT-JXFKEZNVSA-N 2 1 324.468 4.289 20 0 DIADMP CC(C)c1ccc([C@H]([NH2+][C@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000422788744 517485735 /nfs/dbraw/zinc/48/57/35/517485735.db2.gz RINUPLNYWBDUIC-KUHUBIRLSA-N 2 1 314.498 4.158 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000236659325 519630315 /nfs/dbraw/zinc/63/03/15/519630315.db2.gz OAQKVWDZFQKRQB-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)s1 ZINC000155811916 522232540 /nfs/dbraw/zinc/23/25/40/522232540.db2.gz SCQWEZYEFSABOY-AWEZNQCLSA-N 2 1 311.539 4.173 20 0 DIADMP CC[C@H]([NH2+]CCCn1cc[nH+]c1C)c1cccc(Cl)c1F ZINC000338013417 522588980 /nfs/dbraw/zinc/58/89/80/522588980.db2.gz RSPCTLJFIQZKHI-HNNXBMFYSA-N 2 1 309.816 4.115 20 0 DIADMP C[C@H](C[NH2+][C@@H]1C[C@@H](C)Sc2sccc21)C[NH+]1CCCCC1 ZINC000336839956 524499843 /nfs/dbraw/zinc/49/98/43/524499843.db2.gz LKYQFWROZYGJBH-IIAWOOMASA-N 2 1 324.559 4.385 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC[NH+]2CCCCC2)c2ccsc2S1 ZINC000336826414 525266387 /nfs/dbraw/zinc/26/63/87/525266387.db2.gz OCOADFDDTOEWPT-UKRRQHHQSA-N 2 1 310.532 4.139 20 0 DIADMP CSC1(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000368216732 525334543 /nfs/dbraw/zinc/33/45/43/525334543.db2.gz UANLNMCIXGERGQ-HOCLYGCPSA-N 2 1 324.559 4.006 20 0 DIADMP CSC1(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000368216732 525334551 /nfs/dbraw/zinc/33/45/51/525334551.db2.gz UANLNMCIXGERGQ-HOCLYGCPSA-N 2 1 324.559 4.006 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000158651086 525461812 /nfs/dbraw/zinc/46/18/12/525461812.db2.gz UVNXEZRGCKAXRX-MSOLQXFVSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccccn1 ZINC000158651086 525461817 /nfs/dbraw/zinc/46/18/17/525461817.db2.gz UVNXEZRGCKAXRX-MSOLQXFVSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1ccncc1 ZINC000266504623 525520253 /nfs/dbraw/zinc/52/02/53/525520253.db2.gz WEMAQDZPQQAYEF-QZTJIDSGSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000338016693 527422014 /nfs/dbraw/zinc/42/20/14/527422014.db2.gz WXIAKBDFZSQSTQ-FQEVSTJZSA-N 2 1 323.415 4.100 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000338008578 527422799 /nfs/dbraw/zinc/42/27/99/527422799.db2.gz PJRWKGXWOHFZNB-LLVKDONJSA-N 2 1 312.244 4.239 20 0 DIADMP CC(C)[N@@H+](CCC[NH3+])[C@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001173543557 1051737044 /nfs/dbraw/zinc/73/70/44/1051737044.db2.gz MNGYQMSXSHATFX-CYBMUJFWSA-N 2 1 317.304 4.374 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCS2 ZINC000643546472 1035591959 /nfs/dbraw/zinc/59/19/59/1035591959.db2.gz PHEHIUGBVPFCLP-ZFWWWQNUSA-N 2 1 322.905 4.141 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H](C[NH3+])CC[C@H]1C ZINC001206772210 1035738263 /nfs/dbraw/zinc/73/82/63/1035738263.db2.gz ZHAXKSCAZVASRG-MSOLQXFVSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccc2cc[nH+]c(N3CCC(C[N@@H+](C)C(C)C)CC3)c2c1 ZINC000579826508 1035769275 /nfs/dbraw/zinc/76/92/75/1035769275.db2.gz BFHIPORPKHTFFL-UHFFFAOYSA-N 2 1 311.473 4.100 20 0 DIADMP Cc1ccc2cc[nH+]c(N3CCC(C[N@H+](C)C(C)C)CC3)c2c1 ZINC000579826508 1035769285 /nfs/dbraw/zinc/76/92/85/1035769285.db2.gz BFHIPORPKHTFFL-UHFFFAOYSA-N 2 1 311.473 4.100 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CC2(Cl)Cl)cc1 ZINC000782052099 1035789520 /nfs/dbraw/zinc/78/95/20/1035789520.db2.gz GLPXQXXTAJVKGY-BXUZGUMPSA-N 2 1 324.255 4.025 20 0 DIADMP Cc1cnccc1O[C@@H]1CC[N@@H+](CCC(C)(C)c2ccccc2)C1 ZINC001208674028 1035798197 /nfs/dbraw/zinc/79/81/97/1035798197.db2.gz ZIUCMBBQNXOTIG-LJQANCHMSA-N 2 1 324.468 4.211 20 0 DIADMP c1ccc2c(c1)CC[N@@H+](C1CC[NH+](CCC3CCCC3)CC1)C2 ZINC001208693746 1035814245 /nfs/dbraw/zinc/81/42/45/1035814245.db2.gz APCMQGYVBCBJTQ-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP c1ccc2c(c1)CC[N@H+](C1CC[NH+](CCC3CCCC3)CC1)C2 ZINC001208693746 1035814256 /nfs/dbraw/zinc/81/42/56/1035814256.db2.gz APCMQGYVBCBJTQ-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000339682884 1035914671 /nfs/dbraw/zinc/91/46/71/1035914671.db2.gz MSEQVWOXHCIPBU-CABCVRRESA-N 2 1 317.502 4.290 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000037256065 1035987097 /nfs/dbraw/zinc/98/70/97/1035987097.db2.gz NQEMQYRVTGCMNQ-OAHLLOKOSA-N 2 1 301.261 4.128 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccs1 ZINC000154856671 1036039896 /nfs/dbraw/zinc/03/98/96/1036039896.db2.gz MNDMKRJYOWRXCB-OAHLLOKOSA-N 2 1 302.487 4.439 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)o1 ZINC000154880798 1036051499 /nfs/dbraw/zinc/05/14/99/1036051499.db2.gz IPJYKTZHZZVINF-INIZCTEOSA-N 2 1 300.446 4.279 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C[C@@H]2CC=CCC2)C1 ZINC001648792538 1036080693 /nfs/dbraw/zinc/08/06/93/1036080693.db2.gz PTKDOYJVJYPDDU-RTBURBONSA-N 2 1 312.501 4.364 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@@H+]1C ZINC000120785790 1036241445 /nfs/dbraw/zinc/24/14/45/1036241445.db2.gz GNCQHCNZGCEFET-MRRJBJDNSA-N 2 1 310.432 4.124 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@H+]1C ZINC000120785790 1036241458 /nfs/dbraw/zinc/24/14/58/1036241458.db2.gz GNCQHCNZGCEFET-MRRJBJDNSA-N 2 1 310.432 4.124 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000236830835 1036320423 /nfs/dbraw/zinc/32/04/23/1036320423.db2.gz FBDVJWMAZBOWSF-RZMNMVRNSA-N 2 1 300.490 4.208 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000236830835 1036320443 /nfs/dbraw/zinc/32/04/43/1036320443.db2.gz FBDVJWMAZBOWSF-RZMNMVRNSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000537952908 1036356602 /nfs/dbraw/zinc/35/66/02/1036356602.db2.gz XYBVSZBQKFMKFV-XLIONFOSSA-N 2 1 312.501 4.067 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000324627463 1036427743 /nfs/dbraw/zinc/42/77/43/1036427743.db2.gz PSOPVDBIFBAKOW-IIBYNOLFSA-N 2 1 318.464 4.220 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC001648811703 1036493205 /nfs/dbraw/zinc/49/32/05/1036493205.db2.gz VWTFVMXAIDPDOC-XWTMOSNGSA-N 2 1 312.567 4.008 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C)SC2)cc1 ZINC000655720922 1036502040 /nfs/dbraw/zinc/50/20/40/1036502040.db2.gz JEUTUTFGJJCSJD-GRDNDAEWSA-N 2 1 315.486 4.115 20 0 DIADMP CCSc1cccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC001648816692 1036576939 /nfs/dbraw/zinc/57/69/39/1036576939.db2.gz DRQFIOQRPYAHLC-KRWDZBQOSA-N 2 1 320.546 4.400 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC001648817125 1036579548 /nfs/dbraw/zinc/57/95/48/1036579548.db2.gz VWPUOULZRUQUCY-HNNXBMFYSA-N 2 1 308.897 4.250 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000340467251 1036679209 /nfs/dbraw/zinc/67/92/09/1036679209.db2.gz ZGNJAISZWGTOQD-OAHLLOKOSA-N 2 1 324.472 4.019 20 0 DIADMP CC[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1(C)C ZINC000397652733 1036707597 /nfs/dbraw/zinc/70/75/97/1036707597.db2.gz MEHSOTOVVIXLSQ-SVFBPWRDSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006014 1036711564 /nfs/dbraw/zinc/71/15/64/1036711564.db2.gz HXQFVGXQEQUNBX-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006014 1036711580 /nfs/dbraw/zinc/71/15/80/1036711580.db2.gz HXQFVGXQEQUNBX-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006014 1036711596 /nfs/dbraw/zinc/71/15/96/1036711596.db2.gz HXQFVGXQEQUNBX-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006014 1036711617 /nfs/dbraw/zinc/71/16/17/1036711617.db2.gz HXQFVGXQEQUNBX-QAPCUYQASA-N 2 1 314.498 4.187 20 0 DIADMP CCc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001167326928 1036745085 /nfs/dbraw/zinc/74/50/85/1036745085.db2.gz YERJKGIAKKTEFH-OAQYLSRUSA-N 2 1 314.517 4.337 20 0 DIADMP CCc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001167326928 1036745101 /nfs/dbraw/zinc/74/51/01/1036745101.db2.gz YERJKGIAKKTEFH-OAQYLSRUSA-N 2 1 314.517 4.337 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cnc(C3CCCCC3)s2)C1 ZINC000580044685 1036899178 /nfs/dbraw/zinc/89/91/78/1036899178.db2.gz MEGRIGFROPIVCZ-OAHLLOKOSA-N 2 1 321.534 4.012 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000291420305 1036940038 /nfs/dbraw/zinc/94/00/38/1036940038.db2.gz HTVGEZYWIFALSJ-MRXNPFEDSA-N 2 1 324.255 4.010 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000580103892 1036955307 /nfs/dbraw/zinc/95/53/07/1036955307.db2.gz UFRQDWGWBXAHHG-RTWAWAEBSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000580103892 1036955321 /nfs/dbraw/zinc/95/53/21/1036955321.db2.gz UFRQDWGWBXAHHG-RTWAWAEBSA-N 2 1 308.469 4.044 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC(C)(C)C1 ZINC000398014164 1037083570 /nfs/dbraw/zinc/08/35/70/1037083570.db2.gz FJPYLHDIXVHKNN-NEWSRXKRSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCC(C)(C)C1 ZINC000398014164 1037083582 /nfs/dbraw/zinc/08/35/82/1037083582.db2.gz FJPYLHDIXVHKNN-NEWSRXKRSA-N 2 1 300.490 4.065 20 0 DIADMP CCCC(CCC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398022337 1037084639 /nfs/dbraw/zinc/08/46/39/1037084639.db2.gz KQBBNHXVXALLQB-XLIONFOSSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC(CCC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398022337 1037084655 /nfs/dbraw/zinc/08/46/55/1037084655.db2.gz KQBBNHXVXALLQB-XLIONFOSSA-N 2 1 302.506 4.455 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000398023180 1037085406 /nfs/dbraw/zinc/08/54/06/1037085406.db2.gz KWHYCSMFSXAMGL-XMSQKQJNSA-N 2 1 322.496 4.249 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398032525 1037098638 /nfs/dbraw/zinc/09/86/38/1037098638.db2.gz OAGFFBFTCRSADG-CMKODMSKSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398032525 1037098653 /nfs/dbraw/zinc/09/86/53/1037098653.db2.gz OAGFFBFTCRSADG-CMKODMSKSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398032527 1037101011 /nfs/dbraw/zinc/10/10/11/1037101011.db2.gz OAGFFBFTCRSADG-HBFSDRIKSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398032527 1037101017 /nfs/dbraw/zinc/10/10/17/1037101017.db2.gz OAGFFBFTCRSADG-HBFSDRIKSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398038578 1037104423 /nfs/dbraw/zinc/10/44/23/1037104423.db2.gz QXSYOUFZBGBRGA-BJLQDIEVSA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398038578 1037104432 /nfs/dbraw/zinc/10/44/32/1037104432.db2.gz QXSYOUFZBGBRGA-BJLQDIEVSA-N 2 1 302.506 4.169 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398036288 1037105858 /nfs/dbraw/zinc/10/58/58/1037105858.db2.gz QANMETJHPMOMAP-IHPCNDPISA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398036288 1037105864 /nfs/dbraw/zinc/10/58/64/1037105864.db2.gz QANMETJHPMOMAP-IHPCNDPISA-N 2 1 302.506 4.455 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+]([C@@H]2CCc3ccccc32)C1 ZINC001167424470 1037227249 /nfs/dbraw/zinc/22/72/49/1037227249.db2.gz KABUXRTVSLDPNJ-DBXWQHBBSA-N 2 1 312.501 4.260 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc32)C1 ZINC001167424470 1037227267 /nfs/dbraw/zinc/22/72/67/1037227267.db2.gz KABUXRTVSLDPNJ-DBXWQHBBSA-N 2 1 312.501 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1c[nH+]ccc1N)CCC2 ZINC000580639869 1037234530 /nfs/dbraw/zinc/23/45/30/1037234530.db2.gz SXENGBGFEAGPLE-XOBRGWDASA-N 2 1 309.457 4.346 20 0 DIADMP CCCCc1nc(C[NH+]2CCC(C[NH+](CC)CC)CC2)cs1 ZINC000047978564 1037235334 /nfs/dbraw/zinc/23/53/34/1037235334.db2.gz HJIGZABPUVXGFH-UHFFFAOYSA-N 2 1 323.550 4.040 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc3ccccc3[nH]2)CC1 ZINC000684019751 1037244111 /nfs/dbraw/zinc/24/41/11/1037244111.db2.gz AGYASVIKAGKJPD-UHFFFAOYSA-N 2 1 313.489 4.112 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(C)c1 ZINC001167429873 1037246914 /nfs/dbraw/zinc/24/69/14/1037246914.db2.gz NRANUTTZTWQVCV-VQTJNVASSA-N 2 1 314.517 4.481 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000580744471 1037281800 /nfs/dbraw/zinc/28/18/00/1037281800.db2.gz VDUCYPWTNDEVLO-HESLUPGFSA-N 2 1 308.432 4.062 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000580744471 1037281815 /nfs/dbraw/zinc/28/18/15/1037281815.db2.gz VDUCYPWTNDEVLO-HESLUPGFSA-N 2 1 308.432 4.062 20 0 DIADMP Cc1ccc(N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)n1 ZINC000580979295 1037393025 /nfs/dbraw/zinc/39/30/25/1037393025.db2.gz PADJRARPRAFMIY-VQIMIIECSA-N 2 1 309.457 4.021 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000255998611 1037447834 /nfs/dbraw/zinc/44/78/34/1037447834.db2.gz RBSMTKGNSVLMML-BBTUJRGHSA-N 2 1 308.469 4.248 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1 ZINC000255998611 1037447849 /nfs/dbraw/zinc/44/78/49/1037447849.db2.gz RBSMTKGNSVLMML-BBTUJRGHSA-N 2 1 308.469 4.248 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001204552675 1037459022 /nfs/dbraw/zinc/45/90/22/1037459022.db2.gz PLDZCKXTPQIPMQ-ZTBDEIDFSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001204552675 1037459029 /nfs/dbraw/zinc/45/90/29/1037459029.db2.gz PLDZCKXTPQIPMQ-ZTBDEIDFSA-N 2 1 314.517 4.289 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@@H]1C(C)=CCC[C@@H]1C ZINC000581694068 1037921500 /nfs/dbraw/zinc/92/15/00/1037921500.db2.gz BLBSHURJJLHISS-ZWKOTPCHSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@@H]1C(C)=CCC[C@@H]1C ZINC000581694068 1037921510 /nfs/dbraw/zinc/92/15/10/1037921510.db2.gz BLBSHURJJLHISS-ZWKOTPCHSA-N 2 1 303.494 4.150 20 0 DIADMP CC(C)(C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000684410400 1037955440 /nfs/dbraw/zinc/95/54/40/1037955440.db2.gz WUOKDIJFRIEGDF-HXUWFJFHSA-N 2 1 322.496 4.076 20 0 DIADMP CSCCCC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000602556190 1038038389 /nfs/dbraw/zinc/03/83/89/1038038389.db2.gz JJHDDCNFECLFGD-MJGOQNOKSA-N 2 1 318.530 4.087 20 0 DIADMP CSCCCC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000602556190 1038038407 /nfs/dbraw/zinc/03/84/07/1038038407.db2.gz JJHDDCNFECLFGD-MJGOQNOKSA-N 2 1 318.530 4.087 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](CC)c2ccccc2OCC)CC1 ZINC000153940850 1038276325 /nfs/dbraw/zinc/27/63/25/1038276325.db2.gz OFHCZOIHWJXWCN-GOSISDBHSA-N 2 1 304.478 4.000 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000535685719 1038314341 /nfs/dbraw/zinc/31/43/41/1038314341.db2.gz LOPXWTBMDPXZRF-KSSFIOAISA-N 2 1 306.881 4.039 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC000535685718 1038315811 /nfs/dbraw/zinc/31/58/11/1038315811.db2.gz LOPXWTBMDPXZRF-KDOFPFPSSA-N 2 1 306.881 4.039 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226940 1038378825 /nfs/dbraw/zinc/37/88/25/1038378825.db2.gz DUROSBDESLFWQZ-RDJZCZTQSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226940 1038378834 /nfs/dbraw/zinc/37/88/34/1038378834.db2.gz DUROSBDESLFWQZ-RDJZCZTQSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1C ZINC001167499396 1038453688 /nfs/dbraw/zinc/45/36/88/1038453688.db2.gz HWJJOOSBHXQDFA-QFIPXVFZSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1C ZINC001167499396 1038453697 /nfs/dbraw/zinc/45/36/97/1038453697.db2.gz HWJJOOSBHXQDFA-QFIPXVFZSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC001167499396 1038453705 /nfs/dbraw/zinc/45/37/05/1038453705.db2.gz HWJJOOSBHXQDFA-QFIPXVFZSA-N 2 1 322.496 4.257 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H](C)c2ccccc2)CC1 ZINC000604885027 1038463312 /nfs/dbraw/zinc/46/33/12/1038463312.db2.gz AFNUEHNONXXHTO-GOSISDBHSA-N 2 1 302.506 4.234 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000342217109 1038481688 /nfs/dbraw/zinc/48/16/88/1038481688.db2.gz FBNQCCKMRDEGTQ-UHFFFAOYSA-N 2 1 324.255 4.167 20 0 DIADMP CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)CC1CC[NH2+]CC1 ZINC000094012223 1038488611 /nfs/dbraw/zinc/48/86/11/1038488611.db2.gz ZMNRNRUOSYDNBF-UHFFFAOYSA-N 2 1 315.288 4.203 20 0 DIADMP CC(C)[N@H+](Cc1c(Cl)cccc1Cl)CC1CC[NH2+]CC1 ZINC000094012411 1038489508 /nfs/dbraw/zinc/48/95/08/1038489508.db2.gz JNPDNJPVHKOTRX-UHFFFAOYSA-N 2 1 315.288 4.203 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000707898413 1038498535 /nfs/dbraw/zinc/49/85/35/1038498535.db2.gz IPYHFWIPVATOLC-XUVXKRRUSA-N 2 1 321.468 4.021 20 0 DIADMP Cc1ccc(CC[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000605575047 1038537399 /nfs/dbraw/zinc/53/73/99/1038537399.db2.gz GTLKNVQDONEKKQ-CTNGQTDRSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000605575047 1038537401 /nfs/dbraw/zinc/53/74/01/1038537401.db2.gz GTLKNVQDONEKKQ-CTNGQTDRSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000605575047 1038537406 /nfs/dbraw/zinc/53/74/06/1038537406.db2.gz GTLKNVQDONEKKQ-CTNGQTDRSA-N 2 1 314.517 4.124 20 0 DIADMP c1cc2c(o1)CCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000152236038 1038596843 /nfs/dbraw/zinc/59/68/43/1038596843.db2.gz CONAPTVYVNEFEN-GOSISDBHSA-N 2 1 302.462 4.044 20 0 DIADMP c1ccc2cc(CC[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447886 1038603265 /nfs/dbraw/zinc/60/32/65/1038603265.db2.gz LMOQVXZRHQIJIP-JOCHJYFZSA-N 2 1 322.496 4.333 20 0 DIADMP CC(C)CCn1cccc1C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000606469318 1038607469 /nfs/dbraw/zinc/60/74/69/1038607469.db2.gz PPCONKHNRTXOLZ-LJQANCHMSA-N 2 1 319.537 4.278 20 0 DIADMP CCC(CC)C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001167554296 1038611167 /nfs/dbraw/zinc/61/11/67/1038611167.db2.gz MZELGGUFGJLOGD-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CCC(CC)C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001167554296 1038611169 /nfs/dbraw/zinc/61/11/69/1038611169.db2.gz MZELGGUFGJLOGD-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CCC(CC)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001167554296 1038611170 /nfs/dbraw/zinc/61/11/70/1038611170.db2.gz MZELGGUFGJLOGD-NRFANRHFSA-N 2 1 314.517 4.411 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2CC(C)C)C1 ZINC001167557925 1038618563 /nfs/dbraw/zinc/61/85/63/1038618563.db2.gz ADIUOMDXLKJKKL-GOSISDBHSA-N 2 1 302.506 4.049 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2CC(C)C)C1 ZINC001167557925 1038618566 /nfs/dbraw/zinc/61/85/66/1038618566.db2.gz ADIUOMDXLKJKKL-GOSISDBHSA-N 2 1 302.506 4.049 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2CC(C)C)C1 ZINC001167557925 1038618570 /nfs/dbraw/zinc/61/85/70/1038618570.db2.gz ADIUOMDXLKJKKL-GOSISDBHSA-N 2 1 302.506 4.049 20 0 DIADMP CSc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)s1 ZINC000582389470 1038651400 /nfs/dbraw/zinc/65/14/00/1038651400.db2.gz MVKIWIVIQDOURX-CQSZACIVSA-N 2 1 312.548 4.214 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468235176 1038661629 /nfs/dbraw/zinc/66/16/29/1038661629.db2.gz OVKXWAXHNFZCCT-HNAYVOBHSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468235176 1038661631 /nfs/dbraw/zinc/66/16/31/1038661631.db2.gz OVKXWAXHNFZCCT-HNAYVOBHSA-N 2 1 318.892 4.278 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000607358446 1038674652 /nfs/dbraw/zinc/67/46/52/1038674652.db2.gz DVTRYPSYLYZUIJ-CHWSQXEVSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000607358446 1038674658 /nfs/dbraw/zinc/67/46/58/1038674658.db2.gz DVTRYPSYLYZUIJ-CHWSQXEVSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000607358446 1038674661 /nfs/dbraw/zinc/67/46/61/1038674661.db2.gz DVTRYPSYLYZUIJ-CHWSQXEVSA-N 2 1 315.288 4.328 20 0 DIADMP Cc1nccn1CC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000342571975 1038674856 /nfs/dbraw/zinc/67/48/56/1038674856.db2.gz FTSZYNURNJJTPS-FQEVSTJZSA-N 2 1 305.425 4.182 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@@H+]1C ZINC001167586160 1038712723 /nfs/dbraw/zinc/71/27/23/1038712723.db2.gz IERYACCZFPZEQU-KSSFIOAISA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@H+]1C ZINC001167586160 1038712728 /nfs/dbraw/zinc/71/27/28/1038712728.db2.gz IERYACCZFPZEQU-KSSFIOAISA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586160 1038712735 /nfs/dbraw/zinc/71/27/35/1038712735.db2.gz IERYACCZFPZEQU-KSSFIOAISA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586160 1038712739 /nfs/dbraw/zinc/71/27/39/1038712739.db2.gz IERYACCZFPZEQU-KSSFIOAISA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@@H+]1C ZINC001167586154 1038712918 /nfs/dbraw/zinc/71/29/18/1038712918.db2.gz IERYACCZFPZEQU-KBXCAEBGSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@H+]1C ZINC001167586154 1038712924 /nfs/dbraw/zinc/71/29/24/1038712924.db2.gz IERYACCZFPZEQU-KBXCAEBGSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586154 1038712926 /nfs/dbraw/zinc/71/29/26/1038712926.db2.gz IERYACCZFPZEQU-KBXCAEBGSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586154 1038712934 /nfs/dbraw/zinc/71/29/34/1038712934.db2.gz IERYACCZFPZEQU-KBXCAEBGSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@@H+]1C ZINC000608061574 1038761655 /nfs/dbraw/zinc/76/16/55/1038761655.db2.gz ZBDFHWPUAVWLRR-XJKSGUPXSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC[N@H+]1C ZINC000608061574 1038761660 /nfs/dbraw/zinc/76/16/60/1038761660.db2.gz ZBDFHWPUAVWLRR-XJKSGUPXSA-N 2 1 318.461 4.127 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC000608063180 1038763197 /nfs/dbraw/zinc/76/31/97/1038763197.db2.gz CDPQJHLESXKITO-SFHLNBCPSA-N 2 1 312.501 4.209 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc(F)c2)c1 ZINC000123980437 1039184161 /nfs/dbraw/zinc/18/41/61/1039184161.db2.gz TYRPSUKBSQJZST-OAHLLOKOSA-N 2 1 300.421 4.128 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498730 1039276077 /nfs/dbraw/zinc/27/60/77/1039276077.db2.gz VIJFDKHCCVHCPD-ZIAGYGMSSA-N 2 1 320.864 4.469 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC000539498730 1039276096 /nfs/dbraw/zinc/27/60/96/1039276096.db2.gz VIJFDKHCCVHCPD-ZIAGYGMSSA-N 2 1 320.864 4.469 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2o1 ZINC000539556430 1039292033 /nfs/dbraw/zinc/29/20/33/1039292033.db2.gz DUQVTMLOMOQIPR-QRWLVFNGSA-N 2 1 312.457 4.204 20 0 DIADMP CC(C)CCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000539817749 1039343874 /nfs/dbraw/zinc/34/38/74/1039343874.db2.gz OLUHNRMDYSBLOY-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)cc1 ZINC000539817749 1039343888 /nfs/dbraw/zinc/34/38/88/1039343888.db2.gz OLUHNRMDYSBLOY-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000539817749 1039343895 /nfs/dbraw/zinc/34/38/95/1039343895.db2.gz OLUHNRMDYSBLOY-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000539817749 1039343909 /nfs/dbraw/zinc/34/39/09/1039343909.db2.gz OLUHNRMDYSBLOY-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)Cc1cccc(Cl)c1 ZINC000125468834 1039344499 /nfs/dbraw/zinc/34/44/99/1039344499.db2.gz OIZWFTXUPMRZKG-UHFFFAOYSA-N 2 1 305.853 4.147 20 0 DIADMP CC[N@@H+](CCCCn1cc[nH+]c1C)Cc1cccc(Cl)c1 ZINC000125468834 1039344518 /nfs/dbraw/zinc/34/45/18/1039344518.db2.gz OIZWFTXUPMRZKG-UHFFFAOYSA-N 2 1 305.853 4.147 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C1CC2(CCC2)C1 ZINC000448061157 1039344992 /nfs/dbraw/zinc/34/49/92/1039344992.db2.gz SCGZCKWDIXLNDD-YRWFTTLQSA-N 2 1 312.501 4.065 20 0 DIADMP c1c2ccccc2sc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000539850875 1039367349 /nfs/dbraw/zinc/36/73/49/1039367349.db2.gz IDHMMOZZTZJTQN-MRXNPFEDSA-N 2 1 314.498 4.209 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccsc1 ZINC000669850674 1039382685 /nfs/dbraw/zinc/38/26/85/1039382685.db2.gz FFTNHVPFHZOVIY-IIDMSEBBSA-N 2 1 306.519 4.442 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)c1ccsc1 ZINC000669850661 1039382974 /nfs/dbraw/zinc/38/29/74/1039382974.db2.gz DLOGJSDTBVSRME-VKJFTORMSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(C2CCCC2)cc1 ZINC000462782391 1039394509 /nfs/dbraw/zinc/39/45/09/1039394509.db2.gz BRJUJOUBPOKPCV-UHFFFAOYSA-N 2 1 311.473 4.419 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000540162266 1039439879 /nfs/dbraw/zinc/43/98/79/1039439879.db2.gz IBGPPHHTSKEILG-BPQIPLTHSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000540162266 1039439891 /nfs/dbraw/zinc/43/98/91/1039439891.db2.gz IBGPPHHTSKEILG-BPQIPLTHSA-N 2 1 322.443 4.207 20 0 DIADMP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc(Cl)c1F ZINC000650755035 1039458939 /nfs/dbraw/zinc/45/89/39/1039458939.db2.gz XGWKRCBAIHZKJF-INIZCTEOSA-N 2 1 324.802 4.318 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccccc1C(F)(F)F ZINC000540459087 1039495473 /nfs/dbraw/zinc/49/54/73/1039495473.db2.gz IHINQZWNOGDMPO-ZIAGYGMSSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccccc1C(F)(F)F ZINC000540459085 1039496476 /nfs/dbraw/zinc/49/64/76/1039496476.db2.gz IHINQZWNOGDMPO-KGLIPLIRSA-N 2 1 314.395 4.230 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000540591703 1039520775 /nfs/dbraw/zinc/52/07/75/1039520775.db2.gz NKLJVEFBCTWQEW-YJBOKZPZSA-N 2 1 306.469 4.234 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](C)CC(F)F)cc1 ZINC000647317934 1039549339 /nfs/dbraw/zinc/54/93/39/1039549339.db2.gz AFBJQVDRGDMDKZ-OLZOCXBDSA-N 2 1 307.388 4.123 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCC(C)(F)F)C1 ZINC000929644412 1039594600 /nfs/dbraw/zinc/59/46/00/1039594600.db2.gz REQUCWMMUYRENV-HZPDHXFCSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000929644412 1039594614 /nfs/dbraw/zinc/59/46/14/1039594614.db2.gz REQUCWMMUYRENV-HZPDHXFCSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCC(C)(F)F)C1 ZINC000929644412 1039594629 /nfs/dbraw/zinc/59/46/29/1039594629.db2.gz REQUCWMMUYRENV-HZPDHXFCSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cc2cnccc2o1 ZINC000657830352 1039613561 /nfs/dbraw/zinc/61/35/61/1039613561.db2.gz ORDDRYVHPODPDX-OAHLLOKOSA-N 2 1 315.461 4.133 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cc2cnccc2o1 ZINC000657830352 1039613572 /nfs/dbraw/zinc/61/35/72/1039613572.db2.gz ORDDRYVHPODPDX-OAHLLOKOSA-N 2 1 315.461 4.133 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1cc2cnccc2o1 ZINC000657830351 1039614622 /nfs/dbraw/zinc/61/46/22/1039614622.db2.gz ORDDRYVHPODPDX-HNNXBMFYSA-N 2 1 315.461 4.133 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1cc2cnccc2o1 ZINC000657830351 1039614632 /nfs/dbraw/zinc/61/46/32/1039614632.db2.gz ORDDRYVHPODPDX-HNNXBMFYSA-N 2 1 315.461 4.133 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)C(C)(C)C(F)F ZINC000657839081 1039676794 /nfs/dbraw/zinc/67/67/94/1039676794.db2.gz LKDMKIGJFRDLSB-ZNMIVQPWSA-N 2 1 304.469 4.014 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)CCCc2ccccc2Cl)CC1 ZINC000541348396 1039672493 /nfs/dbraw/zinc/67/24/93/1039672493.db2.gz CYGOYJDNGLUPJY-UHFFFAOYSA-N 2 1 308.897 4.077 20 0 DIADMP CS[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)C(C)(C)C ZINC000541383381 1039676318 /nfs/dbraw/zinc/67/63/18/1039676318.db2.gz IRWFERVARAKRIP-GOSISDBHSA-N 2 1 320.546 4.018 20 0 DIADMP CCC(CC)([NH2+]CCCc1c[nH+]cn1C)c1ccc(Cl)cc1 ZINC001167675482 1039717670 /nfs/dbraw/zinc/71/76/70/1039717670.db2.gz SDETWJPZOVGNQL-UHFFFAOYSA-N 2 1 319.880 4.311 20 0 DIADMP Cc1ccc([C@@H]([NH2+]CCCCn2cc[nH+]c2C)C2CCC2)o1 ZINC000541736201 1039734980 /nfs/dbraw/zinc/73/49/80/1039734980.db2.gz FGEPJZXHOFGWGF-SFHVURJKSA-N 2 1 301.434 4.004 20 0 DIADMP Cc1ccc([C@H]([NH2+]CCCCn2cc[nH+]c2C)C2CCC2)o1 ZINC000541736200 1039735452 /nfs/dbraw/zinc/73/54/52/1039735452.db2.gz FGEPJZXHOFGWGF-GOSISDBHSA-N 2 1 301.434 4.004 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@@H](C[NH+](C)C)C3)s2)cc1 ZINC000541909486 1039755665 /nfs/dbraw/zinc/75/56/65/1039755665.db2.gz SAGBYCSUNALMMQ-INIZCTEOSA-N 2 1 314.498 4.107 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccncc3s2)C1 ZINC000657872565 1039954350 /nfs/dbraw/zinc/95/43/50/1039954350.db2.gz OBWZEGIGBVORQM-LSDHHAIUSA-N 2 1 317.502 4.067 20 0 DIADMP Cc1ccc(CC[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000492602774 1039985683 /nfs/dbraw/zinc/98/56/83/1039985683.db2.gz QOGVQMYDYFGZPV-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCSCC2)CC1 ZINC000657890627 1040042080 /nfs/dbraw/zinc/04/20/80/1040042080.db2.gz WFHURZDIOINQOU-SJLPKXTDSA-N 2 1 318.530 4.087 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CC3)[C@@H]1c1cccs1 ZINC000657890303 1040053237 /nfs/dbraw/zinc/05/32/37/1040053237.db2.gz RUJPELRKGZPYQX-HYVNUMGLSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CC3)[C@@H]1c1cccs1 ZINC000657890303 1040053257 /nfs/dbraw/zinc/05/32/57/1040053257.db2.gz RUJPELRKGZPYQX-HYVNUMGLSA-N 2 1 304.503 4.053 20 0 DIADMP Cc1cccc(C)c1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000708563603 1040082537 /nfs/dbraw/zinc/08/25/37/1040082537.db2.gz ZSUWPEYTRVKGFK-TZIWHRDSSA-N 2 1 322.496 4.161 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC000309573701 1040084971 /nfs/dbraw/zinc/08/49/71/1040084971.db2.gz DVOWEMRHWZRVLO-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@@H]1CCCC12CCC2 ZINC000708571060 1040086307 /nfs/dbraw/zinc/08/63/07/1040086307.db2.gz QBAHQPHIZZKVCJ-YZGWKJHDSA-N 2 1 312.501 4.067 20 0 DIADMP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000657893400 1040087444 /nfs/dbraw/zinc/08/74/44/1040087444.db2.gz RGIWQRRTSAGJCO-QBUWPKIASA-N 2 1 320.908 4.266 20 0 DIADMP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000657893400 1040087461 /nfs/dbraw/zinc/08/74/61/1040087461.db2.gz RGIWQRRTSAGJCO-QBUWPKIASA-N 2 1 320.908 4.266 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccs1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309751917 1040093233 /nfs/dbraw/zinc/09/32/33/1040093233.db2.gz ZRHOUEDQSMSNED-SOLBZPMBSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901115 1040099339 /nfs/dbraw/zinc/09/93/39/1040099339.db2.gz NTMSVGBZAMDXAS-HLLBOEOZSA-N 2 1 324.459 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901115 1040099358 /nfs/dbraw/zinc/09/93/58/1040099358.db2.gz NTMSVGBZAMDXAS-HLLBOEOZSA-N 2 1 324.459 4.309 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000309991087 1040103659 /nfs/dbraw/zinc/10/36/59/1040103659.db2.gz ZYAZUOOEKFOPGZ-QUCCMNQESA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H](CC1CC1)[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000309967464 1040103952 /nfs/dbraw/zinc/10/39/52/1040103952.db2.gz LTDOGYFNQAYQBY-FXAWDEMLSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC000310069758 1040106613 /nfs/dbraw/zinc/10/66/13/1040106613.db2.gz CVVJJWZINBUHLO-UGKGYDQZSA-N 2 1 320.480 4.094 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1 ZINC000708582327 1040131862 /nfs/dbraw/zinc/13/18/62/1040131862.db2.gz UGABDNRKWUASAI-IAVZTARUSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1nccc2ccccc21 ZINC000685647660 1040183945 /nfs/dbraw/zinc/18/39/45/1040183945.db2.gz PMJJLDRCSSHQNP-MAUKXSAKSA-N 2 1 313.489 4.252 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc3ccccc3s2)CC1 ZINC000223361124 1040239171 /nfs/dbraw/zinc/23/91/71/1040239171.db2.gz AUVCLQUWGNRZJN-AWEZNQCLSA-N 2 1 302.487 4.426 20 0 DIADMP CC[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000658237115 1040379047 /nfs/dbraw/zinc/37/90/47/1040379047.db2.gz YWKIZHSZNRHONL-MHJFOBGBSA-N 2 1 300.490 4.208 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167684992 1040398817 /nfs/dbraw/zinc/39/88/17/1040398817.db2.gz HPKOJLIGQXLRTJ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167684992 1040398824 /nfs/dbraw/zinc/39/88/24/1040398824.db2.gz HPKOJLIGQXLRTJ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167684992 1040398837 /nfs/dbraw/zinc/39/88/37/1040398837.db2.gz HPKOJLIGQXLRTJ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167684992 1040398849 /nfs/dbraw/zinc/39/88/49/1040398849.db2.gz HPKOJLIGQXLRTJ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1 ZINC000658280497 1040399550 /nfs/dbraw/zinc/39/95/50/1040399550.db2.gz IYESEMULTXPDHQ-LRDDRELGSA-N 2 1 319.399 4.123 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685026 1040400343 /nfs/dbraw/zinc/40/03/43/1040400343.db2.gz HPKOJLIGQXLRTJ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685026 1040400357 /nfs/dbraw/zinc/40/03/57/1040400357.db2.gz HPKOJLIGQXLRTJ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685026 1040400369 /nfs/dbraw/zinc/40/03/69/1040400369.db2.gz HPKOJLIGQXLRTJ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685026 1040400379 /nfs/dbraw/zinc/40/03/79/1040400379.db2.gz HPKOJLIGQXLRTJ-WBMJQRKESA-N 2 1 315.288 4.156 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC000658299956 1040408817 /nfs/dbraw/zinc/40/88/17/1040408817.db2.gz IQZXLTSLJKQSAI-BURNTYAHSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319478 1040417976 /nfs/dbraw/zinc/41/79/76/1040417976.db2.gz BZNBMSVMIPPNCZ-PKOBYXMFSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccco1 ZINC000658319478 1040417989 /nfs/dbraw/zinc/41/79/89/1040417989.db2.gz BZNBMSVMIPPNCZ-PKOBYXMFSA-N 2 1 324.468 4.233 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000569748352 1040537624 /nfs/dbraw/zinc/53/76/24/1040537624.db2.gz OVVUCCBHDKYHKA-YHELAOLJSA-N 2 1 314.517 4.280 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000414062675 1040803766 /nfs/dbraw/zinc/80/37/66/1040803766.db2.gz BZZSHQPKILQRFR-FUHWJXTLSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000414062672 1040804941 /nfs/dbraw/zinc/80/49/41/1040804941.db2.gz BZZSHQPKILQRFR-AEFFLSMTSA-N 2 1 317.864 4.161 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346514 1040905876 /nfs/dbraw/zinc/90/58/76/1040905876.db2.gz GVCBGZBDOOJJHD-XLIONFOSSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346514 1040905894 /nfs/dbraw/zinc/90/58/94/1040905894.db2.gz GVCBGZBDOOJJHD-XLIONFOSSA-N 2 1 323.484 4.033 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2(C4CCC4)CCC2)C3)cc1 ZINC000414168761 1040949902 /nfs/dbraw/zinc/94/99/02/1040949902.db2.gz ALMNJVBEQCRCDB-WKCHPHFGSA-N 2 1 324.512 4.494 20 0 DIADMP Cc1occc1CNCc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000414282528 1041078997 /nfs/dbraw/zinc/07/89/97/1041078997.db2.gz HMEHPLXNCGURFJ-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000414282528 1041079013 /nfs/dbraw/zinc/07/90/13/1041079013.db2.gz HMEHPLXNCGURFJ-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000414282528 1041079029 /nfs/dbraw/zinc/07/90/29/1041079029.db2.gz HMEHPLXNCGURFJ-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c(C)s1 ZINC000809739093 1041241266 /nfs/dbraw/zinc/24/12/66/1041241266.db2.gz XHGWDRFJKSYQBX-UHFFFAOYSA-N 2 1 302.487 4.059 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1cc[nH+]cc1Cl ZINC000301527990 1041244541 /nfs/dbraw/zinc/24/45/41/1041244541.db2.gz GPCABOMIWSFPHQ-YOEHRIQHSA-N 2 1 315.848 4.058 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1cc[nH+]cc1Cl ZINC000301527990 1041244562 /nfs/dbraw/zinc/24/45/62/1041244562.db2.gz GPCABOMIWSFPHQ-YOEHRIQHSA-N 2 1 315.848 4.058 20 0 DIADMP CCC[C@H]([NH2+][C@@H]1CCc2[nH+]ccn2C1)c1cc(C)sc1C ZINC000623934896 1041274558 /nfs/dbraw/zinc/27/45/58/1041274558.db2.gz IZWRVNHWMJECOV-ZBFHGGJFSA-N 2 1 303.475 4.007 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624121051 1041325635 /nfs/dbraw/zinc/32/56/35/1041325635.db2.gz MPRHGPCRNRKDRK-HIFRSBDPSA-N 2 1 323.550 4.132 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121326 1041337377 /nfs/dbraw/zinc/33/73/77/1041337377.db2.gz TZPKYLKXPQEJNN-HZPDHXFCSA-N 2 1 306.519 4.181 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309689186 1041399715 /nfs/dbraw/zinc/39/97/15/1041399715.db2.gz CJOHQDDVUDPQNF-AQNXPRMDSA-N 2 1 300.490 4.067 20 0 DIADMP c1csc(C2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)c1 ZINC000166665700 1041531104 /nfs/dbraw/zinc/53/11/04/1041531104.db2.gz MJCZHERVEHHBCW-DLBZAZTESA-N 2 1 318.530 4.166 20 0 DIADMP CC[C@H](CC(F)F)C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000659973579 1041564939 /nfs/dbraw/zinc/56/49/39/1041564939.db2.gz RYUWXSJJEAJHNX-SJLPKXTDSA-N 2 1 324.459 4.122 20 0 DIADMP CC[C@@H](CC(F)F)C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000660073663 1041598769 /nfs/dbraw/zinc/59/87/69/1041598769.db2.gz IRMGDPHPAYMSJO-INIZCTEOSA-N 2 1 324.459 4.264 20 0 DIADMP CC[C@@H](CC(F)F)C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000660073663 1041598777 /nfs/dbraw/zinc/59/87/77/1041598777.db2.gz IRMGDPHPAYMSJO-INIZCTEOSA-N 2 1 324.459 4.264 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000813789820 1041732516 /nfs/dbraw/zinc/73/25/16/1041732516.db2.gz DYPODBZVPYWNGA-AHSZXGJYSA-N 2 1 312.501 4.350 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001170727716 1041773324 /nfs/dbraw/zinc/77/33/24/1041773324.db2.gz PEUAZEMPLIQCQN-VHDKJUQLSA-N 2 1 324.512 4.206 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](c1cccnc1)C1CCCCC1 ZINC000652137352 1041845145 /nfs/dbraw/zinc/84/51/45/1041845145.db2.gz IFIHQBHWBWAIOI-IBGZPJMESA-N 2 1 303.494 4.023 20 0 DIADMP CC[N@@H+](CCCN[C@@H](C)c1cnccc1C)C1CCCCC1 ZINC000652238226 1041978841 /nfs/dbraw/zinc/97/88/41/1041978841.db2.gz YNRQDSGONQMUFZ-KRWDZBQOSA-N 2 1 303.494 4.085 20 0 DIADMP CC[N@H+](CCC[NH2+][C@@H](C)c1cnccc1C)C1CCCCC1 ZINC000652238226 1041978848 /nfs/dbraw/zinc/97/88/48/1041978848.db2.gz YNRQDSGONQMUFZ-KRWDZBQOSA-N 2 1 303.494 4.085 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H](C)c1cnccc1C)C1CCCCC1 ZINC000652238226 1041978855 /nfs/dbraw/zinc/97/88/55/1041978855.db2.gz YNRQDSGONQMUFZ-KRWDZBQOSA-N 2 1 303.494 4.085 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC000164654407 1042029988 /nfs/dbraw/zinc/02/99/88/1042029988.db2.gz KEDHEPCKLCKQFM-GFCCVEGCSA-N 2 1 309.816 4.115 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2cccc(Cl)c2C1 ZINC001170896768 1042145958 /nfs/dbraw/zinc/14/59/58/1042145958.db2.gz IZXIBQBFBGYLRV-RDJZCZTQSA-N 2 1 320.908 4.051 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cccc(Cl)c2C1 ZINC001170910518 1042155134 /nfs/dbraw/zinc/15/51/34/1042155134.db2.gz JQYJTASFGQBZQE-ULQDDVLXSA-N 2 1 320.908 4.178 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463774 1042176855 /nfs/dbraw/zinc/17/68/55/1042176855.db2.gz BKHWIFSGHHROOR-PXNSSMCTSA-N 2 1 316.489 4.141 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463774 1042176860 /nfs/dbraw/zinc/17/68/60/1042176860.db2.gz BKHWIFSGHHROOR-PXNSSMCTSA-N 2 1 316.489 4.141 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)cc1 ZINC000663467864 1042179372 /nfs/dbraw/zinc/17/93/72/1042179372.db2.gz IIWHWGPSNWGEEJ-HLAWJBBLSA-N 2 1 312.501 4.034 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC000663471804 1042184740 /nfs/dbraw/zinc/18/47/40/1042184740.db2.gz YKQUEFLJEFNRTA-GOEBONIOSA-N 2 1 306.519 4.083 20 0 DIADMP C[C@@H](CCN(C)Cc1cccs1)[N@@H+](C)Cc1cccs1 ZINC000431606432 1042230797 /nfs/dbraw/zinc/23/07/97/1042230797.db2.gz UODLMKWSPASQKW-AWEZNQCLSA-N 2 1 308.516 4.152 20 0 DIADMP C[C@@H](CC[N@H+](C)Cc1cccs1)N(C)Cc1cccs1 ZINC000431606432 1042230803 /nfs/dbraw/zinc/23/08/03/1042230803.db2.gz UODLMKWSPASQKW-AWEZNQCLSA-N 2 1 308.516 4.152 20 0 DIADMP C[C@@H](CC[N@@H+](C)Cc1cccs1)N(C)Cc1cccs1 ZINC000431606432 1042230811 /nfs/dbraw/zinc/23/08/11/1042230811.db2.gz UODLMKWSPASQKW-AWEZNQCLSA-N 2 1 308.516 4.152 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001167833462 1042235272 /nfs/dbraw/zinc/23/52/72/1042235272.db2.gz BLPPODMCZCDVJD-OAHLLOKOSA-N 2 1 308.897 4.209 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001167833571 1042236487 /nfs/dbraw/zinc/23/64/87/1042236487.db2.gz CRXVFBBWQYDTPX-FUHWJXTLSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001167833570 1042236614 /nfs/dbraw/zinc/23/66/14/1042236614.db2.gz CRXVFBBWQYDTPX-AEFFLSMTSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@@H](C)c1ccccc1OC ZINC001167836753 1042248261 /nfs/dbraw/zinc/24/82/61/1042248261.db2.gz GQXZVSPHKKTYFR-SJORKVTESA-N 2 1 306.494 4.199 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](CC)Cc1cccc(OC)c1 ZINC001167838092 1042250306 /nfs/dbraw/zinc/25/03/06/1042250306.db2.gz PUWDUYZVBDPXBX-KRWDZBQOSA-N 2 1 306.494 4.028 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC001167839969 1042251821 /nfs/dbraw/zinc/25/18/21/1042251821.db2.gz CYRVMJXQBRFBPV-KRWDZBQOSA-N 2 1 302.506 4.290 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC001167839972 1042252449 /nfs/dbraw/zinc/25/24/49/1042252449.db2.gz CYRVMJXQBRFBPV-QGZVFWFLSA-N 2 1 302.506 4.290 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278955214 1042252908 /nfs/dbraw/zinc/25/29/08/1042252908.db2.gz WFTNESACWIJYLJ-MRXNPFEDSA-N 2 1 309.457 4.160 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278955211 1042253090 /nfs/dbraw/zinc/25/30/90/1042253090.db2.gz WFTNESACWIJYLJ-INIZCTEOSA-N 2 1 309.457 4.160 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@H](C)Cc1ccccc1OC ZINC001167840369 1042253285 /nfs/dbraw/zinc/25/32/85/1042253285.db2.gz FQPXWJWUBNFJOZ-ZWKOTPCHSA-N 2 1 320.521 4.069 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)C(C)(C)Cc1ccccc1 ZINC001167841010 1042254247 /nfs/dbraw/zinc/25/42/47/1042254247.db2.gz JJKWMSMOUDXJNB-GOSISDBHSA-N 2 1 304.522 4.450 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@H]3CCc4[nH+]ccn4C3)oc2cc1C ZINC000278971437 1042255031 /nfs/dbraw/zinc/25/50/31/1042255031.db2.gz NPDYIXULVQNENR-JKSUJKDBSA-N 2 1 323.440 4.159 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCSc2ccccc2C1 ZINC001167842394 1042258246 /nfs/dbraw/zinc/25/82/46/1042258246.db2.gz WVQJXYBWINCBHQ-INIZCTEOSA-N 2 1 306.519 4.105 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2ccc(Cl)s2)CC1 ZINC000124059112 1042272097 /nfs/dbraw/zinc/27/20/97/1042272097.db2.gz PMWJTXQSWPCAFL-LBPRGKRZSA-N 2 1 300.899 4.173 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)c(F)c1 ZINC000467833451 1042293158 /nfs/dbraw/zinc/29/31/58/1042293158.db2.gz ZQRIVYFSZINLSE-HUUCEWRRSA-N 2 1 310.432 4.128 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CCSc2ccc(Cl)cc21)C[NH+]1CCCC1 ZINC000062078756 1042314652 /nfs/dbraw/zinc/31/46/52/1042314652.db2.gz IMCFVPRNFWDTLL-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP CC1(C)CC([NH2+]Cc2cccc(Cl)c2Cl)CC(C)(C)[NH2+]1 ZINC000021788978 1042324487 /nfs/dbraw/zinc/32/44/87/1042324487.db2.gz VTNBVGCGOFYDHJ-UHFFFAOYSA-N 2 1 315.288 4.392 20 0 DIADMP Cc1[nH+]c2ccccn2c1Nc1ccc(C[NH2+]C(C)(C)C)cc1 ZINC001204677690 1042324949 /nfs/dbraw/zinc/32/49/49/1042324949.db2.gz NWJBJMDXRKBMGQ-UHFFFAOYSA-N 2 1 308.429 4.274 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(C(F)F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000279715294 1042334382 /nfs/dbraw/zinc/33/43/82/1042334382.db2.gz LQWGRIVASVRMEV-YOEHRIQHSA-N 2 1 322.443 4.367 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482864 1042375207 /nfs/dbraw/zinc/37/52/07/1042375207.db2.gz RGOHZNOUUMCSGV-XGHQBKJUSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482864 1042375210 /nfs/dbraw/zinc/37/52/10/1042375210.db2.gz RGOHZNOUUMCSGV-XGHQBKJUSA-N 2 1 308.469 4.487 20 0 DIADMP Cc1cc(C)cc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000237635617 1042377731 /nfs/dbraw/zinc/37/77/31/1042377731.db2.gz PFUDBVIMLMPDHS-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H](C)c2ccccc2)cc1F ZINC000237582575 1042378067 /nfs/dbraw/zinc/37/80/67/1042378067.db2.gz DZJDCYPXWKRRSM-OAHLLOKOSA-N 2 1 323.415 4.213 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1cccnc1 ZINC000246492335 1042420759 /nfs/dbraw/zinc/42/07/59/1042420759.db2.gz AKWPYYRYABEFRY-QZTJIDSGSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411430386 1042445379 /nfs/dbraw/zinc/44/53/79/1042445379.db2.gz YALBMNYTSWOZKW-GOSISDBHSA-N 2 1 323.484 4.261 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000513488492 1042546976 /nfs/dbraw/zinc/54/69/76/1042546976.db2.gz VYNDFPIOXLDCIJ-QMJOVRGKSA-N 2 1 320.908 4.453 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000513488490 1042547126 /nfs/dbraw/zinc/54/71/26/1042547126.db2.gz VYNDFPIOXLDCIJ-MUMAZLPKSA-N 2 1 320.908 4.453 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2cccs2)C[N@H+]1Cc1ccccc1 ZINC000513495935 1042547753 /nfs/dbraw/zinc/54/77/53/1042547753.db2.gz XGXGMVKGFKDLDB-SJLPKXTDSA-N 2 1 314.498 4.138 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]Cc2cccs2)C[N@H+]1Cc1ccccc1 ZINC000513495936 1042548191 /nfs/dbraw/zinc/54/81/91/1042548191.db2.gz XGXGMVKGFKDLDB-WMZOPIPTSA-N 2 1 314.498 4.138 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000513524457 1042549597 /nfs/dbraw/zinc/54/95/97/1042549597.db2.gz GWQOYJWTLPDNLD-KSSFIOAISA-N 2 1 322.443 4.196 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1 ZINC000628322164 1042565505 /nfs/dbraw/zinc/56/55/05/1042565505.db2.gz FZEWQWUQAQDISF-QIJUGHKUSA-N 2 1 322.496 4.034 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@H]2CCC[C@H]21 ZINC000513690595 1042567461 /nfs/dbraw/zinc/56/74/61/1042567461.db2.gz KYKHOAYLMPFFQL-GRYCIOLGSA-N 2 1 319.301 4.017 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@H]2CCC[C@H]21 ZINC000513690595 1042567463 /nfs/dbraw/zinc/56/74/63/1042567463.db2.gz KYKHOAYLMPFFQL-GRYCIOLGSA-N 2 1 319.301 4.017 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@@H]1CCC[NH2+]C1 ZINC000420300106 1042599213 /nfs/dbraw/zinc/59/92/13/1042599213.db2.gz HEKMFQJTJQTZQD-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@@H](c1cccs1)[N@@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000420321341 1042599227 /nfs/dbraw/zinc/59/92/27/1042599227.db2.gz RHUHSWNKLBAGSI-DLBZAZTESA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccncc1Cl ZINC000421834375 1042655598 /nfs/dbraw/zinc/65/55/98/1042655598.db2.gz CDTWWUMCIWDNKX-SOUVJXGZSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccncc1Cl ZINC000421834375 1042655600 /nfs/dbraw/zinc/65/56/00/1042655600.db2.gz CDTWWUMCIWDNKX-SOUVJXGZSA-N 2 1 321.896 4.039 20 0 DIADMP c1ccc([C@H]2CCC[C@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000422714636 1042689251 /nfs/dbraw/zinc/68/92/51/1042689251.db2.gz RGHYHOIBAWXKFW-YSFYHYPLSA-N 2 1 320.480 4.406 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000422770344 1042689998 /nfs/dbraw/zinc/68/99/98/1042689998.db2.gz WFASQVIHRIAXGV-SDDRHHMPSA-N 2 1 301.261 4.032 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000422766877 1042690016 /nfs/dbraw/zinc/69/00/16/1042690016.db2.gz QIZLLZIUWQJMTH-RBUKOAKNSA-N 2 1 314.860 4.161 20 0 DIADMP C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc2ccccc2c1)C1C[NH2+]C1 ZINC000422904612 1042692091 /nfs/dbraw/zinc/69/20/91/1042692091.db2.gz HBXKDGRJFHEWRR-ZHRRBRCNSA-N 2 1 316.448 4.127 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C)c1c[nH+]ccc1N ZINC000422924292 1042692119 /nfs/dbraw/zinc/69/21/19/1042692119.db2.gz UDNMBDQTCHEZMV-ABXQLRGKSA-N 2 1 315.848 4.195 20 0 DIADMP C[C@@H]([NH2+]C[C@@H](C)c1c(Cl)cccc1Cl)c1c[nH+]ccc1N ZINC000422885978 1042692334 /nfs/dbraw/zinc/69/23/34/1042692334.db2.gz ZTUURHIDCGXSQN-GHMZBOCLSA-N 2 1 324.255 4.255 20 0 DIADMP CCCCOc1cccc(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000422886981 1042692472 /nfs/dbraw/zinc/69/24/72/1042692472.db2.gz AHFIUFRDJVJOBG-WOJBJXKFSA-N 2 1 310.441 4.100 20 0 DIADMP CCCOc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)c(C)c1 ZINC000423071811 1042696864 /nfs/dbraw/zinc/69/68/64/1042696864.db2.gz OXXINEOTVFSAPU-PMACEKPBSA-N 2 1 310.441 4.018 20 0 DIADMP C[C@@]1(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000423140199 1042698596 /nfs/dbraw/zinc/69/85/96/1042698596.db2.gz XRYUZMKDVISRDR-MLNNCEHLSA-N 2 1 320.480 4.263 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]CCC[NH2+]Cc2cccnc2)c2ccccc21 ZINC000423190885 1042700222 /nfs/dbraw/zinc/70/02/22/1042700222.db2.gz RYVMNBWCUHFTKC-LEWJYISDSA-N 2 1 323.484 4.036 20 0 DIADMP Cc1cc([C@@H]([NH2+]CCC[NH3+])c2cccc(Cl)c2)c(C)s1 ZINC000423190091 1042700629 /nfs/dbraw/zinc/70/06/29/1042700629.db2.gz NLSJNYQJVPXOSB-INIZCTEOSA-N 2 1 308.878 4.046 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+][C@@H](C[NH3+])CC(C)C)cs2)cs1 ZINC000423261490 1042703217 /nfs/dbraw/zinc/70/32/17/1042703217.db2.gz JWJDZFLNXYWVGH-BXUZGUMPSA-N 2 1 323.531 4.204 20 0 DIADMP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H]([NH3+])C(C)C ZINC000423278620 1042704698 /nfs/dbraw/zinc/70/46/98/1042704698.db2.gz RAOYISKBWYJECZ-XJKSGUPXSA-N 2 1 317.502 4.061 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cs1 ZINC000423295622 1042706259 /nfs/dbraw/zinc/70/62/59/1042706259.db2.gz XAUSBZYYVSNPTC-CHWSQXEVSA-N 2 1 303.475 4.137 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@@H]2CC[NH2+][C@@H](C)C2)c2ccccc2)c1 ZINC000423369411 1042708433 /nfs/dbraw/zinc/70/84/33/1042708433.db2.gz BYAYRPKKHWFPJS-FBBABVLZSA-N 2 1 308.469 4.123 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cc2c(ccc3ccccc23)o1 ZINC000423389314 1042709106 /nfs/dbraw/zinc/70/91/06/1042709106.db2.gz JHZBNDGKUDVFIJ-SUNYJGFJSA-N 2 1 308.425 4.235 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(Cl)cc1Cl ZINC000423386447 1042709537 /nfs/dbraw/zinc/70/95/37/1042709537.db2.gz HFEBZWBTAHACKO-ONERCXAPSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1)[C@H](C)[NH3+] ZINC000423453063 1042714838 /nfs/dbraw/zinc/71/48/38/1042714838.db2.gz XCWPEQVDQFCWOJ-MJBXVCDLSA-N 2 1 302.393 4.004 20 0 DIADMP COc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319162 1042733795 /nfs/dbraw/zinc/73/37/95/1042733795.db2.gz RTXRWHGJTZLCSA-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)c(Cl)c1 ZINC000424319162 1042733798 /nfs/dbraw/zinc/73/37/98/1042733798.db2.gz RTXRWHGJTZLCSA-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319162 1042733803 /nfs/dbraw/zinc/73/38/03/1042733803.db2.gz RTXRWHGJTZLCSA-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP C[C@@H]1CC2(C[N@H+]1Cc1c(Cl)oc3ccccc31)CC[NH2+]CC2 ZINC000424372028 1042738558 /nfs/dbraw/zinc/73/85/58/1042738558.db2.gz FCLCESMKOHZICF-CYBMUJFWSA-N 2 1 318.848 4.050 20 0 DIADMP COc1ccccc1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC000424379705 1042739021 /nfs/dbraw/zinc/73/90/21/1042739021.db2.gz VYQCXARILJSMGT-CDHQVMDDSA-N 2 1 324.468 4.283 20 0 DIADMP C[N@@H+](Cc1ccccc1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC000513976095 1042765081 /nfs/dbraw/zinc/76/50/81/1042765081.db2.gz QCQPXIBUBJUKBP-NRFANRHFSA-N 2 1 308.469 4.173 20 0 DIADMP C[NH+](Cc1ccccc1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC000513976095 1042765083 /nfs/dbraw/zinc/76/50/83/1042765083.db2.gz QCQPXIBUBJUKBP-NRFANRHFSA-N 2 1 308.469 4.173 20 0 DIADMP C[NH+](Cc1ccccc1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000513976095 1042765090 /nfs/dbraw/zinc/76/50/90/1042765090.db2.gz QCQPXIBUBJUKBP-NRFANRHFSA-N 2 1 308.469 4.173 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(Cl)cc1 ZINC001167961150 1042842777 /nfs/dbraw/zinc/84/27/77/1042842777.db2.gz FQFXVXLPGPPKIT-RIJRJKGBSA-N 2 1 318.892 4.396 20 0 DIADMP CC(C)Oc1ccccc1C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000517537544 1042883665 /nfs/dbraw/zinc/88/36/65/1042883665.db2.gz ZXWBKNUEKIKUTH-GOSISDBHSA-N 2 1 318.505 4.218 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+][C@H]1CCC[C@@H]3CCCC[C@H]31)C2 ZINC001167968570 1042956833 /nfs/dbraw/zinc/95/68/33/1042956833.db2.gz RQHBLCBTIJDUTA-SXIALBCKSA-N 2 1 316.533 4.340 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cccc(F)c1 ZINC001167971495 1042963501 /nfs/dbraw/zinc/96/35/01/1042963501.db2.gz WJOSVEHWBSUSCU-RAFMOHDBSA-N 2 1 316.464 4.272 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167978160 1042973548 /nfs/dbraw/zinc/97/35/48/1042973548.db2.gz KYZDONZOWQXSBP-WVVQBRDUSA-N 2 1 324.512 4.102 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc3ccccc32)C1 ZINC000520205843 1043024054 /nfs/dbraw/zinc/02/40/54/1043024054.db2.gz GIWBDGGKNRPIDA-SFHVURJKSA-N 2 1 310.485 4.442 20 0 DIADMP C[N@@H+](CCCc1ccc(Cl)cc1)CC[C@H]1CCCC[NH+]1C ZINC000441359282 1043037999 /nfs/dbraw/zinc/03/79/99/1043037999.db2.gz QWZWZAUCRSJJKY-GOSISDBHSA-N 2 1 308.897 4.079 20 0 DIADMP C[NH+](CCCc1ccc(Cl)cc1)CC[C@H]1CCCC[N@@H+]1C ZINC000441359282 1043038002 /nfs/dbraw/zinc/03/80/02/1043038002.db2.gz QWZWZAUCRSJJKY-GOSISDBHSA-N 2 1 308.897 4.079 20 0 DIADMP C[NH+](CCCc1ccc(Cl)cc1)CC[C@H]1CCCC[N@H+]1C ZINC000441359282 1043038003 /nfs/dbraw/zinc/03/80/03/1043038003.db2.gz QWZWZAUCRSJJKY-GOSISDBHSA-N 2 1 308.897 4.079 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441355902 1043038861 /nfs/dbraw/zinc/03/88/61/1043038861.db2.gz LFLCEFYSHRHSNW-HIFRSBDPSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441355902 1043038865 /nfs/dbraw/zinc/03/88/65/1043038865.db2.gz LFLCEFYSHRHSNW-HIFRSBDPSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC000441355902 1043038869 /nfs/dbraw/zinc/03/88/69/1043038869.db2.gz LFLCEFYSHRHSNW-HIFRSBDPSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC000441355902 1043038874 /nfs/dbraw/zinc/03/88/74/1043038874.db2.gz LFLCEFYSHRHSNW-HIFRSBDPSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441355913 1043038923 /nfs/dbraw/zinc/03/89/23/1043038923.db2.gz LFLCEFYSHRHSNW-ZFWWWQNUSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441355913 1043038925 /nfs/dbraw/zinc/03/89/25/1043038925.db2.gz LFLCEFYSHRHSNW-ZFWWWQNUSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC000441355913 1043038927 /nfs/dbraw/zinc/03/89/27/1043038927.db2.gz LFLCEFYSHRHSNW-ZFWWWQNUSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC000441355913 1043038929 /nfs/dbraw/zinc/03/89/29/1043038929.db2.gz LFLCEFYSHRHSNW-ZFWWWQNUSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441402717 1043043582 /nfs/dbraw/zinc/04/35/82/1043043582.db2.gz BGGQCZNGVAFSAL-VCBZYWHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441402717 1043043591 /nfs/dbraw/zinc/04/35/91/1043043591.db2.gz BGGQCZNGVAFSAL-VCBZYWHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441402717 1043043597 /nfs/dbraw/zinc/04/35/97/1043043597.db2.gz BGGQCZNGVAFSAL-VCBZYWHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441402717 1043043605 /nfs/dbraw/zinc/04/36/05/1043043605.db2.gz BGGQCZNGVAFSAL-VCBZYWHSSA-N 2 1 318.892 4.350 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625246 1043052794 /nfs/dbraw/zinc/05/27/94/1043052794.db2.gz CFXKMYBLAGPAOW-AZUAARDMSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625246 1043052807 /nfs/dbraw/zinc/05/28/07/1043052807.db2.gz CFXKMYBLAGPAOW-AZUAARDMSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625246 1043052817 /nfs/dbraw/zinc/05/28/17/1043052817.db2.gz CFXKMYBLAGPAOW-AZUAARDMSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625246 1043052827 /nfs/dbraw/zinc/05/28/27/1043052827.db2.gz CFXKMYBLAGPAOW-AZUAARDMSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000794827913 1043067426 /nfs/dbraw/zinc/06/74/26/1043067426.db2.gz MBGRMVYOVVQCOX-SIKLNZKXSA-N 2 1 320.480 4.094 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1F ZINC000178699458 1043136143 /nfs/dbraw/zinc/13/61/43/1043136143.db2.gz FKTSOLCNEWGKQV-OLZOCXBDSA-N 2 1 321.465 4.039 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(O)c2)cc1 ZINC000178756829 1043137566 /nfs/dbraw/zinc/13/75/66/1043137566.db2.gz ILEICEPHKYFVQY-HUUCEWRRSA-N 2 1 321.424 4.298 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)cc2F)c1 ZINC000189319875 1043149316 /nfs/dbraw/zinc/14/93/16/1043149316.db2.gz CVXHLKMXFRLFMK-UHFFFAOYSA-N 2 1 320.839 4.221 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@@H+]1C ZINC000246931433 1043159915 /nfs/dbraw/zinc/15/99/15/1043159915.db2.gz GNCQHCNZGCEFET-SUYBPPKGSA-N 2 1 310.432 4.124 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@H+]1C ZINC000246931433 1043159918 /nfs/dbraw/zinc/15/99/18/1043159918.db2.gz GNCQHCNZGCEFET-SUYBPPKGSA-N 2 1 310.432 4.124 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866217482 1043160654 /nfs/dbraw/zinc/16/06/54/1043160654.db2.gz FEVHZFILVNNHOZ-LBPRGKRZSA-N 2 1 321.852 4.006 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1cccc(SC(F)(F)F)c1 ZINC000866217175 1043160693 /nfs/dbraw/zinc/16/06/93/1043160693.db2.gz DIZAJRFZDBMBPA-NSHDSACASA-N 2 1 318.408 4.043 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1cc2c(ccnc2Cl)o1 ZINC000866219210 1043160868 /nfs/dbraw/zinc/16/08/68/1043160868.db2.gz IVKWUCAZKOOHKS-CYBMUJFWSA-N 2 1 321.852 4.008 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866289420 1043174046 /nfs/dbraw/zinc/17/40/46/1043174046.db2.gz CSKXVPXMHPUWAL-GFCCVEGCSA-N 2 1 321.852 4.005 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccnc1 ZINC000184833739 1043190275 /nfs/dbraw/zinc/19/02/75/1043190275.db2.gz KOFRRUVQSPOPOQ-NRFANRHFSA-N 2 1 323.484 4.177 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc2c(ccnc2Cl)o1 ZINC000866370357 1043191880 /nfs/dbraw/zinc/19/18/80/1043191880.db2.gz VFWRFOOCRVJAHR-LBPRGKRZSA-N 2 1 321.852 4.006 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cs1 ZINC000186226145 1043219389 /nfs/dbraw/zinc/21/93/89/1043219389.db2.gz WUGZHLBHYCXJMJ-AWEZNQCLSA-N 2 1 317.502 4.179 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)CC1 ZINC000427607163 1043238287 /nfs/dbraw/zinc/23/82/87/1043238287.db2.gz RWBWZRULVCBDDG-JOCHJYFZSA-N 2 1 320.480 4.415 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000427610538 1043242994 /nfs/dbraw/zinc/24/29/94/1043242994.db2.gz VHSPOAGBURPGIW-FXAWDEMLSA-N 2 1 300.490 4.158 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005477 1043249176 /nfs/dbraw/zinc/24/91/76/1043249176.db2.gz IYTLKZPHGWYDAY-MVJTYMMSSA-N 2 1 322.443 4.205 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[C@@H](F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007043 1043259238 /nfs/dbraw/zinc/25/92/38/1043259238.db2.gz QMDYJJZTVOAXLJ-QQXMDYFESA-N 2 1 318.480 4.156 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2occc21 ZINC000192667025 1043273069 /nfs/dbraw/zinc/27/30/69/1043273069.db2.gz ZZIREEZEIKBHHL-IBGZPJMESA-N 2 1 312.457 4.287 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@@H+]1C ZINC000427691653 1043297886 /nfs/dbraw/zinc/29/78/86/1043297886.db2.gz VVVDOMPMKBIPCI-QGCDCVKKSA-N 2 1 320.480 4.413 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@H+]1C ZINC000427691653 1043297889 /nfs/dbraw/zinc/29/78/89/1043297889.db2.gz VVVDOMPMKBIPCI-QGCDCVKKSA-N 2 1 320.480 4.413 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)ccc1-c1ccccc1 ZINC000427862915 1043311978 /nfs/dbraw/zinc/31/19/78/1043311978.db2.gz IPDMOXWCQYXBHN-UTKZUKDTSA-N 2 1 308.469 4.092 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC001168011376 1043323949 /nfs/dbraw/zinc/32/39/49/1043323949.db2.gz ONECIQCXPJNEQU-ZMMAXQRCSA-N 2 1 302.506 4.452 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccncc1 ZINC000268936996 1043344089 /nfs/dbraw/zinc/34/40/89/1043344089.db2.gz YYDPBEATZDFNQU-QMMLZNLJSA-N 2 1 323.484 4.175 20 0 DIADMP c1ccc([C@H]2CC[C@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000665274447 1043358078 /nfs/dbraw/zinc/35/80/78/1043358078.db2.gz QINIKEMZXAPTOE-NCYKPQTJSA-N 2 1 306.453 4.016 20 0 DIADMP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2csc(C)n2)c1 ZINC000269440647 1043364852 /nfs/dbraw/zinc/36/48/52/1043364852.db2.gz SNVDIZWVNISHCS-CQSZACIVSA-N 2 1 317.502 4.144 20 0 DIADMP C[C@H](CC[NH2+]C1CCC(C(F)F)CC1)[N@@H+](C)Cc1ccccc1 ZINC000442760903 1043412452 /nfs/dbraw/zinc/41/24/52/1043412452.db2.gz AUNIUZHHZPVSRA-FAEJEUNOSA-N 2 1 324.459 4.311 20 0 DIADMP C[C@H]([NH2+]C1CCC(C(F)F)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000442839795 1043434728 /nfs/dbraw/zinc/43/47/28/1043434728.db2.gz YEPOLZCPJMAHAK-JWMHWRSXSA-N 2 1 314.464 4.053 20 0 DIADMP CC[C@H](CCC(F)(F)F)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000872060443 1043443173 /nfs/dbraw/zinc/44/31/73/1043443173.db2.gz QBAUAASKJUTJEU-RBSFLKMASA-N 2 1 320.443 4.350 20 0 DIADMP CC[NH+]1CCC([NH2+]Cc2sc3ccc(Cl)cc3c2C)CC1 ZINC000442856480 1043446000 /nfs/dbraw/zinc/44/60/00/1043446000.db2.gz LNFVOHDGTPQRGC-UHFFFAOYSA-N 2 1 322.905 4.437 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)c1 ZINC000123955146 1043457593 /nfs/dbraw/zinc/45/75/93/1043457593.db2.gz OPPDLTXRVAMVQM-CQSZACIVSA-N 2 1 317.864 4.038 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+][C@H](C)c1c[nH+]ccc1N ZINC000925831087 1043480533 /nfs/dbraw/zinc/48/05/33/1043480533.db2.gz LWDHCGUOGYFHRA-CQSZACIVSA-N 2 1 305.425 4.061 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc2cc[nH]c21 ZINC000348964350 1043483419 /nfs/dbraw/zinc/48/34/19/1043483419.db2.gz KNYDUUSVAXQFIK-UHFFFAOYSA-N 2 1 321.468 4.252 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000349143482 1043493094 /nfs/dbraw/zinc/49/30/94/1043493094.db2.gz BLJFHSIKTMZFHB-RDJZCZTQSA-N 2 1 315.461 4.074 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000349143482 1043493102 /nfs/dbraw/zinc/49/31/02/1043493102.db2.gz BLJFHSIKTMZFHB-RDJZCZTQSA-N 2 1 315.461 4.074 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000349143483 1043494024 /nfs/dbraw/zinc/49/40/24/1043494024.db2.gz BLJFHSIKTMZFHB-WBVHZDCISA-N 2 1 315.461 4.074 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000349143483 1043494028 /nfs/dbraw/zinc/49/40/28/1043494028.db2.gz BLJFHSIKTMZFHB-WBVHZDCISA-N 2 1 315.461 4.074 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCCc2c(Cl)cccc21 ZINC000349463209 1043508117 /nfs/dbraw/zinc/50/81/17/1043508117.db2.gz SLZYUCDZGRQZFI-ACJLOTCBSA-N 2 1 317.864 4.148 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2csc(Cl)c2)CC1 ZINC000191233611 1043551598 /nfs/dbraw/zinc/55/15/98/1043551598.db2.gz JYGFJPFNDVWEPD-LBPRGKRZSA-N 2 1 300.899 4.317 20 0 DIADMP Cc1occc1C[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168019229 1043566548 /nfs/dbraw/zinc/56/65/48/1043566548.db2.gz HPHHVMFABQGLID-HZPDHXFCSA-N 2 1 312.457 4.119 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069267 1043568619 /nfs/dbraw/zinc/56/86/19/1043568619.db2.gz URDLHIYQAKDADX-WMLDXEAASA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069267 1043568621 /nfs/dbraw/zinc/56/86/21/1043568621.db2.gz URDLHIYQAKDADX-WMLDXEAASA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H]([NH2+]Cc1c(F)cc(F)cc1F)c1cccc(C[NH+](C)C)c1 ZINC000926488691 1043584093 /nfs/dbraw/zinc/58/40/93/1043584093.db2.gz JZFMHWKOXRTHDW-LBPRGKRZSA-N 2 1 322.374 4.016 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](CCC(C)C)c1ccoc1 ZINC000353401471 1043604100 /nfs/dbraw/zinc/60/41/00/1043604100.db2.gz IDPILBABTYMZPR-YJBOKZPZSA-N 2 1 303.450 4.188 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](CCC(C)C)c1ccoc1 ZINC000353520642 1043613931 /nfs/dbraw/zinc/61/39/31/1043613931.db2.gz OGMXWKPUKRRRHN-SFHVURJKSA-N 2 1 303.450 4.332 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cccc(C)c1 ZINC000353533231 1043613767 /nfs/dbraw/zinc/61/37/67/1043613767.db2.gz XUCXBRJFQKFHGS-HXUWFJFHSA-N 2 1 323.484 4.408 20 0 DIADMP CC(C)CC[NH+]1CCC([NH2+][C@@H](c2ccccn2)C2CCC2)CC1 ZINC000926751477 1043624202 /nfs/dbraw/zinc/62/42/02/1043624202.db2.gz APOFJSAAZHKFSG-HXUWFJFHSA-N 2 1 315.505 4.023 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(-c3ccccn3)c2)C[C@@H]1C ZINC000353748369 1043641331 /nfs/dbraw/zinc/64/13/31/1043641331.db2.gz RKCBLQPRPCECCY-FXAWDEMLSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@@H]1C ZINC000353748369 1043641349 /nfs/dbraw/zinc/64/13/49/1043641349.db2.gz RKCBLQPRPCECCY-FXAWDEMLSA-N 2 1 323.484 4.053 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(-c3ccccn3)c2)C[C@@H]1C ZINC000353748369 1043641358 /nfs/dbraw/zinc/64/13/58/1043641358.db2.gz RKCBLQPRPCECCY-FXAWDEMLSA-N 2 1 323.484 4.053 20 0 DIADMP CC(C)C[C@H](C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1)c1ccccc1 ZINC000474157402 1043673723 /nfs/dbraw/zinc/67/37/23/1043673723.db2.gz XGBKUUHIGTWSRF-RTBURBONSA-N 2 1 311.473 4.419 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCNCc1ccc(C(F)(F)F)cc1 ZINC000034081372 1043707887 /nfs/dbraw/zinc/70/78/87/1043707887.db2.gz UUKHGWXBQNGNMB-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000034081372 1043707898 /nfs/dbraw/zinc/70/78/98/1043707898.db2.gz UUKHGWXBQNGNMB-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000034081372 1043707908 /nfs/dbraw/zinc/70/79/08/1043707908.db2.gz UUKHGWXBQNGNMB-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474269038 1043719457 /nfs/dbraw/zinc/71/94/57/1043719457.db2.gz YSOLGJLFVUQJRT-AZUAARDMSA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474269038 1043719469 /nfs/dbraw/zinc/71/94/69/1043719469.db2.gz YSOLGJLFVUQJRT-AZUAARDMSA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474269038 1043719481 /nfs/dbraw/zinc/71/94/81/1043719481.db2.gz YSOLGJLFVUQJRT-AZUAARDMSA-N 2 1 302.506 4.090 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876917751 1043723546 /nfs/dbraw/zinc/72/35/46/1043723546.db2.gz VMWJRVUNAUBNHI-HGHGUNKESA-N 2 1 324.468 4.168 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876917751 1043723558 /nfs/dbraw/zinc/72/35/58/1043723558.db2.gz VMWJRVUNAUBNHI-HGHGUNKESA-N 2 1 324.468 4.168 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(C[NH+](C)C)CCCC2)c2ccsc2S1 ZINC000355055162 1043742534 /nfs/dbraw/zinc/74/25/34/1043742534.db2.gz DDGGZIUZRVMTBI-ZFWWWQNUSA-N 2 1 324.559 4.385 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1cccc(O)c1 ZINC000126619584 1043782190 /nfs/dbraw/zinc/78/21/90/1043782190.db2.gz IPQXNIIWRJRBTE-MRXNPFEDSA-N 2 1 316.489 4.088 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc2cccc(F)c2o1 ZINC000355729852 1043786328 /nfs/dbraw/zinc/78/63/28/1043786328.db2.gz GMDNOSSDXYDJDW-CYBMUJFWSA-N 2 1 315.392 4.208 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000474463247 1043789662 /nfs/dbraw/zinc/78/96/62/1043789662.db2.gz BQOMRKMTHZXINW-CABCVRRESA-N 2 1 319.518 4.108 20 0 DIADMP CC(C)C[C@H](C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000474476229 1043795874 /nfs/dbraw/zinc/79/58/74/1043795874.db2.gz OSCJKLHRUHPKMP-AQNXPRMDSA-N 2 1 300.490 4.033 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000356395827 1043835786 /nfs/dbraw/zinc/83/57/86/1043835786.db2.gz UITPEBIDKNSZTM-YVNCXZRQSA-N 2 1 309.457 4.150 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000356395827 1043835799 /nfs/dbraw/zinc/83/57/99/1043835799.db2.gz UITPEBIDKNSZTM-YVNCXZRQSA-N 2 1 309.457 4.150 20 0 DIADMP C[C@H]1CC([N@H+](C)C2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040196 1043875333 /nfs/dbraw/zinc/87/53/33/1043875333.db2.gz KSJVHUKIYUUWHV-GJZGRUSLSA-N 2 1 322.443 4.158 20 0 DIADMP C[C@H]1CC([N@@H+](C)C2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168040196 1043875347 /nfs/dbraw/zinc/87/53/47/1043875347.db2.gz KSJVHUKIYUUWHV-GJZGRUSLSA-N 2 1 322.443 4.158 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168040748 1043883398 /nfs/dbraw/zinc/88/33/98/1043883398.db2.gz OWFVBMKIQPEVOC-OPVJXMOQSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168040748 1043883417 /nfs/dbraw/zinc/88/34/17/1043883417.db2.gz OWFVBMKIQPEVOC-OPVJXMOQSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC1(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412701 1043886250 /nfs/dbraw/zinc/88/62/50/1043886250.db2.gz ZODHWLYMFSPGCO-HRCADAONSA-N 2 1 314.464 4.055 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000474713745 1043895618 /nfs/dbraw/zinc/89/56/18/1043895618.db2.gz PXZDOTRDVVRBOI-ICSRJNTNSA-N 2 1 302.506 4.136 20 0 DIADMP CC[C@H](C)[N@H+](C)CC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709024 1043897266 /nfs/dbraw/zinc/89/72/66/1043897266.db2.gz NFBWAYMJLOTDRA-RFQIPJPRSA-N 2 1 314.926 4.213 20 0 DIADMP CC[C@H](C)[N@@H+](C)CC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709024 1043897281 /nfs/dbraw/zinc/89/72/81/1043897281.db2.gz NFBWAYMJLOTDRA-RFQIPJPRSA-N 2 1 314.926 4.213 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)C1CCCCC1 ZINC000474729814 1043904380 /nfs/dbraw/zinc/90/43/80/1043904380.db2.gz GUDGEZOTJRTLRC-QUCCMNQESA-N 2 1 314.517 4.109 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCC[C@H](C(C)C)C3)CC2)[nH+]c1 ZINC000474796236 1043921270 /nfs/dbraw/zinc/92/12/70/1043921270.db2.gz LPWXTINCBYINCZ-PKOBYXMFSA-N 2 1 315.505 4.163 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1 ZINC000358054983 1044011818 /nfs/dbraw/zinc/01/18/18/1044011818.db2.gz BIRHGJALKYCUAR-NSHGMRRFSA-N 2 1 318.505 4.007 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1C[C@@H](C)Sc2sccc21 ZINC000358088205 1044017698 /nfs/dbraw/zinc/01/76/98/1044017698.db2.gz AFPJBXIFWIDWNI-JMSVASOKSA-N 2 1 321.515 4.104 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000443854999 1044040151 /nfs/dbraw/zinc/04/01/51/1044040151.db2.gz OZUCROAYMGLHML-JRBPQWBISA-N 2 1 304.522 4.221 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000562042140 1044054065 /nfs/dbraw/zinc/05/40/65/1044054065.db2.gz USORTGXMNKERRN-UZLBHIALSA-N 2 1 312.457 4.190 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000562058768 1044056184 /nfs/dbraw/zinc/05/61/84/1044056184.db2.gz RRUFRFDWFXLOMI-GUDVDZBRSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000562058768 1044056198 /nfs/dbraw/zinc/05/61/98/1044056198.db2.gz RRUFRFDWFXLOMI-GUDVDZBRSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3sccc32)C1 ZINC000358337953 1044057810 /nfs/dbraw/zinc/05/78/10/1044057810.db2.gz GEONCZFQVCBFAC-WBVHZDCISA-N 2 1 306.519 4.083 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3sccc32)C1 ZINC000358337940 1044057899 /nfs/dbraw/zinc/05/78/99/1044057899.db2.gz GEONCZFQVCBFAC-RDJZCZTQSA-N 2 1 306.519 4.083 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000358475836 1044074503 /nfs/dbraw/zinc/07/45/03/1044074503.db2.gz WLIQCZZECXTJNC-MDKPJZGXSA-N 2 1 312.501 4.307 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cccnc1 ZINC000359298170 1044153282 /nfs/dbraw/zinc/15/32/82/1044153282.db2.gz YMWABMUXAKFMLQ-MJGOQNOKSA-N 2 1 303.494 4.023 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000359427007 1044165853 /nfs/dbraw/zinc/16/58/53/1044165853.db2.gz FSOPHWMYGVMMPT-RHSMWYFYSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000359427007 1044165859 /nfs/dbraw/zinc/16/58/59/1044165859.db2.gz FSOPHWMYGVMMPT-RHSMWYFYSA-N 2 1 322.493 4.217 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2Cc3ccccc32)cc1 ZINC000346979040 1044178572 /nfs/dbraw/zinc/17/85/72/1044178572.db2.gz WXQBGKCSZNWRBI-KXBFYZLASA-N 2 1 317.436 4.171 20 0 DIADMP CC[C@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccc(OC(F)F)cc1 ZINC000359637675 1044185576 /nfs/dbraw/zinc/18/55/76/1044185576.db2.gz ISCXLMXJYASNNB-INIZCTEOSA-N 2 1 314.420 4.059 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1OC ZINC000360029634 1044227267 /nfs/dbraw/zinc/22/72/67/1044227267.db2.gz QEUQSCIGKJNCEU-UXLLHSPISA-N 2 1 322.880 4.016 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1OC ZINC000360029634 1044227277 /nfs/dbraw/zinc/22/72/77/1044227277.db2.gz QEUQSCIGKJNCEU-UXLLHSPISA-N 2 1 322.880 4.016 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444208232 1044238573 /nfs/dbraw/zinc/23/85/73/1044238573.db2.gz CMBNIGREEZJWQS-HOTGVXAUSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444208232 1044238587 /nfs/dbraw/zinc/23/85/87/1044238587.db2.gz CMBNIGREEZJWQS-HOTGVXAUSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CC(C)(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168052365 1044244993 /nfs/dbraw/zinc/24/49/93/1044244993.db2.gz KOPYUHDEHCWOKW-IZZQQSIFSA-N 2 1 302.506 4.406 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CC(C)(C)C)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168052365 1044244964 /nfs/dbraw/zinc/24/49/64/1044244964.db2.gz KOPYUHDEHCWOKW-IZZQQSIFSA-N 2 1 302.506 4.406 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CC(C)(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168052365 1044244977 /nfs/dbraw/zinc/24/49/77/1044244977.db2.gz KOPYUHDEHCWOKW-IZZQQSIFSA-N 2 1 302.506 4.406 20 0 DIADMP FC1(F)CCC[C@@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000883266710 1044254413 /nfs/dbraw/zinc/25/44/13/1044254413.db2.gz HPNAIQWVEIWSBR-QGZVFWFLSA-N 2 1 322.443 4.066 20 0 DIADMP C[C@H]1CC([N@H+](C)C2CCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053582 1044262741 /nfs/dbraw/zinc/26/27/41/1044262741.db2.gz PIOFTAFIQYYJCP-IRXDYDNUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@H]1CC([N@@H+](C)C2CCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168053582 1044262751 /nfs/dbraw/zinc/26/27/51/1044262751.db2.gz PIOFTAFIQYYJCP-IRXDYDNUSA-N 2 1 300.490 4.302 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CCCC34CC[NH+](C)CC4)o2)cc1 ZINC000475124902 1044280150 /nfs/dbraw/zinc/28/01/50/1044280150.db2.gz LEVJAEIXCHFQJM-UHFFFAOYSA-N 2 1 324.468 4.315 20 0 DIADMP C[C@@H](C[N@H+]1CCCC12CC[NH+](C)CC2)c1cccc(Cl)c1 ZINC000475130726 1044281727 /nfs/dbraw/zinc/28/17/27/1044281727.db2.gz PAUAUKGDWNMKJI-HNNXBMFYSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2c(Cl)oc3ccccc32)CC1 ZINC000475131794 1044282929 /nfs/dbraw/zinc/28/29/29/1044282929.db2.gz VZTFFVUZILKELK-UHFFFAOYSA-N 2 1 318.848 4.146 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCC(C)(C)c2ccccc21 ZINC000360656783 1044295735 /nfs/dbraw/zinc/29/57/35/1044295735.db2.gz KSLSZUBYYFALTG-KXBFYZLASA-N 2 1 311.473 4.230 20 0 DIADMP C[C@@H]1CC([N@@H+](C)CCC2CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168058702 1044307204 /nfs/dbraw/zinc/30/72/04/1044307204.db2.gz BVWMORQOXIJYID-IAGOWNOFSA-N 2 1 300.490 4.160 20 0 DIADMP Clc1ccc(CC2([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000293780261 1044327160 /nfs/dbraw/zinc/32/71/60/1044327160.db2.gz TVTXDUSABDEVPV-ZWKOTPCHSA-N 2 1 318.892 4.022 20 0 DIADMP CC[C@H]([NH2+]CCn1cc[nH+]c1C)c1ccc2cc(OC)ccc2c1 ZINC000360942747 1044332733 /nfs/dbraw/zinc/33/27/33/1044332733.db2.gz QHXPKQCMDHXQHT-FQEVSTJZSA-N 2 1 323.440 4.094 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069953 1044353511 /nfs/dbraw/zinc/35/35/11/1044353511.db2.gz SNQJKWMZHUJLGE-FMKPAKJESA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069953 1044353525 /nfs/dbraw/zinc/35/35/25/1044353525.db2.gz SNQJKWMZHUJLGE-FMKPAKJESA-N 2 1 324.559 4.384 20 0 DIADMP C[C@@H]1C[C@@H](N2CCCCC23CC3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168061460 1044364631 /nfs/dbraw/zinc/36/46/31/1044364631.db2.gz IMBVEHJJECFBSY-OPVJXMOQSA-N 2 1 312.501 4.447 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000361378148 1044398661 /nfs/dbraw/zinc/39/86/61/1044398661.db2.gz QOCGATYISZWIIX-QUCCMNQESA-N 2 1 322.452 4.037 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(F)c2ccccc21 ZINC000294374963 1044412862 /nfs/dbraw/zinc/41/28/62/1044412862.db2.gz RDFGNOUHQOXXLA-HUUCEWRRSA-N 2 1 323.415 4.089 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000361588529 1044421652 /nfs/dbraw/zinc/42/16/52/1044421652.db2.gz FNGMVRSZOJQPFA-LSDHHAIUSA-N 2 1 317.399 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000361588529 1044421660 /nfs/dbraw/zinc/42/16/60/1044421660.db2.gz FNGMVRSZOJQPFA-LSDHHAIUSA-N 2 1 317.399 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000361588528 1044422395 /nfs/dbraw/zinc/42/23/95/1044422395.db2.gz FNGMVRSZOJQPFA-HUUCEWRRSA-N 2 1 317.399 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000361588528 1044422402 /nfs/dbraw/zinc/42/24/02/1044422402.db2.gz FNGMVRSZOJQPFA-HUUCEWRRSA-N 2 1 317.399 4.025 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000565257154 1044423780 /nfs/dbraw/zinc/42/37/80/1044423780.db2.gz DGLSJXGIAZJXIQ-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000565257154 1044423794 /nfs/dbraw/zinc/42/37/94/1044423794.db2.gz DGLSJXGIAZJXIQ-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000565257154 1044423798 /nfs/dbraw/zinc/42/37/98/1044423798.db2.gz DGLSJXGIAZJXIQ-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000565257154 1044423804 /nfs/dbraw/zinc/42/38/04/1044423804.db2.gz DGLSJXGIAZJXIQ-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000565257154 1044423808 /nfs/dbraw/zinc/42/38/08/1044423808.db2.gz DGLSJXGIAZJXIQ-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1C[C@@H](C)Sc2sccc21 ZINC000361763437 1044441376 /nfs/dbraw/zinc/44/13/76/1044441376.db2.gz DPJDVJTYSLXBQH-IUODEOHRSA-N 2 1 321.515 4.248 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H](C)c2ccc(Cl)cc2)C1 ZINC000566587744 1044501067 /nfs/dbraw/zinc/50/10/67/1044501067.db2.gz FNJBFTCLAIOGEW-OWCLPIDISA-N 2 1 308.897 4.152 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475575428 1044514987 /nfs/dbraw/zinc/51/49/87/1044514987.db2.gz ZECZARKQAXBSPH-PTNGSMBKSA-N 2 1 318.892 4.350 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](c1cccc(F)c1)C1CCCC1 ZINC000566981336 1044531611 /nfs/dbraw/zinc/53/16/11/1044531611.db2.gz AFVPQRICGVHLSB-LJQANCHMSA-N 2 1 315.436 4.013 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000295819122 1044563598 /nfs/dbraw/zinc/56/35/98/1044563598.db2.gz BQYBCBKNJDEDDK-CCNLRDMRSA-N 2 1 318.530 4.463 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3cccs3)cc2)C1 ZINC000444634449 1044580512 /nfs/dbraw/zinc/58/05/12/1044580512.db2.gz AZLWVLVVIWRLCT-QGZVFWFLSA-N 2 1 314.498 4.189 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000444691554 1044606865 /nfs/dbraw/zinc/60/68/65/1044606865.db2.gz JSDZTNSNGYFGJM-LJQANCHMSA-N 2 1 314.498 4.331 20 0 DIADMP Cc1ccsc1C[NH+](C)CCC[N@@H+](C)Cc1sccc1C ZINC000568335504 1044617031 /nfs/dbraw/zinc/61/70/31/1044617031.db2.gz ZCGKQESLLLLWKU-UHFFFAOYSA-N 2 1 322.543 4.380 20 0 DIADMP Cc1ccsc1C[NH+](C)CCC[N@H+](C)Cc1sccc1C ZINC000568335504 1044617041 /nfs/dbraw/zinc/61/70/41/1044617041.db2.gz ZCGKQESLLLLWKU-UHFFFAOYSA-N 2 1 322.543 4.380 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000568329661 1044617055 /nfs/dbraw/zinc/61/70/55/1044617055.db2.gz AVZFMJWJDWWNQH-OXQOHEQNSA-N 2 1 316.464 4.082 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)cc1 ZINC000348367690 1044622156 /nfs/dbraw/zinc/62/21/56/1044622156.db2.gz FSENHVBDBXBKIU-HIFRSBDPSA-N 2 1 319.399 4.267 20 0 DIADMP CC(C)CCn1cccc1C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000523391224 1044627099 /nfs/dbraw/zinc/62/70/99/1044627099.db2.gz BQRIGLVKCCHOSA-IBGZPJMESA-N 2 1 319.537 4.136 20 0 DIADMP CC(C)CCn1cccc1C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000523391225 1044628203 /nfs/dbraw/zinc/62/82/03/1044628203.db2.gz BQRIGLVKCCHOSA-LJQANCHMSA-N 2 1 319.537 4.136 20 0 DIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCS2 ZINC000296637715 1044638491 /nfs/dbraw/zinc/63/84/91/1044638491.db2.gz XVIQHEHDMZPMBB-MMNRESRNSA-N 2 1 316.514 4.055 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(C)CCCCC2)C[C@H]1c1ccccc1 ZINC000568776029 1044649415 /nfs/dbraw/zinc/64/94/15/1044649415.db2.gz YXWRIOZZTNVFPC-MOPGFXCFSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(C)CCCCC2)C[C@H]1c1ccccc1 ZINC000568776029 1044649417 /nfs/dbraw/zinc/64/94/17/1044649417.db2.gz YXWRIOZZTNVFPC-MOPGFXCFSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@@H](NC2(c3ccccc3F)CC2)C[C@H]1c1ccccc1 ZINC000569013755 1044666063 /nfs/dbraw/zinc/66/60/63/1044666063.db2.gz NHPJRUREBHJMNG-XLIONFOSSA-N 2 1 324.443 4.240 20 0 DIADMP CN1CC[C@@H]([NH2+]C2(c3ccccc3F)CC2)C[C@H]1c1ccccc1 ZINC000569013755 1044666074 /nfs/dbraw/zinc/66/60/74/1044666074.db2.gz NHPJRUREBHJMNG-XLIONFOSSA-N 2 1 324.443 4.240 20 0 DIADMP C[C@H]1CC[C@@H]1[NH2+]CC1([N@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233196 1044670166 /nfs/dbraw/zinc/67/01/66/1044670166.db2.gz NYRSJIOLMACFBO-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1CC[C@@H]1[NH2+]CC1([N@@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233196 1044670169 /nfs/dbraw/zinc/67/01/69/1044670169.db2.gz NYRSJIOLMACFBO-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3cc4ccccc4o3)CC2)[nH+]c1C ZINC000886664308 1044676064 /nfs/dbraw/zinc/67/60/64/1044676064.db2.gz IOQZJKNDEKGGSO-UHFFFAOYSA-N 2 1 309.413 4.152 20 0 DIADMP CSc1ccccc1C[NH+]1CCC(c2[nH]c(C)c(C)[nH+]2)CC1 ZINC000886662838 1044677532 /nfs/dbraw/zinc/67/75/32/1044677532.db2.gz MZIPWPACEONVRK-UHFFFAOYSA-N 2 1 315.486 4.128 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@H](C)c3ccccc3F)CC2)[nH+]c1C ZINC000886668414 1044677866 /nfs/dbraw/zinc/67/78/66/1044677866.db2.gz SHFHRTOJMMGWSG-CQSZACIVSA-N 2 1 301.409 4.106 20 0 DIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000445315725 1044700819 /nfs/dbraw/zinc/70/08/19/1044700819.db2.gz IVJAKSDGQLWYPE-ROUUACIJSA-N 2 1 324.468 4.423 20 0 DIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000445315725 1044700836 /nfs/dbraw/zinc/70/08/36/1044700836.db2.gz IVJAKSDGQLWYPE-ROUUACIJSA-N 2 1 324.468 4.423 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2(C4CC4)CCC2)C3)cc1 ZINC000886825036 1044710559 /nfs/dbraw/zinc/71/05/59/1044710559.db2.gz LCEMNELIPRKWAF-OWZKRDHZSA-N 2 1 310.485 4.104 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2(C4CC4)CCC2)C3)cc1 ZINC000886825035 1044711605 /nfs/dbraw/zinc/71/16/05/1044711605.db2.gz LCEMNELIPRKWAF-ACDBMABISA-N 2 1 310.485 4.104 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000570289776 1044746598 /nfs/dbraw/zinc/74/65/98/1044746598.db2.gz OEQXWWWVOLSEDB-GOSISDBHSA-N 2 1 317.864 4.137 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)cc1 ZINC000367601858 1044746639 /nfs/dbraw/zinc/74/66/39/1044746639.db2.gz QADRMQAZVHQKRW-CVEARBPZSA-N 2 1 320.440 4.296 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccccc2F)c1 ZINC000123872827 1044789068 /nfs/dbraw/zinc/78/90/68/1044789068.db2.gz LKFALAKAVLNVAT-OAHLLOKOSA-N 2 1 300.421 4.128 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC000572051847 1044839795 /nfs/dbraw/zinc/83/97/95/1044839795.db2.gz SGHGIIOGUZPPPI-STQMWFEESA-N 2 1 302.915 4.041 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC000572051847 1044839812 /nfs/dbraw/zinc/83/98/12/1044839812.db2.gz SGHGIIOGUZPPPI-STQMWFEESA-N 2 1 302.915 4.041 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000573112790 1044893726 /nfs/dbraw/zinc/89/37/26/1044893726.db2.gz LHEQHEVEPFUIFZ-YADHBBJMSA-N 2 1 320.480 4.297 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000573112790 1044893739 /nfs/dbraw/zinc/89/37/39/1044893739.db2.gz LHEQHEVEPFUIFZ-YADHBBJMSA-N 2 1 320.480 4.297 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000574178589 1044944122 /nfs/dbraw/zinc/94/41/22/1044944122.db2.gz LBNHFCZYFRONRK-RTWAWAEBSA-N 2 1 320.480 4.143 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000574178589 1044944137 /nfs/dbraw/zinc/94/41/37/1044944137.db2.gz LBNHFCZYFRONRK-RTWAWAEBSA-N 2 1 320.480 4.143 20 0 DIADMP CN1CCC([N@@H+](C/C=C\c2ccccc2)Cc2ccccc2)CC1 ZINC000574320494 1044948376 /nfs/dbraw/zinc/94/83/76/1044948376.db2.gz XEIPEFGQJSPNKZ-JYRVWZFOSA-N 2 1 320.480 4.296 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000373385857 1044974741 /nfs/dbraw/zinc/97/47/41/1044974741.db2.gz FZNFONCIMIKWKC-LBTBCDHLSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](C[C@H]2CCC(F)(F)C2)C1 ZINC000575336982 1044996307 /nfs/dbraw/zinc/99/63/07/1044996307.db2.gz XJYSPCXZYMUARJ-IKGGRYGDSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000575336982 1044996314 /nfs/dbraw/zinc/99/63/14/1044996314.db2.gz XJYSPCXZYMUARJ-IKGGRYGDSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000575336982 1044996322 /nfs/dbraw/zinc/99/63/22/1044996322.db2.gz XJYSPCXZYMUARJ-IKGGRYGDSA-N 2 1 314.464 4.008 20 0 DIADMP CC[N@@H+](Cc1ccncc1)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411414939 1045005222 /nfs/dbraw/zinc/00/52/22/1045005222.db2.gz AYZUNFYZGVAWQU-UHFFFAOYSA-N 2 1 323.484 4.090 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)cc1 ZINC000446748890 1045028605 /nfs/dbraw/zinc/02/86/05/1045028605.db2.gz VBEXYJOQTGGNMO-PWRODBHTSA-N 2 1 312.501 4.443 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000359946318 1045053665 /nfs/dbraw/zinc/05/36/65/1045053665.db2.gz ZDXKONUUFUZHOG-DOTOQJQBSA-N 2 1 306.519 4.227 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCCc2ccc(Cl)cc2)CC1 ZINC000525422841 1045067238 /nfs/dbraw/zinc/06/72/38/1045067238.db2.gz YRGHBNBWDRGBDC-UHFFFAOYSA-N 2 1 322.924 4.325 20 0 DIADMP C[C@@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@@H+]1CCCC[C@@H]1C ZINC000576864231 1045084588 /nfs/dbraw/zinc/08/45/88/1045084588.db2.gz RSEKIOPNLQRDCW-BRMQNCDRSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@H+]1CCCC[C@@H]1C ZINC000576864231 1045084599 /nfs/dbraw/zinc/08/45/99/1045084599.db2.gz RSEKIOPNLQRDCW-BRMQNCDRSA-N 2 1 322.443 4.063 20 0 DIADMP CCc1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)o2)cc1 ZINC000525802967 1045121976 /nfs/dbraw/zinc/12/19/76/1045121976.db2.gz ZOGVNVMUZINKMH-KRWDZBQOSA-N 2 1 324.468 4.083 20 0 DIADMP CCc1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)o2)cc1 ZINC000525802967 1045121985 /nfs/dbraw/zinc/12/19/85/1045121985.db2.gz ZOGVNVMUZINKMH-KRWDZBQOSA-N 2 1 324.468 4.083 20 0 DIADMP CCc1ccc(-c2ccc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)o2)cc1 ZINC000525802968 1045122308 /nfs/dbraw/zinc/12/23/08/1045122308.db2.gz ZOGVNVMUZINKMH-QGZVFWFLSA-N 2 1 324.468 4.083 20 0 DIADMP CCc1ccc(-c2ccc(C[NH2+]C[C@H]3CC[N@H+](C4CC4)C3)o2)cc1 ZINC000525802968 1045122312 /nfs/dbraw/zinc/12/23/12/1045122312.db2.gz ZOGVNVMUZINKMH-QGZVFWFLSA-N 2 1 324.468 4.083 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000447527821 1045137744 /nfs/dbraw/zinc/13/77/44/1045137744.db2.gz GAQKBRRSFNCYAX-VQTJNVASSA-N 2 1 311.473 4.446 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753564 1045139943 /nfs/dbraw/zinc/13/99/43/1045139943.db2.gz KTVHZOQIENTELC-MZMPZRCHSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753564 1045139948 /nfs/dbraw/zinc/13/99/48/1045139948.db2.gz KTVHZOQIENTELC-MZMPZRCHSA-N 2 1 306.881 4.180 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447583801 1045153043 /nfs/dbraw/zinc/15/30/43/1045153043.db2.gz CMTPOQALOMSFBO-YSTOQKLRSA-N 2 1 312.501 4.350 20 0 DIADMP CCC(C)(C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447590875 1045154491 /nfs/dbraw/zinc/15/44/91/1045154491.db2.gz AUNXWCZNMIEMGX-LDLYASANSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2CC24CCCC4)C3)cc1 ZINC000447600707 1045159066 /nfs/dbraw/zinc/15/90/66/1045159066.db2.gz NCNGCJXOVZEXJG-IYWMVGAKSA-N 2 1 310.485 4.104 20 0 DIADMP C[C@H](CC[NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccc1 ZINC000447822214 1045178699 /nfs/dbraw/zinc/17/86/99/1045178699.db2.gz PCOMNXWAAUOCSZ-MOPGFXCFSA-N 2 1 302.506 4.424 20 0 DIADMP Cc1ccccc1C[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccco1 ZINC000924700916 1045190483 /nfs/dbraw/zinc/19/04/83/1045190483.db2.gz ZLTAGTQYKYEJOV-UFYCRDLUSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccco1 ZINC000924700916 1045190493 /nfs/dbraw/zinc/19/04/93/1045190493.db2.gz ZLTAGTQYKYEJOV-UFYCRDLUSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccco1 ZINC000924700916 1045190500 /nfs/dbraw/zinc/19/05/00/1045190500.db2.gz ZLTAGTQYKYEJOV-UFYCRDLUSA-N 2 1 324.468 4.088 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1csc(C(F)(F)F)c1 ZINC000924718354 1045194646 /nfs/dbraw/zinc/19/46/46/1045194646.db2.gz YSAHVOALUZUBAI-SNVBAGLBSA-N 2 1 317.380 4.013 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000527100335 1045194595 /nfs/dbraw/zinc/19/45/95/1045194595.db2.gz QCFWVODFTXJRKP-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000527100335 1045194599 /nfs/dbraw/zinc/19/45/99/1045194599.db2.gz QCFWVODFTXJRKP-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527116156 1045198329 /nfs/dbraw/zinc/19/83/29/1045198329.db2.gz DDJDSOGMSHXUSP-HZPDHXFCSA-N 2 1 308.897 4.107 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527116156 1045198333 /nfs/dbraw/zinc/19/83/33/1045198333.db2.gz DDJDSOGMSHXUSP-HZPDHXFCSA-N 2 1 308.897 4.107 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000527637698 1045242225 /nfs/dbraw/zinc/24/22/25/1045242225.db2.gz OAJXVUIWTBPZHX-MISYRCLQSA-N 2 1 312.501 4.177 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)[C@H]1CC12CC2 ZINC000527872737 1045271723 /nfs/dbraw/zinc/27/17/23/1045271723.db2.gz YSRFJUPJYOXLDJ-OXJNMPFZSA-N 2 1 324.468 4.190 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccccc2)c1 ZINC000579185985 1045299539 /nfs/dbraw/zinc/29/95/39/1045299539.db2.gz JESURXXFPPZSPA-QZTJIDSGSA-N 2 1 308.469 4.346 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352741 1045309313 /nfs/dbraw/zinc/30/93/13/1045309313.db2.gz JFTYHEIYFKIFMU-LEWJYISDSA-N 2 1 324.512 4.352 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+][C@@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352741 1045309320 /nfs/dbraw/zinc/30/93/20/1045309320.db2.gz JFTYHEIYFKIFMU-LEWJYISDSA-N 2 1 324.512 4.352 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+][C@@H]3CCCC34CCC4)CC2)cc1 ZINC000449072851 1045343959 /nfs/dbraw/zinc/34/39/59/1045343959.db2.gz LSOOLRFXENGXEF-HXUWFJFHSA-N 2 1 312.501 4.006 20 0 DIADMP CSCC1CCC([NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)CC1 ZINC000449082044 1045345272 /nfs/dbraw/zinc/34/52/72/1045345272.db2.gz JZXJXUZOFFLKEC-WWDZGPRUSA-N 2 1 312.567 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccccc2-c2ccccc2C)C1 ZINC000449090755 1045348618 /nfs/dbraw/zinc/34/86/18/1045348618.db2.gz NWCDBRWRWRXVMQ-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CCC3)[C@@H]1c1cccs1 ZINC000449155573 1045353510 /nfs/dbraw/zinc/35/35/10/1045353510.db2.gz BHYSKLTXTHCMMD-BPQIPLTHSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CCC3)[C@@H]1c1cccs1 ZINC000449155573 1045353513 /nfs/dbraw/zinc/35/35/13/1045353513.db2.gz BHYSKLTXTHCMMD-BPQIPLTHSA-N 2 1 318.530 4.443 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@@H+]1C ZINC000449177447 1045354973 /nfs/dbraw/zinc/35/49/73/1045354973.db2.gz VQHWUIFEJMBDGW-NIKGAXFTSA-N 2 1 318.892 4.348 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@H+]1C ZINC000449177447 1045354977 /nfs/dbraw/zinc/35/49/77/1045354977.db2.gz VQHWUIFEJMBDGW-NIKGAXFTSA-N 2 1 318.892 4.348 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC000449178237 1045355396 /nfs/dbraw/zinc/35/53/96/1045355396.db2.gz XGOXVQXNVOWKCN-LFVTVUPYSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC000449178237 1045355401 /nfs/dbraw/zinc/35/54/01/1045355401.db2.gz XGOXVQXNVOWKCN-LFVTVUPYSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC000449178238 1045355481 /nfs/dbraw/zinc/35/54/81/1045355481.db2.gz XGOXVQXNVOWKCN-MOIQIXESSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC000449178238 1045355487 /nfs/dbraw/zinc/35/54/87/1045355487.db2.gz XGOXVQXNVOWKCN-MOIQIXESSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000119148887 1045402270 /nfs/dbraw/zinc/40/22/70/1045402270.db2.gz JAWBRVRXMWWKIK-QGZVFWFLSA-N 2 1 311.473 4.272 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000119148887 1045402275 /nfs/dbraw/zinc/40/22/75/1045402275.db2.gz JAWBRVRXMWWKIK-QGZVFWFLSA-N 2 1 311.473 4.272 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCCC2(F)F)cc1 ZINC000449505921 1045404662 /nfs/dbraw/zinc/40/46/62/1045404662.db2.gz ZQUFQTXSXIQFMO-BBRMVZONSA-N 2 1 319.399 4.267 20 0 DIADMP CCC1([NH2+]Cc2nc3c(s2)C[N@@H+](C(C)C)CC3)CCCCC1 ZINC000449536355 1045410497 /nfs/dbraw/zinc/41/04/97/1045410497.db2.gz PRAUQBBJMZEDPD-UHFFFAOYSA-N 2 1 321.534 4.112 20 0 DIADMP CCC1([NH2+]Cc2nc3c(s2)C[N@H+](C(C)C)CC3)CCCCC1 ZINC000449536355 1045410500 /nfs/dbraw/zinc/41/05/00/1045410500.db2.gz PRAUQBBJMZEDPD-UHFFFAOYSA-N 2 1 321.534 4.112 20 0 DIADMP c1ccc([C@@H]2CCCC[C@@H]2C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000449691825 1045427581 /nfs/dbraw/zinc/42/75/81/1045427581.db2.gz YOBYITDHNOWSDY-MHTWAQMVSA-N 2 1 312.501 4.177 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449730664 1045430980 /nfs/dbraw/zinc/43/09/80/1045430980.db2.gz FXCVSICUDUJXBJ-YJBOKZPZSA-N 2 1 306.881 4.050 20 0 DIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)c1 ZINC000449778535 1045436371 /nfs/dbraw/zinc/43/63/71/1045436371.db2.gz WPAFEZGPQTXVTA-XGXHKWSGSA-N 2 1 318.892 4.193 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CC(F)(F)C1 ZINC000529547226 1045493397 /nfs/dbraw/zinc/49/33/97/1045493397.db2.gz VYUCIYVTAKRGGN-RVKKMQEKSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CC(F)(F)C1 ZINC000529547226 1045493398 /nfs/dbraw/zinc/49/33/98/1045493398.db2.gz VYUCIYVTAKRGGN-RVKKMQEKSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]C[C@@]2(C)CCCS2)CC1 ZINC000628217230 1045546917 /nfs/dbraw/zinc/54/69/17/1045546917.db2.gz PGUXTPYAUKYRMJ-QFBILLFUSA-N 2 1 318.530 4.087 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000390527002 1045557874 /nfs/dbraw/zinc/55/78/74/1045557874.db2.gz CRBDMCXRPGRFEX-NMLBUPMWSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000390527002 1045557883 /nfs/dbraw/zinc/55/78/83/1045557883.db2.gz CRBDMCXRPGRFEX-NMLBUPMWSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000720184285 1045577270 /nfs/dbraw/zinc/57/72/70/1045577270.db2.gz MQOZFDKKTXYBIP-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC000720184285 1045577282 /nfs/dbraw/zinc/57/72/82/1045577282.db2.gz MQOZFDKKTXYBIP-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H](C)C1CCSCC1)C1CCCCC1 ZINC001206559283 1045583856 /nfs/dbraw/zinc/58/38/56/1045583856.db2.gz CSZGXYIYWYIMQK-MRXNPFEDSA-N 2 1 312.567 4.152 20 0 DIADMP Clc1ccc(/C=C/C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334954 1045646194 /nfs/dbraw/zinc/64/61/94/1045646194.db2.gz KIHZZHZWIWSGDY-JUGMSXHOSA-N 2 1 318.892 4.304 20 0 DIADMP Clc1ccc(/C=C/C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334954 1045646195 /nfs/dbraw/zinc/64/61/95/1045646195.db2.gz KIHZZHZWIWSGDY-JUGMSXHOSA-N 2 1 318.892 4.304 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335452 1045646940 /nfs/dbraw/zinc/64/69/40/1045646940.db2.gz OSTCUBWJAPFJTR-VGOKWCNXSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335452 1045646942 /nfs/dbraw/zinc/64/69/42/1045646942.db2.gz OSTCUBWJAPFJTR-VGOKWCNXSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335452 1045646945 /nfs/dbraw/zinc/64/69/45/1045646945.db2.gz OSTCUBWJAPFJTR-VGOKWCNXSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335452 1045646947 /nfs/dbraw/zinc/64/69/47/1045646947.db2.gz OSTCUBWJAPFJTR-VGOKWCNXSA-N 2 1 306.881 4.017 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394402 1045656127 /nfs/dbraw/zinc/65/61/27/1045656127.db2.gz JFFLIDCRWICHKP-UKRRQHHQSA-N 2 1 304.409 4.097 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394402 1045656130 /nfs/dbraw/zinc/65/61/30/1045656130.db2.gz JFFLIDCRWICHKP-UKRRQHHQSA-N 2 1 304.409 4.097 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394403 1045657120 /nfs/dbraw/zinc/65/71/20/1045657120.db2.gz JFFLIDCRWICHKP-ZFWWWQNUSA-N 2 1 304.409 4.097 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cc2cccc(F)c2o1 ZINC000530394403 1045657126 /nfs/dbraw/zinc/65/71/26/1045657126.db2.gz JFFLIDCRWICHKP-ZFWWWQNUSA-N 2 1 304.409 4.097 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c(C)s1 ZINC001138567406 1045663235 /nfs/dbraw/zinc/66/32/35/1045663235.db2.gz ABHOZNXRQDZOLX-SFHVURJKSA-N 2 1 306.519 4.205 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629556384 1045677942 /nfs/dbraw/zinc/67/79/42/1045677942.db2.gz OPBCKYGYQKRKOI-QRVBRYPASA-N 2 1 312.844 4.452 20 0 DIADMP C[C@H]1C[C@H](N(C)Cc2sc3ccccc3c2Cl)CC[N@H+]1C ZINC000530905335 1045749143 /nfs/dbraw/zinc/74/91/43/1045749143.db2.gz KPHIAWVYWQXKRR-QWHCGFSZSA-N 2 1 322.905 4.469 20 0 DIADMP C[C@@]1(C[NH2+]C2CCC(F)(F)CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC000688309317 1045754713 /nfs/dbraw/zinc/75/47/13/1045754713.db2.gz XSNTUBDFRYXUHO-SFHVURJKSA-N 2 1 322.443 4.066 20 0 DIADMP COc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC000753656325 1045784267 /nfs/dbraw/zinc/78/42/67/1045784267.db2.gz ZZCOVEDDJBWJCE-ROUUACIJSA-N 2 1 318.505 4.083 20 0 DIADMP COc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC000753656321 1045784464 /nfs/dbraw/zinc/78/44/64/1045784464.db2.gz ZZCOVEDDJBWJCE-MSOLQXFVSA-N 2 1 318.505 4.083 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1Cl ZINC000531688296 1045892390 /nfs/dbraw/zinc/89/23/90/1045892390.db2.gz JNAWCPLUSNQGGT-AWEZNQCLSA-N 2 1 324.896 4.120 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000531707613 1045901852 /nfs/dbraw/zinc/90/18/52/1045901852.db2.gz NQAXVMZTYNNDTC-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000531707613 1045901863 /nfs/dbraw/zinc/90/18/63/1045901863.db2.gz NQAXVMZTYNNDTC-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H](C3CC3)C3CCC3)C2)c1 ZINC000453099762 1045949534 /nfs/dbraw/zinc/94/95/34/1045949534.db2.gz ZGQJFNLCNSWQIK-HNAYVOBHSA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H](C3CC3)C3CCC3)C2)c1 ZINC000453099762 1045949548 /nfs/dbraw/zinc/94/95/48/1045949548.db2.gz ZGQJFNLCNSWQIK-HNAYVOBHSA-N 2 1 318.530 4.128 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001137851824 1045985243 /nfs/dbraw/zinc/98/52/43/1045985243.db2.gz YGWCFDSARJBDKP-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001137851824 1045985254 /nfs/dbraw/zinc/98/52/54/1045985254.db2.gz YGWCFDSARJBDKP-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP CC(F)(F)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453215789 1045988427 /nfs/dbraw/zinc/98/84/27/1045988427.db2.gz GZXYLVCEDUPDOA-KZNAEPCWSA-N 2 1 322.443 4.065 20 0 DIADMP FC1(F)CCC(CC[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC000902456682 1046000984 /nfs/dbraw/zinc/00/09/84/1046000984.db2.gz QMLXURDXCVQHFZ-MSOLQXFVSA-N 2 1 322.443 4.285 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@@H+]1C ZINC000453308372 1046027660 /nfs/dbraw/zinc/02/76/60/1046027660.db2.gz DLRURMMQQLYQHB-WHCBVINPSA-N 2 1 310.844 4.003 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@H+]1C ZINC000453308372 1046027673 /nfs/dbraw/zinc/02/76/73/1046027673.db2.gz DLRURMMQQLYQHB-WHCBVINPSA-N 2 1 310.844 4.003 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1Cl ZINC001206598421 1046030753 /nfs/dbraw/zinc/03/07/53/1046030753.db2.gz JJZRWPVKXWGDLW-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1c(F)ccc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1Cl ZINC001206598421 1046030767 /nfs/dbraw/zinc/03/07/67/1046030767.db2.gz JJZRWPVKXWGDLW-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1ccc(C[NH+]2CCC([NH+]3CCCC3)CC2)c2ccccc12 ZINC001138013617 1046058358 /nfs/dbraw/zinc/05/83/58/1046058358.db2.gz QUWVNJJVLNHBGS-UHFFFAOYSA-N 2 1 308.469 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753822 1046060176 /nfs/dbraw/zinc/06/01/76/1046060176.db2.gz UGOGPCWDGAWWSG-SRVKXCTJSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)s1 ZINC000902753822 1046060191 /nfs/dbraw/zinc/06/01/91/1046060191.db2.gz UGOGPCWDGAWWSG-SRVKXCTJSA-N 2 1 318.408 4.044 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000453386176 1046063995 /nfs/dbraw/zinc/06/39/95/1046063995.db2.gz AFQZJYYDQZTYOP-VQTJNVASSA-N 2 1 300.490 4.095 20 0 DIADMP CCC(C)(C)OCC[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000453405599 1046077201 /nfs/dbraw/zinc/07/72/01/1046077201.db2.gz JKDWKXCQWKBLDM-HNNXBMFYSA-N 2 1 315.461 4.037 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(C(F)(F)F)c1 ZINC000453403161 1046078190 /nfs/dbraw/zinc/07/81/90/1046078190.db2.gz AQZXCLSYKAPZSL-ZDUSSCGKSA-N 2 1 314.395 4.230 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)cc1 ZINC000453410866 1046079018 /nfs/dbraw/zinc/07/90/18/1046079018.db2.gz VLQPRBMYJGJBMF-OAHLLOKOSA-N 2 1 306.519 4.324 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cc(F)ccc1F ZINC000453396415 1046084397 /nfs/dbraw/zinc/08/43/97/1046084397.db2.gz IRPJAFRCGWKFMH-GOSISDBHSA-N 2 1 310.432 4.126 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCC2CC(F)(F)C2)cc1 ZINC000453434957 1046084923 /nfs/dbraw/zinc/08/49/23/1046084923.db2.gz TXTYNHLYTMDCAS-CYBMUJFWSA-N 2 1 319.399 4.267 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000532246941 1046120894 /nfs/dbraw/zinc/12/08/94/1046120894.db2.gz HSCHXRUVRWIORX-VKJFTORMSA-N 2 1 322.924 4.227 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000532235987 1046123249 /nfs/dbraw/zinc/12/32/49/1046123249.db2.gz TYCIDHLEFXOAOJ-CBZIJGRNSA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000532235987 1046123256 /nfs/dbraw/zinc/12/32/56/1046123256.db2.gz TYCIDHLEFXOAOJ-CBZIJGRNSA-N 2 1 306.519 4.299 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC001168146252 1046148954 /nfs/dbraw/zinc/14/89/54/1046148954.db2.gz QYGXBTOYAGEUCW-CLEWGBKMSA-N 2 1 323.484 4.311 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC001168146252 1046148959 /nfs/dbraw/zinc/14/89/59/1046148959.db2.gz QYGXBTOYAGEUCW-CLEWGBKMSA-N 2 1 323.484 4.311 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903083025 1046158538 /nfs/dbraw/zinc/15/85/38/1046158538.db2.gz YYSNIZBTMXEWEL-ZVRJUHEZSA-N 2 1 318.892 4.018 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903083216 1046159697 /nfs/dbraw/zinc/15/96/97/1046159697.db2.gz BPYCFZIQBXFDRR-MAUASRDWSA-N 2 1 316.876 4.075 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1cc2ccccc2o1 ZINC000903158087 1046177906 /nfs/dbraw/zinc/17/79/06/1046177906.db2.gz QMOOIZJQFSUOMR-ZVRJUHEZSA-N 2 1 310.441 4.241 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1cc2ccccc2o1 ZINC000903158087 1046177918 /nfs/dbraw/zinc/17/79/18/1046177918.db2.gz QMOOIZJQFSUOMR-ZVRJUHEZSA-N 2 1 310.441 4.241 20 0 DIADMP CCSc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c1 ZINC000903175872 1046182847 /nfs/dbraw/zinc/18/28/47/1046182847.db2.gz WRLTZNWHHWOOGR-ZNXRZULTSA-N 2 1 316.514 4.046 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903167574 1046182894 /nfs/dbraw/zinc/18/28/94/1046182894.db2.gz LUFZBRVKWICFKE-ZBSSRIJBSA-N 2 1 316.514 4.217 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C1CC1)CC2 ZINC000903210318 1046196426 /nfs/dbraw/zinc/19/64/26/1046196426.db2.gz WIIWXNMHTLNMJP-SOXMVSPVSA-N 2 1 316.876 4.075 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCCC3(CCCC3)C2)cc1 ZINC001138545025 1046218897 /nfs/dbraw/zinc/21/88/97/1046218897.db2.gz QNZUHTSPAHFLCF-UHFFFAOYSA-N 2 1 309.457 4.337 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCCC3(CCCC3)C2)cc1 ZINC001138545025 1046218910 /nfs/dbraw/zinc/21/89/10/1046218910.db2.gz QNZUHTSPAHFLCF-UHFFFAOYSA-N 2 1 309.457 4.337 20 0 DIADMP CC[N@H+](Cc1cccs1)Cc1ccc(-n2cc[nH+]c2C)cc1 ZINC001138549632 1046222537 /nfs/dbraw/zinc/22/25/37/1046222537.db2.gz BAMRDDOMDAWZPS-UHFFFAOYSA-N 2 1 311.454 4.264 20 0 DIADMP CC[N@@H+](Cc1cccs1)Cc1ccc(-n2cc[nH+]c2C)cc1 ZINC001138549632 1046222554 /nfs/dbraw/zinc/22/25/54/1046222554.db2.gz BAMRDDOMDAWZPS-UHFFFAOYSA-N 2 1 311.454 4.264 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168167363 1046231445 /nfs/dbraw/zinc/23/14/45/1046231445.db2.gz OMZUFTAEWKTZLE-JVPBZIDWSA-N 2 1 320.908 4.253 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(Cl)nc1 ZINC000245548686 1046243310 /nfs/dbraw/zinc/24/33/10/1046243310.db2.gz FVSAGCLXTJBCIR-OWCLPIDISA-N 2 1 323.912 4.144 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc4oc5ccccc5c4c3)C2)C1 ZINC000795308348 1046254588 /nfs/dbraw/zinc/25/45/88/1046254588.db2.gz AUFANNZMXXRGMM-OAQYLSRUSA-N 2 1 320.436 4.114 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc4oc5ccccc5c4c3)C2)C1 ZINC000795308348 1046254596 /nfs/dbraw/zinc/25/45/96/1046254596.db2.gz AUFANNZMXXRGMM-OAQYLSRUSA-N 2 1 320.436 4.114 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc4oc5ccccc5c4c3)C2)C1 ZINC000795308348 1046254604 /nfs/dbraw/zinc/25/46/04/1046254604.db2.gz AUFANNZMXXRGMM-OAQYLSRUSA-N 2 1 320.436 4.114 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1CCC1CCCCC1 ZINC001168173870 1046258111 /nfs/dbraw/zinc/25/81/11/1046258111.db2.gz FGDXGSNMVNJJJG-IBGZPJMESA-N 2 1 303.494 4.407 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1CCC1CCCCC1 ZINC001168173870 1046258118 /nfs/dbraw/zinc/25/81/18/1046258118.db2.gz FGDXGSNMVNJJJG-IBGZPJMESA-N 2 1 303.494 4.407 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc2occc2c1 ZINC001138825753 1046303066 /nfs/dbraw/zinc/30/30/66/1046303066.db2.gz WAXSPUVVZCGABJ-OALUTQOASA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc2occc2c1 ZINC001138825753 1046303078 /nfs/dbraw/zinc/30/30/78/1046303078.db2.gz WAXSPUVVZCGABJ-OALUTQOASA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc2occc2c1 ZINC001138825753 1046303091 /nfs/dbraw/zinc/30/30/91/1046303091.db2.gz WAXSPUVVZCGABJ-OALUTQOASA-N 2 1 312.457 4.272 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000638319612 1046315468 /nfs/dbraw/zinc/31/54/68/1046315468.db2.gz YVBSGKURIGEBCW-NBHGPNQESA-N 2 1 321.468 4.100 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1cccnc1 ZINC000638319612 1046315485 /nfs/dbraw/zinc/31/54/85/1046315485.db2.gz YVBSGKURIGEBCW-NBHGPNQESA-N 2 1 321.468 4.100 20 0 DIADMP CCC[N@H+](C[C@H]([NH3+])CC(F)F)[C@@H](C)c1cc2ccccc2o1 ZINC000903885357 1046333899 /nfs/dbraw/zinc/33/38/99/1046333899.db2.gz FTDDJUOWJOGRHB-GXTWGEPZSA-N 2 1 310.388 4.188 20 0 DIADMP CCC[N@@H+](C[C@H]([NH3+])CC(F)F)[C@@H](C)c1cc2ccccc2o1 ZINC000903885357 1046333916 /nfs/dbraw/zinc/33/39/16/1046333916.db2.gz FTDDJUOWJOGRHB-GXTWGEPZSA-N 2 1 310.388 4.188 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]([NH3+])CC(F)F)c1cccc(C(F)(F)F)c1 ZINC000903924924 1046339618 /nfs/dbraw/zinc/33/96/18/1046339618.db2.gz KKNUGASOFGVBIA-STQMWFEESA-N 2 1 324.337 4.119 20 0 DIADMP CC1CCC([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001168209406 1046420923 /nfs/dbraw/zinc/42/09/23/1046420923.db2.gz RXZYHYGGZUAACO-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccc([C@H]2CCC[N@@H+]2CCCCn2cc[nH+]c2C)s1 ZINC000124020885 1046452778 /nfs/dbraw/zinc/45/27/78/1046452778.db2.gz FRFUVAMLSZMMDM-MRXNPFEDSA-N 2 1 303.475 4.179 20 0 DIADMP Cc1ccc([C@H]2CCC[N@H+]2CCCCn2cc[nH+]c2C)s1 ZINC000124020885 1046452786 /nfs/dbraw/zinc/45/27/86/1046452786.db2.gz FRFUVAMLSZMMDM-MRXNPFEDSA-N 2 1 303.475 4.179 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC000125522400 1046469832 /nfs/dbraw/zinc/46/98/32/1046469832.db2.gz MCHSPDCGHQLWOH-QGZVFWFLSA-N 2 1 301.434 4.182 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000125522400 1046469839 /nfs/dbraw/zinc/46/98/39/1046469839.db2.gz MCHSPDCGHQLWOH-QGZVFWFLSA-N 2 1 301.434 4.182 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125871288 1046473670 /nfs/dbraw/zinc/47/36/70/1046473670.db2.gz XJIVFCNFEZMOOX-RDTXWAMCSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1F ZINC000125871288 1046473674 /nfs/dbraw/zinc/47/36/74/1046473674.db2.gz XJIVFCNFEZMOOX-RDTXWAMCSA-N 2 1 310.432 4.126 20 0 DIADMP CC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1ccc(C)cc1 ZINC000126318300 1046476727 /nfs/dbraw/zinc/47/67/27/1046476727.db2.gz BFJANXXJROFMEN-LJQANCHMSA-N 2 1 320.440 4.125 20 0 DIADMP Fc1ccccc1[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)C1CCCC1 ZINC000677240324 1046476929 /nfs/dbraw/zinc/47/69/29/1046476929.db2.gz GHKQSYRWIDZRBS-FUHIMQAGSA-N 2 1 316.464 4.273 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CCC2)cc1 ZINC000677239999 1046477002 /nfs/dbraw/zinc/47/70/02/1046477002.db2.gz CRRIBQDPJTVYPT-GBESFXJTSA-N 2 1 318.892 4.398 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677241694 1046477636 /nfs/dbraw/zinc/47/76/36/1046477636.db2.gz TYTNYROZMSMPLQ-UAGQMJEPSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]C1(c2ccc(Cl)cc2)CCCCC1 ZINC000677802245 1046527693 /nfs/dbraw/zinc/52/76/93/1046527693.db2.gz KHUVNSWSAPOYKJ-UHFFFAOYSA-N 2 1 317.864 4.294 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCCN1Cc1cc2ccccc2[nH]1 ZINC001137319843 1046547055 /nfs/dbraw/zinc/54/70/55/1046547055.db2.gz PNSTXEJSPDFANX-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cc2ccccc2[nH]1 ZINC001137319843 1046547068 /nfs/dbraw/zinc/54/70/68/1046547068.db2.gz PNSTXEJSPDFANX-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cc2ccccc2[nH]1 ZINC001137319843 1046547077 /nfs/dbraw/zinc/54/70/77/1046547077.db2.gz PNSTXEJSPDFANX-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC001137319843 1046547087 /nfs/dbraw/zinc/54/70/87/1046547087.db2.gz PNSTXEJSPDFANX-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC001137319843 1046547094 /nfs/dbraw/zinc/54/70/94/1046547094.db2.gz PNSTXEJSPDFANX-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139224 1046589582 /nfs/dbraw/zinc/58/95/82/1046589582.db2.gz BKKWRVHDXUVEQO-UXHICEINSA-N 2 1 323.484 4.035 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139224 1046589599 /nfs/dbraw/zinc/58/95/99/1046589599.db2.gz BKKWRVHDXUVEQO-UXHICEINSA-N 2 1 323.484 4.035 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000195136756 1046590475 /nfs/dbraw/zinc/59/04/75/1046590475.db2.gz LJBRVRZFHBHZFH-PZJWPPBQSA-N 2 1 323.484 4.035 20 0 DIADMP c1ccc(C2CC2)c(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000678339455 1046621878 /nfs/dbraw/zinc/62/18/78/1046621878.db2.gz MNEPMXGUDYKEEJ-NQIIRXRSSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000678339455 1046621883 /nfs/dbraw/zinc/62/18/83/1046621883.db2.gz MNEPMXGUDYKEEJ-NQIIRXRSSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000678339455 1046621888 /nfs/dbraw/zinc/62/18/88/1046621888.db2.gz MNEPMXGUDYKEEJ-NQIIRXRSSA-N 2 1 310.485 4.013 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC000643468959 1046667901 /nfs/dbraw/zinc/66/79/01/1046667901.db2.gz RLYWEBNSIMGIQY-HMXCVIKNSA-N 2 1 306.453 4.065 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]Cc1ccccc1-c1ccccc1 ZINC001203031215 1046682977 /nfs/dbraw/zinc/68/29/77/1046682977.db2.gz CEQKEENBGHLWAF-UHFFFAOYSA-N 2 1 310.485 4.421 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533289080 1046686321 /nfs/dbraw/zinc/68/63/21/1046686321.db2.gz RLEDAYUQCAWFNL-JKSUJKDBSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533289080 1046686325 /nfs/dbraw/zinc/68/63/25/1046686325.db2.gz RLEDAYUQCAWFNL-JKSUJKDBSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533289079 1046687445 /nfs/dbraw/zinc/68/74/45/1046687445.db2.gz RLEDAYUQCAWFNL-HZPDHXFCSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533289079 1046687452 /nfs/dbraw/zinc/68/74/52/1046687452.db2.gz RLEDAYUQCAWFNL-HZPDHXFCSA-N 2 1 306.881 4.351 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]Cc1cccc(CC2CCC2)c1 ZINC001203032989 1046690426 /nfs/dbraw/zinc/69/04/26/1046690426.db2.gz SXYBUWWKRAHQQC-UHFFFAOYSA-N 2 1 302.506 4.097 20 0 DIADMP CC[NH+](CC)Cc1ccccc1Nc1c(C)[nH+]c2ccccn21 ZINC001211989450 1046707896 /nfs/dbraw/zinc/70/78/96/1046707896.db2.gz PXPFGUVIFICBMY-UHFFFAOYSA-N 2 1 308.429 4.228 20 0 DIADMP CC[NH+](CC)Cc1ccccc1Nc1ccc2[nH+]c(C)cn2c1 ZINC001211991870 1046725780 /nfs/dbraw/zinc/72/57/80/1046725780.db2.gz RXZSIWYQPPLJBZ-UHFFFAOYSA-N 2 1 308.429 4.228 20 0 DIADMP C[C@@H](C[N@@H+](C)C1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000533519932 1046743912 /nfs/dbraw/zinc/74/39/12/1046743912.db2.gz IXQGGBQVDYQBBB-IBGZPJMESA-N 2 1 322.496 4.387 20 0 DIADMP C[C@@H](C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000533519932 1046743928 /nfs/dbraw/zinc/74/39/28/1046743928.db2.gz IXQGGBQVDYQBBB-IBGZPJMESA-N 2 1 322.496 4.387 20 0 DIADMP C[C@@H](C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000533519932 1046743944 /nfs/dbraw/zinc/74/39/44/1046743944.db2.gz IXQGGBQVDYQBBB-IBGZPJMESA-N 2 1 322.496 4.387 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1C(C)(C)C ZINC000533637932 1046771090 /nfs/dbraw/zinc/77/10/90/1046771090.db2.gz BMMJNOYUBGXCSO-HZPDHXFCSA-N 2 1 300.490 4.119 20 0 DIADMP CC(C)[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000797110258 1046791121 /nfs/dbraw/zinc/79/11/21/1046791121.db2.gz HDWLYAVWXDAZLF-IPQPSQTFSA-N 2 1 320.908 4.294 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3ccc(F)cc32)C1 ZINC000246890161 1046817283 /nfs/dbraw/zinc/81/72/83/1046817283.db2.gz DRLSVHJKMYEIKB-PBHICJAKSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCSc3ccc(F)cc32)C1 ZINC000246890161 1046817306 /nfs/dbraw/zinc/81/73/06/1046817306.db2.gz DRLSVHJKMYEIKB-PBHICJAKSA-N 2 1 322.493 4.073 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)s1 ZINC000246843583 1046818286 /nfs/dbraw/zinc/81/82/86/1046818286.db2.gz CGJINFXFHJNPDR-HUUCEWRRSA-N 2 1 323.550 4.177 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378104 1046872814 /nfs/dbraw/zinc/87/28/14/1046872814.db2.gz OZZCRCHPJVSTEH-ZWKOTPCHSA-N 2 1 317.521 4.151 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378104 1046872829 /nfs/dbraw/zinc/87/28/29/1046872829.db2.gz OZZCRCHPJVSTEH-ZWKOTPCHSA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378104 1046872850 /nfs/dbraw/zinc/87/28/50/1046872850.db2.gz OZZCRCHPJVSTEH-ZWKOTPCHSA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378104 1046872869 /nfs/dbraw/zinc/87/28/69/1046872869.db2.gz OZZCRCHPJVSTEH-ZWKOTPCHSA-N 2 1 317.521 4.151 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)o1 ZINC000067668333 1046890891 /nfs/dbraw/zinc/89/08/91/1046890891.db2.gz MLNJULQSKRUQLI-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)o1 ZINC000067668333 1046890910 /nfs/dbraw/zinc/89/09/10/1046890910.db2.gz MLNJULQSKRUQLI-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)o1 ZINC000067668285 1046892129 /nfs/dbraw/zinc/89/21/29/1046892129.db2.gz ADDXWPOPCDKULH-MRXNPFEDSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)o1 ZINC000067668285 1046892146 /nfs/dbraw/zinc/89/21/46/1046892146.db2.gz ADDXWPOPCDKULH-MRXNPFEDSA-N 2 1 312.457 4.252 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1F ZINC000679773143 1046904885 /nfs/dbraw/zinc/90/48/85/1046904885.db2.gz RCEKCKBTQNEPOI-MPGHIAIKSA-N 2 1 324.871 4.393 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1F ZINC000679773143 1046904889 /nfs/dbraw/zinc/90/48/89/1046904889.db2.gz RCEKCKBTQNEPOI-MPGHIAIKSA-N 2 1 324.871 4.393 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC001140805104 1046907677 /nfs/dbraw/zinc/90/76/77/1046907677.db2.gz RSLYZLJYFVQZBU-QGZVFWFLSA-N 2 1 305.425 4.333 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC001140805104 1046907689 /nfs/dbraw/zinc/90/76/89/1046907689.db2.gz RSLYZLJYFVQZBU-QGZVFWFLSA-N 2 1 305.425 4.333 20 0 DIADMP C[C@@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@]1(C)CC[NH2+]C1 ZINC000261897109 1046954678 /nfs/dbraw/zinc/95/46/78/1046954678.db2.gz VCZXQJAXHSGITA-QFBILLFUSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H](c1cccs1)[N@@H+](Cc1ccccc1)C[C@]1(C)CC[NH2+]C1 ZINC000261897109 1046954686 /nfs/dbraw/zinc/95/46/86/1046954686.db2.gz VCZXQJAXHSGITA-QFBILLFUSA-N 2 1 314.498 4.311 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274275 1046973729 /nfs/dbraw/zinc/97/37/29/1046973729.db2.gz CAWVGDHBOIXTGO-FGZHOGPDSA-N 2 1 320.480 4.270 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274275 1046973739 /nfs/dbraw/zinc/97/37/39/1046973739.db2.gz CAWVGDHBOIXTGO-FGZHOGPDSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274275 1046973748 /nfs/dbraw/zinc/97/37/48/1046973748.db2.gz CAWVGDHBOIXTGO-FGZHOGPDSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC001168274275 1046973757 /nfs/dbraw/zinc/97/37/57/1046973757.db2.gz CAWVGDHBOIXTGO-FGZHOGPDSA-N 2 1 320.480 4.270 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cs1 ZINC000647343723 1046983803 /nfs/dbraw/zinc/98/38/03/1046983803.db2.gz ATKNQWOIFIDUSV-IPELMVKDSA-N 2 1 314.498 4.053 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](C/C=C/c3ccc(Cl)cc3)C2)CC1 ZINC000798956677 1046991516 /nfs/dbraw/zinc/99/15/16/1046991516.db2.gz JROCFHCNXPVXED-DUXPYHPUSA-N 2 1 318.892 4.161 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799179008 1047008988 /nfs/dbraw/zinc/00/89/88/1047008988.db2.gz XVAOLOBEPZTGLZ-CQSZACIVSA-N 2 1 324.871 4.348 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000536661830 1047051795 /nfs/dbraw/zinc/05/17/95/1047051795.db2.gz GLMSCEUFGMHVTG-YOEHRIQHSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000536661830 1047051807 /nfs/dbraw/zinc/05/18/07/1047051807.db2.gz GLMSCEUFGMHVTG-YOEHRIQHSA-N 2 1 302.487 4.063 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000536661827 1047053877 /nfs/dbraw/zinc/05/38/77/1047053877.db2.gz GLMSCEUFGMHVTG-PBHICJAKSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000536661827 1047053891 /nfs/dbraw/zinc/05/38/91/1047053891.db2.gz GLMSCEUFGMHVTG-PBHICJAKSA-N 2 1 302.487 4.063 20 0 DIADMP CCc1ccccc1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001141227904 1047056682 /nfs/dbraw/zinc/05/66/82/1047056682.db2.gz PPRQUEAAIUSPAM-FQEVSTJZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccccc1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001141227904 1047056697 /nfs/dbraw/zinc/05/66/97/1047056697.db2.gz PPRQUEAAIUSPAM-FQEVSTJZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccccc1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001141227904 1047056713 /nfs/dbraw/zinc/05/67/13/1047056713.db2.gz PPRQUEAAIUSPAM-FQEVSTJZSA-N 2 1 322.496 4.203 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2C)CC1 ZINC001141234575 1047058439 /nfs/dbraw/zinc/05/84/39/1047058439.db2.gz PLLQGCOJEHIQMJ-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP C[NH+](C)CCC[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC001141315208 1047085984 /nfs/dbraw/zinc/08/59/84/1047085984.db2.gz UZCUMAYXUKCLDV-UHFFFAOYSA-N 2 1 316.420 4.002 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC001141315208 1047085999 /nfs/dbraw/zinc/08/59/99/1047085999.db2.gz UZCUMAYXUKCLDV-UHFFFAOYSA-N 2 1 316.420 4.002 20 0 DIADMP Cc1nccn1CCC[N@H+](C)[C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000536733001 1047086672 /nfs/dbraw/zinc/08/66/72/1047086672.db2.gz PIGOKMWRWNRBJX-LSDHHAIUSA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000536733001 1047086685 /nfs/dbraw/zinc/08/66/85/1047086685.db2.gz PIGOKMWRWNRBJX-LSDHHAIUSA-N 2 1 319.880 4.359 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000536733001 1047086701 /nfs/dbraw/zinc/08/67/01/1047086701.db2.gz PIGOKMWRWNRBJX-LSDHHAIUSA-N 2 1 319.880 4.359 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379640717 1047092306 /nfs/dbraw/zinc/09/23/06/1047092306.db2.gz CCJVSHSZFWCPOF-LVCYWYKZSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000379640717 1047092320 /nfs/dbraw/zinc/09/23/20/1047092320.db2.gz CCJVSHSZFWCPOF-LVCYWYKZSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CCCC1 ZINC000379654478 1047094940 /nfs/dbraw/zinc/09/49/40/1047094940.db2.gz IPWACZFBMFWBCO-ZWOKBUDYSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C1CCCC1 ZINC000379654478 1047094956 /nfs/dbraw/zinc/09/49/56/1047094956.db2.gz IPWACZFBMFWBCO-ZWOKBUDYSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000536828969 1047102935 /nfs/dbraw/zinc/10/29/35/1047102935.db2.gz UWBPMQWTGGSFDS-LMMKCTJWSA-N 2 1 300.490 4.065 20 0 DIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536840222 1047107541 /nfs/dbraw/zinc/10/75/41/1047107541.db2.gz QXAZVPGEYQVQMF-ZWKOTPCHSA-N 2 1 318.505 4.022 20 0 DIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536840222 1047107546 /nfs/dbraw/zinc/10/75/46/1047107546.db2.gz QXAZVPGEYQVQMF-ZWKOTPCHSA-N 2 1 318.505 4.022 20 0 DIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536839238 1047108307 /nfs/dbraw/zinc/10/83/07/1047108307.db2.gz MYEHMNRQPJNSAH-MSOLQXFVSA-N 2 1 318.505 4.022 20 0 DIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536839238 1047108312 /nfs/dbraw/zinc/10/83/12/1047108312.db2.gz MYEHMNRQPJNSAH-MSOLQXFVSA-N 2 1 318.505 4.022 20 0 DIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536840211 1047108624 /nfs/dbraw/zinc/10/86/24/1047108624.db2.gz QXAZVPGEYQVQMF-MSOLQXFVSA-N 2 1 318.505 4.022 20 0 DIADMP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536840211 1047108629 /nfs/dbraw/zinc/10/86/29/1047108629.db2.gz QXAZVPGEYQVQMF-MSOLQXFVSA-N 2 1 318.505 4.022 20 0 DIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536839251 1047108765 /nfs/dbraw/zinc/10/87/65/1047108765.db2.gz MYEHMNRQPJNSAH-QZTJIDSGSA-N 2 1 318.505 4.022 20 0 DIADMP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536839251 1047108768 /nfs/dbraw/zinc/10/87/68/1047108768.db2.gz MYEHMNRQPJNSAH-QZTJIDSGSA-N 2 1 318.505 4.022 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+](C)C[C@H]1C)CCC2 ZINC000536847981 1047110124 /nfs/dbraw/zinc/11/01/24/1047110124.db2.gz UHKPUIPMKYEBCC-UIAACRFSSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](C)C[C@H]1C)CCC2 ZINC000536847981 1047110130 /nfs/dbraw/zinc/11/01/30/1047110130.db2.gz UHKPUIPMKYEBCC-UIAACRFSSA-N 2 1 300.490 4.117 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000121841378 1047119523 /nfs/dbraw/zinc/11/95/23/1047119523.db2.gz PJLQQELJEIIOJF-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC001116387291 1047135446 /nfs/dbraw/zinc/13/54/46/1047135446.db2.gz DVCTYMQGVKUUAR-CVEARBPZSA-N 2 1 306.519 4.181 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H]2CCc3ccccc32)CC1 ZINC000681663100 1047137745 /nfs/dbraw/zinc/13/77/45/1047137745.db2.gz XKBXIVMPVINRGH-FQEVSTJZSA-N 2 1 300.490 4.118 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180923 1047146537 /nfs/dbraw/zinc/14/65/37/1047146537.db2.gz BSANLANLKQVJOL-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180923 1047146541 /nfs/dbraw/zinc/14/65/41/1047146541.db2.gz BSANLANLKQVJOL-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180923 1047146549 /nfs/dbraw/zinc/14/65/49/1047146549.db2.gz BSANLANLKQVJOL-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(OCC(C)C)c2)C[C@H]1C ZINC000537180923 1047146555 /nfs/dbraw/zinc/14/65/55/1047146555.db2.gz BSANLANLKQVJOL-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3c(Cl)cccc32)C1 ZINC001116565041 1047156685 /nfs/dbraw/zinc/15/66/85/1047156685.db2.gz FXPOJBISSBAVGV-KBXCAEBGSA-N 2 1 306.881 4.039 20 0 DIADMP Cc1ccc(C)c([C@H](N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c2ccccc2)c1 ZINC000325404459 1047187350 /nfs/dbraw/zinc/18/73/50/1047187350.db2.gz IBJUKPQKFKDQTC-CZTZKLFOSA-N 2 1 322.496 4.465 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@@H]2CCN(C)[C@@H](C)C2)c2ccccc2)c1 ZINC000325404459 1047187361 /nfs/dbraw/zinc/18/73/61/1047187361.db2.gz IBJUKPQKFKDQTC-CZTZKLFOSA-N 2 1 322.496 4.465 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(Cl)s1 ZINC000035286243 1047226728 /nfs/dbraw/zinc/22/67/28/1047226728.db2.gz MNNJIOKXPZQTHE-ZDUSSCGKSA-N 2 1 300.899 4.174 20 0 DIADMP CCN1CCC([N@@H+](C)Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001141740403 1047283950 /nfs/dbraw/zinc/28/39/50/1047283950.db2.gz ZXACEDYXTFFDKH-UHFFFAOYSA-N 2 1 320.480 4.174 20 0 DIADMP CC[NH+]1CCC(N(C)Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001141740403 1047283960 /nfs/dbraw/zinc/28/39/60/1047283960.db2.gz ZXACEDYXTFFDKH-UHFFFAOYSA-N 2 1 320.480 4.174 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001141740403 1047283970 /nfs/dbraw/zinc/28/39/70/1047283970.db2.gz ZXACEDYXTFFDKH-UHFFFAOYSA-N 2 1 320.480 4.174 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001141740403 1047283978 /nfs/dbraw/zinc/28/39/78/1047283978.db2.gz ZXACEDYXTFFDKH-UHFFFAOYSA-N 2 1 320.480 4.174 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000390798615 1047298777 /nfs/dbraw/zinc/29/87/77/1047298777.db2.gz MAOMDXFYJWKBOG-LJQANCHMSA-N 2 1 314.498 4.058 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CC4CCC3CC4)C2)cc1 ZINC000394353080 1047310808 /nfs/dbraw/zinc/31/08/08/1047310808.db2.gz IGAXIVSVYZTNEM-WDQDQHCCSA-N 2 1 312.501 4.067 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685725 1047321527 /nfs/dbraw/zinc/32/15/27/1047321527.db2.gz BXYMHPDSHVYMBW-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685725 1047321542 /nfs/dbraw/zinc/32/15/42/1047321542.db2.gz BXYMHPDSHVYMBW-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685726 1047322356 /nfs/dbraw/zinc/32/23/56/1047322356.db2.gz BXYMHPDSHVYMBW-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651685726 1047322370 /nfs/dbraw/zinc/32/23/70/1047322370.db2.gz BXYMHPDSHVYMBW-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCSC(C)(C)C ZINC000398178827 1047327306 /nfs/dbraw/zinc/32/73/06/1047327306.db2.gz WMXISQJNVYVDFB-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808187 1047330608 /nfs/dbraw/zinc/33/06/08/1047330608.db2.gz IPPOMSAJAPTWRX-ROUUACIJSA-N 2 1 323.484 4.130 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808187 1047330618 /nfs/dbraw/zinc/33/06/18/1047330618.db2.gz IPPOMSAJAPTWRX-ROUUACIJSA-N 2 1 323.484 4.130 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H](c2cccnc2)C2CCCCC2)C1 ZINC000652208761 1047345901 /nfs/dbraw/zinc/34/59/01/1047345901.db2.gz OHCBVOISXFUNIN-YLJYHZDGSA-N 2 1 315.505 4.025 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)s1 ZINC001142025641 1047350068 /nfs/dbraw/zinc/35/00/68/1047350068.db2.gz GDJNSXWNFYVGRF-OAHLLOKOSA-N 2 1 324.559 4.310 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)s1 ZINC001142025641 1047350084 /nfs/dbraw/zinc/35/00/84/1047350084.db2.gz GDJNSXWNFYVGRF-OAHLLOKOSA-N 2 1 324.559 4.310 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)s1 ZINC001142025640 1047350250 /nfs/dbraw/zinc/35/02/50/1047350250.db2.gz GDJNSXWNFYVGRF-HNNXBMFYSA-N 2 1 324.559 4.310 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)s1 ZINC001142025640 1047350260 /nfs/dbraw/zinc/35/02/60/1047350260.db2.gz GDJNSXWNFYVGRF-HNNXBMFYSA-N 2 1 324.559 4.310 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2(C4CCC4)CC2)C3)cc1 ZINC000652272862 1047352357 /nfs/dbraw/zinc/35/23/57/1047352357.db2.gz YHPJHSAUAGDPMX-OWZKRDHZSA-N 2 1 310.485 4.104 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2(C4CCC4)CC2)C3)cc1 ZINC000652272861 1047353097 /nfs/dbraw/zinc/35/30/97/1047353097.db2.gz YHPJHSAUAGDPMX-ACDBMABISA-N 2 1 310.485 4.104 20 0 DIADMP Cc1occc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000840949790 1047363112 /nfs/dbraw/zinc/36/31/12/1047363112.db2.gz CJFIRPZGGDDJGC-SEJPIABJSA-N 2 1 324.468 4.263 20 0 DIADMP Cc1occc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000840949790 1047363128 /nfs/dbraw/zinc/36/31/28/1047363128.db2.gz CJFIRPZGGDDJGC-SEJPIABJSA-N 2 1 324.468 4.263 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000653579322 1047403618 /nfs/dbraw/zinc/40/36/18/1047403618.db2.gz ZOLBBUHAEIPLNQ-HXUWFJFHSA-N 2 1 322.456 4.061 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000653579322 1047403625 /nfs/dbraw/zinc/40/36/25/1047403625.db2.gz ZOLBBUHAEIPLNQ-HXUWFJFHSA-N 2 1 322.456 4.061 20 0 DIADMP [NH3+]CCC[N@@H+](C1CCCCC1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255691173 1047422648 /nfs/dbraw/zinc/42/26/48/1047422648.db2.gz WWAHWXLPXJXEDG-HIFRSBDPSA-N 2 1 306.416 4.091 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001168323734 1047448008 /nfs/dbraw/zinc/44/80/08/1047448008.db2.gz BOYLSLIEFARFSH-QQFBHYJXSA-N 2 1 306.881 4.002 20 0 DIADMP COc1cccc([C@@H]2CCCC[N@H+]2C2CCC([NH+](C)C)CC2)c1 ZINC001168323991 1047448079 /nfs/dbraw/zinc/44/80/79/1047448079.db2.gz FPYSWTQHUPYEQL-QLOJAFMTSA-N 2 1 316.489 4.095 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001168323746 1047448132 /nfs/dbraw/zinc/44/81/32/1047448132.db2.gz BSFVRYZBQPGSPG-JTTJXQCZSA-N 2 1 306.881 4.350 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1CCC([NH+](C)C)CC1 ZINC001168328899 1047461676 /nfs/dbraw/zinc/46/16/76/1047461676.db2.gz MCWNCFPCEVFITD-HTWSVDAQSA-N 2 1 318.530 4.418 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000119683932 1047469327 /nfs/dbraw/zinc/46/93/27/1047469327.db2.gz XNYSQTCZFNYPER-SFHVURJKSA-N 2 1 300.490 4.004 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000121785673 1047524878 /nfs/dbraw/zinc/52/48/78/1047524878.db2.gz SSIPPVDTPGDZNH-LJQANCHMSA-N 2 1 316.489 4.098 20 0 DIADMP C[N@@H+](CCCc1c(Cl)cccc1Cl)C1CCC([NH3+])CC1 ZINC000843054771 1047525564 /nfs/dbraw/zinc/52/55/64/1047525564.db2.gz GVLFTBLKROVBDL-UHFFFAOYSA-N 2 1 315.288 4.128 20 0 DIADMP COc1cc(-c2ccccc2)ccc1C[N@@H+](C)C1CCC([NH3+])CC1 ZINC000843054738 1047526407 /nfs/dbraw/zinc/52/64/07/1047526407.db2.gz DVRWSHNBUJXPMC-UHFFFAOYSA-N 2 1 324.468 4.064 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001143251648 1047544657 /nfs/dbraw/zinc/54/46/57/1047544657.db2.gz UOORUVVKXKIMGT-GOSISDBHSA-N 2 1 322.443 4.465 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC001203136742 1047549892 /nfs/dbraw/zinc/54/98/92/1047549892.db2.gz SRGRAJXVGDLDLF-JBXOJTMHSA-N 2 1 306.881 4.065 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649401 1047560478 /nfs/dbraw/zinc/56/04/78/1047560478.db2.gz KHNZJTNECDQUDQ-INIZCTEOSA-N 2 1 320.546 4.209 20 0 DIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649401 1047560479 /nfs/dbraw/zinc/56/04/79/1047560479.db2.gz KHNZJTNECDQUDQ-INIZCTEOSA-N 2 1 320.546 4.209 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649401 1047560480 /nfs/dbraw/zinc/56/04/80/1047560480.db2.gz KHNZJTNECDQUDQ-INIZCTEOSA-N 2 1 320.546 4.209 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649401 1047560481 /nfs/dbraw/zinc/56/04/81/1047560481.db2.gz KHNZJTNECDQUDQ-INIZCTEOSA-N 2 1 320.546 4.209 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649401 1047560483 /nfs/dbraw/zinc/56/04/83/1047560483.db2.gz KHNZJTNECDQUDQ-INIZCTEOSA-N 2 1 320.546 4.209 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206632504 1047572205 /nfs/dbraw/zinc/57/22/05/1047572205.db2.gz LVDKNLBOTSLIGK-GOSISDBHSA-N 2 1 308.469 4.223 20 0 DIADMP C[C@H](c1cccnc1)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000476976285 1047586783 /nfs/dbraw/zinc/58/67/83/1047586783.db2.gz WANXZWBVWHCHKX-ZWKOTPCHSA-N 2 1 315.505 4.119 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C(C)(C)C)cc1 ZINC000315556628 1047609568 /nfs/dbraw/zinc/60/95/68/1047609568.db2.gz XXFYFSUMFOMCJR-FMJMRLDVSA-N 2 1 300.490 4.260 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2ccc(Cl)o2)CC1)CC1CC1 ZINC000537754949 1047636591 /nfs/dbraw/zinc/63/65/91/1047636591.db2.gz DSIRHGXCMONSQL-UHFFFAOYSA-N 2 1 324.896 4.267 20 0 DIADMP CC[C@H](C)C[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000537865173 1047641250 /nfs/dbraw/zinc/64/12/50/1047641250.db2.gz VKJJSXVAIUUCDD-INIZCTEOSA-N 2 1 300.446 4.047 20 0 DIADMP CC[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000537940630 1047644987 /nfs/dbraw/zinc/64/49/87/1047644987.db2.gz RAAIDAVFKVOBMW-KPFFTGBYSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000537950238 1047645637 /nfs/dbraw/zinc/64/56/37/1047645637.db2.gz NOLNSTOZVAOUQA-QAPCUYQASA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000537950238 1047645640 /nfs/dbraw/zinc/64/56/40/1047645640.db2.gz NOLNSTOZVAOUQA-QAPCUYQASA-N 2 1 322.443 4.207 20 0 DIADMP Cc1cccc(C)c1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000538003241 1047652938 /nfs/dbraw/zinc/65/29/38/1047652938.db2.gz YOJXXEAPQSKYDY-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Oc2ccccc2)cc1 ZINC000538405677 1047673427 /nfs/dbraw/zinc/67/34/27/1047673427.db2.gz AQWDACRNFRJVDP-QGZVFWFLSA-N 2 1 322.452 4.391 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000538452018 1047678851 /nfs/dbraw/zinc/67/88/51/1047678851.db2.gz ZYVFTYMDTQMRRP-HNAYVOBHSA-N 2 1 300.446 4.061 20 0 DIADMP CCCCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000538717467 1047699137 /nfs/dbraw/zinc/69/91/37/1047699137.db2.gz CKOCEHOKUPELDS-HKUYNNGSSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000538717467 1047699138 /nfs/dbraw/zinc/69/91/38/1047699138.db2.gz CKOCEHOKUPELDS-HKUYNNGSSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000538717467 1047699140 /nfs/dbraw/zinc/69/91/40/1047699140.db2.gz CKOCEHOKUPELDS-HKUYNNGSSA-N 2 1 318.505 4.170 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000538717467 1047699141 /nfs/dbraw/zinc/69/91/41/1047699141.db2.gz CKOCEHOKUPELDS-HKUYNNGSSA-N 2 1 318.505 4.170 20 0 DIADMP C[C@@H]1C[C@H](N(C)Cc2ccc(-c3ccccc3F)o2)CC[N@H+]1C ZINC000538720080 1047699242 /nfs/dbraw/zinc/69/92/42/1047699242.db2.gz FEJSJXRGJISVDD-HUUCEWRRSA-N 2 1 316.420 4.000 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720080 1047699247 /nfs/dbraw/zinc/69/92/47/1047699247.db2.gz FEJSJXRGJISVDD-HUUCEWRRSA-N 2 1 316.420 4.000 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720080 1047699251 /nfs/dbraw/zinc/69/92/51/1047699251.db2.gz FEJSJXRGJISVDD-HUUCEWRRSA-N 2 1 316.420 4.000 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2csc3ccccc23)[C@@H](C)C1 ZINC000538717314 1047699716 /nfs/dbraw/zinc/69/97/16/1047699716.db2.gz TVPQFGBJUGZOFE-WMLDXEAASA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2csc3ccccc23)[C@@H](C)C1 ZINC000538717314 1047699717 /nfs/dbraw/zinc/69/97/17/1047699717.db2.gz TVPQFGBJUGZOFE-WMLDXEAASA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2csc3ccccc23)[C@@H](C)C1 ZINC000538717314 1047699720 /nfs/dbraw/zinc/69/97/20/1047699720.db2.gz TVPQFGBJUGZOFE-WMLDXEAASA-N 2 1 302.487 4.063 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3)s2)CCN1C ZINC000538738213 1047705455 /nfs/dbraw/zinc/70/54/55/1047705455.db2.gz GGGTVKAHDNJODO-RDJZCZTQSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)s2)CC[N@@H+]1C ZINC000538738213 1047705460 /nfs/dbraw/zinc/70/54/60/1047705460.db2.gz GGGTVKAHDNJODO-RDJZCZTQSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)s2)CC[N@H+]1C ZINC000538738213 1047705463 /nfs/dbraw/zinc/70/54/63/1047705463.db2.gz GGGTVKAHDNJODO-RDJZCZTQSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)s2)CC[NH+]1C ZINC000538738213 1047705470 /nfs/dbraw/zinc/70/54/70/1047705470.db2.gz GGGTVKAHDNJODO-RDJZCZTQSA-N 2 1 314.498 4.330 20 0 DIADMP Cc1ccc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)[nH+]c1C ZINC001156315957 1047707972 /nfs/dbraw/zinc/70/79/72/1047707972.db2.gz DJNQVXHEXYDHOH-VAMGGRTRSA-N 2 1 321.468 4.021 20 0 DIADMP Cc1ccc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)[nH+]c1C ZINC001156315955 1047708181 /nfs/dbraw/zinc/70/81/81/1047708181.db2.gz DJNQVXHEXYDHOH-HSALFYBXSA-N 2 1 321.468 4.021 20 0 DIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752142 1047708407 /nfs/dbraw/zinc/70/84/07/1047708407.db2.gz LGQHBDVBNVOEAV-QGZVFWFLSA-N 2 1 312.457 4.029 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752142 1047708409 /nfs/dbraw/zinc/70/84/09/1047708409.db2.gz LGQHBDVBNVOEAV-QGZVFWFLSA-N 2 1 312.457 4.029 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752142 1047708410 /nfs/dbraw/zinc/70/84/10/1047708410.db2.gz LGQHBDVBNVOEAV-QGZVFWFLSA-N 2 1 312.457 4.029 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000538752142 1047708419 /nfs/dbraw/zinc/70/84/19/1047708419.db2.gz LGQHBDVBNVOEAV-QGZVFWFLSA-N 2 1 312.457 4.029 20 0 DIADMP CCCC[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CC1 ZINC001307414538 1047720655 /nfs/dbraw/zinc/72/06/55/1047720655.db2.gz LMXSZVGGJGCOFS-UHFFFAOYSA-N 2 1 300.490 4.437 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000539058922 1047728999 /nfs/dbraw/zinc/72/89/99/1047728999.db2.gz APRHABXVOVTOFH-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000539058922 1047729005 /nfs/dbraw/zinc/72/90/05/1047729005.db2.gz APRHABXVOVTOFH-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000539058931 1047729860 /nfs/dbraw/zinc/72/98/60/1047729860.db2.gz APRHABXVOVTOFH-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000539058931 1047729862 /nfs/dbraw/zinc/72/98/62/1047729862.db2.gz APRHABXVOVTOFH-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)CCC2 ZINC000539046047 1047731204 /nfs/dbraw/zinc/73/12/04/1047731204.db2.gz GAKJEVVANMSAKE-QSFXBCCZSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)CCC2 ZINC000539046047 1047731214 /nfs/dbraw/zinc/73/12/14/1047731214.db2.gz GAKJEVVANMSAKE-QSFXBCCZSA-N 2 1 300.490 4.260 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@@H](C)c2ccccn2)CC1)CC(C)C ZINC000539098466 1047736472 /nfs/dbraw/zinc/73/64/72/1047736472.db2.gz OVKDUGUALIAAOC-SFHVURJKSA-N 2 1 317.521 4.223 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000539216517 1047742165 /nfs/dbraw/zinc/74/21/65/1047742165.db2.gz FBTNRUXFZQGLLT-KDOFPFPSSA-N 2 1 319.880 4.468 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1cc(F)ccc1F)C(C)C ZINC000479080416 1047837158 /nfs/dbraw/zinc/83/71/58/1047837158.db2.gz RORLXAJANOXPCN-ACJLOTCBSA-N 2 1 321.415 4.093 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](CCOC2CCCCCC2)CC1 ZINC001197582105 1047851061 /nfs/dbraw/zinc/85/10/61/1047851061.db2.gz HSOKGEMLRZVMHA-UHFFFAOYSA-N 2 1 322.537 4.066 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001204142746 1047889641 /nfs/dbraw/zinc/88/96/41/1047889641.db2.gz UXSXCJPJDULCLX-GOSISDBHSA-N 2 1 318.530 4.249 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001204142746 1047889659 /nfs/dbraw/zinc/88/96/59/1047889659.db2.gz UXSXCJPJDULCLX-GOSISDBHSA-N 2 1 318.530 4.249 20 0 DIADMP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cc2c(s1)CCCC2 ZINC000479511623 1047916729 /nfs/dbraw/zinc/91/67/29/1047916729.db2.gz LMGLKIRLGIFZEW-ODIFPOPNSA-N 2 1 318.530 4.294 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001183570524 1047941841 /nfs/dbraw/zinc/94/18/41/1047941841.db2.gz BWLWDIRZZQPAES-SLYNCCJLSA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001183570524 1047941847 /nfs/dbraw/zinc/94/18/47/1047941847.db2.gz BWLWDIRZZQPAES-SLYNCCJLSA-N 2 1 312.501 4.380 20 0 DIADMP Cc1ccc2cc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)[nH]c2c1 ZINC000667534788 1047953180 /nfs/dbraw/zinc/95/31/80/1047953180.db2.gz LKHYOSQBBQCRAW-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP c1c2ccccc2[nH]c1[C@@H]1CCCC[N@@H+]1CCC1CC[NH2+]CC1 ZINC000479689342 1047954991 /nfs/dbraw/zinc/95/49/91/1047954991.db2.gz SLPCDANBRRZEHH-FQEVSTJZSA-N 2 1 311.473 4.085 20 0 DIADMP c1cc2cc(Nc3ccc(O[C@@H]4CCC[NH2+]C4)cc3)ccc2c[nH+]1 ZINC001159949460 1047955242 /nfs/dbraw/zinc/95/52/42/1047955242.db2.gz OVBWUFRKXLJDPZ-HXUWFJFHSA-N 2 1 319.408 4.109 20 0 DIADMP Cc1ccc(CC[NH+]2CCC(C)([NH+]3CCCCC3)CC2)cc1C ZINC001183685817 1047955458 /nfs/dbraw/zinc/95/54/58/1047955458.db2.gz MFGBFVVOSGRSOH-UHFFFAOYSA-N 2 1 314.517 4.186 20 0 DIADMP CCC[C@@H]1CCC[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001198428891 1047956302 /nfs/dbraw/zinc/95/63/02/1047956302.db2.gz KPUZCVWRXSVGAE-HXUWFJFHSA-N 2 1 300.490 4.437 20 0 DIADMP CC[NH+](CC)Cc1ccc(F)c(Nc2ccc3[nH]c[nH+]c3c2)c1 ZINC001160223622 1048003735 /nfs/dbraw/zinc/00/37/35/1048003735.db2.gz LMKPHPZZKJTDBK-UHFFFAOYSA-N 2 1 312.392 4.287 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000479911707 1048004794 /nfs/dbraw/zinc/00/47/94/1048004794.db2.gz LDYCLOYWXWGBNZ-PKOBYXMFSA-N 2 1 303.494 4.023 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000479911707 1048004805 /nfs/dbraw/zinc/00/48/05/1048004805.db2.gz LDYCLOYWXWGBNZ-PKOBYXMFSA-N 2 1 303.494 4.023 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCC2(F)CCC2)CC1 ZINC000554089095 1048007657 /nfs/dbraw/zinc/00/76/57/1048007657.db2.gz RBCIGTSJLGKDQQ-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP CCc1cccc2cc(C[NH2+]CCC[NH+]3CCC(C)CC3)oc21 ZINC001199021312 1048023912 /nfs/dbraw/zinc/02/39/12/1048023912.db2.gz HOUITZCJQSKKQQ-UHFFFAOYSA-N 2 1 314.473 4.207 20 0 DIADMP Cc1cc2cc(C[NH2+]CCC[NH+]3CCCCC3)oc2cc1C ZINC001199038320 1048027621 /nfs/dbraw/zinc/02/76/21/1048027621.db2.gz MQHDLZSGXHRGLK-UHFFFAOYSA-N 2 1 300.446 4.015 20 0 DIADMP CCCCOc1ccccc1C[NH2+]CCC[NH+]1CCC(C)CC1 ZINC001199012426 1048028440 /nfs/dbraw/zinc/02/84/40/1048028440.db2.gz CCZBAJYYEXPKMQ-UHFFFAOYSA-N 2 1 318.505 4.077 20 0 DIADMP CC(C)c1cccc(C[NH2+]CCC[N@@H+](C)Cc2ccccc2)c1 ZINC001199038455 1048029118 /nfs/dbraw/zinc/02/91/18/1048029118.db2.gz PRSRPJPTPXYHFS-UHFFFAOYSA-N 2 1 310.485 4.422 20 0 DIADMP CC[NH+](CC)CC[C@@H]([NH2+]C[C@@]1(C)CCCCO1)c1ccccc1 ZINC001184340364 1048030105 /nfs/dbraw/zinc/03/01/05/1048030105.db2.gz VWARQNLNWREFIU-WOJBJXKFSA-N 2 1 318.505 4.008 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC000480223786 1048094348 /nfs/dbraw/zinc/09/43/48/1048094348.db2.gz JEHQIYGYEANOOE-CABCVRRESA-N 2 1 308.432 4.209 20 0 DIADMP C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)CCCC(F)(F)F ZINC000480220705 1048095152 /nfs/dbraw/zinc/09/51/52/1048095152.db2.gz DKOSTAIMRGHIEX-LJISPDSOSA-N 2 1 308.432 4.064 20 0 DIADMP C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H](C)CCCC(F)(F)F ZINC000480220705 1048095162 /nfs/dbraw/zinc/09/51/62/1048095162.db2.gz DKOSTAIMRGHIEX-LJISPDSOSA-N 2 1 308.432 4.064 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC001199336753 1048056301 /nfs/dbraw/zinc/05/63/01/1048056301.db2.gz WLAINSDTVOYKCL-INIZCTEOSA-N 2 1 308.897 4.393 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cscc2Cl)C1 ZINC001199336168 1048059034 /nfs/dbraw/zinc/05/90/34/1048059034.db2.gz IHAJVQZLMBVNLO-ZDUSSCGKSA-N 2 1 300.899 4.003 20 0 DIADMP CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ccnn1-c1cc[nH+]cc1 ZINC000667626259 1048064950 /nfs/dbraw/zinc/06/49/50/1048064950.db2.gz OEBHRKNTKGZHTF-HXUWFJFHSA-N 2 1 320.440 4.096 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000554362559 1048079428 /nfs/dbraw/zinc/07/94/28/1048079428.db2.gz VHRZEQVBPWLCTB-NHCUHLMSSA-N 2 1 324.468 4.190 20 0 DIADMP CC(C)C[N@@H+]1CCCC[C@H]1C[NH2+][C@H](C)CCCC(F)(F)F ZINC000480186989 1048086770 /nfs/dbraw/zinc/08/67/70/1048086770.db2.gz YLTDECKLGFHJQJ-CABCVRRESA-N 2 1 308.432 4.208 20 0 DIADMP CC(C)C[N@H+]1CCCC[C@H]1C[NH2+][C@H](C)CCCC(F)(F)F ZINC000480186989 1048086787 /nfs/dbraw/zinc/08/67/87/1048086787.db2.gz YLTDECKLGFHJQJ-CABCVRRESA-N 2 1 308.432 4.208 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)c2ccccc12 ZINC000480191098 1048088282 /nfs/dbraw/zinc/08/82/82/1048088282.db2.gz HVHWJXMJLZIAJG-INIZCTEOSA-N 2 1 314.473 4.229 20 0 DIADMP COc1ccc2oc([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)c(C)c2c1 ZINC000480200251 1048089274 /nfs/dbraw/zinc/08/92/74/1048089274.db2.gz WSQZNJGVXQBQQT-HNNXBMFYSA-N 2 1 318.461 4.131 20 0 DIADMP COc1ccc2oc([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)c(C)c2c1 ZINC000480200251 1048089289 /nfs/dbraw/zinc/08/92/89/1048089289.db2.gz WSQZNJGVXQBQQT-HNNXBMFYSA-N 2 1 318.461 4.131 20 0 DIADMP CC(C)C[C@@H](NCCC[N@@H+](C)C1CCCCC1)c1ccccn1 ZINC000480249302 1048103583 /nfs/dbraw/zinc/10/35/83/1048103583.db2.gz PMUDDJNINDOZSG-HXUWFJFHSA-N 2 1 317.521 4.413 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccccn1 ZINC000480249302 1048103585 /nfs/dbraw/zinc/10/35/85/1048103585.db2.gz PMUDDJNINDOZSG-HXUWFJFHSA-N 2 1 317.521 4.413 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccccn1 ZINC000480249302 1048103587 /nfs/dbraw/zinc/10/35/87/1048103587.db2.gz PMUDDJNINDOZSG-HXUWFJFHSA-N 2 1 317.521 4.413 20 0 DIADMP C[C@H](NCc1ccsc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000480275587 1048108923 /nfs/dbraw/zinc/10/89/23/1048108923.db2.gz RWVFEIKQGIZJJV-JSGCOSHPSA-N 2 1 312.910 4.144 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H](Cc2ccccc2)C2CC2)C1 ZINC000480613483 1048191499 /nfs/dbraw/zinc/19/14/99/1048191499.db2.gz JPDOIXNCQZBPBT-GHTZIAJQSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000480610483 1048191956 /nfs/dbraw/zinc/19/19/56/1048191956.db2.gz JHRMKEKHTXXXLQ-DNVCBOLYSA-N 2 1 304.453 4.057 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](Cc2ccccc2)C2CC2)C1 ZINC000480613490 1048192380 /nfs/dbraw/zinc/19/23/80/1048192380.db2.gz JPDOIXNCQZBPBT-WIYYLYMNSA-N 2 1 314.517 4.109 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000554819890 1048195369 /nfs/dbraw/zinc/19/53/69/1048195369.db2.gz JTTKSBZPUWFTAZ-SFHVURJKSA-N 2 1 308.469 4.050 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000554819890 1048195377 /nfs/dbraw/zinc/19/53/77/1048195377.db2.gz JTTKSBZPUWFTAZ-SFHVURJKSA-N 2 1 308.469 4.050 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000554819890 1048195385 /nfs/dbraw/zinc/19/53/85/1048195385.db2.gz JTTKSBZPUWFTAZ-SFHVURJKSA-N 2 1 308.469 4.050 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1F ZINC000480625721 1048200692 /nfs/dbraw/zinc/20/06/92/1048200692.db2.gz NOTBYDKJFLMOJC-GJZGRUSLSA-N 2 1 310.432 4.270 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc2c(c1)COC2 ZINC000480636940 1048204672 /nfs/dbraw/zinc/20/46/72/1048204672.db2.gz GGHDIEOXOKMINJ-DLBZAZTESA-N 2 1 316.489 4.022 20 0 DIADMP C[C@H](N[C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646439 1048207929 /nfs/dbraw/zinc/20/79/29/1048207929.db2.gz VIUNVCDCDIDRIS-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CCN2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646439 1048207940 /nfs/dbraw/zinc/20/79/40/1048207940.db2.gz VIUNVCDCDIDRIS-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646439 1048207954 /nfs/dbraw/zinc/20/79/54/1048207954.db2.gz VIUNVCDCDIDRIS-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(-c2ccncc2)cc1 ZINC000480646439 1048207963 /nfs/dbraw/zinc/20/79/63/1048207963.db2.gz VIUNVCDCDIDRIS-ORYQWCPZSA-N 2 1 321.468 4.026 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)cc(Cl)c1 ZINC000480741947 1048234444 /nfs/dbraw/zinc/23/44/44/1048234444.db2.gz VBRNJYVTCYBRSQ-XZJROXQQSA-N 2 1 313.272 4.271 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC000480897096 1048268229 /nfs/dbraw/zinc/26/82/29/1048268229.db2.gz FBAQOGFMQFWEDG-CABCVRRESA-N 2 1 323.550 4.348 20 0 DIADMP Cc1cc[nH+]c(C)c1NC1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001201470208 1048277139 /nfs/dbraw/zinc/27/71/39/1048277139.db2.gz NBQMDFHLLSLGPQ-UXHICEINSA-N 2 1 319.452 4.431 20 0 DIADMP Cc1cc[nH+]c(C)c1NC1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001201470208 1048277142 /nfs/dbraw/zinc/27/71/42/1048277142.db2.gz NBQMDFHLLSLGPQ-UXHICEINSA-N 2 1 319.452 4.431 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450728 1048277789 /nfs/dbraw/zinc/27/77/89/1048277789.db2.gz ZSVGWJLVVLSAMA-AABGKKOBSA-N 2 1 312.501 4.352 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001201450728 1048277796 /nfs/dbraw/zinc/27/77/96/1048277796.db2.gz ZSVGWJLVVLSAMA-AABGKKOBSA-N 2 1 312.501 4.352 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008585 1048287366 /nfs/dbraw/zinc/28/73/66/1048287366.db2.gz ANVSXEYZRKUYAC-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008585 1048287377 /nfs/dbraw/zinc/28/73/77/1048287377.db2.gz ANVSXEYZRKUYAC-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008584 1048287435 /nfs/dbraw/zinc/28/74/35/1048287435.db2.gz ANVSXEYZRKUYAC-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000481008584 1048287445 /nfs/dbraw/zinc/28/74/45/1048287445.db2.gz ANVSXEYZRKUYAC-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccccc2SCC)C1 ZINC000481041826 1048298296 /nfs/dbraw/zinc/29/82/96/1048298296.db2.gz AXPLQJLHRCEGFN-CVEARBPZSA-N 2 1 306.519 4.181 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC000481042450 1048301101 /nfs/dbraw/zinc/30/11/01/1048301101.db2.gz QVXGIZWCXCDEEK-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC000481042450 1048301110 /nfs/dbraw/zinc/30/11/10/1048301110.db2.gz QVXGIZWCXCDEEK-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053957 1048302268 /nfs/dbraw/zinc/30/22/68/1048302268.db2.gz QVHDPTROLCANHP-HUUCEWRRSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2OCC)C1 ZINC000481053957 1048302280 /nfs/dbraw/zinc/30/22/80/1048302280.db2.gz QVHDPTROLCANHP-HUUCEWRRSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001201543669 1048303079 /nfs/dbraw/zinc/30/30/79/1048303079.db2.gz JGYKVQDDZPZRIM-KRWDZBQOSA-N 2 1 304.478 4.004 20 0 DIADMP CC(C)CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)C1CC1 ZINC000555235894 1048305062 /nfs/dbraw/zinc/30/50/62/1048305062.db2.gz OGTUJHCXNOSMCB-POAQFYNOSA-N 2 1 306.538 4.444 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C[C@@H](C)CCc2ccccc2)C1 ZINC001201558703 1048317288 /nfs/dbraw/zinc/31/72/88/1048317288.db2.gz UQFNPNMJTZCLNQ-PZJWPPBQSA-N 2 1 316.533 4.213 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3)CCCC2)CC[N@H+]1C ZINC000481163105 1048317578 /nfs/dbraw/zinc/31/75/78/1048317578.db2.gz DNLPUJWRDRFQDF-CRAIPNDOSA-N 2 1 320.908 4.224 20 0 DIADMP CC(C)CC[NH+]1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC001201621003 1048333998 /nfs/dbraw/zinc/33/39/98/1048333998.db2.gz WGIWERSSYWGNOP-UHFFFAOYSA-N 2 1 317.864 4.056 20 0 DIADMP CC(C)CC[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001201626315 1048339141 /nfs/dbraw/zinc/33/91/41/1048339141.db2.gz GBKLGFIGTNLOJT-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CC[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001201626315 1048339154 /nfs/dbraw/zinc/33/91/54/1048339154.db2.gz GBKLGFIGTNLOJT-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)CC[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001201626315 1048339167 /nfs/dbraw/zinc/33/91/67/1048339167.db2.gz GBKLGFIGTNLOJT-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(-c3ccccc3)c2)C1 ZINC000481296745 1048354959 /nfs/dbraw/zinc/35/49/59/1048354959.db2.gz URAVNERIUWYVDY-MSOLQXFVSA-N 2 1 308.469 4.346 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000481308001 1048359579 /nfs/dbraw/zinc/35/95/79/1048359579.db2.gz ACMTVWYITUWBOK-KDOFPFPSSA-N 2 1 306.881 4.039 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2-c2ccc([C@H]3CC[N@@H+](C)C3)cc2)c1 ZINC001162913292 1048386317 /nfs/dbraw/zinc/38/63/17/1048386317.db2.gz DZCUBKGJAHZOEQ-KXBFYZLASA-N 2 1 319.452 4.069 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001201947417 1048407837 /nfs/dbraw/zinc/40/78/37/1048407837.db2.gz YJBQKJTZMXEXCS-YRXWBPOGSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)=CCC[C@H](C)CC[NH+]1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001201973544 1048415018 /nfs/dbraw/zinc/41/50/18/1048415018.db2.gz PAUSHSMDTLXWRP-SFHVURJKSA-N 2 1 304.522 4.177 20 0 DIADMP CC(C)=CCC[C@H](C)CC[NH+]1CC2(C1)CC[N@H+](CC1CC1)C2 ZINC001201973544 1048415012 /nfs/dbraw/zinc/41/50/12/1048415012.db2.gz PAUSHSMDTLXWRP-SFHVURJKSA-N 2 1 304.522 4.177 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCCC1 ZINC000481559598 1048432379 /nfs/dbraw/zinc/43/23/79/1048432379.db2.gz RZIHYBWYYHQHOW-CRAIPNDOSA-N 2 1 320.908 4.082 20 0 DIADMP CC(C)(C[NH2+]Cc1ccc(-c2ccccc2)o1)C[NH+]1CCCC1 ZINC001202234076 1048499112 /nfs/dbraw/zinc/49/91/12/1048499112.db2.gz QOOZWTQLSRNKON-UHFFFAOYSA-N 2 1 312.457 4.158 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556037639 1048518033 /nfs/dbraw/zinc/51/80/33/1048518033.db2.gz HBRAZUFTIXSUJS-STZQEDGTSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556037639 1048518042 /nfs/dbraw/zinc/51/80/42/1048518042.db2.gz HBRAZUFTIXSUJS-STZQEDGTSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556037638 1048518456 /nfs/dbraw/zinc/51/84/56/1048518456.db2.gz HBRAZUFTIXSUJS-QIJUGHKUSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556037638 1048518472 /nfs/dbraw/zinc/51/84/72/1048518472.db2.gz HBRAZUFTIXSUJS-QIJUGHKUSA-N 2 1 322.496 4.433 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000556050490 1048526232 /nfs/dbraw/zinc/52/62/32/1048526232.db2.gz JACSNSGXCCXWBX-AWEZNQCLSA-N 2 1 300.421 4.114 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)C2CCCCC2)[C@@H](C)C1 ZINC000482017704 1048548240 /nfs/dbraw/zinc/54/82/40/1048548240.db2.gz PFWMZBIXFZWRBC-SXLOBPIMSA-N 2 1 324.553 4.072 20 0 DIADMP CC[C@@H]1CCC[C@@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001202456743 1048556961 /nfs/dbraw/zinc/55/69/61/1048556961.db2.gz LZHNXHRLAGEEHY-RTBURBONSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cc[nH+]c2cc(NCc3cccc(C[NH+](C)C)c3)ccc12 ZINC001163994935 1048567759 /nfs/dbraw/zinc/56/77/59/1048567759.db2.gz VXCPVBQPWPRTHV-UHFFFAOYSA-N 2 1 305.425 4.217 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)C1 ZINC000482321590 1048587353 /nfs/dbraw/zinc/58/73/53/1048587353.db2.gz PSRCKKQKJQNGGJ-UONOGXRCSA-N 2 1 312.860 4.250 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc(C)c1F ZINC000482326099 1048587993 /nfs/dbraw/zinc/58/79/93/1048587993.db2.gz YEFKGTXTZIAJSR-SJORKVTESA-N 2 1 306.469 4.214 20 0 DIADMP Cc1[nH+]c2ccc(F)cn2c1Nc1cccc(C[NH+]2CCCC2)c1 ZINC001176195790 1048591410 /nfs/dbraw/zinc/59/14/10/1048591410.db2.gz LWYMEXGPYVCYKX-UHFFFAOYSA-N 2 1 324.403 4.121 20 0 DIADMP Cc1cccc(C[C@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)c1 ZINC000482341723 1048591889 /nfs/dbraw/zinc/59/18/89/1048591889.db2.gz CFSDVNCPSZFLKN-FPOVZHCZSA-N 2 1 314.517 4.026 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359813 1048592241 /nfs/dbraw/zinc/59/22/41/1048592241.db2.gz QUFSBJSLCORPSD-KBPBESRZSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2Cl)C1 ZINC000482359813 1048592253 /nfs/dbraw/zinc/59/22/53/1048592253.db2.gz QUFSBJSLCORPSD-KBPBESRZSA-N 2 1 312.860 4.250 20 0 DIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000482357179 1048593407 /nfs/dbraw/zinc/59/34/07/1048593407.db2.gz KHDNYBPHZDXIEB-ROUUACIJSA-N 2 1 318.505 4.246 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)nc2)CC1 ZINC000850037390 1048612437 /nfs/dbraw/zinc/61/24/37/1048612437.db2.gz CDKYZKYNYVBTSC-SJLPKXTDSA-N 2 1 312.461 4.024 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCCC(C)(C)CC2)cn1 ZINC000850037697 1048612736 /nfs/dbraw/zinc/61/27/36/1048612736.db2.gz GQVIMIWRZBMYOK-KRWDZBQOSA-N 2 1 312.461 4.024 20 0 DIADMP Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000482693127 1048660703 /nfs/dbraw/zinc/66/07/03/1048660703.db2.gz NUGADUFRGBUNHQ-RTBURBONSA-N 2 1 300.490 4.049 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC000482692253 1048661193 /nfs/dbraw/zinc/66/11/93/1048661193.db2.gz LGNXVPBWLVCEQB-HXUWFJFHSA-N 2 1 300.490 4.132 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C(C)(C)C)c1 ZINC000166788352 1048666575 /nfs/dbraw/zinc/66/65/75/1048666575.db2.gz JDCLZKVMQXDUBH-QRVBRYPASA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccc2c(C)cc(N3CCC4(CCCC[NH2+]4)CC3)[nH+]c2c1C ZINC001165248344 1048671047 /nfs/dbraw/zinc/67/10/47/1048671047.db2.gz KDISATOIVSUOPL-UHFFFAOYSA-N 2 1 323.484 4.273 20 0 DIADMP Cc1[nH+]c2ccc(NCC[C@H]3CCC[N@H+](C)C3)cc2n1C(C)C ZINC001165289445 1048677615 /nfs/dbraw/zinc/67/76/15/1048677615.db2.gz BNOLMFZRMOOPRD-MRXNPFEDSA-N 2 1 314.477 4.069 20 0 DIADMP Cc1[nH+]c2ccc(NCC[C@H]3CCC[N@@H+](C)C3)cc2n1C(C)C ZINC001165289445 1048677621 /nfs/dbraw/zinc/67/76/21/1048677621.db2.gz BNOLMFZRMOOPRD-MRXNPFEDSA-N 2 1 314.477 4.069 20 0 DIADMP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)C[C@]2(C)C1 ZINC001176629764 1048741031 /nfs/dbraw/zinc/74/10/31/1048741031.db2.gz VDNDCTBOQUNUIN-RTWAWAEBSA-N 2 1 312.501 4.118 20 0 DIADMP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(C4CCCCC4)cc3)C[C@]2(C)C1 ZINC001176629764 1048741042 /nfs/dbraw/zinc/74/10/42/1048741042.db2.gz VDNDCTBOQUNUIN-RTWAWAEBSA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+]1C[C@@H]2C[N@H+](Cc3ccc(C4CCCCC4)cc3)C[C@]2(C)C1 ZINC001176629764 1048741052 /nfs/dbraw/zinc/74/10/52/1048741052.db2.gz VDNDCTBOQUNUIN-RTWAWAEBSA-N 2 1 312.501 4.118 20 0 DIADMP C[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(C4CCCCC4)cc3)C[C@]2(C)C1 ZINC001176629764 1048741062 /nfs/dbraw/zinc/74/10/62/1048741062.db2.gz VDNDCTBOQUNUIN-RTWAWAEBSA-N 2 1 312.501 4.118 20 0 DIADMP CCc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC001190651069 1048773718 /nfs/dbraw/zinc/77/37/18/1048773718.db2.gz GWCVLOOTIZVUMR-NRFANRHFSA-N 2 1 314.517 4.193 20 0 DIADMP C(C1CC2(CCC2)C1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190827856 1048790659 /nfs/dbraw/zinc/79/06/59/1048790659.db2.gz PYDZOQONYYFGHB-GOSISDBHSA-N 2 1 304.522 4.155 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903167573 1048836812 /nfs/dbraw/zinc/83/68/12/1048836812.db2.gz LUFZBRVKWICFKE-YTTRVJOFSA-N 2 1 316.514 4.217 20 0 DIADMP CC[NH+](CC)[C@@H](C[NH2+][C@@H]1CCCc2ccccc2C1)CC(C)C ZINC001177210214 1048845965 /nfs/dbraw/zinc/84/59/65/1048845965.db2.gz ZWBQIFSJZFVURC-NHCUHLMSSA-N 2 1 316.533 4.280 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(C)(C)C2CC2)C1 ZINC001191048756 1048847446 /nfs/dbraw/zinc/84/74/46/1048847446.db2.gz TWKJTRGLNQBCPM-QZTJIDSGSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(C)(C)C2CC2)C1 ZINC001191048756 1048847469 /nfs/dbraw/zinc/84/74/69/1048847469.db2.gz TWKJTRGLNQBCPM-QZTJIDSGSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(C)(C)C2CC2)C1 ZINC001191048756 1048847486 /nfs/dbraw/zinc/84/74/86/1048847486.db2.gz TWKJTRGLNQBCPM-QZTJIDSGSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734588 1048849595 /nfs/dbraw/zinc/84/95/95/1048849595.db2.gz WAMQYIHBFHJYFO-PGUXBMHVSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734588 1048849607 /nfs/dbraw/zinc/84/96/07/1048849607.db2.gz WAMQYIHBFHJYFO-PGUXBMHVSA-N 2 1 301.261 4.127 20 0 DIADMP CC[C@H]1CCC[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001177245505 1048855499 /nfs/dbraw/zinc/85/54/99/1048855499.db2.gz UCZACFDLGKLDOK-GHTZIAJQSA-N 2 1 314.517 4.383 20 0 DIADMP CC[C@H]1CCC[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001177245505 1048855515 /nfs/dbraw/zinc/85/55/15/1048855515.db2.gz UCZACFDLGKLDOK-GHTZIAJQSA-N 2 1 314.517 4.383 20 0 DIADMP C[NH+](C)[C@H](C[NH2+]C1CCc2ccccc2CC1)C1CCCCC1 ZINC001177294435 1048856613 /nfs/dbraw/zinc/85/66/13/1048856613.db2.gz KJGNPQLIMHLJQE-OAQYLSRUSA-N 2 1 314.517 4.034 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(Cl)c1 ZINC001177289701 1048856704 /nfs/dbraw/zinc/85/67/04/1048856704.db2.gz IXZVJOIKURWLSR-CALCHBBNSA-N 2 1 322.924 4.496 20 0 DIADMP CN1CCC([N@@H+](Cc2ccccc2Cl)C2CCCC2)CC1 ZINC001203388104 1048886822 /nfs/dbraw/zinc/88/68/22/1048886822.db2.gz HCQSYVOFHJFLCJ-UHFFFAOYSA-N 2 1 306.881 4.179 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2CC[C@H]2CCC[NH+]2C)cc1 ZINC001191180963 1048889211 /nfs/dbraw/zinc/88/92/11/1048889211.db2.gz BRTUERIMGSBRBY-RLLQIKCJSA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[NH+]2CC[C@H]2CCC[N@@H+]2C)cc1 ZINC001191180963 1048889222 /nfs/dbraw/zinc/88/92/22/1048889222.db2.gz BRTUERIMGSBRBY-RLLQIKCJSA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[NH+]2CC[C@H]2CCC[N@H+]2C)cc1 ZINC001191180963 1048889241 /nfs/dbraw/zinc/88/92/41/1048889241.db2.gz BRTUERIMGSBRBY-RLLQIKCJSA-N 2 1 300.490 4.252 20 0 DIADMP CC(C)C1CCC(C[NH2+][C@@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001177458582 1048890398 /nfs/dbraw/zinc/89/03/98/1048890398.db2.gz DZYCDOJJYWLRSP-QVTFKHNJSA-N 2 1 308.554 4.405 20 0 DIADMP CC(C)C1CCC(C[NH2+][C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001177458582 1048890420 /nfs/dbraw/zinc/89/04/20/1048890420.db2.gz DZYCDOJJYWLRSP-QVTFKHNJSA-N 2 1 308.554 4.405 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000163383183 1048893456 /nfs/dbraw/zinc/89/34/56/1048893456.db2.gz VXEAFZVPIZNYIE-QLFBSQMISA-N 2 1 308.432 4.208 20 0 DIADMP Cc1ccc(SCC[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1C ZINC001191255164 1048895201 /nfs/dbraw/zinc/89/52/01/1048895201.db2.gz BNTZRGSKYLMSSU-SFHVURJKSA-N 2 1 320.546 4.202 20 0 DIADMP Cc1ccc(SCC[N@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1C ZINC001191255164 1048895219 /nfs/dbraw/zinc/89/52/19/1048895219.db2.gz BNTZRGSKYLMSSU-SFHVURJKSA-N 2 1 320.546 4.202 20 0 DIADMP Cc1ccc(SCC[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)cc1C ZINC001191255164 1048895232 /nfs/dbraw/zinc/89/52/32/1048895232.db2.gz BNTZRGSKYLMSSU-SFHVURJKSA-N 2 1 320.546 4.202 20 0 DIADMP Cc1ccc(SCC[NH+](C)CC[C@@H]2CCCC[N@H+]2C)cc1C ZINC001191255164 1048895243 /nfs/dbraw/zinc/89/52/43/1048895243.db2.gz BNTZRGSKYLMSSU-SFHVURJKSA-N 2 1 320.546 4.202 20 0 DIADMP CC[C@H](C[NH2+]CC(C)(C)[N@@H+]1CCC[C@H](C)C1)c1ccccc1 ZINC001177483620 1048897356 /nfs/dbraw/zinc/89/73/56/1048897356.db2.gz ZNBGFYGVAGNEPT-ZWKOTPCHSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@H](C[NH2+]CC(C)(C)[N@H+]1CCC[C@H](C)C1)c1ccccc1 ZINC001177483620 1048897366 /nfs/dbraw/zinc/89/73/66/1048897366.db2.gz ZNBGFYGVAGNEPT-ZWKOTPCHSA-N 2 1 302.506 4.280 20 0 DIADMP CCC[C@H](C)[C@H](CC)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000484147373 1048904106 /nfs/dbraw/zinc/90/41/06/1048904106.db2.gz RXLMHDWNBOAJNQ-WMZOPIPTSA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCC[NH+](CC)CC ZINC001191233223 1048906550 /nfs/dbraw/zinc/90/65/50/1048906550.db2.gz LRKIUKXCBYOVSI-UXHICEINSA-N 2 1 302.506 4.377 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@H]1CC=CCC1 ZINC001177541993 1048913263 /nfs/dbraw/zinc/91/32/63/1048913263.db2.gz IGYHODGRQWPELS-SFHVURJKSA-N 2 1 300.490 4.091 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@@H+]1Cc1ccccc1 ZINC001203504015 1048914219 /nfs/dbraw/zinc/91/42/19/1048914219.db2.gz NPPQEFGYPAFXPC-JBINPLMMSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@H+]1Cc1ccccc1 ZINC001203504015 1048914228 /nfs/dbraw/zinc/91/42/28/1048914228.db2.gz NPPQEFGYPAFXPC-JBINPLMMSA-N 2 1 312.501 4.208 20 0 DIADMP CC/C=C/CC[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359293 1048932285 /nfs/dbraw/zinc/93/22/85/1048932285.db2.gz TYSKQWZUWTWBHH-SHTLVRLNSA-N 2 1 312.501 4.331 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001191368038 1048935431 /nfs/dbraw/zinc/93/54/31/1048935431.db2.gz WMNSFFYKRAFIED-RTBURBONSA-N 2 1 302.506 4.337 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743804 1048938221 /nfs/dbraw/zinc/93/82/21/1048938221.db2.gz OFNWUMCBYMGACR-RTBURBONSA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743804 1048938229 /nfs/dbraw/zinc/93/82/29/1048938229.db2.gz OFNWUMCBYMGACR-RTBURBONSA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743789 1048938586 /nfs/dbraw/zinc/93/85/86/1048938586.db2.gz OFNWUMCBYMGACR-MOPGFXCFSA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743789 1048938592 /nfs/dbraw/zinc/93/85/92/1048938592.db2.gz OFNWUMCBYMGACR-MOPGFXCFSA-N 2 1 300.490 4.352 20 0 DIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1csc(C(F)(F)F)c1)C(C)(C)C ZINC001177821712 1048942979 /nfs/dbraw/zinc/94/29/79/1048942979.db2.gz CSOAPCJABHTFQI-GFCCVEGCSA-N 2 1 322.440 4.223 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000194884119 1048943716 /nfs/dbraw/zinc/94/37/16/1048943716.db2.gz FAZCYIVPVDRPSC-JKSUJKDBSA-N 2 1 306.519 4.180 20 0 DIADMP CCc1cccc2cc(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)oc21 ZINC001177822206 1048944066 /nfs/dbraw/zinc/94/40/66/1048944066.db2.gz IHSGJOKOSQVJCD-GOSISDBHSA-N 2 1 316.489 4.451 20 0 DIADMP C[C@H]1CCCC[C@H]1CC[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001177859908 1048955953 /nfs/dbraw/zinc/95/59/53/1048955953.db2.gz NKMGEOGIDFJZRJ-ICSRJNTNSA-N 2 1 314.517 4.457 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3cccc4cccc2c43)CC1(C)C ZINC001203750797 1048991203 /nfs/dbraw/zinc/99/12/03/1048991203.db2.gz PIJPXSONVBXMEJ-PKOBYXMFSA-N 2 1 308.469 4.290 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc(Cl)c1 ZINC001203801387 1048999019 /nfs/dbraw/zinc/99/90/19/1048999019.db2.gz RCDFYKOUUZZXOT-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc(Cl)c1 ZINC001203801387 1048999032 /nfs/dbraw/zinc/99/90/32/1048999032.db2.gz RCDFYKOUUZZXOT-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1 ZINC001203801387 1048999044 /nfs/dbraw/zinc/99/90/44/1048999044.db2.gz RCDFYKOUUZZXOT-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC001203801387 1048999057 /nfs/dbraw/zinc/99/90/57/1048999057.db2.gz RCDFYKOUUZZXOT-ROUUACIJSA-N 2 1 306.881 4.179 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1Cl ZINC001178249114 1049001680 /nfs/dbraw/zinc/00/16/80/1049001680.db2.gz IPDKIKLLJOQWPW-QGZVFWFLSA-N 2 1 308.897 4.106 20 0 DIADMP Cc1cc([C@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)ccc1F ZINC001178218722 1049005779 /nfs/dbraw/zinc/00/57/79/1049005779.db2.gz XLLZCQBYNMYGNU-SJLPKXTDSA-N 2 1 304.453 4.048 20 0 DIADMP C[N@H+]1CC[C@]2(CCN(Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC001203815307 1049008243 /nfs/dbraw/zinc/00/82/43/1049008243.db2.gz MOAPTHIVHIMQNR-NRFANRHFSA-N 2 1 322.452 4.007 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC001203815307 1049008280 /nfs/dbraw/zinc/00/82/80/1049008280.db2.gz MOAPTHIVHIMQNR-NRFANRHFSA-N 2 1 322.452 4.007 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3cccc(Oc4ccccc4)c3)C2)C1 ZINC001203815307 1049008292 /nfs/dbraw/zinc/00/82/92/1049008292.db2.gz MOAPTHIVHIMQNR-NRFANRHFSA-N 2 1 322.452 4.007 20 0 DIADMP CC[N@@H+](c1ccc(N[C@@H]2CC[NH+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802225 1049024973 /nfs/dbraw/zinc/02/49/73/1049024973.db2.gz JIVMRHUJLROVBD-VQIMIIECSA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@H+](c1ccc(N[C@@H]2CC[NH+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802225 1049024984 /nfs/dbraw/zinc/02/49/84/1049024984.db2.gz JIVMRHUJLROVBD-VQIMIIECSA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@H+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802225 1049024998 /nfs/dbraw/zinc/02/49/98/1049024998.db2.gz JIVMRHUJLROVBD-VQIMIIECSA-N 2 1 303.494 4.064 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1)C(C)C ZINC000776802225 1049025012 /nfs/dbraw/zinc/02/50/12/1049025012.db2.gz JIVMRHUJLROVBD-VQIMIIECSA-N 2 1 303.494 4.064 20 0 DIADMP Cc1cccc(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001203894937 1049025170 /nfs/dbraw/zinc/02/51/70/1049025170.db2.gz NDLWICMNZJFWSP-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1cccc(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC001203894937 1049025185 /nfs/dbraw/zinc/02/51/85/1049025185.db2.gz NDLWICMNZJFWSP-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1cccc(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC001203894937 1049025198 /nfs/dbraw/zinc/02/51/98/1049025198.db2.gz NDLWICMNZJFWSP-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](Cc1cccc(F)c1)C1CCCC1 ZINC001192014841 1049031587 /nfs/dbraw/zinc/03/15/87/1049031587.db2.gz WUHNKDMRDZLQDF-UHFFFAOYSA-N 2 1 306.469 4.302 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000195139117 1049070218 /nfs/dbraw/zinc/07/02/18/1049070218.db2.gz QBFLFKPQAYKRIU-AEFFLSMTSA-N 2 1 314.498 4.229 20 0 DIADMP c1[nH]c2ccccc2c1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001204043746 1049071877 /nfs/dbraw/zinc/07/18/77/1049071877.db2.gz YMXVRCIYOSKCJU-GOSISDBHSA-N 2 1 311.473 4.008 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001192326983 1049079154 /nfs/dbraw/zinc/07/91/54/1049079154.db2.gz YRBSMVXUFLAAJZ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001192326983 1049079168 /nfs/dbraw/zinc/07/91/68/1049079168.db2.gz YRBSMVXUFLAAJZ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001192326983 1049079182 /nfs/dbraw/zinc/07/91/82/1049079182.db2.gz YRBSMVXUFLAAJZ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001192326983 1049079193 /nfs/dbraw/zinc/07/91/93/1049079193.db2.gz YRBSMVXUFLAAJZ-VQIMIIECSA-N 2 1 318.892 4.097 20 0 DIADMP C[C@@H]1CCC[C@H](CC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC001192325643 1049080643 /nfs/dbraw/zinc/08/06/43/1049080643.db2.gz ONYDWBAYCLLBIL-MLYOOKFZSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001192325643 1049080651 /nfs/dbraw/zinc/08/06/51/1049080651.db2.gz ONYDWBAYCLLBIL-MLYOOKFZSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001192325643 1049080658 /nfs/dbraw/zinc/08/06/58/1049080658.db2.gz ONYDWBAYCLLBIL-MLYOOKFZSA-N 2 1 304.522 4.152 20 0 DIADMP c1[nH+]c2ccccn2c1Nc1cccc(C[NH+]2CCCCC2)c1 ZINC001204086962 1049082308 /nfs/dbraw/zinc/08/23/08/1049082308.db2.gz IBBLEXNZVDGEPP-UHFFFAOYSA-N 2 1 306.413 4.064 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001178811786 1049092651 /nfs/dbraw/zinc/09/26/51/1049092651.db2.gz XXXKLKVXJHZUCR-OXHPOLQJSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC001178811786 1049092664 /nfs/dbraw/zinc/09/26/64/1049092664.db2.gz XXXKLKVXJHZUCR-OXHPOLQJSA-N 2 1 314.517 4.454 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1cccc(C2CCCC2)c1)C1CC1 ZINC001178871850 1049103368 /nfs/dbraw/zinc/10/33/68/1049103368.db2.gz BODBITROYQWQEO-UHFFFAOYSA-N 2 1 300.490 4.308 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238651 1049118026 /nfs/dbraw/zinc/11/80/26/1049118026.db2.gz RCTMXAWVTCGMTA-PMXSJFBMSA-N 2 1 314.517 4.301 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238651 1049118037 /nfs/dbraw/zinc/11/80/37/1049118037.db2.gz RCTMXAWVTCGMTA-PMXSJFBMSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238651 1049118045 /nfs/dbraw/zinc/11/80/45/1049118045.db2.gz RCTMXAWVTCGMTA-PMXSJFBMSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)[C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@H]1C ZINC001204238651 1049118058 /nfs/dbraw/zinc/11/80/58/1049118058.db2.gz RCTMXAWVTCGMTA-PMXSJFBMSA-N 2 1 314.517 4.301 20 0 DIADMP CCC[N@@H+](Cc1ccc(OCCC[NH+](C)C)cc1)[C@@H](C)CC ZINC001204266910 1049125848 /nfs/dbraw/zinc/12/58/48/1049125848.db2.gz NYCPIAXHMBGWCN-KRWDZBQOSA-N 2 1 306.494 4.028 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(OCCC[NH+](C)C)cc2)CC1 ZINC001204272923 1049125996 /nfs/dbraw/zinc/12/59/96/1049125996.db2.gz UZNYUGWTRIIBNH-UAPYVXQJSA-N 2 1 318.505 4.028 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC001179159043 1049138744 /nfs/dbraw/zinc/13/87/44/1049138744.db2.gz HRKPYJHFIZDYMS-LJQANCHMSA-N 2 1 308.469 4.175 20 0 DIADMP CC[N@H+](Cc1ccccc1C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001204325456 1049141902 /nfs/dbraw/zinc/14/19/02/1049141902.db2.gz YGAKGUYRDJYHQV-NRFANRHFSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccccc1C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001204325456 1049141909 /nfs/dbraw/zinc/14/19/09/1049141909.db2.gz YGAKGUYRDJYHQV-NRFANRHFSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccccc1C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001204325456 1049141917 /nfs/dbraw/zinc/14/19/17/1049141917.db2.gz YGAKGUYRDJYHQV-NRFANRHFSA-N 2 1 322.496 4.339 20 0 DIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249987 1049189980 /nfs/dbraw/zinc/18/99/80/1049189980.db2.gz QEHRSKOUKLXZTQ-DOTOQJQBSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249987 1049189984 /nfs/dbraw/zinc/18/99/84/1049189984.db2.gz QEHRSKOUKLXZTQ-DOTOQJQBSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249993 1049191006 /nfs/dbraw/zinc/19/10/06/1049191006.db2.gz QEHRSKOUKLXZTQ-WBVHZDCISA-N 2 1 312.457 4.175 20 0 DIADMP C[C@@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249993 1049191014 /nfs/dbraw/zinc/19/10/14/1049191014.db2.gz QEHRSKOUKLXZTQ-WBVHZDCISA-N 2 1 312.457 4.175 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615532 1049201490 /nfs/dbraw/zinc/20/14/90/1049201490.db2.gz IVEJXWGIJBITOC-CIGMURNLSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615532 1049201497 /nfs/dbraw/zinc/20/14/97/1049201497.db2.gz IVEJXWGIJBITOC-CIGMURNLSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001204615532 1049201507 /nfs/dbraw/zinc/20/15/07/1049201507.db2.gz IVEJXWGIJBITOC-CIGMURNLSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)CC[C@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204615532 1049201517 /nfs/dbraw/zinc/20/15/17/1049201517.db2.gz IVEJXWGIJBITOC-CIGMURNLSA-N 2 1 314.517 4.431 20 0 DIADMP C[NH+]1CCC(C[N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001204617537 1049202720 /nfs/dbraw/zinc/20/27/20/1049202720.db2.gz AEARMIBOKYPESQ-UHFFFAOYSA-N 2 1 322.496 4.073 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)C(c1ccccc1)c1ccccc1 ZINC001204645963 1049211478 /nfs/dbraw/zinc/21/14/78/1049211478.db2.gz CTRMKGOKHKRKIY-UHFFFAOYSA-N 2 1 308.469 4.098 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH2+]1)C(c1ccccc1)c1ccccc1 ZINC001204645985 1049212462 /nfs/dbraw/zinc/21/24/62/1049212462.db2.gz DTAMSXYIOQTUFF-HXUWFJFHSA-N 2 1 308.469 4.240 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCN(C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107261 1049218090 /nfs/dbraw/zinc/21/80/90/1049218090.db2.gz MNIHORATMYDZMJ-CHWSQXEVSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107261 1049218100 /nfs/dbraw/zinc/21/81/00/1049218100.db2.gz MNIHORATMYDZMJ-CHWSQXEVSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107261 1049218109 /nfs/dbraw/zinc/21/81/09/1049218109.db2.gz MNIHORATMYDZMJ-CHWSQXEVSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1csc2ccccc12 ZINC000858128159 1049220264 /nfs/dbraw/zinc/22/02/64/1049220264.db2.gz CIRVMHXBTNFFBV-KGLIPLIRSA-N 2 1 302.487 4.425 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](C3c4ccccc4-c4ccccc43)CC[C@H]21 ZINC000485335772 1049222287 /nfs/dbraw/zinc/22/22/87/1049222287.db2.gz GQCAAPFTYMNWOC-HRAATJIYSA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](C3c4ccccc4-c4ccccc43)CC[C@H]21 ZINC000485335772 1049222302 /nfs/dbraw/zinc/22/23/02/1049222302.db2.gz GQCAAPFTYMNWOC-HRAATJIYSA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](C3c4ccccc4-c4ccccc43)CC[C@H]21 ZINC000485335772 1049222332 /nfs/dbraw/zinc/22/23/32/1049222332.db2.gz GQCAAPFTYMNWOC-HRAATJIYSA-N 2 1 318.464 4.173 20 0 DIADMP Cc1cn2cc(Nc3ccc(C[NH2+]C(C)(C)C)cc3)ccc2[nH+]1 ZINC001204684082 1049224206 /nfs/dbraw/zinc/22/42/06/1049224206.db2.gz MHEQQTCWAAFBEO-UHFFFAOYSA-N 2 1 308.429 4.274 20 0 DIADMP C[C@@H](CC1CCCCC1)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001179878332 1049224682 /nfs/dbraw/zinc/22/46/82/1049224682.db2.gz OIVJZOHLSATOHT-ICSRJNTNSA-N 2 1 306.538 4.401 20 0 DIADMP CC1(C)CCC[C@H](C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC001179926508 1049230614 /nfs/dbraw/zinc/23/06/14/1049230614.db2.gz YPCYSZYTQHXLRY-SCTDSRPQSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001179926508 1049230621 /nfs/dbraw/zinc/23/06/21/1049230621.db2.gz YPCYSZYTQHXLRY-SCTDSRPQSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001179926508 1049230647 /nfs/dbraw/zinc/23/06/47/1049230647.db2.gz YPCYSZYTQHXLRY-SCTDSRPQSA-N 2 1 304.522 4.152 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001179919548 1049240690 /nfs/dbraw/zinc/24/06/90/1049240690.db2.gz NEUDPYRYFYIZQX-CKUGGHARSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919548 1049240698 /nfs/dbraw/zinc/24/06/98/1049240698.db2.gz NEUDPYRYFYIZQX-CKUGGHARSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919548 1049240711 /nfs/dbraw/zinc/24/07/11/1049240711.db2.gz NEUDPYRYFYIZQX-CKUGGHARSA-N 2 1 312.501 4.041 20 0 DIADMP c1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000195651603 1049245167 /nfs/dbraw/zinc/24/51/67/1049245167.db2.gz PDMUWXNQHQIYHH-DYESRHJHSA-N 2 1 312.501 4.382 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCc3cc(C(C)(C)C)ccc3C2)CC1 ZINC001179988447 1049245651 /nfs/dbraw/zinc/24/56/51/1049245651.db2.gz DRAZSQHMDPKSNF-UHFFFAOYSA-N 2 1 314.517 4.074 20 0 DIADMP c1ccc(CCCCCC[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000858461740 1049262661 /nfs/dbraw/zinc/26/26/61/1049262661.db2.gz PSGYNSWLYGZNPS-UHFFFAOYSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+]([C@H]4C=CCCC4)C3)CC2)cc1 ZINC000485495449 1049268116 /nfs/dbraw/zinc/26/81/16/1049268116.db2.gz UGZQHXCFSPVIFZ-FQEVSTJZSA-N 2 1 310.485 4.083 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2cc(C)ccc2C)CC1 ZINC001180059363 1049269169 /nfs/dbraw/zinc/26/91/69/1049269169.db2.gz XMOCFVJDOSHMEO-HXUWFJFHSA-N 2 1 300.490 4.172 20 0 DIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097394 1049273502 /nfs/dbraw/zinc/27/35/02/1049273502.db2.gz DAVMRSHZVUKNRM-OAQYLSRUSA-N 2 1 314.517 4.335 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097394 1049273518 /nfs/dbraw/zinc/27/35/18/1049273518.db2.gz DAVMRSHZVUKNRM-OAQYLSRUSA-N 2 1 314.517 4.335 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097394 1049273535 /nfs/dbraw/zinc/27/35/35/1049273535.db2.gz DAVMRSHZVUKNRM-OAQYLSRUSA-N 2 1 314.517 4.335 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cccc(CC2CCC2)c1 ZINC001180097394 1049273544 /nfs/dbraw/zinc/27/35/44/1049273544.db2.gz DAVMRSHZVUKNRM-OAQYLSRUSA-N 2 1 314.517 4.335 20 0 DIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1ccc(-c2cccs2)cc1 ZINC001193850252 1049274608 /nfs/dbraw/zinc/27/46/08/1049274608.db2.gz WPJBIRHYDGIIHW-UHFFFAOYSA-N 2 1 314.498 4.333 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(-c2cccs2)cc1 ZINC001193850252 1049274621 /nfs/dbraw/zinc/27/46/21/1049274621.db2.gz WPJBIRHYDGIIHW-UHFFFAOYSA-N 2 1 314.498 4.333 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2ccns2)cc1 ZINC000858577465 1049280209 /nfs/dbraw/zinc/28/02/09/1049280209.db2.gz QCJCLEAENYIXOM-STQMWFEESA-N 2 1 312.442 4.049 20 0 DIADMP C[N@H+](Cc1cccc(C[NH3+])c1)Cc1ccc(Cl)cc1Cl ZINC001204870376 1049290485 /nfs/dbraw/zinc/29/04/85/1049290485.db2.gz REBPMAXQNUGEFE-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP C[N@@H+](Cc1cccc(C[NH3+])c1)Cc1ccc(Cl)cc1Cl ZINC001204870376 1049290493 /nfs/dbraw/zinc/29/04/93/1049290493.db2.gz REBPMAXQNUGEFE-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP [NH3+]Cc1ccc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)cc1 ZINC001204869689 1049291881 /nfs/dbraw/zinc/29/18/81/1049291881.db2.gz GNIXOBYBPBTQJJ-UHFFFAOYSA-N 2 1 312.844 4.088 20 0 DIADMP C[C@@H]1CCC[N@H+]1Cc1cccc(-c2cncc([C@@H]3CCC[NH2+]3)c2)c1 ZINC000906157200 1049293158 /nfs/dbraw/zinc/29/31/58/1049293158.db2.gz DOAFLNHTWIFXJE-IERDGZPVSA-N 2 1 321.468 4.157 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[C@@](C)([NH3+])C2)c1 ZINC001204946710 1049319605 /nfs/dbraw/zinc/31/96/05/1049319605.db2.gz ROKPZSLXOLBKFC-OAQYLSRUSA-N 2 1 308.469 4.284 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@@](C)([NH3+])C2)c1 ZINC001204946710 1049319613 /nfs/dbraw/zinc/31/96/13/1049319613.db2.gz ROKPZSLXOLBKFC-OAQYLSRUSA-N 2 1 308.469 4.284 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@@H](C)C(C)(C)C)C2)s1 ZINC001194152402 1049327840 /nfs/dbraw/zinc/32/78/40/1049327840.db2.gz AHAIHVHYWMVENF-NVXWUHKLSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@@H](C)C(C)(C)C)C2)s1 ZINC001194152402 1049327855 /nfs/dbraw/zinc/32/78/55/1049327855.db2.gz AHAIHVHYWMVENF-NVXWUHKLSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)C[C@H](C)C(C)(C)C)C2)s1 ZINC001194152403 1049328226 /nfs/dbraw/zinc/32/82/26/1049328226.db2.gz AHAIHVHYWMVENF-RDJZCZTQSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C[C@H](C)C(C)(C)C)C2)s1 ZINC001194152403 1049328242 /nfs/dbraw/zinc/32/82/42/1049328242.db2.gz AHAIHVHYWMVENF-RDJZCZTQSA-N 2 1 322.562 4.492 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001205009500 1049340041 /nfs/dbraw/zinc/34/00/41/1049340041.db2.gz VFSNKNFSYXSLJS-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001205009500 1049340056 /nfs/dbraw/zinc/34/00/56/1049340056.db2.gz VFSNKNFSYXSLJS-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CCC[C@@H](C[NH2+]C)C2)c1 ZINC001205018045 1049343219 /nfs/dbraw/zinc/34/32/19/1049343219.db2.gz QQICREJWGCHKOB-KRWDZBQOSA-N 2 1 308.535 4.302 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001205018352 1049343897 /nfs/dbraw/zinc/34/38/97/1049343897.db2.gz TVGNHJWNNSMZEG-SFHVURJKSA-N 2 1 300.490 4.166 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000485908712 1049361594 /nfs/dbraw/zinc/36/15/94/1049361594.db2.gz VYZKOZYGSMFBOR-XRXFAXGQSA-N 2 1 312.501 4.129 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000485908712 1049361607 /nfs/dbraw/zinc/36/16/07/1049361607.db2.gz VYZKOZYGSMFBOR-XRXFAXGQSA-N 2 1 312.501 4.129 20 0 DIADMP Cc1cccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1C ZINC001205088265 1049370522 /nfs/dbraw/zinc/37/05/22/1049370522.db2.gz DSFBJEAJBLNZNE-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1C ZINC001205088265 1049370533 /nfs/dbraw/zinc/37/05/33/1049370533.db2.gz DSFBJEAJBLNZNE-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1C ZINC001205088265 1049370547 /nfs/dbraw/zinc/37/05/47/1049370547.db2.gz DSFBJEAJBLNZNE-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cccc(N(C)c2ccc(C[N@H+]3CCC[C@@H]([NH3+])CC3)cc2)c1 ZINC001205116572 1049384675 /nfs/dbraw/zinc/38/46/75/1049384675.db2.gz CYRHDHUNWBAVSW-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C[C@H]1C[NH3+] ZINC001205140558 1049392180 /nfs/dbraw/zinc/39/21/80/1049392180.db2.gz NUBQVIJKRPSERG-WMLDXEAASA-N 2 1 314.860 4.034 20 0 DIADMP c1ccc([C@H]2CCCC[N@@H+]2Cc2ccc3c(c2)CC[NH2+]C3)cc1 ZINC001205170793 1049401383 /nfs/dbraw/zinc/40/13/83/1049401383.db2.gz DRQIHJJPLJHFPE-OAQYLSRUSA-N 2 1 306.453 4.060 20 0 DIADMP CC[C@H](Cc1cccs1)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001180795318 1049404640 /nfs/dbraw/zinc/40/46/40/1049404640.db2.gz VAOFBKHSIWGBLT-BRWVUGGUSA-N 2 1 320.546 4.312 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)[C@@H](C)c2nccc3ccccc32)CC1 ZINC001205185352 1049405427 /nfs/dbraw/zinc/40/54/27/1049405427.db2.gz MQPDJNNFHYBENP-INIZCTEOSA-N 2 1 311.473 4.100 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)[C@@H](C)c2nccc3ccccc32)CC1 ZINC001205185352 1049405429 /nfs/dbraw/zinc/40/54/29/1049405429.db2.gz MQPDJNNFHYBENP-INIZCTEOSA-N 2 1 311.473 4.100 20 0 DIADMP CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205263891 1049419671 /nfs/dbraw/zinc/41/96/71/1049419671.db2.gz FFAFJEMLRBVHNL-HXUWFJFHSA-N 2 1 313.489 4.169 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)ccc21 ZINC001205273021 1049422909 /nfs/dbraw/zinc/42/29/09/1049422909.db2.gz CIRORJJOVITJHR-OAQYLSRUSA-N 2 1 321.468 4.035 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC001180978366 1049426490 /nfs/dbraw/zinc/42/64/90/1049426490.db2.gz ZRHOUEDQSMSNED-JZXOWHBKSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2cccc(SC(F)(F)F)c2)CC1 ZINC001205281325 1049427054 /nfs/dbraw/zinc/42/70/54/1049427054.db2.gz SJXBAGMBWIYGTQ-AWEZNQCLSA-N 2 1 318.408 4.002 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(F)c(-c3ccccc3)c2)CC1 ZINC001205296270 1049430574 /nfs/dbraw/zinc/43/05/74/1049430574.db2.gz KLSWSZBGVFGTIU-FQEVSTJZSA-N 2 1 312.432 4.196 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001205295963 1049431193 /nfs/dbraw/zinc/43/11/93/1049431193.db2.gz DLJONLLEUZBPGM-NRFANRHFSA-N 2 1 324.468 4.491 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(F)c(-c3ccccc3)c2)CC1 ZINC001205296271 1049431488 /nfs/dbraw/zinc/43/14/88/1049431488.db2.gz KLSWSZBGVFGTIU-HXUWFJFHSA-N 2 1 312.432 4.196 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC001205296367 1049431566 /nfs/dbraw/zinc/43/15/66/1049431566.db2.gz NQMBNCRCTIZGSW-IEBWSBKVSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C[C@@H]1C[NH3+] ZINC001205303769 1049433128 /nfs/dbraw/zinc/43/31/28/1049433128.db2.gz JYBWQOAPMKUPHW-KGLIPLIRSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C[C@@H]1C[NH3+] ZINC001205303768 1049433369 /nfs/dbraw/zinc/43/33/69/1049433369.db2.gz JYBWQOAPMKUPHW-KBPBESRZSA-N 2 1 318.848 4.017 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cccc1-c1ccccc1 ZINC001205318967 1049435774 /nfs/dbraw/zinc/43/57/74/1049435774.db2.gz XHBQRRTWYIMHKV-JXFKEZNVSA-N 2 1 308.469 4.079 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc2ccccc2[nH]1 ZINC000775621357 1049445332 /nfs/dbraw/zinc/44/53/32/1049445332.db2.gz KRFMVHXUCXSHRY-SJORKVTESA-N 2 1 313.489 4.331 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc2ccccc2[nH]1 ZINC000775621354 1049446103 /nfs/dbraw/zinc/44/61/03/1049446103.db2.gz KRFMVHXUCXSHRY-IAGOWNOFSA-N 2 1 313.489 4.331 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001181155133 1049447997 /nfs/dbraw/zinc/44/79/97/1049447997.db2.gz ZEJLAXGMZAECPX-UFYCRDLUSA-N 2 1 314.517 4.311 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001181155133 1049448004 /nfs/dbraw/zinc/44/80/04/1049448004.db2.gz ZEJLAXGMZAECPX-UFYCRDLUSA-N 2 1 314.517 4.311 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC001181244370 1049453573 /nfs/dbraw/zinc/45/35/73/1049453573.db2.gz QTIOTBUPKDSMBB-UHFFFAOYSA-N 2 1 320.908 4.210 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CCC3(CC3)CC2)[C@H]1c1cccs1 ZINC000486690260 1049455147 /nfs/dbraw/zinc/45/51/47/1049455147.db2.gz FEIUVZUKWSKQPO-QAPCUYQASA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCC3(CC3)CC2)[C@H]1c1cccs1 ZINC000486690260 1049455155 /nfs/dbraw/zinc/45/51/55/1049455155.db2.gz FEIUVZUKWSKQPO-QAPCUYQASA-N 2 1 318.530 4.443 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1C[C@H]1c1ccccc1 ZINC001181486684 1049485658 /nfs/dbraw/zinc/48/56/58/1049485658.db2.gz LUTLSCBVFJFHCG-VXKWHMMOSA-N 2 1 322.496 4.374 20 0 DIADMP C[C@@H](CC1CCCCC1)C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC001181514222 1049486068 /nfs/dbraw/zinc/48/60/68/1049486068.db2.gz BCVBQDPXKSIOTA-FXAWDEMLSA-N 2 1 306.538 4.257 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@](F)(C[NH3+])CC2)cc1 ZINC001205545568 1049495314 /nfs/dbraw/zinc/49/53/14/1049495314.db2.gz JJBBMOUZHBFXSD-YLJYHZDGSA-N 2 1 320.496 4.142 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc(F)cc1 ZINC001205555066 1049497252 /nfs/dbraw/zinc/49/72/52/1049497252.db2.gz OGFAXVNYDYQMOY-UZLBHIALSA-N 2 1 318.480 4.316 20 0 DIADMP Clc1ccc(CC[NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001205555914 1049497711 /nfs/dbraw/zinc/49/77/11/1049497711.db2.gz XYGBWKTXWHOZSH-LJQANCHMSA-N 2 1 320.908 4.269 20 0 DIADMP CCOc1c(Cl)cccc1C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000486952567 1049499398 /nfs/dbraw/zinc/49/93/98/1049499398.db2.gz CFJASJFVCDXIIS-UHFFFAOYSA-N 2 1 324.896 4.138 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)CC1 ZINC001205591278 1049505043 /nfs/dbraw/zinc/50/50/43/1049505043.db2.gz JLCJWTNDBUXUPF-FQEVSTJZSA-N 2 1 318.480 4.387 20 0 DIADMP c1cc2cc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2[nH]1 ZINC001205593976 1049507003 /nfs/dbraw/zinc/50/70/03/1049507003.db2.gz MPFYBXUXIQNFQE-LJQANCHMSA-N 2 1 311.473 4.008 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc2[nH]ccc2c1 ZINC001205599114 1049507914 /nfs/dbraw/zinc/50/79/14/1049507914.db2.gz LSPIYVHREYCHKI-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc2[nH]ccc2c1 ZINC001205599114 1049507923 /nfs/dbraw/zinc/50/79/23/1049507923.db2.gz LSPIYVHREYCHKI-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[C@H](C[N@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1)c1cccc2ccccc21 ZINC001205604434 1049509382 /nfs/dbraw/zinc/50/93/82/1049509382.db2.gz VNPIVKUSXJMWAS-YQVWRLOYSA-N 2 1 310.485 4.250 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)cc1 ZINC001205603090 1049509517 /nfs/dbraw/zinc/50/95/17/1049509517.db2.gz NQIMLPKVZPOHQM-MJGOQNOKSA-N 2 1 318.505 4.062 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001205601184 1049509625 /nfs/dbraw/zinc/50/96/25/1049509625.db2.gz RLXILICXSNNMCF-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1cccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001205601182 1049509917 /nfs/dbraw/zinc/50/99/17/1049509917.db2.gz RLXILICXSNNMCF-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1cccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001205601181 1049510141 /nfs/dbraw/zinc/51/01/41/1049510141.db2.gz RLXILICXSNNMCF-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205616759 1049511645 /nfs/dbraw/zinc/51/16/45/1049511645.db2.gz GWLAUBPOMRNZSM-DZGCQCFKSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC[C@H]1C[NH3+] ZINC001205629148 1049515934 /nfs/dbraw/zinc/51/59/34/1049515934.db2.gz XUVXNAVLAWOPFN-YJBOKZPZSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CC[C@@H](C[NH3+])[C@@H](C)CC3)cc2)o1 ZINC001205636826 1049519334 /nfs/dbraw/zinc/51/93/34/1049519334.db2.gz FGXZCPCKYIIWDW-KXBFYZLASA-N 2 1 312.457 4.062 20 0 DIADMP Cc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c(Cl)cc1Cl ZINC001205652594 1049522652 /nfs/dbraw/zinc/52/26/52/1049522652.db2.gz QAYXVSOVEPXOAW-DGCLKSJQSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1cc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c(Cl)cc1Cl ZINC001205652596 1049524086 /nfs/dbraw/zinc/52/40/86/1049524086.db2.gz QAYXVSOVEPXOAW-WCQYABFASA-N 2 1 315.288 4.109 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])CC2)cccc1-c1ccccc1 ZINC001205651943 1049524311 /nfs/dbraw/zinc/52/43/11/1049524311.db2.gz MGFFHIHRWPXACS-XLIONFOSSA-N 2 1 322.496 4.469 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205678914 1049530844 /nfs/dbraw/zinc/53/08/44/1049530844.db2.gz WKPGSNCNNJNUIC-PXNSSMCTSA-N 2 1 300.490 4.172 20 0 DIADMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc(C4CCC4)cc3)C2)CC1 ZINC001205696900 1049534071 /nfs/dbraw/zinc/53/40/71/1049534071.db2.gz QIOIMKWMKIEIHL-NRFANRHFSA-N 2 1 312.501 4.118 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1cc2ccccc2cc1OC ZINC001205696707 1049534212 /nfs/dbraw/zinc/53/42/12/1049534212.db2.gz NLDGBMQSSQZMNQ-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc2ccccc2cc1OC ZINC001205696707 1049534225 /nfs/dbraw/zinc/53/42/25/1049534225.db2.gz NLDGBMQSSQZMNQ-UHFFFAOYSA-N 2 1 314.473 4.012 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001205718316 1049540965 /nfs/dbraw/zinc/54/09/65/1049540965.db2.gz WUYURBMRDSCXCH-UXHICEINSA-N 2 1 316.464 4.226 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001205718316 1049540976 /nfs/dbraw/zinc/54/09/76/1049540976.db2.gz WUYURBMRDSCXCH-UXHICEINSA-N 2 1 316.464 4.226 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(C)c1 ZINC001205757965 1049556901 /nfs/dbraw/zinc/55/69/01/1049556901.db2.gz JLYKKTNFBPYXDE-XIVKTCCCSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(C)c1 ZINC001205757965 1049556912 /nfs/dbraw/zinc/55/69/12/1049556912.db2.gz JLYKKTNFBPYXDE-XIVKTCCCSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1 ZINC001205757965 1049556924 /nfs/dbraw/zinc/55/69/24/1049556924.db2.gz JLYKKTNFBPYXDE-XIVKTCCCSA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1 ZINC001205757965 1049556932 /nfs/dbraw/zinc/55/69/32/1049556932.db2.gz JLYKKTNFBPYXDE-XIVKTCCCSA-N 2 1 312.501 4.182 20 0 DIADMP C[NH+]1CCC([NH2+]CC2(c3cccc(Cl)c3)CCCCC2)CC1 ZINC001205898659 1049594275 /nfs/dbraw/zinc/59/42/75/1049594275.db2.gz SXNCIWISAOMASP-UHFFFAOYSA-N 2 1 320.908 4.226 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001205901986 1049595151 /nfs/dbraw/zinc/59/51/51/1049595151.db2.gz GQSHTEABZFEZDZ-CHWSQXEVSA-N 2 1 306.500 4.036 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205903262 1049595759 /nfs/dbraw/zinc/59/57/59/1049595759.db2.gz NURVQIRBOHJRDB-HNAYVOBHSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205904476 1049596117 /nfs/dbraw/zinc/59/61/17/1049596117.db2.gz VOYXVNLQQJFNKW-CABCVRRESA-N 2 1 313.489 4.025 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@H]1C ZINC001205915871 1049601991 /nfs/dbraw/zinc/60/19/91/1049601991.db2.gz RFJIBKFTSGMXHP-MSOLQXFVSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccc(N(C)c2ccc(C[N@@H+]3CCCC[C@H]([NH3+])C3)cc2)cc1 ZINC001205931487 1049606514 /nfs/dbraw/zinc/60/65/14/1049606514.db2.gz JUGPGTMHJDPFMP-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP Cc1ccc(N(C)c2ccc(C[N@H+]3CCCC[C@H]([NH3+])C3)cc2)cc1 ZINC001205931487 1049606519 /nfs/dbraw/zinc/60/65/19/1049606519.db2.gz JUGPGTMHJDPFMP-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@H](C[NH3+])[C@H](C)C1)c1cccc2ccccc21 ZINC001205984676 1049618511 /nfs/dbraw/zinc/61/85/11/1049618511.db2.gz UCBQYDZLFJEACJ-ZHALLVOQSA-N 2 1 310.485 4.250 20 0 DIADMP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000774188827 1049618829 /nfs/dbraw/zinc/61/88/29/1049618829.db2.gz JVSDLMAVLULZER-AFYVEPGGSA-N 2 1 314.517 4.454 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)cc1 ZINC001205993417 1049622027 /nfs/dbraw/zinc/62/20/27/1049622027.db2.gz HPPMJVNRPDDYKX-MJGOQNOKSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3cccs3)s2)CCC[C@@H]1C[NH3+] ZINC001206002791 1049626556 /nfs/dbraw/zinc/62/65/56/1049626556.db2.gz BFSVGZSEWSTVQW-UONOGXRCSA-N 2 1 320.527 4.283 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3)s2)CCC[C@@H]1C[NH3+] ZINC001206003511 1049626595 /nfs/dbraw/zinc/62/65/95/1049626595.db2.gz IUYDUTJMUJPBGC-NVXWUHKLSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cc(-c3ccsc3)cs2)CCC[C@@H]1C[NH3+] ZINC001206021751 1049632199 /nfs/dbraw/zinc/63/21/99/1049632199.db2.gz AVXNAMZOOWACTN-UONOGXRCSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)cccc1-c1ccccc1 ZINC001206027270 1049632233 /nfs/dbraw/zinc/63/22/33/1049632233.db2.gz VNWMKZOHQMTBIH-FXAWDEMLSA-N 2 1 322.496 4.469 20 0 DIADMP Cc1cc(Cl)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(Cl)c1 ZINC001206024605 1049632389 /nfs/dbraw/zinc/63/23/89/1049632389.db2.gz KSKGNSPZWLPUOE-OLZOCXBDSA-N 2 1 315.288 4.109 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)c1 ZINC000488433963 1049652881 /nfs/dbraw/zinc/65/28/81/1049652881.db2.gz RXDXZIGWWRJBFJ-MSOLQXFVSA-N 2 1 320.546 4.148 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001206109900 1049656238 /nfs/dbraw/zinc/65/62/38/1049656238.db2.gz XVVYIJJQUVHJLE-KKXNLOMOSA-N 2 1 302.506 4.205 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001206109900 1049656243 /nfs/dbraw/zinc/65/62/43/1049656243.db2.gz XVVYIJJQUVHJLE-KKXNLOMOSA-N 2 1 302.506 4.205 20 0 DIADMP CCCC[N@@H+](C[C@H](OC)C1CCC1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545105 1049668804 /nfs/dbraw/zinc/66/88/04/1049668804.db2.gz KVGKZIYTJKJYEY-SFHVURJKSA-N 2 1 324.553 4.213 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)[C@@H]1CC1(C)C ZINC001182542108 1049685685 /nfs/dbraw/zinc/68/56/85/1049685685.db2.gz BENBFFOKQNDEHX-FUMNGEBKSA-N 2 1 314.517 4.136 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001206263263 1049693167 /nfs/dbraw/zinc/69/31/67/1049693167.db2.gz JUJCRTFCNIWDGF-LPHOPBHVSA-N 2 1 320.908 4.440 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@](C)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001206296794 1049702821 /nfs/dbraw/zinc/70/28/21/1049702821.db2.gz UTTJSWOIJUOMRO-LAUBAEHRSA-N 2 1 310.485 4.394 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC1 ZINC001206294153 1049703311 /nfs/dbraw/zinc/70/33/11/1049703311.db2.gz JMBUAGPGBUSEAW-OAQYLSRUSA-N 2 1 324.468 4.430 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2Oc2ccccc2)CC1 ZINC001206303780 1049705814 /nfs/dbraw/zinc/70/58/14/1049705814.db2.gz GMQYECKXRYTZOF-NRFANRHFSA-N 2 1 324.468 4.430 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC001206310786 1049707570 /nfs/dbraw/zinc/70/75/70/1049707570.db2.gz CHEMFJJPWOKRPX-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2-c2cccs2)CC1 ZINC001206311968 1049708920 /nfs/dbraw/zinc/70/89/20/1049708920.db2.gz XMQCTGWNSVKHAO-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(F)c(Cl)cc2Cl)CC1 ZINC001206318473 1049709571 /nfs/dbraw/zinc/70/95/71/1049709571.db2.gz QAAODIGJUHVVTQ-OAHLLOKOSA-N 2 1 319.251 4.083 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2ccc(-c3cccs3)cc2)C1 ZINC001206363592 1049721586 /nfs/dbraw/zinc/72/15/86/1049721586.db2.gz YFZVXMJWSWKUPP-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2ccc(-c3cccs3)cc2)C1 ZINC001206363592 1049721597 /nfs/dbraw/zinc/72/15/97/1049721597.db2.gz YFZVXMJWSWKUPP-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)C1 ZINC001206541786 1049752631 /nfs/dbraw/zinc/75/26/31/1049752631.db2.gz KICGZEXDEYVOFG-OAQYLSRUSA-N 2 1 324.468 4.430 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206542238 1049753297 /nfs/dbraw/zinc/75/32/97/1049753297.db2.gz VXSZBRRRMHRYMZ-HKUYNNGSSA-N 2 1 312.542 4.059 20 0 DIADMP C[N@@H+](Cc1ccccc1Nc1cc[nH+]c(N)c1)C1CCCCC1 ZINC001206569044 1049759292 /nfs/dbraw/zinc/75/92/92/1049759292.db2.gz URQPPEYGHYNMNW-UHFFFAOYSA-N 2 1 310.445 4.172 20 0 DIADMP Cc1csc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1Cl ZINC001206584202 1049761801 /nfs/dbraw/zinc/76/18/01/1049761801.db2.gz XNRRKDRQIRPTJH-CYBMUJFWSA-N 2 1 300.899 4.062 20 0 DIADMP Cc1csc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1Cl ZINC001206584202 1049761808 /nfs/dbraw/zinc/76/18/08/1049761808.db2.gz XNRRKDRQIRPTJH-CYBMUJFWSA-N 2 1 300.899 4.062 20 0 DIADMP CC(C)[N@@H+](Cc1csc2ccccc12)[C@H]1CCC[NH2+]CC1 ZINC001206591641 1049763417 /nfs/dbraw/zinc/76/34/17/1049763417.db2.gz UPNSGFFPQKNGSF-INIZCTEOSA-N 2 1 302.487 4.254 20 0 DIADMP CC(C)Cc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001206589418 1049764184 /nfs/dbraw/zinc/76/41/84/1049764184.db2.gz GWQJKAJSGSWMOI-FQEVSTJZSA-N 2 1 302.506 4.238 20 0 DIADMP CC(C)Cc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001206589422 1049764449 /nfs/dbraw/zinc/76/44/49/1049764449.db2.gz GWQJKAJSGSWMOI-HXUWFJFHSA-N 2 1 302.506 4.238 20 0 DIADMP Cc1c(Cl)ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1F ZINC001206598386 1049765887 /nfs/dbraw/zinc/76/58/87/1049765887.db2.gz IZTSIHBAJGBRLM-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1F ZINC001206598386 1049765891 /nfs/dbraw/zinc/76/58/91/1049765891.db2.gz IZTSIHBAJGBRLM-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(-c3cccs3)s2)C1 ZINC001206615486 1049770218 /nfs/dbraw/zinc/77/02/18/1049770218.db2.gz FVWIJCGTEXMXFG-CYBMUJFWSA-N 2 1 306.500 4.037 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001206616457 1049770938 /nfs/dbraw/zinc/77/09/38/1049770938.db2.gz OVWHECFQFKOVSB-QGZVFWFLSA-N 2 1 310.441 4.040 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001206727473 1049785171 /nfs/dbraw/zinc/78/51/71/1049785171.db2.gz IMUJPJIXCUNDEC-GIVPXCGWSA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001206727473 1049785186 /nfs/dbraw/zinc/78/51/86/1049785186.db2.gz IMUJPJIXCUNDEC-GIVPXCGWSA-N 2 1 312.501 4.379 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001206770122 1049796730 /nfs/dbraw/zinc/79/67/30/1049796730.db2.gz REPMFHLDVZDRQH-GJZGRUSLSA-N 2 1 316.470 4.100 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001206770646 1049797208 /nfs/dbraw/zinc/79/72/08/1049797208.db2.gz SXSDMGJZFVHKPM-WBVHZDCISA-N 2 1 312.432 4.052 20 0 DIADMP Cc1ccc([C@@H]2C[C@H](C)[N@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000490046281 1049797839 /nfs/dbraw/zinc/79/78/39/1049797839.db2.gz UJCMTNDHCQOVAY-AZUAARDMSA-N 2 1 300.490 4.049 20 0 DIADMP CC[C@H](C[N@H+]1CCCC[C@@H]1[C@@H](C)C[NH+](C)C)c1ccccc1 ZINC001206800781 1049802266 /nfs/dbraw/zinc/80/22/66/1049802266.db2.gz MYKZHJDACAQCSD-NLWGTHIKSA-N 2 1 302.506 4.232 20 0 DIADMP Fc1ccc(C2CCC([NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000490150474 1049803421 /nfs/dbraw/zinc/80/34/21/1049803421.db2.gz MWCIEQKDETXHQK-PEVDHWGLSA-N 2 1 316.464 4.068 20 0 DIADMP Cc1c(C[N@@H+]2C[C@H](C[NH3+])CC[C@@H]2C)cccc1-c1ccccc1 ZINC001206805289 1049804550 /nfs/dbraw/zinc/80/45/50/1049804550.db2.gz BQTVGRXESIJMGL-WMZOPIPTSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1 ZINC001206828365 1049808615 /nfs/dbraw/zinc/80/86/15/1049808615.db2.gz WLJRMDBBCJCZEI-RDJZCZTQSA-N 2 1 320.908 4.155 20 0 DIADMP C[N@@H+]1CC[C@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174678 1049851460 /nfs/dbraw/zinc/85/14/60/1049851460.db2.gz NITZUYFURQVNGR-RBUKOAKNSA-N 2 1 304.522 4.153 20 0 DIADMP C[N@H+]1CC[C@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174678 1049851483 /nfs/dbraw/zinc/85/14/83/1049851483.db2.gz NITZUYFURQVNGR-RBUKOAKNSA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@H]2C[N@H+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174678 1049851496 /nfs/dbraw/zinc/85/14/96/1049851496.db2.gz NITZUYFURQVNGR-RBUKOAKNSA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@H]2C[N@@H+](CC3CCC4(CCCCC4)CC3)CC[C@H]21 ZINC001207174678 1049851512 /nfs/dbraw/zinc/85/15/12/1049851512.db2.gz NITZUYFURQVNGR-RBUKOAKNSA-N 2 1 304.522 4.153 20 0 DIADMP CC1=CCC[C@@H](C)[C@@H]1C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001207252304 1049869493 /nfs/dbraw/zinc/86/94/93/1049869493.db2.gz DMUDEOHRFSRGCS-UYAOXDASSA-N 2 1 306.538 4.279 20 0 DIADMP CC[C@@H]1CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207292134 1049875953 /nfs/dbraw/zinc/87/59/53/1049875953.db2.gz KWWCOJYBAWGBFM-GOSISDBHSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CCC[C@H]4CCC[C@H]43)CC2)cc1 ZINC001207290718 1049876263 /nfs/dbraw/zinc/87/62/63/1049876263.db2.gz BFMKAWWAFDVAAR-NHCUHLMSSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@]1(F)CCCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207286683 1049876455 /nfs/dbraw/zinc/87/64/55/1049876455.db2.gz KHDCPNVCNJWTQB-HXUWFJFHSA-N 2 1 318.480 4.113 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000491033528 1049879929 /nfs/dbraw/zinc/87/99/29/1049879929.db2.gz FCDCVUAFOBFQON-LJQANCHMSA-N 2 1 322.496 4.486 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000491033528 1049879931 /nfs/dbraw/zinc/87/99/31/1049879931.db2.gz FCDCVUAFOBFQON-LJQANCHMSA-N 2 1 322.496 4.486 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001207487592 1049896736 /nfs/dbraw/zinc/89/67/36/1049896736.db2.gz NBSYKDBWVXLSRI-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001207483062 1049897557 /nfs/dbraw/zinc/89/75/57/1049897557.db2.gz COQBJLSWWSXJIR-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP C[N@@H+](CCC1CC[NH+](C)CC1)Cc1cccc(Cl)c1Cl ZINC001207484454 1049897793 /nfs/dbraw/zinc/89/77/93/1049897793.db2.gz LEEIWGQZQVVTQJ-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C1=CCC(CC[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001207509644 1049901402 /nfs/dbraw/zinc/90/14/02/1049901402.db2.gz NTYLGBGKGRWKSB-PZJWPPBQSA-N 2 1 310.485 4.300 20 0 DIADMP C1=CCC(CC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001207509644 1049901404 /nfs/dbraw/zinc/90/14/04/1049901404.db2.gz NTYLGBGKGRWKSB-PZJWPPBQSA-N 2 1 310.485 4.300 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)CC(c1ccccc1)c1ccccc1 ZINC001207523531 1049904358 /nfs/dbraw/zinc/90/43/58/1049904358.db2.gz AKNHMCQDAILZEY-UHFFFAOYSA-N 2 1 322.496 4.236 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)CCCc2ccc(Cl)cc2)CC1 ZINC001207598031 1049914052 /nfs/dbraw/zinc/91/40/52/1049914052.db2.gz BKEUNPCJZRKQJM-UHFFFAOYSA-N 2 1 322.924 4.325 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)CCCCc2ccccc2)CC1 ZINC001207615267 1049918453 /nfs/dbraw/zinc/91/84/53/1049918453.db2.gz QSXHRBSKJVJBTH-UHFFFAOYSA-N 2 1 302.506 4.206 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCC(C)(C)C2)C[C@@H]1c1ccccc1 ZINC000571174362 1049924145 /nfs/dbraw/zinc/92/41/45/1049924145.db2.gz PXCDNYQUVJHTNZ-GBESFXJTSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCC(C)(C)C2)C[C@@H]1c1ccccc1 ZINC000571174362 1049924163 /nfs/dbraw/zinc/92/41/63/1049924163.db2.gz PXCDNYQUVJHTNZ-GBESFXJTSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@@H]2C1 ZINC001207783034 1049938664 /nfs/dbraw/zinc/93/86/64/1049938664.db2.gz AGDMHTBORVDEPF-GSEOLPGOSA-N 2 1 306.538 4.255 20 0 DIADMP C[C@@H](C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1)c1ccccc1 ZINC001207904041 1049951813 /nfs/dbraw/zinc/95/18/13/1049951813.db2.gz URCJDKNIMUQHHV-SFHVURJKSA-N 2 1 312.501 4.131 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)c1ccccc1 ZINC001207907761 1049952274 /nfs/dbraw/zinc/95/22/74/1049952274.db2.gz XPJZAOKEIDQFGN-ICSRJNTNSA-N 2 1 300.490 4.131 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C)c1ccccc1 ZINC001207912071 1049954799 /nfs/dbraw/zinc/95/47/99/1049954799.db2.gz NDRPOGLQHIKLSE-IHPCNDPISA-N 2 1 300.490 4.129 20 0 DIADMP C[C@@H](C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C)c1ccccc1 ZINC001207912071 1049954801 /nfs/dbraw/zinc/95/48/01/1049954801.db2.gz NDRPOGLQHIKLSE-IHPCNDPISA-N 2 1 300.490 4.129 20 0 DIADMP C[C@@H](C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C)c1ccccc1 ZINC001207912071 1049954803 /nfs/dbraw/zinc/95/48/03/1049954803.db2.gz NDRPOGLQHIKLSE-IHPCNDPISA-N 2 1 300.490 4.129 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)cc1 ZINC001207936473 1049960065 /nfs/dbraw/zinc/96/00/65/1049960065.db2.gz HFULEJFDGYXRPK-GHTZIAJQSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)cc1 ZINC001207936473 1049960068 /nfs/dbraw/zinc/96/00/68/1049960068.db2.gz HFULEJFDGYXRPK-GHTZIAJQSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1 ZINC001207936473 1049960076 /nfs/dbraw/zinc/96/00/76/1049960076.db2.gz HFULEJFDGYXRPK-GHTZIAJQSA-N 2 1 314.517 4.016 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1CC1(C)CC[NH+](C)CC1 ZINC001208110174 1049974507 /nfs/dbraw/zinc/97/45/07/1049974507.db2.gz XFRPWWBTODIMJF-QGZVFWFLSA-N 2 1 318.530 4.277 20 0 DIADMP CC/C=C\CCC[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001208134567 1049976912 /nfs/dbraw/zinc/97/69/12/1049976912.db2.gz LYTNBWBJTAVBDI-PLNGDYQASA-N 2 1 300.490 4.329 20 0 DIADMP CC/C=C\CCC[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC001208134567 1049976915 /nfs/dbraw/zinc/97/69/15/1049976915.db2.gz LYTNBWBJTAVBDI-PLNGDYQASA-N 2 1 300.490 4.329 20 0 DIADMP CC[NH+]1CCC(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001208595137 1049997957 /nfs/dbraw/zinc/99/79/57/1049997957.db2.gz QCZYVWSACGOGGN-UHFFFAOYSA-N 2 1 318.892 4.161 20 0 DIADMP CCC[N@@H+]1C[C@@H]2C[NH+](C[C@@H](C)c3cccc4ccccc43)C[C@@H]2C1 ZINC001208710626 1050005882 /nfs/dbraw/zinc/00/58/82/1050005882.db2.gz RCADQZOHARSDPX-RLLQIKCJSA-N 2 1 322.496 4.217 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@@H+](C[C@@H](C)c3cccc4ccccc43)C[C@@H]2C1 ZINC001208710626 1050005887 /nfs/dbraw/zinc/00/58/87/1050005887.db2.gz RCADQZOHARSDPX-RLLQIKCJSA-N 2 1 322.496 4.217 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@H+](C[C@@H](C)c3cccc4ccccc43)C[C@@H]2C1 ZINC001208710626 1050005892 /nfs/dbraw/zinc/00/58/92/1050005892.db2.gz RCADQZOHARSDPX-RLLQIKCJSA-N 2 1 322.496 4.217 20 0 DIADMP CC[NH+]1CCC([N@H+](C)C[C@H](C)c2cccc3ccccc32)CC1 ZINC001208719311 1050006120 /nfs/dbraw/zinc/00/61/20/1050006120.db2.gz SWSWMKZOWHINTH-KRWDZBQOSA-N 2 1 310.485 4.359 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)C[C@H](C)c2cccc3ccccc32)CC1 ZINC001208719311 1050006124 /nfs/dbraw/zinc/00/61/24/1050006124.db2.gz SWSWMKZOWHINTH-KRWDZBQOSA-N 2 1 310.485 4.359 20 0 DIADMP Fc1ccc(CCC[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001208774036 1050009158 /nfs/dbraw/zinc/00/91/58/1050009158.db2.gz XRHLPNRQTIOEML-HXUWFJFHSA-N 2 1 318.480 4.099 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1CCCc1ccc(F)cc1 ZINC001208770269 1050009876 /nfs/dbraw/zinc/00/98/76/1050009876.db2.gz MNRCZPKRHPNDRU-VQTJNVASSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCCc1ccc(F)cc1 ZINC001208770269 1050009877 /nfs/dbraw/zinc/00/98/77/1050009877.db2.gz MNRCZPKRHPNDRU-VQTJNVASSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCCc1ccc(F)cc1 ZINC001208770269 1050009881 /nfs/dbraw/zinc/00/98/81/1050009881.db2.gz MNRCZPKRHPNDRU-VQTJNVASSA-N 2 1 318.480 4.097 20 0 DIADMP CCC[N@@H+](CCCCCOCc1ccccc1)CCC[NH+](C)C ZINC001208815450 1050012485 /nfs/dbraw/zinc/01/24/85/1050012485.db2.gz UEBKXXLFIPFFHL-UHFFFAOYSA-N 2 1 320.521 4.037 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168387800 1050023656 /nfs/dbraw/zinc/02/36/56/1050023656.db2.gz UUXBEQWASBAUGB-QGZVFWFLSA-N 2 1 318.892 4.004 20 0 DIADMP CCC[N@H+](C[C@@H]1CCC[NH+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929415 1050024350 /nfs/dbraw/zinc/02/43/50/1050024350.db2.gz RTMZWYJBCYBXJY-AZUAARDMSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[N@@H+](C[C@@H]1CCC[NH+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929415 1050024355 /nfs/dbraw/zinc/02/43/55/1050024355.db2.gz RTMZWYJBCYBXJY-AZUAARDMSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929415 1050024360 /nfs/dbraw/zinc/02/43/60/1050024360.db2.gz RTMZWYJBCYBXJY-AZUAARDMSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929415 1050024366 /nfs/dbraw/zinc/02/43/66/1050024366.db2.gz RTMZWYJBCYBXJY-AZUAARDMSA-N 2 1 302.506 4.409 20 0 DIADMP FC1(F)CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208932891 1050024494 /nfs/dbraw/zinc/02/44/94/1050024494.db2.gz RYHWZEGYRADPEL-SFHVURJKSA-N 2 1 322.443 4.020 20 0 DIADMP FC1(F)CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208932891 1050024498 /nfs/dbraw/zinc/02/44/98/1050024498.db2.gz RYHWZEGYRADPEL-SFHVURJKSA-N 2 1 322.443 4.020 20 0 DIADMP FC1(F)CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208932891 1050024504 /nfs/dbraw/zinc/02/45/04/1050024504.db2.gz RYHWZEGYRADPEL-SFHVURJKSA-N 2 1 322.443 4.020 20 0 DIADMP C[N@H+](Cc1ccccc1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929106 1050024948 /nfs/dbraw/zinc/02/49/48/1050024948.db2.gz NMLAJCQBFYYFIZ-OAQYLSRUSA-N 2 1 308.469 4.031 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929106 1050024953 /nfs/dbraw/zinc/02/49/53/1050024953.db2.gz NMLAJCQBFYYFIZ-OAQYLSRUSA-N 2 1 308.469 4.031 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929106 1050024959 /nfs/dbraw/zinc/02/49/59/1050024959.db2.gz NMLAJCQBFYYFIZ-OAQYLSRUSA-N 2 1 308.469 4.031 20 0 DIADMP Cc1ccc(C[N@@H+](C)C[C@@H]2CCC[NH+](Cc3ccccc3)C2)cc1 ZINC001208931643 1050025227 /nfs/dbraw/zinc/02/52/27/1050025227.db2.gz BTIPXKGABOVZQU-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC001208931643 1050025234 /nfs/dbraw/zinc/02/52/34/1050025234.db2.gz BTIPXKGABOVZQU-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001208931643 1050025240 /nfs/dbraw/zinc/02/52/40/1050025240.db2.gz BTIPXKGABOVZQU-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP C[C@]1(F)CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208932846 1050025271 /nfs/dbraw/zinc/02/52/71/1050025271.db2.gz RAQHIDZAIVVKMD-PMACEKPBSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208932846 1050025275 /nfs/dbraw/zinc/02/52/75/1050025275.db2.gz RAQHIDZAIVVKMD-PMACEKPBSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208932846 1050025282 /nfs/dbraw/zinc/02/52/82/1050025282.db2.gz RAQHIDZAIVVKMD-PMACEKPBSA-N 2 1 318.480 4.113 20 0 DIADMP CCC[N@H+](C[C@@H]1CCC[NH+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929419 1050025391 /nfs/dbraw/zinc/02/53/91/1050025391.db2.gz RTMZWYJBCYBXJY-UYAOXDASSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[N@@H+](C[C@@H]1CCC[NH+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929419 1050025394 /nfs/dbraw/zinc/02/53/94/1050025394.db2.gz RTMZWYJBCYBXJY-UYAOXDASSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929419 1050025397 /nfs/dbraw/zinc/02/53/97/1050025397.db2.gz RTMZWYJBCYBXJY-UYAOXDASSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H](C)CC ZINC001208929419 1050025403 /nfs/dbraw/zinc/02/54/03/1050025403.db2.gz RTMZWYJBCYBXJY-UYAOXDASSA-N 2 1 302.506 4.409 20 0 DIADMP C[C@]1(F)CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)CC1 ZINC001208932847 1050025693 /nfs/dbraw/zinc/02/56/93/1050025693.db2.gz RAQHIDZAIVVKMD-UXHICEINSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208932847 1050025698 /nfs/dbraw/zinc/02/56/98/1050025698.db2.gz RAQHIDZAIVVKMD-UXHICEINSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208932847 1050025704 /nfs/dbraw/zinc/02/57/04/1050025704.db2.gz RAQHIDZAIVVKMD-UXHICEINSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@H]1CCC[N@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935145 1050026244 /nfs/dbraw/zinc/02/62/44/1050026244.db2.gz INGFUMKCZXDROI-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935145 1050026249 /nfs/dbraw/zinc/02/62/49/1050026249.db2.gz INGFUMKCZXDROI-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935145 1050026256 /nfs/dbraw/zinc/02/62/56/1050026256.db2.gz INGFUMKCZXDROI-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@@H]1C ZINC001208935145 1050026263 /nfs/dbraw/zinc/02/62/63/1050026263.db2.gz INGFUMKCZXDROI-GGPKGHCWSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC4(CCCC4)CC3)C2)cc1 ZINC001208945138 1050026720 /nfs/dbraw/zinc/02/67/20/1050026720.db2.gz ZAHOKDSOSYRCMT-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H](C[NH+]3C4CCCC3CCC4)C2)cc1 ZINC001208944978 1050027243 /nfs/dbraw/zinc/02/72/43/1050027243.db2.gz QDLLVYDIRKPIKH-MWXLCCTBSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3C4CCCC3CCC4)C2)cc1 ZINC001208944978 1050027251 /nfs/dbraw/zinc/02/72/51/1050027251.db2.gz QDLLVYDIRKPIKH-MWXLCCTBSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC[C@@H]4CCCC[C@@H]43)C2)cc1 ZINC001208947797 1050027259 /nfs/dbraw/zinc/02/72/59/1050027259.db2.gz DAEIYJURFZIXDV-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCC[C@@H]4CCCC[C@@H]43)C2)cc1 ZINC001208947797 1050027265 /nfs/dbraw/zinc/02/72/65/1050027265.db2.gz DAEIYJURFZIXDV-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCC[C@@H]4CCCC[C@@H]43)C2)cc1 ZINC001208947797 1050027273 /nfs/dbraw/zinc/02/72/73/1050027273.db2.gz DAEIYJURFZIXDV-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208938323 1050027415 /nfs/dbraw/zinc/02/74/15/1050027415.db2.gz ASZZZTXZUVEMMF-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H]1CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208938323 1050027424 /nfs/dbraw/zinc/02/74/24/1050027424.db2.gz ASZZZTXZUVEMMF-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@@H]1CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208938323 1050027429 /nfs/dbraw/zinc/02/74/29/1050027429.db2.gz ASZZZTXZUVEMMF-QUCCMNQESA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC[C@H]4CCCC[C@H]43)C2)cc1 ZINC001208947802 1050028814 /nfs/dbraw/zinc/02/88/14/1050028814.db2.gz DAEIYJURFZIXDV-PWRODBHTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCC[C@H]4CCCC[C@H]43)C2)cc1 ZINC001208947802 1050028821 /nfs/dbraw/zinc/02/88/21/1050028821.db2.gz DAEIYJURFZIXDV-PWRODBHTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCC[C@H]4CCCC[C@H]43)C2)cc1 ZINC001208947802 1050028827 /nfs/dbraw/zinc/02/88/27/1050028827.db2.gz DAEIYJURFZIXDV-PWRODBHTSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208938094 1050028854 /nfs/dbraw/zinc/02/88/54/1050028854.db2.gz WVAFSNDICLXZRT-IBGZPJMESA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCCCCC3)C2)cc1 ZINC001208960256 1050029242 /nfs/dbraw/zinc/02/92/42/1050029242.db2.gz VESHNVXKWNTUCT-HXUWFJFHSA-N 2 1 300.490 4.165 20 0 DIADMP CCC[C@H]1CCCC[NH+]1C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949329 1050029493 /nfs/dbraw/zinc/02/94/93/1050029493.db2.gz LBCJGSRQGHSFGR-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H]1CCCC[N@H+]1C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949329 1050029488 /nfs/dbraw/zinc/02/94/88/1050029488.db2.gz LBCJGSRQGHSFGR-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H]1CCCC[NH+]1C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949329 1050029498 /nfs/dbraw/zinc/02/94/98/1050029498.db2.gz LBCJGSRQGHSFGR-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3cc(F)ccc23)CC1 ZINC001209695102 1050076532 /nfs/dbraw/zinc/07/65/32/1050076532.db2.gz DULSAVXSIQJZKY-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP CC[NH+](CC)Cc1ccc(Nc2[nH+]c3ccccc3n2C)cc1 ZINC001209821743 1050089591 /nfs/dbraw/zinc/08/95/91/1050089591.db2.gz UDUYQCQHULJSBU-UHFFFAOYSA-N 2 1 308.429 4.159 20 0 DIADMP C(=C/C[N@@H+](C1CC1)C1CCCC1)\C[NH+](C1CC1)C1CCCC1 ZINC000590925993 1050114181 /nfs/dbraw/zinc/11/41/81/1050114181.db2.gz IAPKWRFLKFCCPL-AATRIKPKSA-N 2 1 302.506 4.357 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000573127392 1050133995 /nfs/dbraw/zinc/13/39/95/1050133995.db2.gz ZZHFGTTZAFUIDF-GOEBONIOSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000573127393 1050134088 /nfs/dbraw/zinc/13/40/88/1050134088.db2.gz ZZHFGTTZAFUIDF-HOCLYGCPSA-N 2 1 306.881 4.083 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646118276 1050151255 /nfs/dbraw/zinc/15/12/55/1050151255.db2.gz HLELRXBAFHRTTM-HXUWFJFHSA-N 2 1 321.468 4.365 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646118276 1050151262 /nfs/dbraw/zinc/15/12/62/1050151262.db2.gz HLELRXBAFHRTTM-HXUWFJFHSA-N 2 1 321.468 4.365 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ccccc2F)cc1 ZINC000347941879 1050161888 /nfs/dbraw/zinc/16/18/88/1050161888.db2.gz ANGMIIUABGWIQJ-OAHLLOKOSA-N 2 1 323.415 4.213 20 0 DIADMP CSc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)s1 ZINC000573409743 1050176863 /nfs/dbraw/zinc/17/68/63/1050176863.db2.gz QWDFVVFXSYCNGZ-UHFFFAOYSA-N 2 1 324.559 4.357 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3cc(C)ccc23)CC1 ZINC001136976664 1050266115 /nfs/dbraw/zinc/26/61/15/1050266115.db2.gz KAJPLGFLFNURRE-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@H]2CCc3cc(Cl)ccc3C2)C1 ZINC001171113161 1050384102 /nfs/dbraw/zinc/38/41/02/1050384102.db2.gz OYHDCLAHVCLZHI-BEFAXECRSA-N 2 1 320.908 4.038 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccnc(Cl)c1 ZINC000157879208 1050457122 /nfs/dbraw/zinc/45/71/22/1050457122.db2.gz MEFAACSEEVTOEC-CABCVRRESA-N 2 1 309.885 4.040 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2c(C)cccc2F)cc1 ZINC000766216140 1050466376 /nfs/dbraw/zinc/46/63/76/1050466376.db2.gz LMNTXRZHLCEEIR-HNNXBMFYSA-N 2 1 323.415 4.479 20 0 DIADMP CC(C)CCC[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170057550 1050479059 /nfs/dbraw/zinc/47/90/59/1050479059.db2.gz LMVHSBXHKAYJRG-ICSRJNTNSA-N 2 1 302.506 4.313 20 0 DIADMP CCc1cccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001144323444 1050542471 /nfs/dbraw/zinc/54/24/71/1050542471.db2.gz DLXZXGXCWQRTPB-QFIPXVFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1cccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001144323444 1050542478 /nfs/dbraw/zinc/54/24/78/1050542478.db2.gz DLXZXGXCWQRTPB-QFIPXVFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1cccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001144323444 1050542486 /nfs/dbraw/zinc/54/24/86/1050542486.db2.gz DLXZXGXCWQRTPB-QFIPXVFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCCCCC[C@@H](CCCC)[N@H+]1CCC(F)(F)[C@H](C[NH3+])C1 ZINC001246558055 1050546505 /nfs/dbraw/zinc/54/65/05/1050546505.db2.gz NXGKWRPTDGFBBG-HZPDHXFCSA-N 2 1 304.469 4.432 20 0 DIADMP CC(C)CCC[C@H](C)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170070983 1050579013 /nfs/dbraw/zinc/57/90/13/1050579013.db2.gz HQMWRHVEGHPJBI-BJLQDIEVSA-N 2 1 317.521 4.368 20 0 DIADMP CC(C)CCC[C@H](C)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001170083736 1050663218 /nfs/dbraw/zinc/66/32/18/1050663218.db2.gz YWQZZWUYADNZAU-ROUUACIJSA-N 2 1 324.553 4.213 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CCCCCC[NH3+] ZINC000846218767 1050695999 /nfs/dbraw/zinc/69/59/99/1050695999.db2.gz UROZESNXGDQEHS-ZDUSSCGKSA-N 2 1 302.384 4.217 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccccc1SC(C)(C)C ZINC000788581914 1050707845 /nfs/dbraw/zinc/70/78/45/1050707845.db2.gz CHGVACABGBHWME-AWEZNQCLSA-N 2 1 317.502 4.433 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CCC3CCC3)C2)s1 ZINC001170086806 1050711020 /nfs/dbraw/zinc/71/10/20/1050711020.db2.gz XVPGXBSKJWYNMT-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CCC3CCC3)C2)s1 ZINC001170086806 1050711035 /nfs/dbraw/zinc/71/10/35/1050711035.db2.gz XVPGXBSKJWYNMT-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCC3CCC3)C2)s1 ZINC001170086806 1050711050 /nfs/dbraw/zinc/71/10/50/1050711050.db2.gz XVPGXBSKJWYNMT-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000742374904 1050835532 /nfs/dbraw/zinc/83/55/32/1050835532.db2.gz KCVFPRDJEKSQOB-PKOBYXMFSA-N 2 1 318.505 4.218 20 0 DIADMP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000742375915 1050836621 /nfs/dbraw/zinc/83/66/21/1050836621.db2.gz XZVOPJMUPITOGX-HKUYNNGSSA-N 2 1 318.505 4.218 20 0 DIADMP Cc1ccc(C[N@H+]([C@H]2CC[C@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001170119445 1050881941 /nfs/dbraw/zinc/88/19/41/1050881941.db2.gz ASFPUHJHIKSHAB-LEAZDLGRSA-N 2 1 300.490 4.256 20 0 DIADMP C[C@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4cccs4)C3)CC2)C1 ZINC001170137056 1050962097 /nfs/dbraw/zinc/96/20/97/1050962097.db2.gz MRXIYWBBPHTDHJ-DLBZAZTESA-N 2 1 318.530 4.225 20 0 DIADMP CCOc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000773074739 1051051844 /nfs/dbraw/zinc/05/18/44/1051051844.db2.gz HNKPMQUZXQRXDM-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@H]1CC[C@H]([NH+]2CCC([N@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156278 1051061244 /nfs/dbraw/zinc/06/12/44/1051061244.db2.gz CDKYFUGIRKTDBW-KXBFYZLASA-N 2 1 320.908 4.425 20 0 DIADMP C[C@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccc(Cl)cc3)CC2)C1 ZINC001170156278 1051061253 /nfs/dbraw/zinc/06/12/53/1051061253.db2.gz CDKYFUGIRKTDBW-KXBFYZLASA-N 2 1 320.908 4.425 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(CC(C)C)cc2)C1 ZINC000743862907 1051082491 /nfs/dbraw/zinc/08/24/91/1051082491.db2.gz MUAFXQSCZPMKRG-HXUWFJFHSA-N 2 1 302.506 4.049 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(CC(C)C)cc2)C1 ZINC000743862907 1051082504 /nfs/dbraw/zinc/08/25/04/1051082504.db2.gz MUAFXQSCZPMKRG-HXUWFJFHSA-N 2 1 302.506 4.049 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)C1 ZINC001170162994 1051120270 /nfs/dbraw/zinc/12/02/70/1051120270.db2.gz VSXOSXHDJSOKNI-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)C1 ZINC001170162994 1051120276 /nfs/dbraw/zinc/12/02/76/1051120276.db2.gz VSXOSXHDJSOKNI-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)C1 ZINC001170162994 1051120282 /nfs/dbraw/zinc/12/02/82/1051120282.db2.gz VSXOSXHDJSOKNI-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP CC(C)C[C@@H](C)C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170204962 1051150082 /nfs/dbraw/zinc/15/00/82/1051150082.db2.gz HDJVBILWTHEMFL-CTNGQTDRSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001170259061 1051165397 /nfs/dbraw/zinc/16/53/97/1051165397.db2.gz ATKFVDDBYYTECJ-HNNXBMFYSA-N 2 1 320.908 4.255 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170260341 1051166183 /nfs/dbraw/zinc/16/61/83/1051166183.db2.gz IMWROHKTKCSVMO-ZTFGCOKTSA-N 2 1 320.908 4.253 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC001170250188 1051171532 /nfs/dbraw/zinc/17/15/32/1051171532.db2.gz HDONSUKWHNXTLB-HZPDHXFCSA-N 2 1 308.897 4.125 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ccccn1 ZINC001171622864 1051179174 /nfs/dbraw/zinc/17/91/74/1051179174.db2.gz AHOJLGDGKQYKEP-QGZVFWFLSA-N 2 1 303.494 4.020 20 0 DIADMP CC[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ccccc1OC ZINC001171623617 1051180256 /nfs/dbraw/zinc/18/02/56/1051180256.db2.gz DNVZKBCUCYVVTR-KRWDZBQOSA-N 2 1 318.505 4.387 20 0 DIADMP C[N@@H+]([C@H]1CCc2ccccc21)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171644825 1051181975 /nfs/dbraw/zinc/18/19/75/1051181975.db2.gz PTPWGWIJOAPTNN-SFHVURJKSA-N 2 1 300.490 4.257 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001171676128 1051192197 /nfs/dbraw/zinc/19/21/97/1051192197.db2.gz WURQIGUNDARDRQ-LJQANCHMSA-N 2 1 316.533 4.368 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@@]1(C)Cc1ccccc1Cl ZINC001171900111 1051236561 /nfs/dbraw/zinc/23/65/61/1051236561.db2.gz HIIQSNAMORKZSY-HKUYNNGSSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@@]1(C)Cc1ccccc1Cl ZINC001171900111 1051236576 /nfs/dbraw/zinc/23/65/76/1051236576.db2.gz HIIQSNAMORKZSY-HKUYNNGSSA-N 2 1 320.908 4.221 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@@]1(C)Cc1ccccc1Cl ZINC001171900111 1051236590 /nfs/dbraw/zinc/23/65/90/1051236590.db2.gz HIIQSNAMORKZSY-HKUYNNGSSA-N 2 1 320.908 4.221 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@@H]2CCCC[C@H]2F)CC[N@H+]1Cc1ccccc1 ZINC001171966478 1051249677 /nfs/dbraw/zinc/24/96/77/1051249677.db2.gz VAVSZNLPLPFDIV-IPMKNSEASA-N 2 1 318.480 4.300 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966022 1051249739 /nfs/dbraw/zinc/24/97/39/1051249739.db2.gz SDYBQQRGWBKNDR-XLIONFOSSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966022 1051249747 /nfs/dbraw/zinc/24/97/47/1051249747.db2.gz SDYBQQRGWBKNDR-XLIONFOSSA-N 2 1 323.484 4.175 20 0 DIADMP CC[C@@H]1CC[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989290 1051255565 /nfs/dbraw/zinc/25/55/65/1051255565.db2.gz CGMITFODQMXBCY-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989290 1051255581 /nfs/dbraw/zinc/25/55/81/1051255581.db2.gz CGMITFODQMXBCY-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989290 1051255592 /nfs/dbraw/zinc/25/55/92/1051255592.db2.gz CGMITFODQMXBCY-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171989290 1051255599 /nfs/dbraw/zinc/25/55/99/1051255599.db2.gz CGMITFODQMXBCY-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976042 1051265314 /nfs/dbraw/zinc/26/53/14/1051265314.db2.gz HURXBSTZPMCCIN-AZUAARDMSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976042 1051265324 /nfs/dbraw/zinc/26/53/24/1051265324.db2.gz HURXBSTZPMCCIN-AZUAARDMSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976042 1051265332 /nfs/dbraw/zinc/26/53/32/1051265332.db2.gz HURXBSTZPMCCIN-AZUAARDMSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976042 1051265341 /nfs/dbraw/zinc/26/53/41/1051265341.db2.gz HURXBSTZPMCCIN-AZUAARDMSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983929 1051266876 /nfs/dbraw/zinc/26/68/76/1051266876.db2.gz BAVJOLVRUYVVJY-PKOBYXMFSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983929 1051266887 /nfs/dbraw/zinc/26/68/87/1051266887.db2.gz BAVJOLVRUYVVJY-PKOBYXMFSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983929 1051266894 /nfs/dbraw/zinc/26/68/94/1051266894.db2.gz BAVJOLVRUYVVJY-PKOBYXMFSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983929 1051266904 /nfs/dbraw/zinc/26/69/04/1051266904.db2.gz BAVJOLVRUYVVJY-PKOBYXMFSA-N 2 1 312.501 4.304 20 0 DIADMP C[N@@H+](CC1CCC1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171980454 1051267404 /nfs/dbraw/zinc/26/74/04/1051267404.db2.gz FEGDGRIHJVGPBG-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CC1CCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980454 1051267416 /nfs/dbraw/zinc/26/74/16/1051267416.db2.gz FEGDGRIHJVGPBG-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CC1CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980454 1051267425 /nfs/dbraw/zinc/26/74/25/1051267425.db2.gz FEGDGRIHJVGPBG-LJQANCHMSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984695 1051267639 /nfs/dbraw/zinc/26/76/39/1051267639.db2.gz XQRCSZRQXAGCIV-KRWDZBQOSA-N 2 1 300.490 4.208 20 0 DIADMP CC1(C)C[C@H]([NH2+]C2(CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171980482 1051269220 /nfs/dbraw/zinc/26/92/20/1051269220.db2.gz VNWSQKVICDRONP-LJQANCHMSA-N 2 1 312.501 4.352 20 0 DIADMP CC1(C)C[C@H]([NH+]2C[C@H]3CCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001171978165 1051269965 /nfs/dbraw/zinc/26/99/65/1051269965.db2.gz WTHLHWSODMOVRC-VAMGGRTRSA-N 2 1 312.501 4.162 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@@H](CF)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988249 1051271294 /nfs/dbraw/zinc/27/12/94/1051271294.db2.gz QEFGPYRKMBRLBF-RBUKOAKNSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@@H](CF)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988249 1051271305 /nfs/dbraw/zinc/27/13/05/1051271305.db2.gz QEFGPYRKMBRLBF-RBUKOAKNSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988249 1051271315 /nfs/dbraw/zinc/27/13/15/1051271315.db2.gz QEFGPYRKMBRLBF-RBUKOAKNSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC[C@@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988249 1051271334 /nfs/dbraw/zinc/27/13/34/1051271334.db2.gz QEFGPYRKMBRLBF-RBUKOAKNSA-N 2 1 318.480 4.111 20 0 DIADMP CC[C@@H]1CCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985293 1051272157 /nfs/dbraw/zinc/27/21/57/1051272157.db2.gz VEZWMMIGABKSQR-MOPGFXCFSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985293 1051272166 /nfs/dbraw/zinc/27/21/66/1051272166.db2.gz VEZWMMIGABKSQR-MOPGFXCFSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985293 1051272170 /nfs/dbraw/zinc/27/21/70/1051272170.db2.gz VEZWMMIGABKSQR-MOPGFXCFSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985293 1051272176 /nfs/dbraw/zinc/27/21/76/1051272176.db2.gz VEZWMMIGABKSQR-MOPGFXCFSA-N 2 1 300.490 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CC4(CCC4)C2)C3)cc1 ZINC001172070341 1051274514 /nfs/dbraw/zinc/27/45/14/1051274514.db2.gz ZHDZOGUVOWPZES-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP CCC[N@H+](CC)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080333 1051277777 /nfs/dbraw/zinc/27/77/77/1051277777.db2.gz UCDFCWAJDVBVGL-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCC[N@@H+](CC)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080333 1051277792 /nfs/dbraw/zinc/27/77/92/1051277792.db2.gz UCDFCWAJDVBVGL-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCC[NH+](CC)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172080333 1051277810 /nfs/dbraw/zinc/27/78/10/1051277810.db2.gz UCDFCWAJDVBVGL-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP CCC[NH+](CC)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172080333 1051277830 /nfs/dbraw/zinc/27/78/30/1051277830.db2.gz UCDFCWAJDVBVGL-ACDBMABISA-N 2 1 300.490 4.304 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1ccc(Cl)cc1)C2 ZINC001172101598 1051278010 /nfs/dbraw/zinc/27/80/10/1051278010.db2.gz FSUQSVFQYYZYPI-NNZMDNLPSA-N 2 1 320.908 4.266 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1ccc(Cl)cc1)C2 ZINC001172101598 1051278022 /nfs/dbraw/zinc/27/80/22/1051278022.db2.gz FSUQSVFQYYZYPI-NNZMDNLPSA-N 2 1 320.908 4.266 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172063806 1051284903 /nfs/dbraw/zinc/28/49/03/1051284903.db2.gz CURLXBVPKIBIMM-OFOKGCAXSA-N 2 1 312.501 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CC2CCCC2)C3)cc1 ZINC001172064857 1051286506 /nfs/dbraw/zinc/28/65/06/1051286506.db2.gz HJEXQZMYNQRSGW-WKCHPHFGSA-N 2 1 312.501 4.352 20 0 DIADMP c1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172069964 1051287864 /nfs/dbraw/zinc/28/78/64/1051287864.db2.gz YVHABIXUTJDLBT-KOUNCHBCSA-N 2 1 320.480 4.362 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125332 1051288678 /nfs/dbraw/zinc/28/86/78/1051288678.db2.gz PMJKBYIQFIETED-WCXIOVBPSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125332 1051288686 /nfs/dbraw/zinc/28/86/86/1051288686.db2.gz PMJKBYIQFIETED-WCXIOVBPSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125332 1051288697 /nfs/dbraw/zinc/28/86/97/1051288697.db2.gz PMJKBYIQFIETED-WCXIOVBPSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@@H](c3ccccc3Cl)C1)C2 ZINC001172125332 1051288708 /nfs/dbraw/zinc/28/87/08/1051288708.db2.gz PMJKBYIQFIETED-WCXIOVBPSA-N 2 1 318.892 4.145 20 0 DIADMP C[C@@H]1C[C@H](F)C[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172070062 1051289769 /nfs/dbraw/zinc/28/97/69/1051289769.db2.gz WLIVRYIJUBRUMN-MTEHYEEQSA-N 2 1 316.464 4.004 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127400 1051289434 /nfs/dbraw/zinc/28/94/34/1051289434.db2.gz JCTMLUKOXOIJDU-CGXNFDGLSA-N 2 1 312.501 4.271 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127400 1051289449 /nfs/dbraw/zinc/28/94/49/1051289449.db2.gz JCTMLUKOXOIJDU-CGXNFDGLSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127400 1051289459 /nfs/dbraw/zinc/28/94/59/1051289459.db2.gz JCTMLUKOXOIJDU-CGXNFDGLSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H](c3ccccc3)CC1)C2 ZINC001172127400 1051289462 /nfs/dbraw/zinc/28/94/62/1051289462.db2.gz JCTMLUKOXOIJDU-CGXNFDGLSA-N 2 1 312.501 4.271 20 0 DIADMP C[C@@H]1C[C@H](F)C[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070062 1051289732 /nfs/dbraw/zinc/28/97/32/1051289732.db2.gz WLIVRYIJUBRUMN-MTEHYEEQSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@H](F)C[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172070062 1051289742 /nfs/dbraw/zinc/28/97/42/1051289742.db2.gz WLIVRYIJUBRUMN-MTEHYEEQSA-N 2 1 316.464 4.004 20 0 DIADMP C[C@@H]1C[C@H](F)C[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070062 1051289757 /nfs/dbraw/zinc/28/97/57/1051289757.db2.gz WLIVRYIJUBRUMN-MTEHYEEQSA-N 2 1 316.464 4.004 20 0 DIADMP CC[N@H+](Cc1cccc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129966 1051291510 /nfs/dbraw/zinc/29/15/10/1051291510.db2.gz MOTHFSNSQQCFLG-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172129966 1051291522 /nfs/dbraw/zinc/29/15/22/1051291522.db2.gz MOTHFSNSQQCFLG-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1cccc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172129966 1051291531 /nfs/dbraw/zinc/29/15/31/1051291531.db2.gz MOTHFSNSQQCFLG-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP CC[NH+](Cc1cccc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172129966 1051291541 /nfs/dbraw/zinc/29/15/41/1051291541.db2.gz MOTHFSNSQQCFLG-PIIMJCKOSA-N 2 1 306.881 4.177 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131097 1051293149 /nfs/dbraw/zinc/29/31/49/1051293149.db2.gz UWTBAPNXPYXKQV-JONQDZQNSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172131097 1051293157 /nfs/dbraw/zinc/29/31/57/1051293157.db2.gz UWTBAPNXPYXKQV-JONQDZQNSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172131097 1051293164 /nfs/dbraw/zinc/29/31/64/1051293164.db2.gz UWTBAPNXPYXKQV-JONQDZQNSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172131097 1051293172 /nfs/dbraw/zinc/29/31/72/1051293172.db2.gz UWTBAPNXPYXKQV-JONQDZQNSA-N 2 1 306.881 4.348 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001172130996 1051294291 /nfs/dbraw/zinc/29/42/91/1051294291.db2.gz SRULFNCHZNZUGL-FCGDIQPGSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001172130996 1051294303 /nfs/dbraw/zinc/29/43/03/1051294303.db2.gz SRULFNCHZNZUGL-FCGDIQPGSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1cccc(Cl)c1)C2 ZINC001172130996 1051294314 /nfs/dbraw/zinc/29/43/14/1051294314.db2.gz SRULFNCHZNZUGL-FCGDIQPGSA-N 2 1 318.892 4.492 20 0 DIADMP CCCC[C@@H](CC)COCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172107880 1051296349 /nfs/dbraw/zinc/29/63/49/1051296349.db2.gz LCTVGHSSRIERHH-YSTOQKLRSA-N 2 1 324.553 4.214 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1c(F)cccc1Cl ZINC001172107563 1051297095 /nfs/dbraw/zinc/29/70/95/1051297095.db2.gz FNYLAZMFGVFOOI-FQUUOJAGSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1c(F)cccc1Cl ZINC001172107563 1051297110 /nfs/dbraw/zinc/29/71/10/1051297110.db2.gz FNYLAZMFGVFOOI-FQUUOJAGSA-N 2 1 310.844 4.145 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172109692 1051300652 /nfs/dbraw/zinc/30/06/52/1051300652.db2.gz JZASRAQQGVMMMB-FCGDIQPGSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172109692 1051300660 /nfs/dbraw/zinc/30/06/60/1051300660.db2.gz JZASRAQQGVMMMB-FCGDIQPGSA-N 2 1 304.453 4.128 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1Cl ZINC001172110794 1051301046 /nfs/dbraw/zinc/30/10/46/1051301046.db2.gz PHVUBAFBWNQMJY-LLLHUVSDSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ccc1Cl ZINC001172110794 1051301057 /nfs/dbraw/zinc/30/10/57/1051301057.db2.gz PHVUBAFBWNQMJY-LLLHUVSDSA-N 2 1 306.881 4.314 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)ccc1F ZINC001172112106 1051302163 /nfs/dbraw/zinc/30/21/63/1051302163.db2.gz TUFBIKZMWYSOLD-KRXQYRFLSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(Cl)c1 ZINC001172109708 1051302532 /nfs/dbraw/zinc/30/25/32/1051302532.db2.gz KDHRIRHWBBDOLK-ZJPYXAASSA-N 2 1 306.881 4.396 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1 ZINC001172109708 1051302534 /nfs/dbraw/zinc/30/25/34/1051302534.db2.gz KDHRIRHWBBDOLK-ZJPYXAASSA-N 2 1 306.881 4.396 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001172112674 1051302784 /nfs/dbraw/zinc/30/27/84/1051302784.db2.gz YUDQZSSMPFKWRF-GGXPGOJBSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172112674 1051302795 /nfs/dbraw/zinc/30/27/95/1051302795.db2.gz YUDQZSSMPFKWRF-GGXPGOJBSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1csc3ccccc13)C2 ZINC001172115855 1051304870 /nfs/dbraw/zinc/30/48/70/1051304870.db2.gz FRMMOSRFYGBQQA-MUJYYYPQSA-N 2 1 300.471 4.006 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1Cl ZINC001172116999 1051305210 /nfs/dbraw/zinc/30/52/10/1051305210.db2.gz JRVNFUPAAMOYJX-KRXQYRFLSA-N 2 1 306.881 4.396 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001172121768 1051305500 /nfs/dbraw/zinc/30/55/00/1051305500.db2.gz MGGAPLGWWWAIRE-RDGPPVDQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001172121768 1051305511 /nfs/dbraw/zinc/30/55/11/1051305511.db2.gz MGGAPLGWWWAIRE-RDGPPVDQSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1ccc(Cl)cc1)C2 ZINC001172121768 1051305518 /nfs/dbraw/zinc/30/55/18/1051305518.db2.gz MGGAPLGWWWAIRE-RDGPPVDQSA-N 2 1 318.892 4.492 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172113961 1051305862 /nfs/dbraw/zinc/30/58/62/1051305862.db2.gz KZOAJKZTRADMGO-XLNTUCKNSA-N 2 1 300.490 4.476 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172113961 1051305868 /nfs/dbraw/zinc/30/58/68/1051305868.db2.gz KZOAJKZTRADMGO-XLNTUCKNSA-N 2 1 300.490 4.476 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1cc(F)ccc1F)C2 ZINC001172124355 1051306102 /nfs/dbraw/zinc/30/61/02/1051306102.db2.gz KTNJFEUGUWBKEK-RCJHGTSTSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1cc(F)ccc1F)C2 ZINC001172124355 1051306116 /nfs/dbraw/zinc/30/61/16/1051306116.db2.gz KTNJFEUGUWBKEK-RCJHGTSTSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(C)(C)c1cccc(Cl)c1)C2 ZINC001172117570 1051306597 /nfs/dbraw/zinc/30/65/97/1051306597.db2.gz MPQRZTJLTXOKMN-OSYLJGHBSA-N 2 1 306.881 4.180 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(C)(C)c1cccc(Cl)c1)C2 ZINC001172117570 1051306608 /nfs/dbraw/zinc/30/66/08/1051306608.db2.gz MPQRZTJLTXOKMN-OSYLJGHBSA-N 2 1 306.881 4.180 20 0 DIADMP CC[NH+](CC)Cc1ccc(F)c(Nc2cc(OC)c(C)c[nH+]2)c1 ZINC001215725914 1051325302 /nfs/dbraw/zinc/32/53/02/1051325302.db2.gz QQCLGMMQFXLSIC-UHFFFAOYSA-N 2 1 317.408 4.123 20 0 DIADMP CCC(CC)[N@H+]([C@H](C)CCO[C@H](C)CC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172332231 1051357198 /nfs/dbraw/zinc/35/71/98/1051357198.db2.gz HLFRXJWDYMJIJV-YWTNHNAXSA-N 2 1 312.542 4.341 20 0 DIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](CC1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172334469 1051359502 /nfs/dbraw/zinc/35/95/02/1051359502.db2.gz MLOMUUMUZUBSHP-ZULIPRJHSA-N 2 1 324.553 4.342 20 0 DIADMP CC[C@@H](C)OCC[C@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338545 1051360810 /nfs/dbraw/zinc/36/08/10/1051360810.db2.gz ZADRAMOMJLNGBD-ZMMAXQRCSA-N 2 1 310.526 4.095 20 0 DIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172337931 1051361418 /nfs/dbraw/zinc/36/14/18/1051361418.db2.gz XHSOSRNUNZGLLD-JPLJXNOCSA-N 2 1 324.553 4.485 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000380907864 1051366642 /nfs/dbraw/zinc/36/66/42/1051366642.db2.gz IJWOTXLIDKEBCM-MJGOQNOKSA-N 2 1 312.457 4.151 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000380907864 1051366653 /nfs/dbraw/zinc/36/66/53/1051366653.db2.gz IJWOTXLIDKEBCM-MJGOQNOKSA-N 2 1 312.457 4.151 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172390608 1051393854 /nfs/dbraw/zinc/39/38/54/1051393854.db2.gz WHMFOMVCGCPMSF-RLLQIKCJSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172390608 1051393862 /nfs/dbraw/zinc/39/38/62/1051393862.db2.gz WHMFOMVCGCPMSF-RLLQIKCJSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001172400552 1051398804 /nfs/dbraw/zinc/39/88/04/1051398804.db2.gz LDZMFXKJECGPPX-DFQSSKMNSA-N 2 1 302.506 4.311 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001172400552 1051398811 /nfs/dbraw/zinc/39/88/11/1051398811.db2.gz LDZMFXKJECGPPX-DFQSSKMNSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)COCC[C@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001172477543 1051402777 /nfs/dbraw/zinc/40/27/77/1051402777.db2.gz AWICQRNBMAIFBL-SFHVURJKSA-N 2 1 324.553 4.167 20 0 DIADMP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390643892 1051405976 /nfs/dbraw/zinc/40/59/76/1051405976.db2.gz LRHNBDGNRFIDAA-ZWKOTPCHSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390643892 1051405979 /nfs/dbraw/zinc/40/59/79/1051405979.db2.gz LRHNBDGNRFIDAA-ZWKOTPCHSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)OCC[C@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437861 1051405974 /nfs/dbraw/zinc/40/59/74/1051405974.db2.gz WYCLJQQYZYVCJG-LNLFQRSKSA-N 2 1 310.526 4.095 20 0 DIADMP CC(C)OCC[C@H](C)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172436681 1051406047 /nfs/dbraw/zinc/40/60/47/1051406047.db2.gz GTRTVZBJTZYXJV-IHPCNDPISA-N 2 1 324.553 4.342 20 0 DIADMP CCC(CC)[N@@H+]([C@@H](C)CCOCC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172467095 1051414814 /nfs/dbraw/zinc/41/48/14/1051414814.db2.gz HTYBXRIWTFPACO-LNLFQRSKSA-N 2 1 312.542 4.198 20 0 DIADMP CC[N@@H+](C)C1CC[NH+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172550259 1051433187 /nfs/dbraw/zinc/43/31/87/1051433187.db2.gz VSPSDQJMUJQOTA-UYAOXDASSA-N 2 1 300.490 4.129 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172555851 1051438611 /nfs/dbraw/zinc/43/86/11/1051438611.db2.gz JYNZQQZPJDJYBA-DFQSSKMNSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172557201 1051438968 /nfs/dbraw/zinc/43/89/68/1051438968.db2.gz PAKVHJNCQGJKMQ-RSPOEFSDSA-N 2 1 300.490 4.031 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172558157 1051441087 /nfs/dbraw/zinc/44/10/87/1051441087.db2.gz SMIMEMLJWUPSTD-QRVBRYPASA-N 2 1 300.490 4.175 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172558157 1051441097 /nfs/dbraw/zinc/44/10/97/1051441097.db2.gz SMIMEMLJWUPSTD-QRVBRYPASA-N 2 1 300.490 4.175 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001169070420 1051506133 /nfs/dbraw/zinc/50/61/33/1051506133.db2.gz QCTOMPZCUMVUHF-NRSPTQNISA-N 2 1 316.533 4.352 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001169070421 1051506935 /nfs/dbraw/zinc/50/69/35/1051506935.db2.gz QCTOMPZCUMVUHF-TYPHKJRUSA-N 2 1 316.533 4.352 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C[C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169125289 1051522873 /nfs/dbraw/zinc/52/28/73/1051522873.db2.gz YHULBRNFUQCDNE-RDGPPVDQSA-N 2 1 318.892 4.048 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(c3cccc(Cl)c3)CC1)C2 ZINC001169126101 1051523476 /nfs/dbraw/zinc/52/34/76/1051523476.db2.gz PNIYQBXCIHMKBB-BWTSREIZSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3cccc4ccccc43)CC1)C2 ZINC001169108570 1051529129 /nfs/dbraw/zinc/52/91/29/1051529129.db2.gz BMVYTNLJZLOZEB-BCDXTJNWSA-N 2 1 306.453 4.044 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139650 1051529405 /nfs/dbraw/zinc/52/94/05/1051529405.db2.gz CSVMEVIZSBYGKI-BORJPKMPSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139650 1051529415 /nfs/dbraw/zinc/52/94/15/1051529415.db2.gz CSVMEVIZSBYGKI-BORJPKMPSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139650 1051529425 /nfs/dbraw/zinc/52/94/25/1051529425.db2.gz CSVMEVIZSBYGKI-BORJPKMPSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001169139650 1051529434 /nfs/dbraw/zinc/52/94/34/1051529434.db2.gz CSVMEVIZSBYGKI-BORJPKMPSA-N 2 1 304.865 4.102 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172843042 1051530629 /nfs/dbraw/zinc/53/06/29/1051530629.db2.gz UJINZWLCCPULNQ-APIJFGDWSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172843042 1051530638 /nfs/dbraw/zinc/53/06/38/1051530638.db2.gz UJINZWLCCPULNQ-APIJFGDWSA-N 2 1 324.871 4.015 20 0 DIADMP CC1(C)C[C@@H](Nc2[nH+]ccc3cc(F)ccc32)C[C@](C)(C[NH3+])C1 ZINC001169148593 1051535056 /nfs/dbraw/zinc/53/50/56/1051535056.db2.gz XQQLPEQFLXYNRB-BEFAXECRSA-N 2 1 315.436 4.330 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155651 1051540560 /nfs/dbraw/zinc/54/05/60/1051540560.db2.gz UDCOQLOMXPTCAR-MUQADHOPSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169155651 1051540577 /nfs/dbraw/zinc/54/05/77/1051540577.db2.gz UDCOQLOMXPTCAR-MUQADHOPSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169155651 1051540589 /nfs/dbraw/zinc/54/05/89/1051540589.db2.gz UDCOQLOMXPTCAR-MUQADHOPSA-N 2 1 316.514 4.171 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC[C@H]1C[NH3+] ZINC001206004565 1051547499 /nfs/dbraw/zinc/54/74/99/1051547499.db2.gz UBGUUFWCLNVRJJ-LPHOPBHVSA-N 2 1 320.480 4.065 20 0 DIADMP CC[N@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC)CC1 ZINC001169262335 1051559090 /nfs/dbraw/zinc/55/90/90/1051559090.db2.gz YIJHZCPURMIBMJ-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC)CC1 ZINC001169262335 1051559103 /nfs/dbraw/zinc/55/91/03/1051559103.db2.gz YIJHZCPURMIBMJ-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001172877475 1051561162 /nfs/dbraw/zinc/56/11/62/1051561162.db2.gz BYALLYKADRDPNR-CYBMUJFWSA-N 2 1 324.921 4.037 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234357 1051564389 /nfs/dbraw/zinc/56/43/89/1051564389.db2.gz NULAEJDPPSRDSH-HUUCEWRRSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234357 1051564401 /nfs/dbraw/zinc/56/44/01/1051564401.db2.gz NULAEJDPPSRDSH-HUUCEWRRSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2n1)C[NH+]1CCCCC1 ZINC000178408877 1051570480 /nfs/dbraw/zinc/57/04/80/1051570480.db2.gz ASXZBIPJAGLXFX-SJORKVTESA-N 2 1 311.473 4.007 20 0 DIADMP CO[C@@H]1CCC[C@@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928451 1051574255 /nfs/dbraw/zinc/57/42/55/1051574255.db2.gz LDBAEWCSSDBUTD-UAFMIMERSA-N 2 1 322.537 4.096 20 0 DIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)CC[C@@H]1F ZINC001206185416 1051588340 /nfs/dbraw/zinc/58/83/40/1051588340.db2.gz NOFVMTCUUMSCMM-GELBITPBSA-N 2 1 324.443 4.118 20 0 DIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)CC[C@H]1F ZINC001206185417 1051588546 /nfs/dbraw/zinc/58/85/46/1051588546.db2.gz NOFVMTCUUMSCMM-IRXJPXPOSA-N 2 1 324.443 4.118 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3ccc(C)cc3C2)CC1 ZINC001173108130 1051610041 /nfs/dbraw/zinc/61/00/41/1051610041.db2.gz FBMUJIJMZVKCLA-UHFFFAOYSA-N 2 1 300.490 4.006 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2Cc3ccc(Cl)cc3C2)CC1 ZINC001173113054 1051612076 /nfs/dbraw/zinc/61/20/76/1051612076.db2.gz HKVRECJCVOMQMQ-UHFFFAOYSA-N 2 1 306.881 4.309 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](c3ccc(F)cc3)C2)CC1 ZINC001173114479 1051612224 /nfs/dbraw/zinc/61/22/24/1051612224.db2.gz MAHMAXAVUJKOHX-QHGAOEGBSA-N 2 1 318.480 4.268 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@H]2CCc3ccccc32)CC1 ZINC001173117852 1051614067 /nfs/dbraw/zinc/61/40/67/1051614067.db2.gz ZVRSXBRHZNRFMG-QLOJAFMTSA-N 2 1 300.490 4.259 20 0 DIADMP CCCC[C@@H](CC(C)C)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001173255526 1051656974 /nfs/dbraw/zinc/65/69/74/1051656974.db2.gz DUACNAIAEWZAIH-KRWDZBQOSA-N 3 1 313.574 4.067 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173268930 1051667355 /nfs/dbraw/zinc/66/73/55/1051667355.db2.gz FGBDJOIPOXOTPM-KNTRFNDTSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173268932 1051667398 /nfs/dbraw/zinc/66/73/98/1051667398.db2.gz FGBDJOIPOXOTPM-MVJPYGJCSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001173271013 1051669271 /nfs/dbraw/zinc/66/92/71/1051669271.db2.gz OYIGDZFUXCYPRE-CABCVRRESA-N 2 1 306.881 4.169 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000520949881 1051675312 /nfs/dbraw/zinc/67/53/12/1051675312.db2.gz VJYUNLGFJKDOFQ-SWVCQTRFSA-N 2 1 300.490 4.192 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293175 1051675654 /nfs/dbraw/zinc/67/56/54/1051675654.db2.gz JZCRHGJIFWHCQY-LAUBAEHRSA-N 2 1 312.501 4.088 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001173293175 1051675655 /nfs/dbraw/zinc/67/56/55/1051675655.db2.gz JZCRHGJIFWHCQY-LAUBAEHRSA-N 2 1 312.501 4.088 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc2[nH]c[nH+]c2c1C ZINC001169698626 1051677451 /nfs/dbraw/zinc/67/74/51/1051677451.db2.gz SAJMKVLCASKDKJ-OAHLLOKOSA-N 2 1 306.413 4.111 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001173296123 1051677821 /nfs/dbraw/zinc/67/78/21/1051677821.db2.gz SHTAGCZPPRCKBH-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001173296123 1051677833 /nfs/dbraw/zinc/67/78/33/1051677833.db2.gz SHTAGCZPPRCKBH-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001173296123 1051677842 /nfs/dbraw/zinc/67/78/42/1051677842.db2.gz SHTAGCZPPRCKBH-HZEGPAAWSA-N 2 1 312.501 4.019 20 0 DIADMP CCSC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001173296719 1051678024 /nfs/dbraw/zinc/67/80/24/1051678024.db2.gz VVJCLCWHLZGSKV-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP CCSC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001173296719 1051678029 /nfs/dbraw/zinc/67/80/29/1051678029.db2.gz VVJCLCWHLZGSKV-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1[nH+]ccc(N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1Cl ZINC000494020514 1051680132 /nfs/dbraw/zinc/68/01/32/1051680132.db2.gz NGRKJSSKHTYIGZ-GOEBONIOSA-N 2 1 321.896 4.134 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001173280688 1051685997 /nfs/dbraw/zinc/68/59/97/1051685997.db2.gz PMNPSKCCMGGLFM-HKUYNNGSSA-N 2 1 316.489 4.146 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC001173289056 1051691197 /nfs/dbraw/zinc/69/11/97/1051691197.db2.gz QMLZBVBLCAEJNM-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC001169782266 1051698803 /nfs/dbraw/zinc/69/88/03/1051698803.db2.gz YODJUSOFXBPDJS-KRWDZBQOSA-N 2 1 312.501 4.044 20 0 DIADMP c1[nH+]cn([C@@H]2CCCC3(CCCCC3)C2)c1C1CC[NH2+]CC1 ZINC001173347806 1051707367 /nfs/dbraw/zinc/70/73/67/1051707367.db2.gz AVCQYBIIUIDECV-QGZVFWFLSA-N 2 1 301.478 4.416 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(F)c1F ZINC000183191949 1051709640 /nfs/dbraw/zinc/70/96/40/1051709640.db2.gz PYHXALBEYGXWMO-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc(F)c1F ZINC000183191949 1051709655 /nfs/dbraw/zinc/70/96/55/1051709655.db2.gz PYHXALBEYGXWMO-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP Cc1ccccc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183183580 1051710116 /nfs/dbraw/zinc/71/01/16/1051710116.db2.gz GRFNZKPMNHBKLH-OKZBNKHCSA-N 2 1 300.490 4.299 20 0 DIADMP CCSc1cccc(C[NH2+]C2CC[NH+](CC(C)C)CC2)c1 ZINC000185461616 1051769176 /nfs/dbraw/zinc/76/91/76/1051769176.db2.gz VIEGOOAYASEAAH-UHFFFAOYSA-N 2 1 306.519 4.009 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000219149596 1051773662 /nfs/dbraw/zinc/77/36/62/1051773662.db2.gz KAVCKJKOFGZWPI-ZDUSSCGKSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000219149596 1051773676 /nfs/dbraw/zinc/77/36/76/1051773676.db2.gz KAVCKJKOFGZWPI-ZDUSSCGKSA-N 2 1 302.384 4.086 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c1 ZINC001206211681 1051786651 /nfs/dbraw/zinc/78/66/51/1051786651.db2.gz OQOCJOPXISNIHC-SJORKVTESA-N 2 1 312.498 4.132 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cs1 ZINC000186248589 1051803035 /nfs/dbraw/zinc/80/30/35/1051803035.db2.gz LMZZUKLXGOUZKK-HOTGVXAUSA-N 2 1 323.550 4.429 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186283096 1051804823 /nfs/dbraw/zinc/80/48/23/1051804823.db2.gz PJIMSYDLCKBJJH-SOUVJXGZSA-N 2 1 322.518 4.060 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186283096 1051804830 /nfs/dbraw/zinc/80/48/30/1051804830.db2.gz PJIMSYDLCKBJJH-SOUVJXGZSA-N 2 1 322.518 4.060 20 0 DIADMP CSc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000768169192 1051891981 /nfs/dbraw/zinc/89/19/81/1051891981.db2.gz RRZGTFHGAOBJEA-UHFFFAOYSA-N 2 1 314.498 4.102 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000494482460 1051903450 /nfs/dbraw/zinc/90/34/50/1051903450.db2.gz FLAMDMBONKAALO-KBXCAEBGSA-N 2 1 306.519 4.189 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(Cl)cs1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206611 1052034157 /nfs/dbraw/zinc/03/41/57/1052034157.db2.gz ADJKPMGGYUXKKA-CHWSQXEVSA-N 2 1 312.910 4.144 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000195139621 1052037177 /nfs/dbraw/zinc/03/71/77/1052037177.db2.gz LOGPTBMMDQRVDR-SJLPKXTDSA-N 2 1 312.457 4.015 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000195139621 1052037183 /nfs/dbraw/zinc/03/71/83/1052037183.db2.gz LOGPTBMMDQRVDR-SJLPKXTDSA-N 2 1 312.457 4.015 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2-c2ccccc2)C1 ZINC000769517208 1052073140 /nfs/dbraw/zinc/07/31/40/1052073140.db2.gz ZYIGEKBLQCKZAS-SFHVURJKSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2-c2ccccc2)C1 ZINC000769517208 1052073143 /nfs/dbraw/zinc/07/31/43/1052073143.db2.gz ZYIGEKBLQCKZAS-SFHVURJKSA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC000769517208 1052073157 /nfs/dbraw/zinc/07/31/57/1052073157.db2.gz ZYIGEKBLQCKZAS-SFHVURJKSA-N 2 1 308.469 4.127 20 0 DIADMP CCCCC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)C(C)(C)C ZINC000808696462 1052084413 /nfs/dbraw/zinc/08/44/13/1052084413.db2.gz UQYNAKBAGDNSCS-RTBURBONSA-N 2 1 324.553 4.214 20 0 DIADMP c1csc(C([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2cccs2)c1 ZINC000227321350 1052139527 /nfs/dbraw/zinc/13/95/27/1052139527.db2.gz LJRWLUGKJRTZSQ-KBPBESRZSA-N 2 1 318.511 4.115 20 0 DIADMP c1csc(C([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2cccs2)c1 ZINC000227321350 1052139537 /nfs/dbraw/zinc/13/95/37/1052139537.db2.gz LJRWLUGKJRTZSQ-KBPBESRZSA-N 2 1 318.511 4.115 20 0 DIADMP CCCCC[C@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218224397 1052210098 /nfs/dbraw/zinc/21/00/98/1052210098.db2.gz XOIDVZXFDMGOBD-IBGZPJMESA-N 2 1 318.505 4.347 20 0 DIADMP CCC[C@@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)C(C)(C)C ZINC001218293622 1052218859 /nfs/dbraw/zinc/21/88/59/1052218859.db2.gz KQVQYYVCHDQTJO-LJQANCHMSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218294186 1052218965 /nfs/dbraw/zinc/21/89/65/1052218965.db2.gz ISMVKRQIKPYYAM-VQIMIIECSA-N 2 1 318.505 4.203 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccc(OC3CCCCCCC3)cc2)CC1 ZINC001218352102 1052229292 /nfs/dbraw/zinc/22/92/92/1052229292.db2.gz AMJPLNJFZFIMHD-UHFFFAOYSA-N 2 1 316.489 4.101 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309720344 1052235640 /nfs/dbraw/zinc/23/56/40/1052235640.db2.gz MCDYVACTNWIJOC-GIVPXCGWSA-N 2 1 314.517 4.457 20 0 DIADMP CCC[C@@H](C)[C@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218438290 1052238649 /nfs/dbraw/zinc/23/86/49/1052238649.db2.gz IRPRMWYCDJJVTR-UZLBHIALSA-N 2 1 318.505 4.203 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)c1csc(Cl)c1)C[NH+]1CCCCC1 ZINC000230408189 1052268493 /nfs/dbraw/zinc/26/84/93/1052268493.db2.gz QVHCQNLKTJEZRO-OLZOCXBDSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCSC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000089516532 1052380096 /nfs/dbraw/zinc/38/00/96/1052380096.db2.gz FZOYZDGJDJLURK-FUHWJXTLSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCSC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000089516532 1052380104 /nfs/dbraw/zinc/38/01/04/1052380104.db2.gz FZOYZDGJDJLURK-FUHWJXTLSA-N 2 1 320.546 4.161 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)C1CCCCC1 ZINC000237094967 1052434433 /nfs/dbraw/zinc/43/44/33/1052434433.db2.gz GSLRCAAMJXXRDJ-HUUCEWRRSA-N 2 1 320.443 4.352 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000237518633 1052441151 /nfs/dbraw/zinc/44/11/51/1052441151.db2.gz LZAPXWNFDABRAV-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1CCC[C@@](C[NH2+]C2CCC(C(F)(F)F)CC2)([NH+](C)C)C1 ZINC000237529182 1052441993 /nfs/dbraw/zinc/44/19/93/1052441993.db2.gz FHZOBGMWGZCSCZ-SLTXQBBLSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccc(C)cc2)o1 ZINC000237578808 1052443393 /nfs/dbraw/zinc/44/33/93/1052443393.db2.gz YVWXYPGGAXNUGE-MRXNPFEDSA-N 2 1 323.440 4.186 20 0 DIADMP C[C@@H]1CCC[C@@](C[NH2+]C2CCC(C(F)(F)F)CC2)([NH+](C)C)C1 ZINC000237598111 1052443448 /nfs/dbraw/zinc/44/34/48/1052443448.db2.gz FHZOBGMWGZCSCZ-PRLABOORSA-N 2 1 320.443 4.208 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC001222147961 1052450424 /nfs/dbraw/zinc/45/04/24/1052450424.db2.gz GFAGUAHGTWQMPF-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC001222147961 1052450428 /nfs/dbraw/zinc/45/04/28/1052450428.db2.gz GFAGUAHGTWQMPF-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP Clc1sc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc12 ZINC001222153959 1052451543 /nfs/dbraw/zinc/45/15/43/1052451543.db2.gz DOBSAFSEFUSQDP-KRWDZBQOSA-N 2 1 320.889 4.130 20 0 DIADMP Clc1sc(C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc12 ZINC001222153959 1052451544 /nfs/dbraw/zinc/45/15/44/1052451544.db2.gz DOBSAFSEFUSQDP-KRWDZBQOSA-N 2 1 320.889 4.130 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1)c1ccccc1 ZINC001222153913 1052451633 /nfs/dbraw/zinc/45/16/33/1052451633.db2.gz CNUUYWPEPBFTIR-QUCCMNQESA-N 2 1 300.490 4.036 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)o1 ZINC001222155295 1052453082 /nfs/dbraw/zinc/45/30/82/1052453082.db2.gz ZNJLPPPSSPPUTO-FXAWDEMLSA-N 2 1 318.505 4.327 20 0 DIADMP Fc1cccc(CCC[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222155191 1052453164 /nfs/dbraw/zinc/45/31/64/1052453164.db2.gz XLQNTXBCGCTVIN-FQEVSTJZSA-N 2 1 318.480 4.004 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)o1 ZINC001222171408 1052455971 /nfs/dbraw/zinc/45/59/71/1052455971.db2.gz BGSUPFOVLFUVDV-HXUWFJFHSA-N 2 1 312.457 4.179 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@]12CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222231622 1052464957 /nfs/dbraw/zinc/46/49/57/1052464957.db2.gz OJYMUIRFRWGWPX-UTKZUKDTSA-N 2 1 308.469 4.161 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222258459 1052470317 /nfs/dbraw/zinc/47/03/17/1052470317.db2.gz ATBAEWFOXMGRRK-ICSRJNTNSA-N 2 1 324.553 4.074 20 0 DIADMP C1C[C@H]2C[C@@H]([NH2+][C@H]3CCCC[C@H]3C3CCCCC3)CC[N@H+]2C1 ZINC000316720166 1052471604 /nfs/dbraw/zinc/47/16/04/1052471604.db2.gz FISYUDXQHLSSMH-MUGJNUQGSA-N 2 1 304.522 4.342 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CCC[C@]3(CC[NH2+]3)C2)CC1 ZINC001222277645 1052472339 /nfs/dbraw/zinc/47/23/39/1052472339.db2.gz QCOVHRHAELKHNQ-UXHICEINSA-N 2 1 302.506 4.287 20 0 DIADMP c1sc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1-c1ccccc1 ZINC000317107812 1052480282 /nfs/dbraw/zinc/48/02/82/1052480282.db2.gz BWDLMYCTEOWNAX-ROUUACIJSA-N 2 1 312.482 4.132 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222315835 1052480685 /nfs/dbraw/zinc/48/06/85/1052480685.db2.gz PJWUVLUBXIDNSZ-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001222315931 1052480755 /nfs/dbraw/zinc/48/07/55/1052480755.db2.gz RJZQSXMYDWFTKZ-HXUWFJFHSA-N 2 1 300.490 4.137 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001222316464 1052480806 /nfs/dbraw/zinc/48/08/06/1052480806.db2.gz WNCWIFJDUCSOFG-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP CCc1cc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)ccc1Cl ZINC001222320337 1052481990 /nfs/dbraw/zinc/48/19/90/1052481990.db2.gz GVUFLOGRRIRHSA-SFHVURJKSA-N 2 1 306.881 4.011 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)s1 ZINC001222320176 1052482013 /nfs/dbraw/zinc/48/20/13/1052482013.db2.gz CEUCXNNDGFWWKG-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320532 1052482103 /nfs/dbraw/zinc/48/21/03/1052482103.db2.gz JEPMTRLLBCLGLM-KRWDZBQOSA-N 2 1 324.921 4.170 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c(C)c1Cl ZINC001222326305 1052484015 /nfs/dbraw/zinc/48/40/15/1052484015.db2.gz UJCHQAZUTWCTBE-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)C2)cc1 ZINC001222353825 1052490190 /nfs/dbraw/zinc/49/01/90/1052490190.db2.gz IJFHGPQJBZDGCO-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)cc1 ZINC001222353825 1052490194 /nfs/dbraw/zinc/49/01/94/1052490194.db2.gz IJFHGPQJBZDGCO-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222426340 1052499260 /nfs/dbraw/zinc/49/92/60/1052499260.db2.gz AXQXDIBCWGXZDI-NRFANRHFSA-N 2 1 320.436 4.304 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222426340 1052499264 /nfs/dbraw/zinc/49/92/64/1052499264.db2.gz AXQXDIBCWGXZDI-NRFANRHFSA-N 2 1 320.436 4.304 20 0 DIADMP CC1=CC[C@@H](CC[N@H+]2C[C@@H](c3ccccc3)C3(C[NH2+]C3)C2)C1(C)C ZINC001222596051 1052515497 /nfs/dbraw/zinc/51/54/97/1052515497.db2.gz PCLLSASAVMSCOZ-PMACEKPBSA-N 2 1 324.512 4.058 20 0 DIADMP CC/C=C\CCCCC[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222596219 1052515613 /nfs/dbraw/zinc/51/56/13/1052515613.db2.gz SKMOSNFUBYEDJB-XQQSMPNESA-N 2 1 312.501 4.202 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)s1 ZINC001222629474 1052520295 /nfs/dbraw/zinc/52/02/95/1052520295.db2.gz IROFEBNCTNBJKU-CALCHBBNSA-N 2 1 320.546 4.302 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cccc(Oc2ccccc2)c1 ZINC000320557747 1052531596 /nfs/dbraw/zinc/53/15/96/1052531596.db2.gz JQKZJNOVGIWZOH-SJLPKXTDSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C/C=C/c1ccccc1 ZINC000398007161 1052561884 /nfs/dbraw/zinc/56/18/84/1052561884.db2.gz ZSOFFMWZFURAKI-RMFZZGRPSA-N 2 1 320.480 4.200 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)s2)CC1 ZINC000037150209 1052605795 /nfs/dbraw/zinc/60/57/95/1052605795.db2.gz QFVDVRPTHJLPGY-GFCCVEGCSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(F)c(Cl)c1 ZINC000037786522 1052629319 /nfs/dbraw/zinc/62/93/19/1052629319.db2.gz MDRYYYIEMHRYAH-GFCCVEGCSA-N 2 1 312.860 4.393 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2sc(C(C)(C)C)nc2C)CC1 ZINC000124127316 1052637242 /nfs/dbraw/zinc/63/72/42/1052637242.db2.gz SBLGCHHZJGKQHI-ZDUSSCGKSA-N 2 1 323.550 4.274 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)C(c2ccccc2)c2ccccc2)C1 ZINC000124154637 1052637701 /nfs/dbraw/zinc/63/77/01/1052637701.db2.gz BPGPHKLBTWVOKX-OALUTQOASA-N 2 1 322.496 4.138 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CCN([C@H](C)c3ccccc3)CC2)o1 ZINC000125189237 1052645758 /nfs/dbraw/zinc/64/57/58/1052645758.db2.gz WNQQIDAUMYKLMZ-IAGOWNOFSA-N 2 1 312.457 4.464 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)o1 ZINC000125189006 1052645981 /nfs/dbraw/zinc/64/59/81/1052645981.db2.gz WNQQIDAUMYKLMZ-IRXDYDNUSA-N 2 1 312.457 4.464 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccco1)C1CCCC1 ZINC000125474339 1052649216 /nfs/dbraw/zinc/64/92/16/1052649216.db2.gz LOKBSLCBPKAVDX-UHFFFAOYSA-N 2 1 301.434 4.010 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000125474339 1052649218 /nfs/dbraw/zinc/64/92/18/1052649218.db2.gz LOKBSLCBPKAVDX-UHFFFAOYSA-N 2 1 301.434 4.010 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2ccccc2C)C[C@@H]1C ZINC000125523646 1052649674 /nfs/dbraw/zinc/64/96/74/1052649674.db2.gz MJMCVVVXVYOVON-HKUYNNGSSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2ccccc2C)C[C@@H]1C ZINC000125523646 1052649680 /nfs/dbraw/zinc/64/96/80/1052649680.db2.gz MJMCVVVXVYOVON-HKUYNNGSSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000125772973 1052653345 /nfs/dbraw/zinc/65/33/45/1052653345.db2.gz GDSJLRYJLJBNGX-ZBFHGGJFSA-N 2 1 323.550 4.346 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000126183540 1052667185 /nfs/dbraw/zinc/66/71/85/1052667185.db2.gz PLTFQICXSWCXHF-FQEVSTJZSA-N 2 1 309.457 4.124 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000126183540 1052667188 /nfs/dbraw/zinc/66/71/88/1052667188.db2.gz PLTFQICXSWCXHF-FQEVSTJZSA-N 2 1 309.457 4.124 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000126665963 1052674089 /nfs/dbraw/zinc/67/40/89/1052674089.db2.gz YQOWHYFYFKIZEU-RTBURBONSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000126665963 1052674090 /nfs/dbraw/zinc/67/40/90/1052674090.db2.gz YQOWHYFYFKIZEU-RTBURBONSA-N 2 1 322.452 4.195 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccs1 ZINC000126796849 1052678350 /nfs/dbraw/zinc/67/83/50/1052678350.db2.gz VDZDYDCDDAHTDK-GJZGRUSLSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccs1 ZINC000126796849 1052678352 /nfs/dbraw/zinc/67/83/52/1052678352.db2.gz VDZDYDCDDAHTDK-GJZGRUSLSA-N 2 1 320.527 4.372 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2Cl)c1 ZINC000065976592 1052683788 /nfs/dbraw/zinc/68/37/88/1052683788.db2.gz GUYRSWSHCBINFU-UHFFFAOYSA-N 2 1 316.876 4.470 20 0 DIADMP CC[N@@H+](CCCn1ccnc1C)[C@@H](C)c1cc2ccccc2o1 ZINC000127315820 1052692634 /nfs/dbraw/zinc/69/26/34/1052692634.db2.gz VABNKWUUESWMKC-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP CC[N@H+](CCCn1cc[nH+]c1C)[C@@H](C)c1cc2ccccc2o1 ZINC000127315820 1052692637 /nfs/dbraw/zinc/69/26/37/1052692637.db2.gz VABNKWUUESWMKC-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP CC[N@@H+](CCCn1cc[nH+]c1C)[C@@H](C)c1cc2ccccc2o1 ZINC000127315820 1052692639 /nfs/dbraw/zinc/69/26/39/1052692639.db2.gz VABNKWUUESWMKC-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@@H](C)c3cccc(C)c3C)CC2)[nH+]1 ZINC000128098648 1052708698 /nfs/dbraw/zinc/70/86/98/1052708698.db2.gz NDXRXNMRLGMVJO-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CCC(C)(C)C ZINC000540044767 1052752618 /nfs/dbraw/zinc/75/26/18/1052752618.db2.gz LIUPIWGEUULCBU-UHFFFAOYSA-N 2 1 303.494 4.056 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129455975 1052790102 /nfs/dbraw/zinc/79/01/02/1052790102.db2.gz YAHRNOVUEBQUGZ-IRXDYDNUSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129455975 1052790109 /nfs/dbraw/zinc/79/01/09/1052790109.db2.gz YAHRNOVUEBQUGZ-IRXDYDNUSA-N 2 1 314.498 4.311 20 0 DIADMP CCc1ccccc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556093422 1052796951 /nfs/dbraw/zinc/79/69/51/1052796951.db2.gz IBTXPRGPUNBIHW-RTWAWAEBSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556093422 1052796954 /nfs/dbraw/zinc/79/69/54/1052796954.db2.gz IBTXPRGPUNBIHW-RTWAWAEBSA-N 2 1 308.469 4.174 20 0 DIADMP C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129624681 1052798407 /nfs/dbraw/zinc/79/84/07/1052798407.db2.gz NMYBCUXBSCIRSZ-GMXVVIOVSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000129624681 1052798412 /nfs/dbraw/zinc/79/84/12/1052798412.db2.gz NMYBCUXBSCIRSZ-GMXVVIOVSA-N 2 1 301.261 4.127 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C[C@@H]1c1ccccc1 ZINC000556178513 1052816958 /nfs/dbraw/zinc/81/69/58/1052816958.db2.gz IVTMBPWIYSDJQE-RYQLBKOJSA-N 2 1 322.443 4.237 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCCC(F)(F)C2)C[C@@H]1c1ccccc1 ZINC000556178513 1052816962 /nfs/dbraw/zinc/81/69/62/1052816962.db2.gz IVTMBPWIYSDJQE-RYQLBKOJSA-N 2 1 322.443 4.237 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)CC[N@@H+]1C ZINC000498353583 1052820429 /nfs/dbraw/zinc/82/04/29/1052820429.db2.gz MXWPZAVTOQPQHD-GSEOLPGOSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)CC[N@H+]1C ZINC000498353583 1052820432 /nfs/dbraw/zinc/82/04/32/1052820432.db2.gz MXWPZAVTOQPQHD-GSEOLPGOSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCCCF)CC[N@@H+]1Cc1ccccc1 ZINC000556497898 1052857125 /nfs/dbraw/zinc/85/71/25/1052857125.db2.gz QVMATDIHKAZPBJ-HKUYNNGSSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCCCF)CC[N@H+]1Cc1ccccc1 ZINC000556497898 1052857131 /nfs/dbraw/zinc/85/71/31/1052857131.db2.gz QVMATDIHKAZPBJ-HKUYNNGSSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497898 1052857137 /nfs/dbraw/zinc/85/71/37/1052857137.db2.gz QVMATDIHKAZPBJ-HKUYNNGSSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497898 1052857143 /nfs/dbraw/zinc/85/71/43/1052857143.db2.gz QVMATDIHKAZPBJ-HKUYNNGSSA-N 2 1 306.469 4.111 20 0 DIADMP COCC[N@H+](C)CC[C@H]([NH2+]C1CCCCCC1)c1ccccc1 ZINC000556769223 1052880853 /nfs/dbraw/zinc/88/08/53/1052880853.db2.gz MYAKUADMOHHWJT-FQEVSTJZSA-N 2 1 318.505 4.008 20 0 DIADMP COCC[N@@H+](C)CC[C@H]([NH2+]C1CCCCCC1)c1ccccc1 ZINC000556769223 1052880859 /nfs/dbraw/zinc/88/08/59/1052880859.db2.gz MYAKUADMOHHWJT-FQEVSTJZSA-N 2 1 318.505 4.008 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000556817979 1052886890 /nfs/dbraw/zinc/88/68/90/1052886890.db2.gz WNGBYFBDFIWBPB-DLBZAZTESA-N 2 1 304.503 4.049 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000556817979 1052886894 /nfs/dbraw/zinc/88/68/94/1052886894.db2.gz WNGBYFBDFIWBPB-DLBZAZTESA-N 2 1 304.503 4.049 20 0 DIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888111 1052894705 /nfs/dbraw/zinc/89/47/05/1052894705.db2.gz XUDOVFDKOBDXOD-FQEVSTJZSA-N 2 1 323.484 4.055 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888111 1052894710 /nfs/dbraw/zinc/89/47/10/1052894710.db2.gz XUDOVFDKOBDXOD-FQEVSTJZSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888111 1052894712 /nfs/dbraw/zinc/89/47/12/1052894712.db2.gz XUDOVFDKOBDXOD-FQEVSTJZSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(-c2ccccn2)c1 ZINC000556888111 1052894717 /nfs/dbraw/zinc/89/47/17/1052894717.db2.gz XUDOVFDKOBDXOD-FQEVSTJZSA-N 2 1 323.484 4.055 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)cc2)cc1 ZINC001226786207 1052931290 /nfs/dbraw/zinc/93/12/90/1052931290.db2.gz XIJNERCGLXITCH-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC000518946913 1053105662 /nfs/dbraw/zinc/10/56/62/1053105662.db2.gz AAVZKRKQAHQMJJ-ZJXIFLPPSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC000518946913 1053105665 /nfs/dbraw/zinc/10/56/65/1053105665.db2.gz AAVZKRKQAHQMJJ-ZJXIFLPPSA-N 2 1 300.490 4.236 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC001319192154 1053226541 /nfs/dbraw/zinc/22/65/41/1053226541.db2.gz JHMVAZGRDBBMRR-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC001319199192 1053227139 /nfs/dbraw/zinc/22/71/39/1053227139.db2.gz RWBAVNCFVXETBV-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC001319199192 1053227152 /nfs/dbraw/zinc/22/71/52/1053227152.db2.gz RWBAVNCFVXETBV-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC001319199013 1053227555 /nfs/dbraw/zinc/22/75/55/1053227555.db2.gz LSXLBOYEXKSXIR-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000251346831 1053230978 /nfs/dbraw/zinc/23/09/78/1053230978.db2.gz RFVKPFMWTCYWAR-SQNIBIBYSA-N 2 1 306.881 4.254 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccccn1 ZINC000090586181 1053237974 /nfs/dbraw/zinc/23/79/74/1053237974.db2.gz CCSSGXPPWSOLKS-UYAOXDASSA-N 2 1 317.521 4.126 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccn1 ZINC000090586181 1053237982 /nfs/dbraw/zinc/23/79/82/1053237982.db2.gz CCSSGXPPWSOLKS-UYAOXDASSA-N 2 1 317.521 4.126 20 0 DIADMP Fc1ccccc1[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284497 1053257516 /nfs/dbraw/zinc/25/75/16/1053257516.db2.gz BRYRWVVKLAVWFK-MGPUTAFESA-N 2 1 316.464 4.131 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1Cl ZINC000091268690 1053259045 /nfs/dbraw/zinc/25/90/45/1053259045.db2.gz LNKQLOQAARTIBQ-GOSISDBHSA-N 2 1 306.881 4.254 20 0 DIADMP Fc1ccccc1[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284499 1053259415 /nfs/dbraw/zinc/25/94/15/1053259415.db2.gz BRYRWVVKLAVWFK-FOIQADDNSA-N 2 1 316.464 4.131 20 0 DIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC)C1 ZINC001319754871 1053270921 /nfs/dbraw/zinc/27/09/21/1053270921.db2.gz MHQUVRYSBUOFOP-HUUCEWRRSA-N 2 1 324.896 4.121 20 0 DIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC)C1 ZINC001319754871 1053270925 /nfs/dbraw/zinc/27/09/25/1053270925.db2.gz MHQUVRYSBUOFOP-HUUCEWRRSA-N 2 1 324.896 4.121 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC001319756501 1053272413 /nfs/dbraw/zinc/27/24/13/1053272413.db2.gz XRFICXOHMJYUCX-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC001319935721 1053286393 /nfs/dbraw/zinc/28/63/93/1053286393.db2.gz XBAIRLYDMIBYGI-LPHOPBHVSA-N 2 1 304.478 4.141 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](c2ccc(C)o2)C2CCCC2)C1 ZINC001319935720 1053286521 /nfs/dbraw/zinc/28/65/21/1053286521.db2.gz XBAIRLYDMIBYGI-APWZRJJASA-N 2 1 304.478 4.141 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(CC(C)C)cc1)C(C)C ZINC000618481584 1053312380 /nfs/dbraw/zinc/31/23/80/1053312380.db2.gz PCNYZNZOXUXZDS-FQEVSTJZSA-N 2 1 313.489 4.377 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867433 1053368406 /nfs/dbraw/zinc/36/84/06/1053368406.db2.gz VWFRUJPPQMXVJM-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)C1 ZINC001320867433 1053368425 /nfs/dbraw/zinc/36/84/25/1053368425.db2.gz VWFRUJPPQMXVJM-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CCCC[C@H]2[NH+](C)C)C1 ZINC001200089768 1053371537 /nfs/dbraw/zinc/37/15/37/1053371537.db2.gz XQMITNYCYHLMHB-JOZSIVFUSA-N 2 1 314.517 4.421 20 0 DIADMP CC1(C)CC[N@@H+](Cc2cccc(CC3CCC3)c2)CC(C)(C)[NH2+]1 ZINC001474755884 1053395508 /nfs/dbraw/zinc/39/55/08/1053395508.db2.gz ULZNMWQWCNBALW-UHFFFAOYSA-N 2 1 314.517 4.382 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](CNCc2cc(Cl)ccc2Cl)C1 ZINC001200243993 1053493580 /nfs/dbraw/zinc/49/35/80/1053493580.db2.gz OTUQFUUSTVSSQM-CYBMUJFWSA-N 2 1 315.288 4.203 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC001200255938 1053503358 /nfs/dbraw/zinc/50/33/58/1053503358.db2.gz RSZBMIMBIBFSIT-OAHLLOKOSA-N 2 1 308.897 4.112 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC001200255938 1053503371 /nfs/dbraw/zinc/50/33/71/1053503371.db2.gz RSZBMIMBIBFSIT-OAHLLOKOSA-N 2 1 308.897 4.112 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472759 1053582172 /nfs/dbraw/zinc/58/21/72/1053582172.db2.gz PIUKASJHJYUCAU-KGLIPLIRSA-N 2 1 320.864 4.469 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)C1 ZINC001323472759 1053582177 /nfs/dbraw/zinc/58/21/77/1053582177.db2.gz PIUKASJHJYUCAU-KGLIPLIRSA-N 2 1 320.864 4.469 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940094 1053614130 /nfs/dbraw/zinc/61/41/30/1053614130.db2.gz DRRRXPZZGJNKFE-BBRMVZONSA-N 2 1 312.860 4.252 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC)C1)c1cccc(Cl)c1F ZINC001323940094 1053614139 /nfs/dbraw/zinc/61/41/39/1053614139.db2.gz DRRRXPZZGJNKFE-BBRMVZONSA-N 2 1 312.860 4.252 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](c2cccs2)C2CCCC2)C1 ZINC001324836079 1053682616 /nfs/dbraw/zinc/68/26/16/1053682616.db2.gz VIWRWXOQUIBGGW-QAPCUYQASA-N 2 1 306.519 4.301 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)c3ccccc32)C1 ZINC001324963999 1053691540 /nfs/dbraw/zinc/69/15/40/1053691540.db2.gz DOTDMLJJHWRRTN-CVEARBPZSA-N 2 1 314.448 4.361 20 0 DIADMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000153703813 1053707890 /nfs/dbraw/zinc/70/78/90/1053707890.db2.gz CEPNNUXEQWWARV-JKSUJKDBSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCCC(F)(F)F)C1 ZINC000153703813 1053707901 /nfs/dbraw/zinc/70/79/01/1053707901.db2.gz CEPNNUXEQWWARV-JKSUJKDBSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCCC(F)(F)F)C1 ZINC000153703813 1053707911 /nfs/dbraw/zinc/70/79/11/1053707911.db2.gz CEPNNUXEQWWARV-JKSUJKDBSA-N 2 1 320.443 4.305 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000153703813 1053707922 /nfs/dbraw/zinc/70/79/22/1053707922.db2.gz CEPNNUXEQWWARV-JKSUJKDBSA-N 2 1 320.443 4.305 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(C)c(Cl)c2)CC1 ZINC001231424923 1053749661 /nfs/dbraw/zinc/74/96/61/1053749661.db2.gz KMLMSNUZFQZYAI-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(C)c(Cl)c2)CC1 ZINC001231424923 1053749675 /nfs/dbraw/zinc/74/96/75/1053749675.db2.gz KMLMSNUZFQZYAI-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(c3cccs3)CCCCC2)CC[N@H+]1C ZINC000155177729 1053766872 /nfs/dbraw/zinc/76/68/72/1053766872.db2.gz ORXMZOAGVQEWDI-JKSUJKDBSA-N 2 1 306.519 4.022 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3cccs3)CCCCC2)CC[N@H+]1C ZINC000155177811 1053767818 /nfs/dbraw/zinc/76/78/18/1053767818.db2.gz ORXMZOAGVQEWDI-CVEARBPZSA-N 2 1 306.519 4.022 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+](C)CC2CC[NH+](C)CC2)c(C)c1C ZINC001231494020 1053768509 /nfs/dbraw/zinc/76/85/09/1053768509.db2.gz RFXSYXYILPAZQZ-UHFFFAOYSA-N 2 1 302.506 4.002 20 0 DIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1csc(C)n1 ZINC000269419498 1053780343 /nfs/dbraw/zinc/78/03/43/1053780343.db2.gz LJIQMULGKSDSSL-CQSZACIVSA-N 2 1 317.502 4.144 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccco1 ZINC000155774069 1053786020 /nfs/dbraw/zinc/78/60/20/1053786020.db2.gz CKHFNKNBCVPSDI-IRXDYDNUSA-N 2 1 312.457 4.362 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CCC4(C3)CC[NH+](C)CC4)cc2)o1 ZINC001231597975 1053796889 /nfs/dbraw/zinc/79/68/89/1053796889.db2.gz RECCWZRSTNBFIQ-UHFFFAOYSA-N 2 1 324.468 4.173 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2cc(C(C)C)c(OC)cc2C)CC1 ZINC001231625896 1053805115 /nfs/dbraw/zinc/80/51/15/1053805115.db2.gz FRYWSNXOUXSYFL-UHFFFAOYSA-N 2 1 318.505 4.043 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2cc(C(C)C)c(OC)cc2C)CC1 ZINC001231625896 1053805131 /nfs/dbraw/zinc/80/51/31/1053805131.db2.gz FRYWSNXOUXSYFL-UHFFFAOYSA-N 2 1 318.505 4.043 20 0 DIADMP CSc1ccccc1C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001231785299 1053856955 /nfs/dbraw/zinc/85/69/55/1053856955.db2.gz KIKMJEMMODFBBM-SFHVURJKSA-N 2 1 318.530 4.249 20 0 DIADMP CSc1ccccc1C[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001231785856 1053857476 /nfs/dbraw/zinc/85/74/76/1053857476.db2.gz JYDJCRIZFOUJQU-ZWKOTPCHSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccccc1C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001231785856 1053857491 /nfs/dbraw/zinc/85/74/91/1053857491.db2.gz JYDJCRIZFOUJQU-ZWKOTPCHSA-N 2 1 318.530 4.247 20 0 DIADMP CSc1ccccc1C[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001231785856 1053857509 /nfs/dbraw/zinc/85/75/09/1053857509.db2.gz JYDJCRIZFOUJQU-ZWKOTPCHSA-N 2 1 318.530 4.247 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001231809240 1053869940 /nfs/dbraw/zinc/86/99/40/1053869940.db2.gz JRZVHWQFOWLEFH-DENIHFKCSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@H+](C)C3)oc2cc1C ZINC000158125935 1053890611 /nfs/dbraw/zinc/89/06/11/1053890611.db2.gz HOOADDUIVDWCKV-HOTGVXAUSA-N 2 1 300.446 4.042 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@@H+](C)C3)oc2cc1C ZINC000158125935 1053890626 /nfs/dbraw/zinc/89/06/26/1053890626.db2.gz HOOADDUIVDWCKV-HOTGVXAUSA-N 2 1 300.446 4.042 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@H+](C)C3)oc2cc1C ZINC000158126194 1053891112 /nfs/dbraw/zinc/89/11/12/1053891112.db2.gz HOOADDUIVDWCKV-JKSUJKDBSA-N 2 1 300.446 4.042 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+]C[C@H]3CCC[N@@H+](C)C3)oc2cc1C ZINC000158126194 1053891124 /nfs/dbraw/zinc/89/11/24/1053891124.db2.gz HOOADDUIVDWCKV-JKSUJKDBSA-N 2 1 300.446 4.042 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000158653198 1053914327 /nfs/dbraw/zinc/91/43/27/1053914327.db2.gz MYVMAZZHXTXNSV-ZWKOTPCHSA-N 2 1 303.494 4.167 20 0 DIADMP C[N@@H+](Cc1cc2c[nH+]ccc2[nH]1)Cc1ccccc1C(F)(F)F ZINC001232014406 1053941130 /nfs/dbraw/zinc/94/11/30/1053941130.db2.gz PEXVUDXVZPIUAY-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232018852 1053942542 /nfs/dbraw/zinc/94/25/42/1053942542.db2.gz PHOHIWYMVJKXKU-IBGZPJMESA-N 2 1 321.424 4.046 20 0 DIADMP CCC[C@@H](C(=O)c1ccccc1)[N@@H+](C)Cc1cc2c[nH+]ccc2[nH]1 ZINC001232018852 1053942555 /nfs/dbraw/zinc/94/25/55/1053942555.db2.gz PHOHIWYMVJKXKU-IBGZPJMESA-N 2 1 321.424 4.046 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCCC3(CCCC3)C2)c1 ZINC001232143852 1053970653 /nfs/dbraw/zinc/97/06/53/1053970653.db2.gz DDURBZSMBQTVPK-UHFFFAOYSA-N 2 1 304.453 4.044 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1nccc2ccccc21 ZINC001232252715 1054007384 /nfs/dbraw/zinc/00/73/84/1054007384.db2.gz YCFPXBISOCYBBW-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1nccc2ccccc21 ZINC001232252715 1054007399 /nfs/dbraw/zinc/00/73/99/1054007399.db2.gz YCFPXBISOCYBBW-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1nccc2ccccc21 ZINC001232252715 1054007412 /nfs/dbraw/zinc/00/74/12/1054007412.db2.gz YCFPXBISOCYBBW-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP C(C1CCCC1)[N@@H+]1CC[C@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001200837553 1054025370 /nfs/dbraw/zinc/02/53/70/1054025370.db2.gz BWSYNLYFYCPDFH-IBGZPJMESA-N 2 1 304.522 4.344 20 0 DIADMP C(C1CCCC1)[N@H+]1CC[C@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001200837553 1054025385 /nfs/dbraw/zinc/02/53/85/1054025385.db2.gz BWSYNLYFYCPDFH-IBGZPJMESA-N 2 1 304.522 4.344 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3ccc(C)c(C)c3)CC2)[nH+]c1 ZINC000163481327 1054043124 /nfs/dbraw/zinc/04/31/24/1054043124.db2.gz QHUOYFMOKIAAIV-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP FC1(F)CCCC[C@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000294352219 1054075738 /nfs/dbraw/zinc/07/57/38/1054075738.db2.gz ZGGYGHDBFHYOER-KRWDZBQOSA-N 2 1 322.443 4.066 20 0 DIADMP CC(C)(C)n1c[nH+]cc1[C@H]1CCCN(c2cc[nH+]cc2C2CC2)C1 ZINC001336855041 1054248313 /nfs/dbraw/zinc/24/83/13/1054248313.db2.gz ICNCELWWYYVYLN-INIZCTEOSA-N 2 1 324.472 4.295 20 0 DIADMP Cc1cccnc1CNCc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC001337565855 1054272595 /nfs/dbraw/zinc/27/25/95/1054272595.db2.gz DDKSIKUJMHTORD-SFHVURJKSA-N 2 1 323.484 4.054 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC001337565855 1054272604 /nfs/dbraw/zinc/27/26/04/1054272604.db2.gz DDKSIKUJMHTORD-SFHVURJKSA-N 2 1 323.484 4.054 20 0 DIADMP Cc1cccnc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC001337565855 1054272615 /nfs/dbraw/zinc/27/26/15/1054272615.db2.gz DDKSIKUJMHTORD-SFHVURJKSA-N 2 1 323.484 4.054 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCSc3cc(C)c(C)cc32)C1 ZINC001338445624 1054306382 /nfs/dbraw/zinc/30/63/82/1054306382.db2.gz GKKANOIEBNQQDS-FUHWJXTLSA-N 2 1 318.530 4.162 20 0 DIADMP Cc1cc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)sc1C ZINC001233663661 1054325619 /nfs/dbraw/zinc/32/56/19/1054325619.db2.gz ANZMHOIYYUEINI-UHFFFAOYSA-N 2 1 318.530 4.205 20 0 DIADMP Cc1cc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)sc1C ZINC001233663661 1054325627 /nfs/dbraw/zinc/32/56/27/1054325627.db2.gz ANZMHOIYYUEINI-UHFFFAOYSA-N 2 1 318.530 4.205 20 0 DIADMP Cc1cc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)sc1C ZINC001233693302 1054335313 /nfs/dbraw/zinc/33/53/13/1054335313.db2.gz UEGMFQYSAMXSOK-DLBZAZTESA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)sc1C ZINC001233693302 1054335321 /nfs/dbraw/zinc/33/53/21/1054335321.db2.gz UEGMFQYSAMXSOK-DLBZAZTESA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)sc1C ZINC001233693302 1054335335 /nfs/dbraw/zinc/33/53/35/1054335335.db2.gz UEGMFQYSAMXSOK-DLBZAZTESA-N 2 1 306.519 4.204 20 0 DIADMP C[C@H](CC[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000379849444 1054422762 /nfs/dbraw/zinc/42/27/62/1054422762.db2.gz GIVOUSLPMPYLOX-CTNGQTDRSA-N 2 1 322.496 4.292 20 0 DIADMP Cc1sccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000339293401 1054496192 /nfs/dbraw/zinc/49/61/92/1054496192.db2.gz MYETZFMHPYFXLC-BEFAXECRSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1sccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000339293401 1054496197 /nfs/dbraw/zinc/49/61/97/1054496197.db2.gz MYETZFMHPYFXLC-BEFAXECRSA-N 2 1 314.498 4.199 20 0 DIADMP C[C@H](CC1CC1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001347529152 1054572325 /nfs/dbraw/zinc/57/23/25/1054572325.db2.gz XOUCAXVEYUZEEO-ZNDGOPKYSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409761 1054588374 /nfs/dbraw/zinc/58/83/74/1054588374.db2.gz OCUDWENNWWETKE-DZGCQCFKSA-N 2 1 302.487 4.425 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409761 1054588387 /nfs/dbraw/zinc/58/83/87/1054588387.db2.gz OCUDWENNWWETKE-DZGCQCFKSA-N 2 1 302.487 4.425 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530675 1054614688 /nfs/dbraw/zinc/61/46/88/1054614688.db2.gz HXFYMOPNXXKODV-YPMHNXCESA-N 2 1 312.910 4.241 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530675 1054614694 /nfs/dbraw/zinc/61/46/94/1054614694.db2.gz HXFYMOPNXXKODV-YPMHNXCESA-N 2 1 312.910 4.241 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235016653 1054640866 /nfs/dbraw/zinc/64/08/66/1054640866.db2.gz GOLKTOQEFFVQRZ-SLFFLAALSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)CC1 ZINC001235016653 1054640869 /nfs/dbraw/zinc/64/08/69/1054640869.db2.gz GOLKTOQEFFVQRZ-SLFFLAALSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cccc1-c1ccccc1 ZINC001235002888 1054640980 /nfs/dbraw/zinc/64/09/80/1054640980.db2.gz YHCXHFBGJUDHPE-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001235000278 1054641878 /nfs/dbraw/zinc/64/18/78/1054641878.db2.gz QCTZOQKSULBAJY-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001235039034 1054642748 /nfs/dbraw/zinc/64/27/48/1054642748.db2.gz MMPFEYFTRHEADH-HXUWFJFHSA-N 2 1 300.490 4.137 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@@]4(CC[NH2+]C4)C3)cc12 ZINC001235033034 1054643724 /nfs/dbraw/zinc/64/37/24/1054643724.db2.gz NXGPFZDYYMBSKM-HXUWFJFHSA-N 2 1 322.477 4.240 20 0 DIADMP c1ccc(CCCCC[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001235039974 1054644063 /nfs/dbraw/zinc/64/40/63/1054644063.db2.gz JTMIVYMFRYZGME-HXUWFJFHSA-N 2 1 300.490 4.008 20 0 DIADMP CSc1cccc(Cl)c1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235036681 1054644079 /nfs/dbraw/zinc/64/40/79/1054644079.db2.gz AQZQDRYLXNIHEA-QGZVFWFLSA-N 2 1 324.921 4.170 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235036681 1054644085 /nfs/dbraw/zinc/64/40/85/1054644085.db2.gz AQZQDRYLXNIHEA-QGZVFWFLSA-N 2 1 324.921 4.170 20 0 DIADMP CSc1ccc(Cl)cc1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235037910 1054644221 /nfs/dbraw/zinc/64/42/21/1054644221.db2.gz IUUSNABQYUSTOQ-QGZVFWFLSA-N 2 1 324.921 4.170 20 0 DIADMP CSc1ccc(Cl)cc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235037910 1054644228 /nfs/dbraw/zinc/64/42/28/1054644228.db2.gz IUUSNABQYUSTOQ-QGZVFWFLSA-N 2 1 324.921 4.170 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235042362 1054645694 /nfs/dbraw/zinc/64/56/94/1054645694.db2.gz AXRRFFNACRVEND-IBGZPJMESA-N 2 1 314.498 4.318 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)cc2s1 ZINC001235040551 1054647278 /nfs/dbraw/zinc/64/72/78/1054647278.db2.gz SYQNYTNLRUQPBX-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001235091734 1054654138 /nfs/dbraw/zinc/65/41/38/1054654138.db2.gz AWJNXHVCLUKDJM-UHFFFAOYSA-N 2 1 322.452 4.054 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001235094429 1054656873 /nfs/dbraw/zinc/65/68/73/1054656873.db2.gz XEXWGTCFCRKQTB-UHFFFAOYSA-N 2 1 324.443 4.068 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[NH+]1CCC2(CC[NH2+]2)CC1 ZINC001235111755 1054659769 /nfs/dbraw/zinc/65/97/69/1054659769.db2.gz UTTPFWYWJFOPTL-UHFFFAOYSA-N 2 1 322.452 4.115 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H]1CCCc2c(C)ccc(C)c21 ZINC000349408216 1054662762 /nfs/dbraw/zinc/66/27/62/1054662762.db2.gz JJKMPYURHALPGD-IFXJQAMLSA-N 2 1 311.473 4.112 20 0 DIADMP C[C@@H](C[N@@H+]1CCCC[C@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120420 1054663011 /nfs/dbraw/zinc/66/30/11/1054663011.db2.gz BIGCCYRZIJJXMS-LAUBAEHRSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120420 1054663019 /nfs/dbraw/zinc/66/30/19/1054663019.db2.gz BIGCCYRZIJJXMS-LAUBAEHRSA-N 2 1 308.469 4.161 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[N@H+]1CCCC12CC[NH2+]CC2 ZINC001235144976 1054664960 /nfs/dbraw/zinc/66/49/60/1054664960.db2.gz UKLDHMLPZZUHLY-UHFFFAOYSA-N 2 1 312.501 4.452 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CCCC34CC[NH2+]CC4)cc2)c1 ZINC001235145234 1054665134 /nfs/dbraw/zinc/66/51/34/1054665134.db2.gz RMOSDSJSHIPHGZ-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c(F)cc1Cl ZINC001235156132 1054666614 /nfs/dbraw/zinc/66/66/14/1054666614.db2.gz MUQTXGJBPVMOOT-GOSISDBHSA-N 2 1 324.871 4.142 20 0 DIADMP Clc1ccc(CCC[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001235153543 1054666690 /nfs/dbraw/zinc/66/66/90/1054666690.db2.gz SRBBGGLYHIVQKZ-IBGZPJMESA-N 2 1 320.908 4.127 20 0 DIADMP CSc1cc(C)cc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1 ZINC001235157816 1054666717 /nfs/dbraw/zinc/66/67/17/1054666717.db2.gz SBJUKUVGHJTUKA-LJQANCHMSA-N 2 1 318.530 4.071 20 0 DIADMP c1cc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c2cccccc1-2 ZINC001235154701 1054667167 /nfs/dbraw/zinc/66/71/67/1054667167.db2.gz KIXHOBLSWBEEEZ-OAQYLSRUSA-N 2 1 308.469 4.146 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CCCC34CC[NH2+]CC4)c2)cs1 ZINC001235145322 1054667925 /nfs/dbraw/zinc/66/79/25/1054667925.db2.gz UDOGUDFZEFDDDL-UHFFFAOYSA-N 2 1 318.511 4.195 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c(Cl)c1 ZINC001235156804 1054667991 /nfs/dbraw/zinc/66/79/91/1054667991.db2.gz RPRCTOVYSBJKMM-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235158707 1054669184 /nfs/dbraw/zinc/66/91/84/1054669184.db2.gz MRTPSLKMTUCRDS-FQEVSTJZSA-N 2 1 300.490 4.164 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235159962 1054669658 /nfs/dbraw/zinc/66/96/58/1054669658.db2.gz ZHOIBVXQLGJTDI-IBGZPJMESA-N 2 1 320.908 4.311 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1C ZINC001235159844 1054669795 /nfs/dbraw/zinc/66/97/95/1054669795.db2.gz WTLPGQFYDDSFOI-LJQANCHMSA-N 2 1 320.908 4.311 20 0 DIADMP Cc1cc(C[N@@H+]2CCCCC23CC[NH2+]CC3)cc(C)c1Cl ZINC001235190739 1054679932 /nfs/dbraw/zinc/67/99/32/1054679932.db2.gz JSSJDWDJZNQWKO-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C[N@H+]2CCCCC23CC[NH2+]CC3)cc(C)c1Cl ZINC001235190739 1054679937 /nfs/dbraw/zinc/67/99/37/1054679937.db2.gz JSSJDWDJZNQWKO-UHFFFAOYSA-N 2 1 306.881 4.065 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235190452 1054680890 /nfs/dbraw/zinc/68/08/90/1054680890.db2.gz IHLFUJZZGFRBJP-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c1 ZINC001235198677 1054684491 /nfs/dbraw/zinc/68/44/91/1054684491.db2.gz SMGUMFSNPBYNME-NHCUHLMSSA-N 2 1 320.480 4.012 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC000179503601 1054685109 /nfs/dbraw/zinc/68/51/09/1054685109.db2.gz QTXZMPWVNCNXQI-UHFFFAOYSA-N 2 1 317.436 4.283 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)C1c2ccccc2-c2ccccc21 ZINC000179503601 1054685122 /nfs/dbraw/zinc/68/51/22/1054685122.db2.gz QTXZMPWVNCNXQI-UHFFFAOYSA-N 2 1 317.436 4.283 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CCC[N@H+]3CCCC2CCCC2)cc1 ZINC001235248160 1054692264 /nfs/dbraw/zinc/69/22/64/1054692264.db2.gz OUPHRFRUNGATTN-NHCUHLMSSA-N 2 1 312.501 4.178 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@]23CCC[N@@H+]3CCCC2CCCC2)cc1 ZINC001235248160 1054692268 /nfs/dbraw/zinc/69/22/68/1054692268.db2.gz OUPHRFRUNGATTN-NHCUHLMSSA-N 2 1 312.501 4.178 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235272514 1054697776 /nfs/dbraw/zinc/69/77/76/1054697776.db2.gz QCTXGNPIRSNUQJ-SFTDATJTSA-N 2 1 320.480 4.154 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235272507 1054698341 /nfs/dbraw/zinc/69/83/41/1054698341.db2.gz QCTXGNPIRSNUQJ-RTWAWAEBSA-N 2 1 320.480 4.154 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)c2)cc1 ZINC001235319700 1054701523 /nfs/dbraw/zinc/70/15/23/1054701523.db2.gz JQIMJNGMHFWOCS-FGZHOGPDSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)c2)cc1 ZINC001235319700 1054701533 /nfs/dbraw/zinc/70/15/33/1054701533.db2.gz JQIMJNGMHFWOCS-FGZHOGPDSA-N 2 1 320.480 4.046 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@H](C3C[NH2+]C3)C2)CC1 ZINC001235337916 1054702377 /nfs/dbraw/zinc/70/23/77/1054702377.db2.gz LXBJOOVGEQVOHQ-MOPGFXCFSA-N 2 1 302.506 4.001 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cc2s1 ZINC001235425999 1054715050 /nfs/dbraw/zinc/71/50/50/1054715050.db2.gz KNTKOZSTTZAECF-ROUUACIJSA-N 2 1 314.498 4.113 20 0 DIADMP c1ccc2cc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)ccc2c1 ZINC001235426707 1054715808 /nfs/dbraw/zinc/71/58/08/1054715808.db2.gz QNIBDDZHBIZNGX-LEWJYISDSA-N 2 1 308.469 4.051 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235424631 1054716035 /nfs/dbraw/zinc/71/60/35/1054716035.db2.gz HUHILFXELIGRBA-ZWKOTPCHSA-N 2 1 300.490 4.022 20 0 DIADMP CC(C)(CC[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC001235424050 1054716127 /nfs/dbraw/zinc/71/61/27/1054716127.db2.gz JCFCZYRYLBVUJI-RTBURBONSA-N 2 1 314.517 4.066 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235431736 1054717072 /nfs/dbraw/zinc/71/70/72/1054717072.db2.gz VRHUEKAPRUJWNO-RBUKOAKNSA-N 2 1 324.468 4.158 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)CC1CC[NH2+]CC1 ZINC001235433035 1054717580 /nfs/dbraw/zinc/71/75/80/1054717580.db2.gz FDQRPNDPFRYBEZ-UHFFFAOYSA-N 2 1 308.469 4.093 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc1 ZINC001235429736 1054718321 /nfs/dbraw/zinc/71/83/21/1054718321.db2.gz ZHRLJJILMAKJHC-UXHICEINSA-N 2 1 300.490 4.022 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235427804 1054718656 /nfs/dbraw/zinc/71/86/56/1054718656.db2.gz OHUFHLXTWYLEJQ-DLBZAZTESA-N 2 1 320.908 4.168 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235429607 1054718984 /nfs/dbraw/zinc/71/89/84/1054718984.db2.gz BGOLUCVBWSYIOA-IAGOWNOFSA-N 2 1 318.530 4.010 20 0 DIADMP c1cc(C2CCC2)ccc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235427756 1054719120 /nfs/dbraw/zinc/71/91/20/1054719120.db2.gz ODOPRYREGUUDJV-RTWAWAEBSA-N 2 1 312.501 4.166 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3sc21)C1CC[NH2+]CC1 ZINC001235465903 1054730819 /nfs/dbraw/zinc/73/08/19/1054730819.db2.gz KAWFOAIPWQBCOT-UHFFFAOYSA-N 2 1 310.466 4.238 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@](C)(Cc1ccccc1)c1ccccc1 ZINC001473551266 1054743126 /nfs/dbraw/zinc/74/31/26/1054743126.db2.gz VUDHLCBSPMKESO-YADHBBJMSA-N 2 1 322.496 4.218 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001235674537 1054769488 /nfs/dbraw/zinc/76/94/88/1054769488.db2.gz GRVWAQMINJTWLH-SHBDEGQCSA-N 2 1 306.453 4.028 20 0 DIADMP [NH3+]Cc1cccc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC001235693603 1054780864 /nfs/dbraw/zinc/78/08/64/1054780864.db2.gz DNPRLTOOKQPPID-SFHVURJKSA-N 2 1 300.833 4.136 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(-c2ccccc2)s1 ZINC001235717374 1054788483 /nfs/dbraw/zinc/78/84/83/1054788483.db2.gz SJZULEFLPTYYRU-UHFFFAOYSA-N 2 1 314.498 4.237 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001235724681 1054789640 /nfs/dbraw/zinc/78/96/40/1054789640.db2.gz BREVWCVQVKDMBP-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(C)sc1C ZINC000623861172 1054792085 /nfs/dbraw/zinc/79/20/85/1054792085.db2.gz QLTXRRGHZLQPMU-MAUKXSAKSA-N 2 1 306.519 4.280 20 0 DIADMP CC1([NH3+])CC[NH+](Cc2ccc(-c3ccccc3)cc2Cl)CC1 ZINC001235752863 1054799113 /nfs/dbraw/zinc/79/91/13/1054799113.db2.gz SUDGDUHXDXNQRT-UHFFFAOYSA-N 2 1 314.860 4.320 20 0 DIADMP CC(C)(C)c1cc(C[N@H+]2CC[C@@H](C[NH3+])C2)cc(C(C)(C)C)c1 ZINC001235751200 1054799231 /nfs/dbraw/zinc/79/92/31/1054799231.db2.gz WXQGHIVWWQBMOB-HNNXBMFYSA-N 2 1 302.506 4.062 20 0 DIADMP Cc1csc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)n1 ZINC000623877064 1054800271 /nfs/dbraw/zinc/80/02/71/1054800271.db2.gz PVJIXZWDYRINQR-OAHLLOKOSA-N 2 1 317.502 4.143 20 0 DIADMP Cc1csc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)n1 ZINC000623877064 1054800286 /nfs/dbraw/zinc/80/02/86/1054800286.db2.gz PVJIXZWDYRINQR-OAHLLOKOSA-N 2 1 317.502 4.143 20 0 DIADMP CC[N@@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C1CC[NH2+]CC1 ZINC001235761781 1054800261 /nfs/dbraw/zinc/80/02/61/1054800261.db2.gz PXODRWRTUOMBGU-CMDGGOBGSA-N 2 1 320.480 4.431 20 0 DIADMP CC[N@@H+](Cc1ccc(Oc2ccccc2)c(C)c1)C1CC[NH2+]CC1 ZINC001235764873 1054800964 /nfs/dbraw/zinc/80/09/64/1054800964.db2.gz NIKFDHJAXPGYBP-UHFFFAOYSA-N 2 1 324.468 4.361 20 0 DIADMP CC[N@@H+](Cc1ccc(C2CCCCC2)cc1)C1CC[NH2+]CC1 ZINC001235765302 1054801093 /nfs/dbraw/zinc/80/10/93/1054801093.db2.gz ZIBTUKHNVKIEND-UHFFFAOYSA-N 2 1 300.490 4.308 20 0 DIADMP [NH3+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001235774452 1054803801 /nfs/dbraw/zinc/80/38/01/1054803801.db2.gz ALQBWMRJHYHBAG-MQVJKMGUSA-N 2 1 316.832 4.054 20 0 DIADMP CC(C)Oc1ccc2ccccc2c1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH3+])C2 ZINC001235808698 1054811019 /nfs/dbraw/zinc/81/10/19/1054811019.db2.gz DENUGXLJOBLCQG-BCDXTJNWSA-N 2 1 324.468 4.081 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)cc1 ZINC001235838784 1054819542 /nfs/dbraw/zinc/81/95/42/1054819542.db2.gz BZMRUMURLINUSK-AWEZNQCLSA-N 2 1 306.862 4.197 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902393 1054840892 /nfs/dbraw/zinc/84/08/92/1054840892.db2.gz FKWKJCBQICNOOW-RDTXWAMCSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235902393 1054840901 /nfs/dbraw/zinc/84/09/01/1054840901.db2.gz FKWKJCBQICNOOW-RDTXWAMCSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906858 1054842659 /nfs/dbraw/zinc/84/26/59/1054842659.db2.gz OZVOESBSVQDIRG-ZFWWWQNUSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906858 1054842664 /nfs/dbraw/zinc/84/26/64/1054842664.db2.gz OZVOESBSVQDIRG-ZFWWWQNUSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908542 1054844411 /nfs/dbraw/zinc/84/44/11/1054844411.db2.gz YFSBDJZRIJWFLJ-WBVHZDCISA-N 2 1 319.452 4.147 20 0 DIADMP C[C@@H]1CC[C@H]([NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908542 1054844417 /nfs/dbraw/zinc/84/44/17/1054844417.db2.gz YFSBDJZRIJWFLJ-WBVHZDCISA-N 2 1 319.452 4.147 20 0 DIADMP [NH3+]CC[C@@H]1CCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235925708 1054848939 /nfs/dbraw/zinc/84/89/39/1054848939.db2.gz XYCVFLBDPBUMLS-KRWDZBQOSA-N 2 1 319.452 4.148 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cc2c(s1)C[NH2+]CC2 ZINC001235952544 1054866681 /nfs/dbraw/zinc/86/66/81/1054866681.db2.gz ZFOOVDLENBZNHH-LBPRGKRZSA-N 2 1 320.889 4.240 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CC1CC2(C1)CC[NH2+]CC2 ZINC001235949562 1054866865 /nfs/dbraw/zinc/86/68/65/1054866865.db2.gz OYDFKGADQFABNK-AWEZNQCLSA-N 2 1 306.881 4.113 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C[C@H]1CCC[NH2+]C1 ZINC001235950406 1054866927 /nfs/dbraw/zinc/86/69/27/1054866927.db2.gz FEHJOGPJDLGFER-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C[C@H]1CCC[NH2+]C1 ZINC001235950406 1054866937 /nfs/dbraw/zinc/86/69/37/1054866937.db2.gz FEHJOGPJDLGFER-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+](Cc1ccc(C2CCCCC2)cc1)C[C@@H]1CCC[NH2+]C1 ZINC001235958257 1054870131 /nfs/dbraw/zinc/87/01/31/1054870131.db2.gz CAJIVDNJOONVAU-GOSISDBHSA-N 2 1 300.490 4.166 20 0 DIADMP [NH3+][C@@H]1[C@@H]2CC[C@H]1C[N@H+](Cc1cccc3c4ccccc4sc31)C2 ZINC001235959162 1054870303 /nfs/dbraw/zinc/87/03/03/1054870303.db2.gz FRZUFMDSVQZLNE-HBCWATKFSA-N 2 1 322.477 4.224 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+](C)C[C@@H]3CCC[NH2+]C3)c2)cc1 ZINC001235956760 1054870774 /nfs/dbraw/zinc/87/07/74/1054870774.db2.gz HKVIMUQTMTWMTI-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](CC3CC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001235960907 1054872134 /nfs/dbraw/zinc/87/21/34/1054872134.db2.gz YAOAWNMRPKFVGD-HXUWFJFHSA-N 2 1 312.501 4.036 20 0 DIADMP CC[N@H+](Cc1ccccc1-c1ccccc1C)[C@H]1CCC[NH2+]C1 ZINC001236005896 1054891841 /nfs/dbraw/zinc/89/18/41/1054891841.db2.gz GFRPMMVCFXEFIZ-IBGZPJMESA-N 2 1 308.469 4.236 20 0 DIADMP CC[N@@H+](Cc1ccccc1-c1ccccc1C)[C@H]1CCC[NH2+]C1 ZINC001236005896 1054891854 /nfs/dbraw/zinc/89/18/54/1054891854.db2.gz GFRPMMVCFXEFIZ-IBGZPJMESA-N 2 1 308.469 4.236 20 0 DIADMP C[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)C1CCC(C(C)(C)C)CC1 ZINC001236007973 1054893575 /nfs/dbraw/zinc/89/35/75/1054893575.db2.gz HSFSUWRVVUJFBJ-UHFFFAOYSA-N 2 1 320.546 4.431 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1cccc(F)c1)C(C)(C)C ZINC000181056866 1054900137 /nfs/dbraw/zinc/90/01/37/1054900137.db2.gz OYWMHZHVVDDVNX-GOSISDBHSA-N 2 1 317.452 4.488 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046368 1054911767 /nfs/dbraw/zinc/91/17/67/1054911767.db2.gz GBBOMCHLAFRART-ZFWWWQNUSA-N 2 1 310.466 4.224 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046368 1054911784 /nfs/dbraw/zinc/91/17/84/1054911784.db2.gz GBBOMCHLAFRART-ZFWWWQNUSA-N 2 1 310.466 4.224 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236067205 1054923819 /nfs/dbraw/zinc/92/38/19/1054923819.db2.gz NXXSSKJIKLTPBF-INIZCTEOSA-N 2 1 314.860 4.048 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001236067240 1054924844 /nfs/dbraw/zinc/92/48/44/1054924844.db2.gz OLODWSWJVBUBGW-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP CCC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(F)cc1F ZINC000181660202 1054926627 /nfs/dbraw/zinc/92/66/27/1054926627.db2.gz WPSBZMDZZJTMNN-GOSISDBHSA-N 2 1 321.415 4.381 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728477 1054932902 /nfs/dbraw/zinc/93/29/02/1054932902.db2.gz SJDUTUTWQWLVIR-STQMWFEESA-N 2 1 306.837 4.079 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728477 1054932913 /nfs/dbraw/zinc/93/29/13/1054932913.db2.gz SJDUTUTWQWLVIR-STQMWFEESA-N 2 1 306.837 4.079 20 0 DIADMP C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@@H+]2CCCCCC[NH3+] ZINC001236103967 1054947156 /nfs/dbraw/zinc/94/71/56/1054947156.db2.gz FSQDKPJLMVTDSU-YADHBBJMSA-N 2 1 320.480 4.382 20 0 DIADMP Cc1cc(C[N@@H+](C)CCCC[NH3+])cc(C)c1-c1ccc(F)cc1 ZINC001236142696 1054968013 /nfs/dbraw/zinc/96/80/13/1054968013.db2.gz ZVNBLSIXDLDEOY-UHFFFAOYSA-N 2 1 314.448 4.280 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 ZINC001236141589 1054969054 /nfs/dbraw/zinc/96/90/54/1054969054.db2.gz KQILQUPDRJOSRB-UHFFFAOYSA-N 2 1 320.521 4.158 20 0 DIADMP Cn1c2ccccc2c(C[N@@H+](C)CCCC[NH3+])c1-c1ccccc1 ZINC001236142335 1054969134 /nfs/dbraw/zinc/96/91/34/1054969134.db2.gz WBGIEVGGDJKFGH-UHFFFAOYSA-N 2 1 321.468 4.016 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC001236152722 1054970727 /nfs/dbraw/zinc/97/07/27/1054970727.db2.gz XFWAIOUJAMBTLG-LJQANCHMSA-N 2 1 312.844 4.280 20 0 DIADMP CCC[N@@H+](C[C@H](C)Cc1ccc(C(C)C)cc1)C1CC[NH2+]CC1 ZINC001236180865 1054982431 /nfs/dbraw/zinc/98/24/31/1054982431.db2.gz PGJJELWCVQWGRR-GOSISDBHSA-N 2 1 316.533 4.453 20 0 DIADMP C[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1ccc2ccccc2c1 ZINC001236185029 1054984704 /nfs/dbraw/zinc/98/47/04/1054984704.db2.gz YZECDOCEXZDRFD-UHFFFAOYSA-N 2 1 322.477 4.179 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@@H+](C)Cc1ccc(C[NH3+])cc1 ZINC001236189025 1054985296 /nfs/dbraw/zinc/98/52/96/1054985296.db2.gz IESACXWGAMUYED-MRXNPFEDSA-N 2 1 304.437 4.492 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@@H+]1CC1CC2(C1)CC[NH2+]CC2 ZINC001236190276 1054988093 /nfs/dbraw/zinc/98/80/93/1054988093.db2.gz RZUBITBLLZBHCV-HXUWFJFHSA-N 2 1 323.484 4.085 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@H+]1Cc1cccc2c[nH+]cn21 ZINC001236192186 1054990275 /nfs/dbraw/zinc/99/02/75/1054990275.db2.gz GFEHSQXFHFWRBW-HXUWFJFHSA-N 2 1 316.408 4.153 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@@H+]1Cc1cccc2c[nH+]cn21 ZINC001236192186 1054990289 /nfs/dbraw/zinc/99/02/89/1054990289.db2.gz GFEHSQXFHFWRBW-HXUWFJFHSA-N 2 1 316.408 4.153 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCc2occc21 ZINC000360035436 1054995038 /nfs/dbraw/zinc/99/50/38/1054995038.db2.gz BBVXJTYSVYCADV-NSISKUIASA-N 2 1 324.468 4.157 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCc2occc21 ZINC000360035436 1054995048 /nfs/dbraw/zinc/99/50/48/1054995048.db2.gz BBVXJTYSVYCADV-NSISKUIASA-N 2 1 324.468 4.157 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC001236196372 1054995214 /nfs/dbraw/zinc/99/52/14/1054995214.db2.gz YTBHKAYRWQKCKR-UHFFFAOYSA-N 2 1 314.860 4.008 20 0 DIADMP C[N@H+](Cc1ccc(SC(F)(F)F)cc1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236211113 1055001097 /nfs/dbraw/zinc/00/10/97/1055001097.db2.gz GZGHASUISWLGRZ-ZIAGYGMSSA-N 2 1 318.408 4.000 20 0 DIADMP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236211113 1055001110 /nfs/dbraw/zinc/00/11/10/1055001110.db2.gz GZGHASUISWLGRZ-ZIAGYGMSSA-N 2 1 318.408 4.000 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(F)ccc(Cl)c2Cl)CC1 ZINC001236215297 1055001565 /nfs/dbraw/zinc/00/15/65/1055001565.db2.gz NIUXYSFPEYIVKQ-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)CC[C@H](C)CCCC(C)(C)OC)CC1 ZINC001236213948 1055002495 /nfs/dbraw/zinc/00/24/95/1055002495.db2.gz ZKKTUALCRDPLSV-WWDZGPRUSA-N 2 1 312.542 4.070 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(F)c(Cl)cc2Cl)CC1 ZINC001236215218 1055002417 /nfs/dbraw/zinc/00/24/17/1055002417.db2.gz KZHBPNAHUZZURE-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)C[C@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001236213359 1055002683 /nfs/dbraw/zinc/00/26/83/1055002683.db2.gz QDDYGVDTTCLNSI-MDMXATFFSA-N 2 1 316.533 4.451 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1cccs1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236216619 1055004064 /nfs/dbraw/zinc/00/40/64/1055004064.db2.gz KVQVCEBLKSODAJ-DLBZAZTESA-N 2 1 300.471 4.117 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@H+](C)[C@@H]3CCCC[C@H]3[NH3+])ccc21 ZINC001236219202 1055008658 /nfs/dbraw/zinc/00/86/58/1055008658.db2.gz VQCGSDUNJHUGOA-WIYYLYMNSA-N 2 1 321.468 4.033 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@@H+](C)[C@@H]3CCCC[C@H]3[NH3+])ccc21 ZINC001236219202 1055008673 /nfs/dbraw/zinc/00/86/73/1055008673.db2.gz VQCGSDUNJHUGOA-WIYYLYMNSA-N 2 1 321.468 4.033 20 0 DIADMP COc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CCCC[C@H]3[NH3+])cc2)cc1 ZINC001236218727 1055009345 /nfs/dbraw/zinc/00/93/45/1055009345.db2.gz SXSZYYZFUMBMQG-NHCUHLMSSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CCCC[C@H]3[NH3+])cc2)cc1 ZINC001236218727 1055009357 /nfs/dbraw/zinc/00/93/57/1055009357.db2.gz SXSZYYZFUMBMQG-NHCUHLMSSA-N 2 1 324.468 4.064 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])c(C)c12 ZINC001236219467 1055011123 /nfs/dbraw/zinc/01/11/23/1055011123.db2.gz WOMJRZQNLVCXLJ-QWHCGFSZSA-N 2 1 308.516 4.281 20 0 DIADMP Cc1csc2sc(C[N@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])c(C)c12 ZINC001236219467 1055011138 /nfs/dbraw/zinc/01/11/38/1055011138.db2.gz WOMJRZQNLVCXLJ-QWHCGFSZSA-N 2 1 308.516 4.281 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222636 1055011708 /nfs/dbraw/zinc/01/17/08/1055011708.db2.gz JYBTYEKSFGAQMP-WGSAOQKQSA-N 2 1 324.468 4.489 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@@H+](C)[C@H]3CC[C@H]([NH3+])CC3)ccc21 ZINC001236220904 1055012772 /nfs/dbraw/zinc/01/27/72/1055012772.db2.gz AADGPKQVAMUVOH-QAQDUYKDSA-N 2 1 321.468 4.033 20 0 DIADMP C[N@@H+](Cc1c(Cl)cccc1C(F)(F)F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224643 1055014342 /nfs/dbraw/zinc/01/43/42/1055014342.db2.gz UKFNEASIPOMHOR-XYPYZODXSA-N 2 1 320.786 4.061 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236225062 1055015034 /nfs/dbraw/zinc/01/50/34/1055015034.db2.gz ZPVFRGPOYPPBEQ-HAQNSBGRSA-N 2 1 320.786 4.061 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)C3(C)CC[NH2+]CC3)cc2)cc1 ZINC001236227083 1055016766 /nfs/dbraw/zinc/01/67/66/1055016766.db2.gz ZISCKAWJBJBCTI-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+](C)C1(C)CC[NH2+]CC1 ZINC001236228320 1055019770 /nfs/dbraw/zinc/01/97/70/1055019770.db2.gz SXQDLMRGIZUIAQ-UHFFFAOYSA-N 2 1 324.468 4.361 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH3+])cc1)Cc1cccc(C(F)(F)F)c1 ZINC001236284962 1055047278 /nfs/dbraw/zinc/04/72/78/1055047278.db2.gz AQJPRAWCINPSAR-UHFFFAOYSA-N 2 1 322.374 4.186 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c(C)c1 ZINC001236287337 1055050701 /nfs/dbraw/zinc/05/07/01/1055050701.db2.gz RSEBREQNDOTAKR-UHFFFAOYSA-N 2 1 308.469 4.058 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236320264 1055055642 /nfs/dbraw/zinc/05/56/42/1055055642.db2.gz OUKTUHAFWCJBRH-IYBDPMFKSA-N 2 1 320.436 4.017 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000184501980 1055077864 /nfs/dbraw/zinc/07/78/64/1055077864.db2.gz FMUMPKIJQFLEHV-ZDUSSCGKSA-N 2 1 320.506 4.077 20 0 DIADMP Fc1cccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1Cl ZINC001236373990 1055078856 /nfs/dbraw/zinc/07/88/56/1055078856.db2.gz BELPYZAPIJNSSH-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1cccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1Cl ZINC001236373990 1055078868 /nfs/dbraw/zinc/07/88/68/1055078868.db2.gz BELPYZAPIJNSSH-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP c1cc(C2CC2)ccc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374450 1055082718 /nfs/dbraw/zinc/08/27/18/1055082718.db2.gz CQFQDYALLYQSLU-GOSISDBHSA-N 2 1 312.501 4.308 20 0 DIADMP Cc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)ccc1Cl ZINC001236375303 1055082951 /nfs/dbraw/zinc/08/29/51/1055082951.db2.gz IXVBRFBNDIMXRI-QGZVFWFLSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c(C)c1 ZINC001236374417 1055082976 /nfs/dbraw/zinc/08/29/76/1055082976.db2.gz RBLZUISXWIRBFO-SFHVURJKSA-N 2 1 300.490 4.048 20 0 DIADMP CSc1ccccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375975 1055083381 /nfs/dbraw/zinc/08/33/81/1055083381.db2.gz NUQOTXWVGBQMFW-MRXNPFEDSA-N 2 1 318.530 4.153 20 0 DIADMP C[C@H]([NH2+]CCSc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185681769 1055094706 /nfs/dbraw/zinc/09/47/06/1055094706.db2.gz SNQRUZMWXUMVIR-DLBZAZTESA-N 2 1 318.530 4.021 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000185667138 1055094915 /nfs/dbraw/zinc/09/49/15/1055094915.db2.gz BZZDHYGIZVKXJY-ZIFCJYIRSA-N 2 1 300.490 4.033 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C[C@@H]1CC[NH2+]C1 ZINC001236408079 1055099020 /nfs/dbraw/zinc/09/90/20/1055099020.db2.gz KUKGFXXGVVXSEG-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP CC[N@H+](Cc1cccc(-c2ccc(C)cc2)c1)C[C@H]1CC[NH2+]C1 ZINC001236408129 1055099657 /nfs/dbraw/zinc/09/96/57/1055099657.db2.gz LGIRKRUYIBTLJK-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@H+](Cc1ccccc1-c1ccccc1C)C[C@H]1CC[NH2+]C1 ZINC001236408408 1055101105 /nfs/dbraw/zinc/10/11/05/1055101105.db2.gz LNSSHFALMTYUDX-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@H+](Cc1sc2scc(C)c2c1C)C[C@@H]1CC[NH2+]C1 ZINC001236410297 1055101979 /nfs/dbraw/zinc/10/19/79/1055101979.db2.gz YLDKIEPIGMKOSD-CYBMUJFWSA-N 2 1 308.516 4.011 20 0 DIADMP CC[N@H+](Cc1cccc(-c2ccccc2)c1C)C[C@H]1CC[NH2+]C1 ZINC001236412787 1055103595 /nfs/dbraw/zinc/10/35/95/1055103595.db2.gz YKAVPKFRQSJIAZ-SFHVURJKSA-N 2 1 308.469 4.093 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(-c2ccc3c(c2)C[N@H+](C)CC3)cc1 ZINC001236447920 1055118110 /nfs/dbraw/zinc/11/81/10/1055118110.db2.gz PIXLHUNXESMTPX-UHFFFAOYSA-N 2 1 308.469 4.087 20 0 DIADMP Clc1ccccc1C[N@@H+](C[C@@H]1CC=CCC1)C1CC[NH2+]CC1 ZINC001236451362 1055121258 /nfs/dbraw/zinc/12/12/58/1055121258.db2.gz PMSMHGKBZUJTOM-MRXNPFEDSA-N 2 1 318.892 4.250 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(C2CC2)cc1)C1CC[NH2+]CC1 ZINC001236457916 1055124429 /nfs/dbraw/zinc/12/44/29/1055124429.db2.gz QMYPUFLGEIXEIM-UHFFFAOYSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(Cl)cs1)C1CC[NH2+]CC1 ZINC001236458519 1055124465 /nfs/dbraw/zinc/12/44/65/1055124465.db2.gz VNEAXOYSVFYDMA-UHFFFAOYSA-N 2 1 300.899 4.002 20 0 DIADMP CC(C)c1ccccc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236456660 1055125013 /nfs/dbraw/zinc/12/50/13/1055125013.db2.gz COUYFVZHVRNXKC-UHFFFAOYSA-N 2 1 302.506 4.410 20 0 DIADMP [NH3+]Cc1cccc(C2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1F ZINC001236475073 1055133766 /nfs/dbraw/zinc/13/37/66/1055133766.db2.gz LNBZMJODBHWNIB-MOPGFXCFSA-N 2 1 322.427 4.105 20 0 DIADMP C[NH2+]Cc1ccccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001236476183 1055135399 /nfs/dbraw/zinc/13/53/99/1055135399.db2.gz RUQXMYBHBPARID-RTWAWAEBSA-N 2 1 318.464 4.226 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380927937 1055136964 /nfs/dbraw/zinc/13/69/64/1055136964.db2.gz DJDQQLYYGKXKDI-ZCNNSNEGSA-N 2 1 300.490 4.067 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236480483 1055137245 /nfs/dbraw/zinc/13/72/45/1055137245.db2.gz GAMKHRKWNYSVNS-HNNXBMFYSA-N 2 1 306.469 4.124 20 0 DIADMP Fc1ccc(C[N@H+](CCC2CCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236502382 1055151253 /nfs/dbraw/zinc/15/12/53/1055151253.db2.gz QQPCNNRAJTVQJC-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP Fc1ccc(C[N@@H+](CCC2CCCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236502382 1055151260 /nfs/dbraw/zinc/15/12/60/1055151260.db2.gz QQPCNNRAJTVQJC-UHFFFAOYSA-N 2 1 322.443 4.099 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236509125 1055152289 /nfs/dbraw/zinc/15/22/89/1055152289.db2.gz GWEJSKBZSGOBOL-HNNXBMFYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C[C@H]1CC=CCC1)C1CC[NH2+]CC1 ZINC001236509716 1055153014 /nfs/dbraw/zinc/15/30/14/1055153014.db2.gz QCNZGIPKILKLRR-KRWDZBQOSA-N 2 1 316.464 4.044 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2ccccc2F)CC1 ZINC001236533839 1055164832 /nfs/dbraw/zinc/16/48/32/1055164832.db2.gz IOBIVPDOLGMGQP-WGSAOQKQSA-N 2 1 312.432 4.098 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccsc2)Cc2ccccc2F)CC1 ZINC001236533989 1055165152 /nfs/dbraw/zinc/16/51/52/1055165152.db2.gz LWNZDPMODSWPEV-QAQDUYKDSA-N 2 1 318.461 4.159 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236540155 1055168556 /nfs/dbraw/zinc/16/85/56/1055168556.db2.gz IRZCAYLPTUNOGA-IYARVYRRSA-N 2 1 322.443 4.145 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3cc[nH]c3c2)CC2CCC2)CC1 ZINC001236541805 1055170833 /nfs/dbraw/zinc/17/08/33/1055170833.db2.gz KXWYAKWUKXFCLA-WGSAOQKQSA-N 2 1 311.473 4.040 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1 ZINC001236542183 1055170923 /nfs/dbraw/zinc/17/09/23/1055170923.db2.gz OVGWPVGEPJIKNK-IYARVYRRSA-N 2 1 304.453 4.006 20 0 DIADMP Cc1c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc(F)c1F ZINC001236540854 1055171208 /nfs/dbraw/zinc/17/12/08/1055171208.db2.gz LOZSIMGSBIVKIZ-QAQDUYKDSA-N 2 1 322.443 4.145 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3cccnc32)CC2CCC2)CC1 ZINC001236542415 1055172067 /nfs/dbraw/zinc/17/20/67/1055172067.db2.gz QBODLRXJAVDXAF-MXVIHJGJSA-N 2 1 323.484 4.107 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3c2CCC3)CC2CCC2)CC1 ZINC001236543532 1055172517 /nfs/dbraw/zinc/17/25/17/1055172517.db2.gz XSFWTROMDPYGEL-MXVIHJGJSA-N 2 1 312.501 4.047 20 0 DIADMP CC(C)c1nc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cs1 ZINC001236542873 1055173195 /nfs/dbraw/zinc/17/31/95/1055173195.db2.gz VLLONZLNGUHABK-JCNLHEQBSA-N 2 1 321.534 4.139 20 0 DIADMP Cc1c2ccccc2[nH]c1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550119 1055177287 /nfs/dbraw/zinc/17/72/87/1055177287.db2.gz GXJLXVIJTJDDCU-QAQDUYKDSA-N 2 1 313.489 4.204 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(C(C)(C)C)[nH]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236549749 1055177707 /nfs/dbraw/zinc/17/77/07/1055177707.db2.gz AMMBMRCKTKETHZ-JCNLHEQBSA-N 2 1 305.510 4.040 20 0 DIADMP CCCc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236549762 1055177885 /nfs/dbraw/zinc/17/78/85/1055177885.db2.gz BGTDZUJLBBKTOE-WKILWMFISA-N 2 1 308.535 4.429 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1OC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551558 1055179589 /nfs/dbraw/zinc/17/95/89/1055179589.db2.gz RKPVICFMHQCCMC-WGSAOQKQSA-N 2 1 318.505 4.202 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(-c3ccccc3)o2)CC2CC2)CC1 ZINC001236552034 1055180221 /nfs/dbraw/zinc/18/02/21/1055180221.db2.gz FUKCQKYWSMUWEC-WGSAOQKQSA-N 2 1 324.468 4.429 20 0 DIADMP CC(C)C[N@@H+](Cc1cccc(F)c1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236553031 1055180399 /nfs/dbraw/zinc/18/03/99/1055180399.db2.gz VRPPKMFUFIACHK-SHTZXODSSA-N 2 1 312.860 4.207 20 0 DIADMP CSc1cc(C)cc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236554742 1055182161 /nfs/dbraw/zinc/18/21/61/1055182161.db2.gz TXDZXZSSYXPCNP-IYARVYRRSA-N 2 1 320.546 4.445 20 0 DIADMP CC1=CC[C@@H](CC[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)C1(C)C ZINC001236553510 1055182346 /nfs/dbraw/zinc/18/23/46/1055182346.db2.gz YWJWJUARWULGKM-FHWLQOOXSA-N 2 1 304.522 4.351 20 0 DIADMP Cc1ccccc1C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236556560 1055184715 /nfs/dbraw/zinc/18/47/15/1055184715.db2.gz WPJMGQXNDXTATP-MEMLXQNLSA-N 2 1 308.469 4.267 20 0 DIADMP Cc1ccc(CCC[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236566204 1055185486 /nfs/dbraw/zinc/18/54/86/1055185486.db2.gz FQNZMCWEUJDINH-SAABIXHNSA-N 2 1 304.478 4.035 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cn2)C2CCCCC2)CC1 ZINC001236565296 1055185508 /nfs/dbraw/zinc/18/55/08/1055185508.db2.gz CSJKZCVCHXUFLW-RZDIXWSQSA-N 2 1 321.896 4.140 20 0 DIADMP C[C@H](C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236566097 1055185576 /nfs/dbraw/zinc/18/55/76/1055185576.db2.gz BPLPDJORGUDBFC-YVWKXTFCSA-N 2 1 300.490 4.305 20 0 DIADMP Cc1ccccc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236565665 1055186422 /nfs/dbraw/zinc/18/64/22/1055186422.db2.gz LTLJIOZMHKQMIW-KESTWPANSA-N 2 1 300.490 4.400 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc3ccccc3[nH]2)C2CCCC2)CC1 ZINC001236567047 1055187668 /nfs/dbraw/zinc/18/76/68/1055187668.db2.gz RNAGUAJDGNLKJY-RUCARUNLSA-N 2 1 311.473 4.182 20 0 DIADMP C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000381859787 1055187903 /nfs/dbraw/zinc/18/79/03/1055187903.db2.gz IJCYTRSVIDTDFG-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(Cl)c2F)C2CCCC2)CC1 ZINC001236567689 1055188251 /nfs/dbraw/zinc/18/82/51/1055188251.db2.gz ZJOSJUJRPHWCGV-KOMQPUFPSA-N 2 1 324.871 4.494 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)n1 ZINC001236568366 1055189546 /nfs/dbraw/zinc/18/95/46/1055189546.db2.gz XISDXVZTFAVESK-KESTWPANSA-N 2 1 315.505 4.103 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572453 1055192860 /nfs/dbraw/zinc/19/28/60/1055192860.db2.gz POSMLBRGNWIUII-KOMQPUFPSA-N 2 1 306.881 4.273 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(C)cc1O ZINC001236572109 1055193099 /nfs/dbraw/zinc/19/30/99/1055193099.db2.gz SDZBVLQSSUNPMV-UAPYVXQJSA-N 2 1 316.489 4.024 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)c(O)c2)C2CCCC2)CC1 ZINC001236572304 1055193247 /nfs/dbraw/zinc/19/32/47/1055193247.db2.gz UVTZGIAFARQLRF-KOMQPUFPSA-N 2 1 322.880 4.060 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2coc3ccccc23)C2CCCC2)CC1 ZINC001236572274 1055193287 /nfs/dbraw/zinc/19/32/87/1055193287.db2.gz UPLPEDJQMRBKFJ-SAABIXHNSA-N 2 1 312.457 4.447 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2Cl)C2CCCC2)CC1 ZINC001236572001 1055193541 /nfs/dbraw/zinc/19/35/41/1055193541.db2.gz PHRXXHGBNMIWRD-KOMQPUFPSA-N 2 1 324.871 4.494 20 0 DIADMP C[C@@H]([NH2+]C1CCCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381945454 1055193509 /nfs/dbraw/zinc/19/35/09/1055193509.db2.gz YXIYNDNPVYXKBT-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2csc(Cl)c2)C2CCCC2)CC1 ZINC001236572539 1055193668 /nfs/dbraw/zinc/19/36/68/1055193668.db2.gz ZJNATHMMQZFKIH-CTYIDZIISA-N 2 1 312.910 4.416 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381982994 1055195241 /nfs/dbraw/zinc/19/52/41/1055195241.db2.gz NJURHLPIJIILJH-RLLQIKCJSA-N 2 1 300.490 4.067 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccsc2Cl)C2CCCC2)CC1 ZINC001236574292 1055195259 /nfs/dbraw/zinc/19/52/59/1055195259.db2.gz MVAKCKDOAQWDFM-CTYIDZIISA-N 2 1 312.910 4.416 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@H+](C2CCC2)C2CC[NH2+]CC2)c1 ZINC001236637781 1055207703 /nfs/dbraw/zinc/20/77/03/1055207703.db2.gz VRKKOUOHSSGMDG-UHFFFAOYSA-N 2 1 306.881 4.063 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)c1 ZINC001236637781 1055207709 /nfs/dbraw/zinc/20/77/09/1055207709.db2.gz VRKKOUOHSSGMDG-UHFFFAOYSA-N 2 1 306.881 4.063 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCC2CCCCC2)Cc2ccccn2)CC1 ZINC001236662283 1055217773 /nfs/dbraw/zinc/21/77/73/1055217773.db2.gz BLOCYPUORQZFGI-KESTWPANSA-N 2 1 315.505 4.124 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cccc3sccc32)CC1 ZINC001236679903 1055223954 /nfs/dbraw/zinc/22/39/54/1055223954.db2.gz QUQUWLWPYCLCPO-UHFFFAOYSA-N 2 1 316.514 4.454 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236701418 1055233380 /nfs/dbraw/zinc/23/33/80/1055233380.db2.gz SLFFWSWWMLGKKR-WDSOQIARSA-N 2 1 318.505 4.203 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236714390 1055241920 /nfs/dbraw/zinc/24/19/20/1055241920.db2.gz ODIHCXPONGTXMB-MHCKVMFOSA-N 2 1 300.490 4.423 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2cccs2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236726708 1055243656 /nfs/dbraw/zinc/24/36/56/1055243656.db2.gz NVEZNMYIFSSVFK-IYARVYRRSA-N 2 1 314.498 4.329 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)CC2CCCC2)CC1 ZINC001236741248 1055246777 /nfs/dbraw/zinc/24/67/77/1055246777.db2.gz BISJQXCECBKKGV-WGSAOQKQSA-N 2 1 304.453 4.088 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccs2)Cc2ccc(F)cc2)CC1 ZINC001236741622 1055247863 /nfs/dbraw/zinc/24/78/63/1055247863.db2.gz FYEHVNKXZNLMMW-QAQDUYKDSA-N 2 1 318.461 4.159 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc2[nH]ccc2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767501 1055250247 /nfs/dbraw/zinc/25/02/47/1055250247.db2.gz NIYNRLDARNPDHV-IYARVYRRSA-N 2 1 313.489 4.286 20 0 DIADMP Cc1ccnc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236755153 1055251158 /nfs/dbraw/zinc/25/11/58/1055251158.db2.gz KUGLVFXXBKOKIP-KESTWPANSA-N 2 1 315.505 4.042 20 0 DIADMP Cc1cccc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)n1 ZINC001236755374 1055251795 /nfs/dbraw/zinc/25/17/95/1055251795.db2.gz ORHDQRCXRUZSSB-KESTWPANSA-N 2 1 315.505 4.042 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1F ZINC001236766973 1055252141 /nfs/dbraw/zinc/25/21/41/1055252141.db2.gz JMEWPCDTMVHNKK-WKILWMFISA-N 2 1 324.459 4.391 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(Cl)ccc1N)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236766182 1055252519 /nfs/dbraw/zinc/25/25/19/1055252519.db2.gz DXOASFAOWPHEKA-WKILWMFISA-N 2 1 323.912 4.040 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)CC2CCSCC2)CC1 ZINC001236754011 1055252605 /nfs/dbraw/zinc/25/26/05/1055252605.db2.gz BKWDUOVABXEVBN-WGSAOQKQSA-N 2 1 324.578 4.282 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)c(O)c(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781664 1055254792 /nfs/dbraw/zinc/25/47/92/1055254792.db2.gz HAMXZXXAKXKTAC-UAPYVXQJSA-N 2 1 318.505 4.270 20 0 DIADMP Cc1cccc(CC[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236768089 1055255129 /nfs/dbraw/zinc/25/51/29/1055255129.db2.gz MRSFWZDMNYABQC-WGSAOQKQSA-N 2 1 302.506 4.156 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)sc1C ZINC001236779431 1055255285 /nfs/dbraw/zinc/25/52/85/1055255285.db2.gz JAHPJJWKMRUVEQ-WKILWMFISA-N 2 1 308.535 4.483 20 0 DIADMP COc1cc(C)cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236779272 1055255639 /nfs/dbraw/zinc/25/56/39/1055255639.db2.gz GVLVRBOTWRPCNQ-IYARVYRRSA-N 2 1 318.505 4.122 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(F)cc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783018 1055257125 /nfs/dbraw/zinc/25/71/25/1055257125.db2.gz XKFXDRHSBJYLGT-UAPYVXQJSA-N 2 1 306.469 4.395 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(F)cc(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782137 1055257243 /nfs/dbraw/zinc/25/72/43/1055257243.db2.gz OEKNMLCCFHFPSA-SAABIXHNSA-N 2 1 322.468 4.095 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(F)c(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781819 1055258404 /nfs/dbraw/zinc/25/84/04/1055258404.db2.gz JTKKDNQUOXYQPR-JCNLHEQBSA-N 2 1 322.468 4.095 20 0 DIADMP CCOc1ccc(C[N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236782260 1055258531 /nfs/dbraw/zinc/25/85/31/1055258531.db2.gz HPGLNLIOYBBAIK-UAPYVXQJSA-N 2 1 318.505 4.346 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(F)c(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782397 1055258665 /nfs/dbraw/zinc/25/86/65/1055258665.db2.gz QXHZGAPZYFUEPC-SAABIXHNSA-N 2 1 306.469 4.395 20 0 DIADMP CCC(CC)[N@@H+](Cc1c(F)cccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782954 1055259175 /nfs/dbraw/zinc/25/91/75/1055259175.db2.gz VNPHNHARHNEEFC-KOMQPUFPSA-N 2 1 322.468 4.095 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@@H+](Cc3cccc4c5ccccc5sc43)C[C@H]12 ZINC001236822102 1055277207 /nfs/dbraw/zinc/27/72/07/1055277207.db2.gz YGASEWOVONYHOP-DOPJRALCSA-N 2 1 322.477 4.224 20 0 DIADMP CCC[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@H]1CC[NH2+]C1 ZINC001236836488 1055282606 /nfs/dbraw/zinc/28/26/06/1055282606.db2.gz WHONKIOZXXHAJM-KRWDZBQOSA-N 2 1 322.452 4.408 20 0 DIADMP CCC[N@H+](Cc1ccccc1-c1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC001236836528 1055284308 /nfs/dbraw/zinc/28/43/08/1055284308.db2.gz WUNYGNUIQXFRAY-GOSISDBHSA-N 2 1 308.469 4.175 20 0 DIADMP CCC[N@H+](Cc1cccc(-c2ccccc2)c1C)C[C@@H]1CC[NH2+]C1 ZINC001236843207 1055286711 /nfs/dbraw/zinc/28/67/11/1055286711.db2.gz LPHOTFBGBOBUMI-LJQANCHMSA-N 2 1 322.496 4.484 20 0 DIADMP CCC[N@H+](Cc1ccc(Cc2ccccc2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236844509 1055290225 /nfs/dbraw/zinc/29/02/25/1055290225.db2.gz VKOHGBKAUVDOTQ-QFIPXVFZSA-N 2 1 322.496 4.099 20 0 DIADMP CC(C)[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)[C@@H](C)c1ccccc1 ZINC001236861292 1055295102 /nfs/dbraw/zinc/29/51/02/1055295102.db2.gz ZEQPEUXWJZIVSK-HNNXBMFYSA-N 2 1 314.498 4.365 20 0 DIADMP C[C@H]([NH2+]C/C=C\c1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383944346 1055308912 /nfs/dbraw/zinc/30/89/12/1055308912.db2.gz VQHYBIOYLBHOTP-NQMAKTNFSA-N 2 1 320.480 4.200 20 0 DIADMP Clc1cc(C[N@H+]2CCCC3(CCC3)C2)ccc1-n1ccnc1 ZINC001236908219 1055310333 /nfs/dbraw/zinc/31/03/33/1055310333.db2.gz DWZUPTPQAVFBQD-UHFFFAOYSA-N 2 1 315.848 4.292 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(F)c3ccoc32)CC1 ZINC001236907140 1055312117 /nfs/dbraw/zinc/31/21/17/1055312117.db2.gz WMHOMQALODJSIQ-UHFFFAOYSA-N 2 1 318.436 4.124 20 0 DIADMP Clc1cc(C[N@H+]2CC[C@H]3CCC[C@@H]3C2)ccc1-n1ccnc1 ZINC001236906742 1055312155 /nfs/dbraw/zinc/31/21/55/1055312155.db2.gz MNJOLOKDWMBBTD-HZPDHXFCSA-N 2 1 315.848 4.148 20 0 DIADMP Clc1cc(C[N@H+]2CC[C@H]3CCC[C@H]3C2)ccc1-n1ccnc1 ZINC001236906738 1055312314 /nfs/dbraw/zinc/31/23/14/1055312314.db2.gz MNJOLOKDWMBBTD-CVEARBPZSA-N 2 1 315.848 4.148 20 0 DIADMP [NH3+]CCCC[N@H+]1CCC[C@@H]1c1cc(C(F)(F)F)ccc1Cl ZINC001237057021 1055353659 /nfs/dbraw/zinc/35/36/59/1055353659.db2.gz FFMZHKODYBZLCJ-CQSZACIVSA-N 2 1 320.786 4.235 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@@](C)(C[NH3+])C2)cc1 ZINC001237057842 1055353710 /nfs/dbraw/zinc/35/37/10/1055353710.db2.gz NUNXBEGMUIKUKV-PXNSSMCTSA-N 2 1 302.506 4.049 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)C1 ZINC001237057944 1055354165 /nfs/dbraw/zinc/35/41/65/1055354165.db2.gz ORUGWNKYRKBOLF-FQEVSTJZSA-N 2 1 310.441 4.040 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@](C)(C[NH3+])C2)cc1 ZINC001237058508 1055356093 /nfs/dbraw/zinc/35/60/93/1055356093.db2.gz QEEJXQSBVJPROL-HXUWFJFHSA-N 2 1 318.505 4.207 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)s2)C1 ZINC001237056839 1055356206 /nfs/dbraw/zinc/35/62/06/1055356206.db2.gz KBDDXZLBBYADAJ-MRXNPFEDSA-N 2 1 306.500 4.037 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCC[C@](C)(C[NH3+])C3)c2)cc1 ZINC001237056148 1055356518 /nfs/dbraw/zinc/35/65/18/1055356518.db2.gz GTEGJNPNWRMXHK-OAQYLSRUSA-N 2 1 324.468 4.348 20 0 DIADMP CC(C)(C)c1[nH]c2ccccc2c1C[N@H+]1CCC[C@@](C)(C[NH3+])C1 ZINC001237056035 1055356736 /nfs/dbraw/zinc/35/67/36/1055356736.db2.gz FUAMPSPHNNXKEU-FQEVSTJZSA-N 2 1 313.489 4.026 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC001237059858 1055358117 /nfs/dbraw/zinc/35/81/17/1055358117.db2.gz WJLOEGDGBKCNSX-HXUWFJFHSA-N 2 1 308.425 4.147 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC[C@@](C)(C[NH3+])C1 ZINC001237080618 1055362233 /nfs/dbraw/zinc/36/22/33/1055362233.db2.gz HEIXCHBXPNEOSZ-NRFANRHFSA-N 2 1 324.468 4.348 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(-c2ccsc2)c1 ZINC001237081458 1055363831 /nfs/dbraw/zinc/36/38/31/1055363831.db2.gz HYAAUZZRUDPBDK-QNBRMCRTSA-N 2 1 312.482 4.117 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(-c2ccc(F)cc2)c1 ZINC001237082752 1055367425 /nfs/dbraw/zinc/36/74/25/1055367425.db2.gz WHMPCMWDPJUKBZ-QKUVIELKSA-N 2 1 324.443 4.194 20 0 DIADMP Cc1c(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)ccc(F)c1F ZINC001237161504 1055389845 /nfs/dbraw/zinc/38/98/45/1055389845.db2.gz LFDNVXPLVIHOFL-DLBZAZTESA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)ccc(F)c1F ZINC001237161504 1055389859 /nfs/dbraw/zinc/38/98/59/1055389859.db2.gz LFDNVXPLVIHOFL-DLBZAZTESA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)ccc(F)c1F ZINC001237161504 1055389870 /nfs/dbraw/zinc/38/98/70/1055389870.db2.gz LFDNVXPLVIHOFL-DLBZAZTESA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(C[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)ccc(F)c1F ZINC001237161504 1055389882 /nfs/dbraw/zinc/38/98/82/1055389882.db2.gz LFDNVXPLVIHOFL-DLBZAZTESA-N 2 1 322.443 4.112 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccc3ccccc3c2)CC[N@H+]1C ZINC000624267317 1055398547 /nfs/dbraw/zinc/39/85/47/1055398547.db2.gz JYTCGNYBOVUVHE-OXQOHEQNSA-N 2 1 310.485 4.190 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)CC1 ZINC001237274975 1055412665 /nfs/dbraw/zinc/41/26/65/1055412665.db2.gz IIVRWHYAKHBRHX-UYAOXDASSA-N 2 1 324.512 4.116 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](C1CCCC1)C1CCN(C)CC1 ZINC001237333529 1055432204 /nfs/dbraw/zinc/43/22/04/1055432204.db2.gz NDTOGZGBHDSPQJ-UHFFFAOYSA-N 2 1 314.517 4.396 20 0 DIADMP c1cc(-c2csc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)c2)cs1 ZINC001237410685 1055450684 /nfs/dbraw/zinc/45/06/84/1055450684.db2.gz CTTVDRYXLDHBTA-CXAGYDPISA-N 2 1 318.511 4.051 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)c2)cs1 ZINC001237410685 1055450692 /nfs/dbraw/zinc/45/06/92/1055450692.db2.gz CTTVDRYXLDHBTA-CXAGYDPISA-N 2 1 318.511 4.051 20 0 DIADMP Cc1csc2sc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@@H]4C3)c(C)c12 ZINC001237407593 1055450960 /nfs/dbraw/zinc/45/09/60/1055450960.db2.gz YCDQNACTPDSCCK-ZIAGYGMSSA-N 2 1 320.527 4.154 20 0 DIADMP Cc1c(Cl)cccc1C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC001620868636 1055495703 /nfs/dbraw/zinc/49/57/03/1055495703.db2.gz KORPSDLAJMLQBA-INIZCTEOSA-N 2 1 308.897 4.106 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001620872958 1055501785 /nfs/dbraw/zinc/50/17/85/1055501785.db2.gz LLIZUYUQANHCJX-NJDAHSKKSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001620898292 1055524334 /nfs/dbraw/zinc/52/43/34/1055524334.db2.gz OEGWQIUVFDRBNO-HNNXBMFYSA-N 2 1 300.446 4.095 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CC[C@@H]4CCC[C@@H]4C3)cc21 ZINC001237875566 1055548986 /nfs/dbraw/zinc/54/89/86/1055548986.db2.gz APZDLNBREZTJRG-PKOBYXMFSA-N 2 1 310.485 4.310 20 0 DIADMP CC[N@@H+](Cc1ccc2c(c1)C(C(C)C)=[NH+]CC2)Cc1ccccn1 ZINC001237884475 1055550530 /nfs/dbraw/zinc/55/05/30/1055550530.db2.gz BTWASSLJWJDNHA-UHFFFAOYSA-N 2 1 321.468 4.105 20 0 DIADMP C[N@H+](CCSC(C)(C)C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000801931932 1055550586 /nfs/dbraw/zinc/55/05/86/1055550586.db2.gz DUWCIGHNZFSVFG-UHFFFAOYSA-N 2 1 320.546 4.115 20 0 DIADMP C[N@@H+](CCSC(C)(C)C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000801931932 1055550596 /nfs/dbraw/zinc/55/05/96/1055550596.db2.gz DUWCIGHNZFSVFG-UHFFFAOYSA-N 2 1 320.546 4.115 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+](C)Cc3ccsc3)cc21 ZINC001237886000 1055552176 /nfs/dbraw/zinc/55/21/76/1055552176.db2.gz JREGEODKERSLOW-UHFFFAOYSA-N 2 1 312.482 4.381 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C/C=C/c1ccc(F)cc1F ZINC001620945971 1055560755 /nfs/dbraw/zinc/56/07/55/1055560755.db2.gz BRJJXENPYCVBGS-QWNKOJSDSA-N 2 1 322.443 4.078 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@H+](Cc1ccccn1)C1CCCCC1 ZINC001238119646 1055608587 /nfs/dbraw/zinc/60/85/87/1055608587.db2.gz PEVJJIFLMRAVIH-UHFFFAOYSA-N 2 1 320.440 4.064 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2Cc2cccc3c[nH+]cn32)c1 ZINC001238116011 1055609450 /nfs/dbraw/zinc/60/94/50/1055609450.db2.gz ONGNFYGKIDTPEQ-FQEVSTJZSA-N 2 1 305.425 4.288 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2cccc3c[nH+]cn32)c1 ZINC001238116011 1055609458 /nfs/dbraw/zinc/60/94/58/1055609458.db2.gz ONGNFYGKIDTPEQ-FQEVSTJZSA-N 2 1 305.425 4.288 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCC2(C1)CC[NH+](CCCOC)CC2 ZINC001278208525 1055629779 /nfs/dbraw/zinc/62/97/79/1055629779.db2.gz XSZVEQRSNVOHDR-LJQANCHMSA-N 2 1 324.553 4.027 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@@H+]2CCCC2(C)C)C[C@@H](c2ccccc2)C1 ZINC001620967789 1055715524 /nfs/dbraw/zinc/71/55/24/1055715524.db2.gz ZQSGCTAXAJSPFX-YSIASYRMSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@H+]2CCCC2(C)C)C[C@@H](c2ccccc2)C1 ZINC001620967789 1055715533 /nfs/dbraw/zinc/71/55/33/1055715533.db2.gz ZQSGCTAXAJSPFX-YSIASYRMSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[NH+]1CCC([NH2+]Cc2cccc(Oc3ccccc3)c2)CC1 ZINC000061016349 1055859266 /nfs/dbraw/zinc/85/92/66/1055859266.db2.gz XJOUSZUHFGZBQE-UHFFFAOYSA-N 2 1 324.468 4.443 20 0 DIADMP CCC[NH+]1CCC([NH2+]Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000061016361 1055860491 /nfs/dbraw/zinc/86/04/91/1055860491.db2.gz ZURQAMJLCBRBPW-UHFFFAOYSA-N 2 1 308.469 4.318 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H](c2ccccc2)C2CCCC2)CC1(C)C ZINC001620751331 1055925319 /nfs/dbraw/zinc/92/53/19/1055925319.db2.gz JNNLDKWTAAAHIY-RBUKOAKNSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cs1 ZINC001620760265 1055931197 /nfs/dbraw/zinc/93/11/97/1055931197.db2.gz WNZLRUQYMGJKHA-UHFFFAOYSA-N 2 1 306.519 4.191 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCC2)CC1(C)C ZINC001620764472 1055935996 /nfs/dbraw/zinc/93/59/96/1055935996.db2.gz SUKBCBKHDGZSQT-KRWDZBQOSA-N 2 1 320.908 4.224 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C/C=C/c2cccc(F)c2)c1 ZINC001620778448 1055947029 /nfs/dbraw/zinc/94/70/29/1055947029.db2.gz UQZFQNKEHPWBAA-UXBLZVDNSA-N 2 1 312.432 4.080 20 0 DIADMP CC[C@H]1CCC[N@@H+](C(C)(C)C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC001620791155 1055967567 /nfs/dbraw/zinc/96/75/67/1055967567.db2.gz AHKSNKSBHLHXEB-IHPCNDPISA-N 2 1 314.517 4.280 20 0 DIADMP CC[C@H]1CCC[N@H+](C(C)(C)C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC001620791155 1055967578 /nfs/dbraw/zinc/96/75/78/1055967578.db2.gz AHKSNKSBHLHXEB-IHPCNDPISA-N 2 1 314.517 4.280 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)CC[N@@H+]1Cc1ccccc1 ZINC001621007646 1055974296 /nfs/dbraw/zinc/97/42/96/1055974296.db2.gz ICTXILJOLKYGHB-RQXATKFSSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC001621007646 1055974302 /nfs/dbraw/zinc/97/43/02/1055974302.db2.gz ICTXILJOLKYGHB-RQXATKFSSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(F)cc2Cl)C1 ZINC001620724622 1055987107 /nfs/dbraw/zinc/98/71/07/1055987107.db2.gz FSGFLFGYHPPJOS-AWEZNQCLSA-N 2 1 312.860 4.081 20 0 DIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000671766335 1056006858 /nfs/dbraw/zinc/00/68/58/1056006858.db2.gz GXFUUOWUSUGPLM-QZTJIDSGSA-N 2 1 315.505 4.270 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccccc2C[NH+](C)C)nc1 ZINC001239681459 1056023100 /nfs/dbraw/zinc/02/31/00/1056023100.db2.gz HHDMHGNYGJIDNO-OAQYLSRUSA-N 2 1 323.484 4.357 20 0 DIADMP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(Cl)o2)c1 ZINC000069716206 1056025611 /nfs/dbraw/zinc/02/56/11/1056025611.db2.gz RQKQPBJWWWYVQG-UHFFFAOYSA-N 2 1 306.837 4.065 20 0 DIADMP C[N@H+]1CC[C@H](c2ccc(-c3ccc(C[NH+]4CCCC4)cc3)cc2)C1 ZINC001240062385 1056298166 /nfs/dbraw/zinc/29/81/66/1056298166.db2.gz ULXLMFMAATVIFE-QFIPXVFZSA-N 2 1 320.480 4.369 20 0 DIADMP CC[C@@H](C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)[NH+]1CCCC1 ZINC000474473830 1056318568 /nfs/dbraw/zinc/31/85/68/1056318568.db2.gz GNYFNKPVQAFBQQ-LMPOIIKSSA-N 2 1 320.443 4.208 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474727504 1056344646 /nfs/dbraw/zinc/34/46/46/1056344646.db2.gz REZWACPMZOUWQQ-RFQIPJPRSA-N 2 1 314.926 4.213 20 0 DIADMP CC(C)[NH+](CCC[NH2+]C/C=C\c1ccc(F)cc1F)C(C)C ZINC001620828400 1056538277 /nfs/dbraw/zinc/53/82/77/1056538277.db2.gz REQRWNCRVJHGRL-ALCCZGGFSA-N 2 1 310.432 4.077 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)C[C@@H](C)C1 ZINC001615577637 1056541168 /nfs/dbraw/zinc/54/11/68/1056541168.db2.gz JMRAUKQJYIBVEL-FUMNGEBKSA-N 2 1 306.538 4.399 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c(C)c1C ZINC001615791573 1056574433 /nfs/dbraw/zinc/57/44/33/1056574433.db2.gz JFCSUTMFWCBZJX-DJJJIMSYSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1C ZINC001615791573 1056574443 /nfs/dbraw/zinc/57/44/43/1056574443.db2.gz JFCSUTMFWCBZJX-DJJJIMSYSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)c(C)c1C ZINC001615791573 1056574455 /nfs/dbraw/zinc/57/44/55/1056574455.db2.gz JFCSUTMFWCBZJX-DJJJIMSYSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)c(C)c1C ZINC001615791573 1056574466 /nfs/dbraw/zinc/57/44/66/1056574466.db2.gz JFCSUTMFWCBZJX-DJJJIMSYSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615845997 1056584112 /nfs/dbraw/zinc/58/41/12/1056584112.db2.gz FJIZRWZKYBJNSI-JBACZVJFSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615845997 1056584122 /nfs/dbraw/zinc/58/41/22/1056584122.db2.gz FJIZRWZKYBJNSI-JBACZVJFSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615845997 1056584135 /nfs/dbraw/zinc/58/41/35/1056584135.db2.gz FJIZRWZKYBJNSI-JBACZVJFSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)[C@@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001615861597 1056586564 /nfs/dbraw/zinc/58/65/64/1056586564.db2.gz KSOQLWAVQFMHPZ-HXUWFJFHSA-N 2 1 300.490 4.150 20 0 DIADMP CC(C)[C@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001615861595 1056588721 /nfs/dbraw/zinc/58/87/21/1056588721.db2.gz KSOQLWAVQFMHPZ-FQEVSTJZSA-N 2 1 300.490 4.150 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC001616382371 1056647409 /nfs/dbraw/zinc/64/74/09/1056647409.db2.gz KJDVDABZAPZJNF-PMACEKPBSA-N 2 1 300.490 4.382 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@@H+](CCC[NH+]3CCCCC3)CC2)cc1 ZINC001616576212 1056680126 /nfs/dbraw/zinc/68/01/26/1056680126.db2.gz JUGGWSLJBWGKKY-GOSISDBHSA-N 2 1 318.480 4.271 20 0 DIADMP C[C@H]1CCC[C@H](CC[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001616879868 1056731472 /nfs/dbraw/zinc/73/14/72/1056731472.db2.gz GZTHYCOLEHZRRZ-ZWKOTPCHSA-N 2 1 302.506 4.396 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC001617197885 1056790807 /nfs/dbraw/zinc/79/08/07/1056790807.db2.gz FXGPYKUDKGFUHX-QFBILLFUSA-N 2 1 302.506 4.461 20 0 DIADMP Cc1ccccc1[C@@H](C)[N@H+](CC[C@@H]1CCC[NH+]1C)CC(C)C ZINC001617888628 1056897864 /nfs/dbraw/zinc/89/78/64/1056897864.db2.gz UTMLCPFRZNFBCA-MOPGFXCFSA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH+](CC[C@@H]1CCC[N@@H+]1C)CC(C)C ZINC001617888628 1056897871 /nfs/dbraw/zinc/89/78/71/1056897871.db2.gz UTMLCPFRZNFBCA-MOPGFXCFSA-N 2 1 302.506 4.498 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH+](CC[C@@H]1CCC[N@H+]1C)CC(C)C ZINC001617888628 1056897876 /nfs/dbraw/zinc/89/78/76/1056897876.db2.gz UTMLCPFRZNFBCA-MOPGFXCFSA-N 2 1 302.506 4.498 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]CCCCn1cc[nH+]c1C ZINC000657892412 1057070821 /nfs/dbraw/zinc/07/08/21/1057070821.db2.gz YQTJJRBWQSQVOI-GOSISDBHSA-N 2 1 319.880 4.236 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000347895444 1057244589 /nfs/dbraw/zinc/24/45/89/1057244589.db2.gz FIMIUCRVZNHYCC-UHFFFAOYSA-N 2 1 311.473 4.145 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccn1 ZINC000766082371 1057298215 /nfs/dbraw/zinc/29/82/15/1057298215.db2.gz RREJIANLCBTMJL-HXUWFJFHSA-N 2 1 315.505 4.165 20 0 DIADMP C[C@H](c1ccncc1)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000675641662 1057391299 /nfs/dbraw/zinc/39/12/99/1057391299.db2.gz RDJZYEAINAYOGW-ZWKOTPCHSA-N 2 1 315.505 4.119 20 0 DIADMP C[NH+](C)C1(C[NH2+][C@H](CCC2CCCC2)C(C)(C)C)CCOCC1 ZINC000675747192 1057408842 /nfs/dbraw/zinc/40/88/42/1057408842.db2.gz HZLGIWGHRVJUTR-GOSISDBHSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccncc2)cc1 ZINC000675926900 1057432942 /nfs/dbraw/zinc/43/29/42/1057432942.db2.gz IUBNEFOPPJGJQM-CVEARBPZSA-N 2 1 320.440 4.030 20 0 DIADMP CCC[N@H+]1CCCC[C@H]1c1ccc(-c2ccc3c(c2)C[NH2+]C3)nc1 ZINC001242676169 1057443835 /nfs/dbraw/zinc/44/38/35/1057443835.db2.gz OBJXOCLZLPYZJA-NRFANRHFSA-N 2 1 321.468 4.289 20 0 DIADMP Cc1nc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c(C)s1 ZINC000676490321 1057479383 /nfs/dbraw/zinc/47/93/83/1057479383.db2.gz NINLMLZSHSVGBE-KGLIPLIRSA-N 2 1 309.523 4.065 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCCNc2ccccc21)C1CCCCC1 ZINC000347923603 1057552428 /nfs/dbraw/zinc/55/24/28/1057552428.db2.gz OOBKXBIIQOZDNZ-FQEVSTJZSA-N 2 1 315.505 4.178 20 0 DIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000671770032 1057560656 /nfs/dbraw/zinc/56/06/56/1057560656.db2.gz QFCTYLMHRQQYSL-FHWLQOOXSA-N 2 1 320.908 4.296 20 0 DIADMP CCCC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC)cc1 ZINC000166482570 1057583277 /nfs/dbraw/zinc/58/32/77/1057583277.db2.gz RVZXKFSKFWJTGN-NSHGMRRFSA-N 2 1 316.489 4.143 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000161660954 1057599853 /nfs/dbraw/zinc/59/98/53/1057599853.db2.gz SGWNKSIGJIFGTR-GGPKGHCWSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccoc2)C1 ZINC000727466743 1057655011 /nfs/dbraw/zinc/65/50/11/1057655011.db2.gz FAOGZKBNABYTRS-CALCHBBNSA-N 2 1 312.457 4.047 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]Cc2ccoc2)C1 ZINC000727466743 1057655012 /nfs/dbraw/zinc/65/50/12/1057655012.db2.gz FAOGZKBNABYTRS-CALCHBBNSA-N 2 1 312.457 4.047 20 0 DIADMP c1ccc(-c2cccc(C[N@@H+]3CC[C@@H](C[NH+]4CCCC4)C3)c2)cc1 ZINC000536662727 1057673889 /nfs/dbraw/zinc/67/38/89/1057673889.db2.gz VKTIHMMEJNHITH-FQEVSTJZSA-N 2 1 320.480 4.271 20 0 DIADMP Fc1ccccc1[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)C1CCCC1 ZINC000166825903 1057677891 /nfs/dbraw/zinc/67/78/91/1057677891.db2.gz GHKQSYRWIDZRBS-SQGPQFPESA-N 2 1 316.464 4.273 20 0 DIADMP Cc1cc(-c2ccc(C3CC[NH+](C)CC3)cc2)cn2cc[nH+]c12 ZINC001243655084 1057744906 /nfs/dbraw/zinc/74/49/06/1057744906.db2.gz RFUGMQYXOZSKOW-UHFFFAOYSA-N 2 1 305.425 4.119 20 0 DIADMP C(=C/C1CC[NH2+]CC1)\c1cccc2c1C[N@@H+](Cc1ccccc1)C2 ZINC001243895542 1057800622 /nfs/dbraw/zinc/80/06/22/1057800622.db2.gz CSAWCVHHFGQTFT-MDZDMXLPSA-N 2 1 318.464 4.215 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2-c2c(F)cccc2C2CC2)CC1 ZINC001244120719 1057876138 /nfs/dbraw/zinc/87/61/38/1057876138.db2.gz UCTUYJQASXFWPD-UHFFFAOYSA-N 2 1 324.443 4.293 20 0 DIADMP C[N@H+]1CC[C@@H](c2ccc(-c3ccc([C@H]4CCC[NH2+]4)cc3)cc2)C1 ZINC001245355652 1058151086 /nfs/dbraw/zinc/15/10/86/1058151086.db2.gz JPOWGFSYHNKZCH-NHCUHLMSSA-N 2 1 306.453 4.197 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@H](c3ccncc3)C3CCC3)CC[NH2+]2)cc1 ZINC001550351847 1058339385 /nfs/dbraw/zinc/33/93/85/1058339385.db2.gz SLDUAVMSHINFEF-HKBOAZHASA-N 2 1 321.468 4.006 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[C@H]2c2ccccc2)C1 ZINC001550505173 1058340949 /nfs/dbraw/zinc/34/09/49/1058340949.db2.gz VBFSLLWUHCLDNI-ZRNYENFQSA-N 2 1 323.484 4.230 20 0 DIADMP CCC[N@H+]1CCCC[C@H]1c1ccc(-c2ccc3c[nH+]cn3c2)nc1 ZINC001245898754 1058605952 /nfs/dbraw/zinc/60/59/52/1058605952.db2.gz WORLTKZSSQSYEW-FQEVSTJZSA-N 2 1 320.440 4.333 20 0 DIADMP c1ccc(C([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)c2ccccc2)cc1 ZINC001246071208 1058664110 /nfs/dbraw/zinc/66/41/10/1058664110.db2.gz IVZFGVOWPSCLTF-PMOLBWCYSA-N 2 1 306.453 4.039 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC001246081314 1058670690 /nfs/dbraw/zinc/67/06/90/1058670690.db2.gz MSMNFXKEQDIARA-FUHWJXTLSA-N 2 1 304.453 4.097 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)ccc1Cl ZINC001246115969 1058685043 /nfs/dbraw/zinc/68/50/43/1058685043.db2.gz LWFKTTZZQGDIOD-ZYHUDNBSSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1Cl ZINC001246162848 1058706187 /nfs/dbraw/zinc/70/61/87/1058706187.db2.gz GRJZWFJYDREPSY-CABCVRRESA-N 2 1 306.881 4.446 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246173573 1058715094 /nfs/dbraw/zinc/71/50/94/1058715094.db2.gz BDMNVDUKPBWMHB-UYAOXDASSA-N 2 1 324.443 4.206 20 0 DIADMP CCC1CCC([NH2+][C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CC1 ZINC001246171214 1058717510 /nfs/dbraw/zinc/71/75/10/1058717510.db2.gz KXOAEXHTLJFKPM-ZLJKYQPZSA-N 2 1 318.480 4.486 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@@H]1CCCC[NH2+]1 ZINC001246174869 1058718805 /nfs/dbraw/zinc/71/88/05/1058718805.db2.gz FOLAFDYFDDTCBJ-OCCSQVGLSA-N 2 1 315.288 4.046 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246189339 1058729315 /nfs/dbraw/zinc/72/93/15/1058729315.db2.gz CCSMZLNHMPTWGW-UYAOXDASSA-N 2 1 324.468 4.345 20 0 DIADMP C[C@@]1([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CCC[NH2+]C1 ZINC001246187001 1058731459 /nfs/dbraw/zinc/73/14/59/1058731459.db2.gz FHQXTDRYXNTZGL-VMWRSERWSA-N 2 1 306.881 4.098 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c(C)c1 ZINC001246185949 1058732084 /nfs/dbraw/zinc/73/20/84/1058732084.db2.gz XLAAMPLIAAQCRW-PZJWPPBQSA-N 2 1 308.469 4.195 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246185421 1058732437 /nfs/dbraw/zinc/73/24/37/1058732437.db2.gz WEBFENQSQISXQT-UIFIKXQLSA-N 2 1 324.443 4.204 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]C2c3ccccc3-c3ccccc32)CC[NH2+]1 ZINC001246201445 1058740997 /nfs/dbraw/zinc/74/09/97/1058740997.db2.gz UZUYRNJDBFESKV-MGPUTAFESA-N 2 1 306.453 4.123 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(F)c(Cl)c2)CC[NH2+]1 ZINC001246211506 1058743418 /nfs/dbraw/zinc/74/34/18/1058743418.db2.gz KFPIFVQHCVLYSF-BPLDGKMQSA-N 2 1 312.860 4.441 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccc(F)c(Cl)c1 ZINC001246212853 1058745656 /nfs/dbraw/zinc/74/56/56/1058745656.db2.gz OLNFOYFYMXCYKS-AXAPSJFSSA-N 2 1 312.860 4.296 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccc(Cl)c(F)c1 ZINC001246215658 1058747901 /nfs/dbraw/zinc/74/79/01/1058747901.db2.gz ZYDBCWRUNKFPFV-PVXIVEMSSA-N 2 1 312.860 4.296 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246214349 1058747943 /nfs/dbraw/zinc/74/79/43/1058747943.db2.gz ZTQYMYOGAHDYKS-HZEGPAAWSA-N 2 1 324.443 4.073 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CCC2=CCCCC2)CC[NH2+]1 ZINC001246231239 1058752244 /nfs/dbraw/zinc/75/22/44/1058752244.db2.gz CZCSCXAALQWEJX-AZUAARDMSA-N 2 1 316.464 4.407 20 0 DIADMP CC[C@@H]1CC([NH2+]C2(c3cccc(Cl)c3)CC2)C[C@@H](CC)[NH2+]1 ZINC001246237314 1058760736 /nfs/dbraw/zinc/76/07/36/1058760736.db2.gz NNJJCJSGHKVTGD-HZPDHXFCSA-N 2 1 306.881 4.228 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]C2(c3cccc(Cl)c3)CC2)C[C@H](CC)[NH2+]1 ZINC001246237288 1058761294 /nfs/dbraw/zinc/76/12/94/1058761294.db2.gz NNJJCJSGHKVTGD-BJWYYQGGSA-N 2 1 306.881 4.228 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H](C)C2CCCC2)CC[NH2+]1 ZINC001246242934 1058763484 /nfs/dbraw/zinc/76/34/84/1058763484.db2.gz JYHAVBYGLWPVJS-FNHZYXHNSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H](C)C2CCCCC2)CC[NH2+]1 ZINC001246252353 1058771275 /nfs/dbraw/zinc/77/12/75/1058771275.db2.gz VNAZQYLRVATTEM-ZTNFWEORSA-N 2 1 318.480 4.486 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246253442 1058772254 /nfs/dbraw/zinc/77/22/54/1058772254.db2.gz MAOLCMVSYQDLMG-VCTAVGKDSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)cc(Cl)c1 ZINC001246255275 1058773678 /nfs/dbraw/zinc/77/36/78/1058773678.db2.gz VGJZPNFVNJYKRA-XGVBPZLHSA-N 2 1 313.272 4.317 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246255285 1058774875 /nfs/dbraw/zinc/77/48/75/1058774875.db2.gz VNJHYQWKUYLWIE-QMTHXVAHSA-N 2 1 301.261 4.175 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246262011 1058779222 /nfs/dbraw/zinc/77/92/22/1058779222.db2.gz GQEBVPHVIGGHPE-RTBURBONSA-N 2 1 312.432 4.144 20 0 DIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1Cl ZINC001246264562 1058781413 /nfs/dbraw/zinc/78/14/13/1058781413.db2.gz CGHYCWQSDKFACR-FUNVUKJBSA-N 2 1 313.272 4.101 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)C[C@H](C)[NH2+]1 ZINC001246271626 1058782946 /nfs/dbraw/zinc/78/29/46/1058782946.db2.gz NXVGFVHAERFUCO-PTEHBNRSSA-N 2 1 315.288 4.347 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2F)C(C)C)CC[NH2+]1 ZINC001246271086 1058783509 /nfs/dbraw/zinc/78/35/09/1058783509.db2.gz DVVNQWASDYNUOW-GJYPPUQNSA-N 2 1 306.469 4.423 20 0 DIADMP C[C@@H]1CC([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)C[C@@H](C)[NH2+]1 ZINC001246271621 1058784912 /nfs/dbraw/zinc/78/49/12/1058784912.db2.gz NXVGFVHAERFUCO-GHMZBOCLSA-N 2 1 315.288 4.347 20 0 DIADMP c1ccc([C@H]([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C2CC2)cc1 ZINC001246275239 1058790024 /nfs/dbraw/zinc/79/00/24/1058790024.db2.gz ZWOYLXBHFSLKQK-HBMCJLEFSA-N 2 1 306.453 4.221 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246274686 1058790976 /nfs/dbraw/zinc/79/09/76/1058790976.db2.gz ZTQYMYOGAHDYKS-ZIBCJSCZSA-N 2 1 324.443 4.073 20 0 DIADMP c1ccc([C@H]([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C2CC2)cc1 ZINC001246275240 1058791368 /nfs/dbraw/zinc/79/13/68/1058791368.db2.gz ZWOYLXBHFSLKQK-NJYVYQBISA-N 2 1 306.453 4.221 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccccc1F ZINC001246277266 1058794569 /nfs/dbraw/zinc/79/45/69/1058794569.db2.gz QKWRLNFQMVWPSE-JCGIZDLHSA-N 2 1 306.469 4.423 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246305243 1058814323 /nfs/dbraw/zinc/81/43/23/1058814323.db2.gz HKHNBVQWUYCDKB-GPMSIDNRSA-N 2 1 304.453 4.177 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246309838 1058815506 /nfs/dbraw/zinc/81/55/06/1058815506.db2.gz OOYXGRDSBRBGKM-HKUYNNGSSA-N 2 1 318.480 4.486 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246310038 1058820916 /nfs/dbraw/zinc/82/09/16/1058820916.db2.gz LYSQRTDHTISBDS-CJNGLKHVSA-N 2 1 308.897 4.331 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(OC)cc1 ZINC001246316479 1058825178 /nfs/dbraw/zinc/82/51/78/1058825178.db2.gz ZMCDAYBBKHGDNR-CEWLAPEOSA-N 2 1 324.468 4.229 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@H](CC)c2ccc(F)cc2F)CC[NH2+]1 ZINC001246316504 1058826087 /nfs/dbraw/zinc/82/60/87/1058826087.db2.gz GXNIKYLUZNHJJS-HDMKZQKVSA-N 2 1 310.432 4.316 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246318080 1058830413 /nfs/dbraw/zinc/83/04/13/1058830413.db2.gz PTRMZUBPWMEJFK-XUVXKRRUSA-N 2 1 312.432 4.360 20 0 DIADMP C[C@H](CC1CCCCC1)[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246317709 1058830722 /nfs/dbraw/zinc/83/07/22/1058830722.db2.gz XOFAEMYSYJTLON-LSTHTHJFSA-N 2 1 300.490 4.428 20 0 DIADMP c1cc2c(cccc2C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC001246318899 1058831970 /nfs/dbraw/zinc/83/19/70/1058831970.db2.gz TTZBFSCRCVVDBB-IEBWSBKVSA-N 2 1 322.477 4.484 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](CC(C)C)c2ccccn2)C[C@@H](CC)[NH2+]1 ZINC001246325071 1058835271 /nfs/dbraw/zinc/83/52/71/1058835271.db2.gz IAEAOBJYLPQWSZ-MDZRGWNJSA-N 2 1 303.494 4.068 20 0 DIADMP C[C@H]1[NH2+]CCC[C@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246329080 1058837017 /nfs/dbraw/zinc/83/70/17/1058837017.db2.gz OKCOMJBUAKYQQR-WGDNJCCTSA-N 2 1 306.881 4.096 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccn1 ZINC001246328517 1058839725 /nfs/dbraw/zinc/83/97/25/1058839725.db2.gz YORRYTGRDCTTRQ-MJGOQNOKSA-N 2 1 315.505 4.213 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246330138 1058840026 /nfs/dbraw/zinc/84/00/26/1058840026.db2.gz AVEQQSJIVRYDMA-PTKHLAPESA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccn1 ZINC001246328515 1058840289 /nfs/dbraw/zinc/84/02/89/1058840289.db2.gz YORRYTGRDCTTRQ-HKUYNNGSSA-N 2 1 315.505 4.213 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CC23CCCCC3)CC[NH2+]1 ZINC001246333546 1058845072 /nfs/dbraw/zinc/84/50/72/1058845072.db2.gz JVTFJCVZQSENFL-NZSAHSFTSA-N 2 1 316.464 4.240 20 0 DIADMP FC(F)(F)[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001246343016 1058854821 /nfs/dbraw/zinc/85/48/21/1058854821.db2.gz ULBQFYPIVKGFHN-KFWWJZLASA-N 2 1 318.427 4.010 20 0 DIADMP Cc1ccc(F)cc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246347497 1058862303 /nfs/dbraw/zinc/86/23/03/1058862303.db2.gz HETVLSOTFCPMDX-CVAIRZPRSA-N 2 1 312.432 4.278 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)C1CCCCC1 ZINC001246350360 1058862520 /nfs/dbraw/zinc/86/25/20/1058862520.db2.gz HEPXVXVOANJNRO-MOPGFXCFSA-N 2 1 300.490 4.428 20 0 DIADMP Fc1ccccc1C1([NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)CCC1 ZINC001246366231 1058875336 /nfs/dbraw/zinc/87/53/36/1058875336.db2.gz NHOPMJKRLXNUJQ-MRXNPFEDSA-N 2 1 316.464 4.249 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)C1 ZINC001246375862 1058882936 /nfs/dbraw/zinc/88/29/36/1058882936.db2.gz SSKXESJOSRGXFY-HNNXBMFYSA-N 2 1 320.908 4.477 20 0 DIADMP CCCCC[C@H](C)[NH2+]C1(c2ccccc2Cl)CC[NH2+]CC1 ZINC001246376621 1058883969 /nfs/dbraw/zinc/88/39/69/1058883969.db2.gz WMBGXJSQFJGYNP-HNNXBMFYSA-N 2 1 308.897 4.477 20 0 DIADMP COc1ccccc1C1([NH2+][C@H](C)CCCC(C)C)CC[NH2+]CC1 ZINC001246378380 1058884894 /nfs/dbraw/zinc/88/48/94/1058884894.db2.gz XNJUKLBUGSNRRK-QGZVFWFLSA-N 2 1 318.505 4.078 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246386103 1058892044 /nfs/dbraw/zinc/89/20/44/1058892044.db2.gz DQUFZMXQIDKVQA-AEFFLSMTSA-N 2 1 304.453 4.096 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](c2ccncc2Cl)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246391774 1058896426 /nfs/dbraw/zinc/89/64/26/1058896426.db2.gz GUXGMHUEFVHTRM-LBTNJELSSA-N 2 1 321.896 4.085 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246390615 1058898668 /nfs/dbraw/zinc/89/86/68/1058898668.db2.gz FASJHVOIOAKNOZ-SNRMKQJTSA-N 2 1 318.480 4.423 20 0 DIADMP Fc1ccccc1[C@@H](CC1CCC1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246405200 1058907857 /nfs/dbraw/zinc/90/78/57/1058907857.db2.gz OPZFPBBCKBRPIL-AXVVYFOYSA-N 2 1 316.464 4.320 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)C[C@H](C)[NH2+]1 ZINC001246410237 1058912279 /nfs/dbraw/zinc/91/22/79/1058912279.db2.gz ZJQGKXUMWOXSCZ-MVWRLGRASA-N 2 1 304.453 4.176 20 0 DIADMP CCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246414919 1058919749 /nfs/dbraw/zinc/91/97/49/1058919749.db2.gz VDSNDAKDFZEPGE-OZOXKJRCSA-N 2 1 324.468 4.229 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+][C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1 ZINC001246453234 1058941628 /nfs/dbraw/zinc/94/16/28/1058941628.db2.gz AYONPBZRAQNVMJ-NXOAAHMSSA-N 2 1 304.478 4.045 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cc(F)cc(F)c1 ZINC001246460652 1058944134 /nfs/dbraw/zinc/94/41/34/1058944134.db2.gz GLRQWVJNAFSRNT-BBWFWOEESA-N 2 1 310.432 4.172 20 0 DIADMP CC(C)[NH2+]CC[NH2+][C@H](C)CC(c1ccccc1)c1ccccc1 ZINC001246460833 1058950479 /nfs/dbraw/zinc/95/04/79/1058950479.db2.gz OABLXTPESSQAJN-GOSISDBHSA-N 2 1 310.485 4.185 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C1CCCCC1 ZINC001246491752 1058965206 /nfs/dbraw/zinc/96/52/06/1058965206.db2.gz SXQJVFDEOLCIHL-HSALFYBXSA-N 2 1 300.490 4.428 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cc(F)cc(Cl)c1 ZINC001246490229 1058967444 /nfs/dbraw/zinc/96/74/44/1058967444.db2.gz OCQVDQRBMKIVBH-XFBWCDHKSA-N 2 1 312.860 4.296 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)C1CCCCC1 ZINC001246491758 1058967771 /nfs/dbraw/zinc/96/77/71/1058967771.db2.gz SXQJVFDEOLCIHL-UFYCRDLUSA-N 2 1 300.490 4.428 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)CCC2 ZINC001246496182 1058972017 /nfs/dbraw/zinc/97/20/17/1058972017.db2.gz DCWQEPCNJBICCW-CEMLEFRQSA-N 2 1 320.480 4.455 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246499558 1058974481 /nfs/dbraw/zinc/97/44/81/1058974481.db2.gz LCHQGLPOFTUGLX-ZRGWGRIASA-N 2 1 322.443 4.243 20 0 DIADMP Fc1cccc2c1CCC[C@H]2[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246500163 1058975608 /nfs/dbraw/zinc/97/56/08/1058975608.db2.gz PHRCZRKKBSFXBG-DQLDELGASA-N 2 1 324.443 4.286 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H]2CCOc3ccc(Cl)cc32)C[C@@H](CC)[NH2+]1 ZINC001246511571 1058979239 /nfs/dbraw/zinc/97/92/39/1058979239.db2.gz JXLLVJXFZJNFGV-CPUCHLNUSA-N 2 1 322.880 4.062 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H]2CCOc3ccc(Cl)cc32)C[C@H](CC)[NH2+]1 ZINC001246511587 1058979357 /nfs/dbraw/zinc/97/93/57/1058979357.db2.gz JXLLVJXFZJNFGV-IVSAIRAKSA-N 2 1 322.880 4.062 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246521261 1058981897 /nfs/dbraw/zinc/98/18/97/1058981897.db2.gz NPQDDMQDXYCIKN-VXKWHMMOSA-N 2 1 322.496 4.260 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246521258 1058982447 /nfs/dbraw/zinc/98/24/47/1058982447.db2.gz NPQDDMQDXYCIKN-FGZHOGPDSA-N 2 1 322.496 4.260 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CCCC23CCC3)CC[NH2+]1 ZINC001246521532 1058983965 /nfs/dbraw/zinc/98/39/65/1058983965.db2.gz BPDJNVWRMGQIFJ-WDSOQIARSA-N 2 1 316.464 4.240 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246537649 1058989202 /nfs/dbraw/zinc/98/92/02/1058989202.db2.gz XFXLUJQUCGKPQM-OALUTQOASA-N 2 1 318.892 4.206 20 0 DIADMP Clc1ccc2c(c1)C[N@@H+](C1CCC3(CC[NH2+]CC3)CC1)CC2 ZINC001246542032 1058991808 /nfs/dbraw/zinc/99/18/08/1058991808.db2.gz UWOSEMQXXGPJMZ-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246542516 1058995221 /nfs/dbraw/zinc/99/52/21/1058995221.db2.gz PUPASPDXWBKVIT-GXTWGEPZSA-N 2 1 315.288 4.128 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCCC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246550995 1058996963 /nfs/dbraw/zinc/99/69/63/1058996963.db2.gz RUMZSTRGWZKHKO-QRVBRYPASA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCCC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246550997 1058997229 /nfs/dbraw/zinc/99/72/29/1058997229.db2.gz RUMZSTRGWZKHKO-QYZOEREBSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@](C)([NH3+])CC1 ZINC001246547334 1058997447 /nfs/dbraw/zinc/99/74/47/1058997447.db2.gz CKVQAABPRCCTQN-YJBOKZPZSA-N 2 1 324.534 4.273 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CCN[C@H](c2ccccc2)C1 ZINC001246551539 1059000202 /nfs/dbraw/zinc/00/02/02/1059000202.db2.gz ZOLGGBYPYHCFBW-PBEJRMEISA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246551539 1059000225 /nfs/dbraw/zinc/00/02/25/1059000225.db2.gz ZOLGGBYPYHCFBW-PBEJRMEISA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246551539 1059000248 /nfs/dbraw/zinc/00/02/48/1059000248.db2.gz ZOLGGBYPYHCFBW-PBEJRMEISA-N 2 1 306.453 4.099 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@H](C)C2)CC[NH2+]1 ZINC001246572732 1059002018 /nfs/dbraw/zinc/00/20/18/1059002018.db2.gz KITGZQJAXJAJPZ-ODZKNYGOSA-N 2 1 318.480 4.295 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)[C@H](C)C2)CC[NH2+]1 ZINC001246572732 1059002039 /nfs/dbraw/zinc/00/20/39/1059002039.db2.gz KITGZQJAXJAJPZ-ODZKNYGOSA-N 2 1 318.480 4.295 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@H](C)C2)CC[NH2+]1 ZINC001246572734 1059005083 /nfs/dbraw/zinc/00/50/83/1059005083.db2.gz KITGZQJAXJAJPZ-UQWBFEFOSA-N 2 1 318.480 4.295 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H](C)[C@H](C)C2)CC[NH2+]1 ZINC001246572734 1059005102 /nfs/dbraw/zinc/00/51/02/1059005102.db2.gz KITGZQJAXJAJPZ-UQWBFEFOSA-N 2 1 318.480 4.295 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246564072 1059005453 /nfs/dbraw/zinc/00/54/53/1059005453.db2.gz WRGFOFKRXVOCSB-RBUKOAKNSA-N 2 1 316.464 4.418 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCCC[C@H](C)C2)CC[NH2+]1 ZINC001246561414 1059006225 /nfs/dbraw/zinc/00/62/25/1059006225.db2.gz SKSXVXSDEOKJQE-YJLNNSPDSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCCC[C@H](C)C2)CC[NH2+]1 ZINC001246561414 1059006251 /nfs/dbraw/zinc/00/62/51/1059006251.db2.gz SKSXVXSDEOKJQE-YJLNNSPDSA-N 2 1 304.453 4.049 20 0 DIADMP C[C@@H]1C[N@H+](C2CCC(c3ccccc3)CC2)CCC[C@@H]1C[NH3+] ZINC001246565055 1059006295 /nfs/dbraw/zinc/00/62/95/1059006295.db2.gz GZYQDEATDPSIFR-IHJVYAAUSA-N 2 1 300.490 4.020 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246561169 1059007247 /nfs/dbraw/zinc/00/72/47/1059007247.db2.gz IPYLFBWKECJKEY-LJQANCHMSA-N 2 1 316.464 4.275 20 0 DIADMP [NH3+][C@@H]1CC[N@@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@@H]1F ZINC001246588326 1059009520 /nfs/dbraw/zinc/00/95/20/1059009520.db2.gz PVGWEWVLUIFPLS-DQVOVIAYSA-N 2 1 324.871 4.127 20 0 DIADMP [NH3+][C@@H]1CC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@@H]1F ZINC001246588326 1059009540 /nfs/dbraw/zinc/00/95/40/1059009540.db2.gz PVGWEWVLUIFPLS-DQVOVIAYSA-N 2 1 324.871 4.127 20 0 DIADMP C[C@H]1CC([N@@H+](Cc2ccccc2)C2CCCCC2)C[C@H](C)[NH2+]1 ZINC001246595802 1059016770 /nfs/dbraw/zinc/01/67/70/1059016770.db2.gz IRIOQANTKNMFRZ-IRXDYDNUSA-N 2 1 300.490 4.350 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001246597042 1059022177 /nfs/dbraw/zinc/02/21/77/1059022177.db2.gz WFCUOSFHZJNJOV-RTWAWAEBSA-N 2 1 316.533 4.496 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246609168 1059025249 /nfs/dbraw/zinc/02/52/49/1059025249.db2.gz XQRMKXGLQROVGF-KSSFIOAISA-N 2 1 324.871 4.018 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246608637 1059026016 /nfs/dbraw/zinc/02/60/16/1059026016.db2.gz USPQPGRSATYXNM-KSSFIOAISA-N 2 1 324.871 4.018 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH+]2CCC3(CCCC[NH2+]3)CC2)cc1 ZINC001246612081 1059028792 /nfs/dbraw/zinc/02/87/92/1059028792.db2.gz QGCDXOIHNQVKAV-QGZVFWFLSA-N 2 1 318.530 4.084 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@@H+]3CCC[C@@]34CCC[NH2+]CC4)C2)cc1 ZINC001246608689 1059029179 /nfs/dbraw/zinc/02/91/79/1059029179.db2.gz VBOLUJNPKYJPSC-NJDAHSKKSA-N 2 1 312.501 4.321 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246613425 1059029299 /nfs/dbraw/zinc/02/92/99/1059029299.db2.gz ZHYPYUACDNTXGB-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc([C@H]2C[N@@H+](C3CCC4(CCCC4)CC3)CC23C[NH2+]C3)cc1 ZINC001246616681 1059032166 /nfs/dbraw/zinc/03/21/66/1059032166.db2.gz AEGUKNPEKXQFIJ-HXUWFJFHSA-N 2 1 324.512 4.178 20 0 DIADMP c1ccc(C[C@H]2C[C@H]([N@H+]3CCCC4(CCCC4)C3)CC[NH2+]2)cc1 ZINC001246614681 1059034641 /nfs/dbraw/zinc/03/46/41/1059034641.db2.gz PABWAVMLSQHAAF-VQTJNVASSA-N 2 1 312.501 4.006 20 0 DIADMP CCCCC[C@@H](CCC)[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001246640328 1059042637 /nfs/dbraw/zinc/04/26/37/1059042637.db2.gz SNDDPEPREUCRBG-HZPDHXFCSA-N 2 1 302.453 4.056 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246635516 1059043186 /nfs/dbraw/zinc/04/31/86/1059043186.db2.gz RWGJTUHIYUUUMR-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC2CC1(C[NH3+])C2 ZINC001246643692 1059046273 /nfs/dbraw/zinc/04/62/73/1059046273.db2.gz CGWOTUANVHCZKE-LYGNXSNRSA-N 2 1 320.480 4.020 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246643924 1059050612 /nfs/dbraw/zinc/05/06/12/1059050612.db2.gz IAHPRZHFUHXJSB-HNAYVOBHSA-N 2 1 320.908 4.125 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@@H+]2CCCC[C@@]23CCC[NH2+]C3)cc1 ZINC001246649545 1059052177 /nfs/dbraw/zinc/05/21/77/1059052177.db2.gz CQCDNMBLDLNIJR-MJGOQNOKSA-N 2 1 318.530 4.084 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCCC[C@@]23CCC[NH2+]C3)cc1 ZINC001246649545 1059052193 /nfs/dbraw/zinc/05/21/93/1059052193.db2.gz CQCDNMBLDLNIJR-MJGOQNOKSA-N 2 1 318.530 4.084 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2C)CC[NH2+]1 ZINC001246681382 1059062092 /nfs/dbraw/zinc/06/20/92/1059062092.db2.gz OBQOWYHEGKSHHT-HBFSDRIKSA-N 2 1 300.490 4.443 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2ccccc2C)C[C@@H](CC)[NH2+]1 ZINC001246682571 1059062678 /nfs/dbraw/zinc/06/26/78/1059062678.db2.gz WDOBBRCLISVURK-HLIPFELVSA-N 2 1 300.490 4.441 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cc1 ZINC001246677532 1059063643 /nfs/dbraw/zinc/06/36/43/1059063643.db2.gz IMWNWGLLUNIYEW-TYPHKJRUSA-N 2 1 314.517 4.028 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C[C@@H](C)C1 ZINC001246678491 1059064046 /nfs/dbraw/zinc/06/40/46/1059064046.db2.gz XLZJLERSDNKNKI-ZCLUNYJNSA-N 2 1 312.501 4.033 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2C)C[C@H](CC)[NH2+]1 ZINC001246682570 1059064847 /nfs/dbraw/zinc/06/48/47/1059064847.db2.gz WDOBBRCLISVURK-DOADOZAASA-N 2 1 300.490 4.441 20 0 DIADMP CC[C@H](CC(C)C)[N@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246683291 1059066667 /nfs/dbraw/zinc/06/66/67/1059066667.db2.gz IFUIJJUNWREXMD-PWRODBHTSA-N 2 1 314.517 4.064 20 0 DIADMP CC(C)CCC[C@@H](C)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246686251 1059068143 /nfs/dbraw/zinc/06/81/43/1059068143.db2.gz QGAHRLQHFKGAMU-NRSPTQNISA-N 2 1 314.517 4.280 20 0 DIADMP CC(C)=CCC[C@H](C)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246683334 1059070745 /nfs/dbraw/zinc/07/07/45/1059070745.db2.gz RNKHLAAKZBDGDO-CEWLAPEOSA-N 2 1 312.501 4.200 20 0 DIADMP CCCC[N@H+](CCC)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246774802 1059071099 /nfs/dbraw/zinc/07/10/99/1059071099.db2.gz GUHHHUKLSHLCQK-MJGOQNOKSA-N 2 1 306.469 4.439 20 0 DIADMP CCCC[N@@H+](CCC)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246774802 1059071118 /nfs/dbraw/zinc/07/11/18/1059071118.db2.gz GUHHHUKLSHLCQK-MJGOQNOKSA-N 2 1 306.469 4.439 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246767251 1059073062 /nfs/dbraw/zinc/07/30/62/1059073062.db2.gz AXFWMYKOJNYDIY-WOJBJXKFSA-N 2 1 300.490 4.211 20 0 DIADMP CCCC[N@H+](CCC)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246774786 1059076176 /nfs/dbraw/zinc/07/61/76/1059076176.db2.gz GUHHHUKLSHLCQK-HKUYNNGSSA-N 2 1 306.469 4.439 20 0 DIADMP CCCC[N@@H+](CCC)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246774786 1059076196 /nfs/dbraw/zinc/07/61/96/1059076196.db2.gz GUHHHUKLSHLCQK-HKUYNNGSSA-N 2 1 306.469 4.439 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246779308 1059077097 /nfs/dbraw/zinc/07/70/97/1059077097.db2.gz RTMXOXNCEWPCJF-VQTJNVASSA-N 2 1 312.501 4.321 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(C)cc2)C[C@H](CC)[NH2+]1 ZINC001246781009 1059079014 /nfs/dbraw/zinc/07/90/14/1059079014.db2.gz MPWSRLMATHRPMD-YRPNKDGESA-N 2 1 300.490 4.441 20 0 DIADMP C[N@@H+]([C@@H]1CCN[C@@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783532 1059079615 /nfs/dbraw/zinc/07/96/15/1059079615.db2.gz ONUNQJCSNMQWTP-HXTOSXCISA-N 2 1 324.512 4.380 20 0 DIADMP C[N@H+]([C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783532 1059079639 /nfs/dbraw/zinc/07/96/39/1059079639.db2.gz ONUNQJCSNMQWTP-HXTOSXCISA-N 2 1 324.512 4.380 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783532 1059079658 /nfs/dbraw/zinc/07/96/58/1059079658.db2.gz ONUNQJCSNMQWTP-HXTOSXCISA-N 2 1 324.512 4.380 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246776548 1059082639 /nfs/dbraw/zinc/08/26/39/1059082639.db2.gz OBQCPAYPOHZMAV-ZCNNSNEGSA-N 2 1 314.517 4.108 20 0 DIADMP c1csc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246786606 1059084169 /nfs/dbraw/zinc/08/41/69/1059084169.db2.gz MDLYHASMVKBCFM-CVEARBPZSA-N 2 1 304.503 4.340 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246784988 1059084398 /nfs/dbraw/zinc/08/43/98/1059084398.db2.gz ITNIEJJIRDVMLW-IAGOWNOFSA-N 2 1 304.865 4.152 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@H](C(C)(C)C)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783594 1059084729 /nfs/dbraw/zinc/08/47/29/1059084729.db2.gz PKALHRVIAYPQLS-XOUIXPDISA-N 2 1 304.522 4.054 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)CC[NH2+]1 ZINC001246783815 1059088394 /nfs/dbraw/zinc/08/83/94/1059088394.db2.gz FBBQKRLCLXAHIL-FGTMMUONSA-N 2 1 306.881 4.254 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246791012 1059091347 /nfs/dbraw/zinc/09/13/47/1059091347.db2.gz XATKWMMWNXMTRV-YJBOKZPZSA-N 2 1 302.437 4.027 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246789134 1059091565 /nfs/dbraw/zinc/09/15/65/1059091565.db2.gz JFNHZANANMJOBG-RHSMWYFYSA-N 2 1 304.865 4.152 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2Cl)CC[NH2+]1 ZINC001246788953 1059091776 /nfs/dbraw/zinc/09/17/76/1059091776.db2.gz IHRQTTYNWAUOFV-WBAXXEDZSA-N 2 1 306.881 4.254 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2OC)CC[NH2+]1 ZINC001246790898 1059092456 /nfs/dbraw/zinc/09/24/56/1059092456.db2.gz IERNEZWKEYEETR-ZIFCJYIRSA-N 2 1 316.489 4.143 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(OC)cc2)C[C@H](CC)[NH2+]1 ZINC001246790483 1059093301 /nfs/dbraw/zinc/09/33/01/1059093301.db2.gz WSUSULINNXTGAM-DOADOZAASA-N 2 1 316.489 4.141 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246793082 1059094657 /nfs/dbraw/zinc/09/46/57/1059094657.db2.gz CZXHNJUJWBJAJH-FCGDIQPGSA-N 2 1 304.453 4.272 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792148 1059096699 /nfs/dbraw/zinc/09/66/99/1059096699.db2.gz OBVIZPPCRGLPKY-MKSNKDDYSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792148 1059096721 /nfs/dbraw/zinc/09/67/21/1059096721.db2.gz OBVIZPPCRGLPKY-MKSNKDDYSA-N 2 1 322.443 4.411 20 0 DIADMP c1ccc2cc(C3CC[NH+]([C@H]4CCCC[NH2+]C4)CC3)ccc2c1 ZINC001246794460 1059098729 /nfs/dbraw/zinc/09/87/29/1059098729.db2.gz ZUPMBLGNNJLMBE-NRFANRHFSA-N 2 1 308.469 4.161 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246799920 1059101349 /nfs/dbraw/zinc/10/13/49/1059101349.db2.gz PJWHGMTXCBGECW-OALUTQOASA-N 2 1 316.464 4.418 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246796064 1059101689 /nfs/dbraw/zinc/10/16/89/1059101689.db2.gz KUOFTFOXXRCWSX-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246796064 1059101703 /nfs/dbraw/zinc/10/17/03/1059101703.db2.gz KUOFTFOXXRCWSX-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP CC[N@@H+]([C@@H](C)CC(C)(C)SCc1ccco1)C1CC[NH2+]CC1 ZINC001246799040 1059101893 /nfs/dbraw/zinc/10/18/93/1059101893.db2.gz WBTOQBUXKRGCJQ-HNNXBMFYSA-N 2 1 324.534 4.144 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCSC[C@@H]2c2ccccc2)C[C@H](CC)[NH2+]1 ZINC001246806679 1059102113 /nfs/dbraw/zinc/10/21/13/1059102113.db2.gz HREACBCWCHGTCT-FCGDIQPGSA-N 2 1 318.530 4.086 20 0 DIADMP CC[C@H]1C[C@@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246804296 1059103088 /nfs/dbraw/zinc/10/30/88/1059103088.db2.gz FWAXRVKTHMYNIB-ONTIZHBOSA-N 2 1 320.480 4.165 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001246807737 1059103200 /nfs/dbraw/zinc/10/32/00/1059103200.db2.gz QUBGTKRHNLEREN-LQWHRVPQSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccccc1[C@@H]1CC[N@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001246807737 1059103208 /nfs/dbraw/zinc/10/32/08/1059103208.db2.gz QUBGTKRHNLEREN-LQWHRVPQSA-N 2 1 324.443 4.108 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@H](C)C[C@H]2C)CC[NH2+]1 ZINC001246812398 1059105545 /nfs/dbraw/zinc/10/55/45/1059105545.db2.gz ZTZPXEDEIHDVHX-KOJWFEOWSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@H](C)C[C@H]2C)CC[NH2+]1 ZINC001246812398 1059105550 /nfs/dbraw/zinc/10/55/50/1059105550.db2.gz ZTZPXEDEIHDVHX-KOJWFEOWSA-N 2 1 304.453 4.048 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809606 1059106133 /nfs/dbraw/zinc/10/61/33/1059106133.db2.gz KKRNLOWHHNQBOT-ZACQAIPSSA-N 2 1 320.908 4.440 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+](C)CCc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246815349 1059106794 /nfs/dbraw/zinc/10/67/94/1059106794.db2.gz YECJMANULPPJBM-MSOLQXFVSA-N 2 1 308.897 4.125 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+]([C@@H]2CCC[C@]3(CC[NH2+]C3)C2)C1 ZINC001246809014 1059107618 /nfs/dbraw/zinc/10/76/18/1059107618.db2.gz FYIKHPLZIASQKT-MDZRGWNJSA-N 2 1 318.892 4.052 20 0 DIADMP C[N@@H+](CCc1cccc(Cl)c1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246820584 1059111532 /nfs/dbraw/zinc/11/15/32/1059111532.db2.gz GYIDNNAQUMQDQE-UHFFFAOYSA-N 2 1 320.908 4.127 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)s1 ZINC001246826875 1059113727 /nfs/dbraw/zinc/11/37/27/1059113727.db2.gz YZVQCRUTOGNURC-KBPBESRZSA-N 2 1 324.921 4.461 20 0 DIADMP Fc1cccc([C@@H]2CC[N@@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC001246836327 1059114141 /nfs/dbraw/zinc/11/41/41/1059114141.db2.gz XDXJTNGHTTWAOZ-HLAWJBBLSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1cccc([C@@H]2CC[N@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC001246836327 1059114150 /nfs/dbraw/zinc/11/41/50/1059114150.db2.gz XDXJTNGHTTWAOZ-HLAWJBBLSA-N 2 1 324.443 4.108 20 0 DIADMP CCC(C)(C)C1CCC([N@@H+](CCCOC)C2CC[NH2+]CC2)CC1 ZINC001246835665 1059115626 /nfs/dbraw/zinc/11/56/26/1059115626.db2.gz LJSSAYAMALZQSI-UHFFFAOYSA-N 2 1 324.553 4.072 20 0 DIADMP CC[N@H+](Cc1cccc(OC)c1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838711 1059117294 /nfs/dbraw/zinc/11/72/94/1059117294.db2.gz FEPATKHOFDXSJJ-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1cccc(OC)c1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838711 1059117308 /nfs/dbraw/zinc/11/73/08/1059117308.db2.gz FEPATKHOFDXSJJ-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246839263 1059119298 /nfs/dbraw/zinc/11/92/98/1059119298.db2.gz IGCOQYMHZFRTHQ-QGZVFWFLSA-N 2 1 306.881 4.084 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841210 1059119603 /nfs/dbraw/zinc/11/96/03/1059119603.db2.gz NAHGFPYKURNEJU-HKUYNNGSSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841210 1059119613 /nfs/dbraw/zinc/11/96/13/1059119613.db2.gz NAHGFPYKURNEJU-HKUYNNGSSA-N 2 1 304.453 4.049 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246842971 1059121606 /nfs/dbraw/zinc/12/16/06/1059121606.db2.gz HGVPQSARPHSZDH-GOSISDBHSA-N 2 1 322.452 4.053 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246845242 1059122277 /nfs/dbraw/zinc/12/22/77/1059122277.db2.gz LUFUBXLBFSJPCE-IBGZPJMESA-N 2 1 300.490 4.136 20 0 DIADMP Fc1ccc([C@@H]2CC[N@@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246846403 1059122947 /nfs/dbraw/zinc/12/29/47/1059122947.db2.gz GWBXFOXKAYNJNY-GIVPXCGWSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccc([C@@H]2CC[N@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246846403 1059122958 /nfs/dbraw/zinc/12/29/58/1059122958.db2.gz GWBXFOXKAYNJNY-GIVPXCGWSA-N 2 1 324.443 4.108 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1 ZINC001246844488 1059123136 /nfs/dbraw/zinc/12/31/36/1059123136.db2.gz JHESIGMZLVPPNS-FGZHOGPDSA-N 2 1 322.496 4.044 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@H]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1 ZINC001246844497 1059123232 /nfs/dbraw/zinc/12/32/32/1059123232.db2.gz JHESIGMZLVPPNS-YADHBBJMSA-N 2 1 322.496 4.044 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)C[C@H](CC)[NH2+]1 ZINC001246848782 1059127260 /nfs/dbraw/zinc/12/72/60/1059127260.db2.gz DZTDJYQBXHXWNL-YSHGAJCASA-N 2 1 320.908 4.439 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2cccc(OC)c2)C[C@@H](CC)[NH2+]1 ZINC001246849086 1059127418 /nfs/dbraw/zinc/12/74/18/1059127418.db2.gz PWPZPQYHOTWWDS-MBOZVWFJSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246849896 1059129148 /nfs/dbraw/zinc/12/91/48/1059129148.db2.gz SJJCQLUZCBJSDJ-JLSDUUJJSA-N 2 1 306.881 4.255 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(OC)c2)C[C@H](CC)[NH2+]1 ZINC001246849077 1059129674 /nfs/dbraw/zinc/12/96/74/1059129674.db2.gz PWPZPQYHOTWWDS-DOADOZAASA-N 2 1 316.489 4.141 20 0 DIADMP COc1ccc([C@@H](C)[N@@H+](C)C2CCC3(CCC[NH2+]C3)CC2)cc1 ZINC001246853013 1059131461 /nfs/dbraw/zinc/13/14/61/1059131461.db2.gz QGBURPQQCONATN-PPDQVPDSSA-N 2 1 316.489 4.000 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@@H+]3CC[C@@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851057 1059132685 /nfs/dbraw/zinc/13/26/85/1059132685.db2.gz YDDPYZRMBWKFKT-HKBOAZHASA-N 2 1 312.501 4.382 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@H+]3CC[C@@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851057 1059132695 /nfs/dbraw/zinc/13/26/95/1059132695.db2.gz YDDPYZRMBWKFKT-HKBOAZHASA-N 2 1 312.501 4.382 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246856418 1059132994 /nfs/dbraw/zinc/13/29/94/1059132994.db2.gz ZEVKVFILBFHPNS-QRQLOZEOSA-N 2 1 320.908 4.440 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246852147 1059133102 /nfs/dbraw/zinc/13/31/02/1059133102.db2.gz NDSVEXRZBOTZMJ-MOPGFXCFSA-N 2 1 324.468 4.441 20 0 DIADMP F[C@@H]1CCC2(C1)CC[NH+]([C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)CC2 ZINC001246851283 1059133749 /nfs/dbraw/zinc/13/37/49/1059133749.db2.gz FENXSYJERGCKBT-GUDVDZBRSA-N 2 1 316.464 4.084 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852153 1059133831 /nfs/dbraw/zinc/13/38/31/1059133831.db2.gz NFEJXGNWYQNTGI-QXAKKESOSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@@H+](C1CCC(C(C)(C)C)CC1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246856171 1059134331 /nfs/dbraw/zinc/13/43/31/1059134331.db2.gz ZBLRLHRDSYFGDI-QQGUTBHFSA-N 2 1 306.538 4.445 20 0 DIADMP C[NH2+]C[C@H]1CC[N@H+]([C@H](C)CC(c2ccccc2)c2ccccc2)C1 ZINC001246861672 1059136688 /nfs/dbraw/zinc/13/66/88/1059136688.db2.gz CUUNZTXTCXKBFW-RTBURBONSA-N 2 1 322.496 4.138 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246865042 1059137418 /nfs/dbraw/zinc/13/74/18/1059137418.db2.gz XPMPEKSSVKISLW-IEBWSBKVSA-N 2 1 314.517 4.338 20 0 DIADMP CC[N@H+](Cc1cccc(F)c1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246858886 1059138095 /nfs/dbraw/zinc/13/80/95/1059138095.db2.gz CULZRHPBVUDLHC-WOJBJXKFSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246858886 1059138106 /nfs/dbraw/zinc/13/81/06/1059138106.db2.gz CULZRHPBVUDLHC-WOJBJXKFSA-N 2 1 312.432 4.141 20 0 DIADMP c1ccc2c(c1)oc1c2CC[N@H+](C2CCC3(CCC[NH2+]C3)CC2)C1 ZINC001246872157 1059142133 /nfs/dbraw/zinc/14/21/33/1059142133.db2.gz CMAFJZLQLHBTEA-UHFFFAOYSA-N 2 1 324.468 4.103 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246867432 1059142876 /nfs/dbraw/zinc/14/28/76/1059142876.db2.gz XLKOZQJZYCQDHU-SFHVURJKSA-N 2 1 304.453 4.103 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246870071 1059143635 /nfs/dbraw/zinc/14/36/35/1059143635.db2.gz YIHZGVZJNTUYEJ-KSEOMHKRSA-N 2 1 320.480 4.489 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246870071 1059143648 /nfs/dbraw/zinc/14/36/48/1059143648.db2.gz YIHZGVZJNTUYEJ-KSEOMHKRSA-N 2 1 320.480 4.489 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246879306 1059145674 /nfs/dbraw/zinc/14/56/74/1059145674.db2.gz LLQLEFJMYJXVNM-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@@H+]2CCC[C@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886426 1059151011 /nfs/dbraw/zinc/15/10/11/1059151011.db2.gz KPXHCDNHQIEFJL-JLSDUUJJSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886426 1059151026 /nfs/dbraw/zinc/15/10/26/1059151026.db2.gz KPXHCDNHQIEFJL-JLSDUUJJSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC[NH2+]1 ZINC001246886994 1059152558 /nfs/dbraw/zinc/15/25/58/1059152558.db2.gz HOTCNZPWJBPNQC-OKZBNKHCSA-N 2 1 306.881 4.254 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC[NH2+]1 ZINC001246886993 1059153770 /nfs/dbraw/zinc/15/37/70/1059153770.db2.gz HOTCNZPWJBPNQC-FGTMMUONSA-N 2 1 306.881 4.254 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c1 ZINC001246888476 1059155374 /nfs/dbraw/zinc/15/53/74/1059155374.db2.gz VZKBZSDNXDDJGX-JLAWEPINSA-N 2 1 318.892 4.399 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c(F)c1 ZINC001246886855 1059155644 /nfs/dbraw/zinc/15/56/44/1059155644.db2.gz LVAOUTQMQWVVOU-OBONGRFPSA-N 2 1 320.427 4.024 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246889565 1059155684 /nfs/dbraw/zinc/15/56/84/1059155684.db2.gz QXWPFAPEQMYUNG-MUQADHOPSA-N 2 1 316.514 4.219 20 0 DIADMP CCC[N@@H+](C1CC[NH2+]CC1)C1CCC(c2ccccc2)CC1 ZINC001246892315 1059156051 /nfs/dbraw/zinc/15/60/51/1059156051.db2.gz ASYXJFUKGKJAGL-UHFFFAOYSA-N 2 1 300.490 4.177 20 0 DIADMP C[N@H+]([C@H]1CC[NH2+][C@@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892836 1059156240 /nfs/dbraw/zinc/15/62/40/1059156240.db2.gz OJVJPKALBYWRCP-LEWJYISDSA-N 2 1 322.496 4.433 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892836 1059156245 /nfs/dbraw/zinc/15/62/45/1059156245.db2.gz OJVJPKALBYWRCP-LEWJYISDSA-N 2 1 322.496 4.433 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246887420 1059156285 /nfs/dbraw/zinc/15/62/85/1059156285.db2.gz NQJGLHPROROLJU-QZTJIDSGSA-N 2 1 318.892 4.399 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246890360 1059156600 /nfs/dbraw/zinc/15/66/00/1059156600.db2.gz UBVPQZSZOAXQIL-NJAFHUGGSA-N 2 1 318.530 4.322 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[NH2+]1 ZINC001246896007 1059158395 /nfs/dbraw/zinc/15/83/95/1059158395.db2.gz RSYWSAIAWIDVRJ-JSFADZTLSA-N 2 1 316.464 4.049 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCC[C@H]2c2c(F)cccc2F)C[C@@H](CC)[NH2+]1 ZINC001246899745 1059160849 /nfs/dbraw/zinc/16/08/49/1059160849.db2.gz FYWITXUYHOGEEH-LBTNJELSSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2c(F)cccc2F)C[C@@H](CC)[NH2+]1 ZINC001246899745 1059160855 /nfs/dbraw/zinc/16/08/55/1059160855.db2.gz FYWITXUYHOGEEH-LBTNJELSSA-N 2 1 322.443 4.411 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@H+]3CCSc4ccccc4C3)CCN2)cc1 ZINC001246904849 1059164419 /nfs/dbraw/zinc/16/44/19/1059164419.db2.gz JHZQJIVWAYOSLK-RTBURBONSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@H]2C[C@H](N3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904849 1059164428 /nfs/dbraw/zinc/16/44/28/1059164428.db2.gz JHZQJIVWAYOSLK-RTBURBONSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904849 1059164433 /nfs/dbraw/zinc/16/44/33/1059164433.db2.gz JHZQJIVWAYOSLK-RTBURBONSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904849 1059164437 /nfs/dbraw/zinc/16/44/37/1059164437.db2.gz JHZQJIVWAYOSLK-RTBURBONSA-N 2 1 324.493 4.088 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1C ZINC001246906667 1059166491 /nfs/dbraw/zinc/16/64/91/1059166491.db2.gz FVGDEKFEOZRENB-LJQANCHMSA-N 2 1 300.490 4.190 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2C3CCCC2CCC3)CC[NH2+]1 ZINC001246905486 1059166601 /nfs/dbraw/zinc/16/66/01/1059166601.db2.gz MRLDDMUOWXVYRX-SMRJSYMMSA-N 2 1 316.464 4.334 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246907734 1059166908 /nfs/dbraw/zinc/16/69/08/1059166908.db2.gz UYEKXOGBOQQVEJ-SFHVURJKSA-N 2 1 322.452 4.053 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2C2C[C@@H](C)[NH2+][C@H](C)C2)cc1C ZINC001246908565 1059167533 /nfs/dbraw/zinc/16/75/33/1059167533.db2.gz LOEDPNKXWFAEHK-HLIPFELVSA-N 2 1 300.490 4.359 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)cc1C ZINC001246907083 1059167711 /nfs/dbraw/zinc/16/77/11/1059167711.db2.gz HZFSLVHFTWTIAI-VXKWHMMOSA-N 2 1 322.496 4.099 20 0 DIADMP CC[N@H+](Cc1ccc(C)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246906753 1059168754 /nfs/dbraw/zinc/16/87/54/1059168754.db2.gz GNEIWRHTTYJZOP-LEWJYISDSA-N 2 1 308.469 4.310 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246906753 1059168762 /nfs/dbraw/zinc/16/87/62/1059168762.db2.gz GNEIWRHTTYJZOP-LEWJYISDSA-N 2 1 308.469 4.310 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)C1CCC2(CC[NH2+]C2)CC1 ZINC001246911612 1059172157 /nfs/dbraw/zinc/17/21/57/1059172157.db2.gz VGJRMNMMXBREME-SYJJWHGVSA-N 2 1 306.881 4.255 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246913366 1059174390 /nfs/dbraw/zinc/17/43/90/1059174390.db2.gz INMHNCRBOYQCDC-INIZCTEOSA-N 2 1 320.546 4.161 20 0 DIADMP FC(F)(F)c1ccc([C@@H]2CCC[N@H+]2[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246920254 1059175362 /nfs/dbraw/zinc/17/53/62/1059175362.db2.gz DJLMVAKVXNITEG-HZMVEIRTSA-N 2 1 324.390 4.125 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+](C)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001246916469 1059176013 /nfs/dbraw/zinc/17/60/13/1059176013.db2.gz HYXFHMPPGPXWFP-UHOFOFEASA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001246916469 1059176025 /nfs/dbraw/zinc/17/60/25/1059176025.db2.gz HYXFHMPPGPXWFP-UHOFOFEASA-N 2 1 312.910 4.022 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC001246917410 1059176750 /nfs/dbraw/zinc/17/67/50/1059176750.db2.gz CUANCDHSVHRJEA-FUHWJXTLSA-N 2 1 320.546 4.161 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC001246917410 1059176755 /nfs/dbraw/zinc/17/67/55/1059176755.db2.gz CUANCDHSVHRJEA-FUHWJXTLSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+](C)[C@@H]1CCCC[C@H]1[NH3+] ZINC001246916458 1059176789 /nfs/dbraw/zinc/17/67/89/1059176789.db2.gz HYXFHMPPGPXWFP-DAXOMENPSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CCCC[C@H]1[NH3+] ZINC001246916458 1059176795 /nfs/dbraw/zinc/17/67/95/1059176795.db2.gz HYXFHMPPGPXWFP-DAXOMENPSA-N 2 1 312.910 4.022 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](CC)Cc2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC001246916409 1059177396 /nfs/dbraw/zinc/17/73/96/1059177396.db2.gz SDDJVOYXVXMGCY-JKSUJKDBSA-N 2 1 314.395 4.058 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C1C[C@@H](C)[NH2+][C@H](C)C1 ZINC001246917182 1059177479 /nfs/dbraw/zinc/17/74/79/1059177479.db2.gz WKSIKGGSMWHLNL-CHWSQXEVSA-N 2 1 314.395 4.056 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932814 1059181114 /nfs/dbraw/zinc/18/11/14/1059181114.db2.gz HLDWZDGNGHLCNY-FUHWJXTLSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC001246937155 1059184454 /nfs/dbraw/zinc/18/44/54/1059184454.db2.gz ZIQMJYQJTLKQRB-MNZLEMJZSA-N 2 1 318.480 4.204 20 0 DIADMP CC1CCC([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)CC1 ZINC001246939221 1059185245 /nfs/dbraw/zinc/18/52/45/1059185245.db2.gz ACSZQQHJZKKADY-UHFFFAOYSA-N 2 1 318.480 4.206 20 0 DIADMP [NH3+][C@H]1CC[N@H+](C2CCC3(CCCCC3)CC2)C[C@H]1C(F)(F)F ZINC001246943222 1059189379 /nfs/dbraw/zinc/18/93/79/1059189379.db2.gz ZSGSBKSRGMXHLV-CABCVRRESA-N 2 1 318.427 4.091 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246943974 1059190219 /nfs/dbraw/zinc/19/02/19/1059190219.db2.gz SPOSRYSASDBNFJ-SFHVURJKSA-N 2 1 306.469 4.349 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246941714 1059190437 /nfs/dbraw/zinc/19/04/37/1059190437.db2.gz BEKQAFOERBOCFQ-PMACEKPBSA-N 2 1 312.501 4.363 20 0 DIADMP C[C@@H](CC1CC1)[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001246947325 1059193111 /nfs/dbraw/zinc/19/31/11/1059193111.db2.gz VBIBTOVWTBTGSB-AWEZNQCLSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246949584 1059194192 /nfs/dbraw/zinc/19/41/92/1059194192.db2.gz AOJWFGLFFUVRHY-RHSMWYFYSA-N 2 1 306.881 4.083 20 0 DIADMP Cc1ccc(C[C@H](C)[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001246947725 1059194484 /nfs/dbraw/zinc/19/44/84/1059194484.db2.gz XHNCCHVCXDTAJC-KRWDZBQOSA-N 2 1 302.506 4.026 20 0 DIADMP Fc1ccc(F)c([C@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246947977 1059195459 /nfs/dbraw/zinc/19/54/59/1059195459.db2.gz OMLOESRTDQSSKW-KFKAGJAMSA-N 2 1 320.427 4.024 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246946275 1059195773 /nfs/dbraw/zinc/19/57/73/1059195773.db2.gz KQDMNPUKBBKQJS-SFHVURJKSA-N 2 1 302.506 4.108 20 0 DIADMP CCCCCC[C@H](CCC)[N@@H+](CCOCC)C1CC[NH2+]CC1 ZINC001246952104 1059196555 /nfs/dbraw/zinc/19/65/55/1059196555.db2.gz YDWZRZGUZUFXIH-SFHVURJKSA-N 2 1 312.542 4.216 20 0 DIADMP CC(C)(C)C[N@@H+]([C@H]1CC[C@@H](c2ccccc2)C1)C1CC[NH2+]CC1 ZINC001246948109 1059196657 /nfs/dbraw/zinc/19/66/57/1059196657.db2.gz AQJCDLREOSVELP-QUCCMNQESA-N 2 1 314.517 4.423 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](Cc1ccc(OC)cc1)C1CC[NH2+]CC1 ZINC001246953164 1059198480 /nfs/dbraw/zinc/19/84/80/1059198480.db2.gz LXNLVCAUSHMJNR-SFHVURJKSA-N 2 1 318.505 4.074 20 0 DIADMP CC[C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956177 1059199747 /nfs/dbraw/zinc/19/97/47/1059199747.db2.gz QPRPPPSAFGGNPB-KSSFIOAISA-N 2 1 322.443 4.098 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246956177 1059199760 /nfs/dbraw/zinc/19/97/60/1059199760.db2.gz QPRPPPSAFGGNPB-KSSFIOAISA-N 2 1 322.443 4.098 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246956812 1059204455 /nfs/dbraw/zinc/20/44/55/1059204455.db2.gz VOZRNXAHJKQUQS-INIZCTEOSA-N 2 1 324.459 4.344 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001246961182 1059206021 /nfs/dbraw/zinc/20/60/21/1059206021.db2.gz IMEZUIJGFCWJPY-INIZCTEOSA-N 2 1 306.469 4.267 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CCC2)C[C@H](CC)[NH2+]1 ZINC001246959231 1059206641 /nfs/dbraw/zinc/20/66/41/1059206641.db2.gz FRROBWJPQQFZGJ-RUYXUALKSA-N 2 1 300.490 4.350 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246962564 1059206688 /nfs/dbraw/zinc/20/66/88/1059206688.db2.gz KEHSIPCXVFBFNP-OALUTQOASA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccc(F)cc2C)C2CC[NH2+]CC2)C1 ZINC001246963875 1059207773 /nfs/dbraw/zinc/20/77/73/1059207773.db2.gz ZUQUPPFBABLZIX-OXJNMPFZSA-N 2 1 318.480 4.267 20 0 DIADMP CCCCC[C@@H](CCC)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246956619 1059208595 /nfs/dbraw/zinc/20/85/95/1059208595.db2.gz ZFKARLRNSPBZGS-LJQANCHMSA-N 2 1 317.521 4.385 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@H]2CC[NH2+][C@H](C(C)C)C2)c1C ZINC001246966615 1059209915 /nfs/dbraw/zinc/20/99/15/1059209915.db2.gz LBUUGFUBVWWHEI-PMACEKPBSA-N 2 1 300.490 4.044 20 0 DIADMP CCCC(CCC)[N@H+](Cc1c(F)cccc1F)C1CC[NH2+]CC1 ZINC001246965687 1059210618 /nfs/dbraw/zinc/21/06/18/1059210618.db2.gz QDAARSWGOAKUMX-UHFFFAOYSA-N 2 1 324.459 4.488 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1c(F)cccc1F)C1CC[NH2+]CC1 ZINC001246965687 1059210633 /nfs/dbraw/zinc/21/06/33/1059210633.db2.gz QDAARSWGOAKUMX-UHFFFAOYSA-N 2 1 324.459 4.488 20 0 DIADMP c1ccc(C[N@@H+](C2CCC2)[C@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246965920 1059211026 /nfs/dbraw/zinc/21/10/26/1059211026.db2.gz QZMLUJNHSNFEPR-FQEVSTJZSA-N 2 1 312.501 4.496 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1ccc(OC)cc1)C1CC[NH2+]CC1 ZINC001246964538 1059211814 /nfs/dbraw/zinc/21/18/14/1059211814.db2.gz NNEYUIBMMDYQLV-GOSISDBHSA-N 2 1 318.505 4.218 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@H](C)C1 ZINC001246966277 1059213310 /nfs/dbraw/zinc/21/33/10/1059213310.db2.gz VXLDBVKHZWMACJ-YWZLYKJASA-N 2 1 318.480 4.267 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001246969041 1059213607 /nfs/dbraw/zinc/21/36/07/1059213607.db2.gz JCCYGSJSVYPENG-DUXKGJEZSA-N 2 1 314.517 4.298 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CCC3(C2)CC[NH2+]CC3)c1C ZINC001246967345 1059213703 /nfs/dbraw/zinc/21/37/03/1059213703.db2.gz MOHIMVISTHXJNE-HXUWFJFHSA-N 2 1 312.501 4.190 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@H](C)C1 ZINC001246966272 1059213782 /nfs/dbraw/zinc/21/37/82/1059213782.db2.gz VXLDBVKHZWMACJ-MGPUTAFESA-N 2 1 318.480 4.267 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246974778 1059214944 /nfs/dbraw/zinc/21/49/44/1059214944.db2.gz QYPYJGLWWQZVON-DFQSSKMNSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246974121 1059215193 /nfs/dbraw/zinc/21/51/93/1059215193.db2.gz HYLHIOIZLGYYDF-CYBMUJFWSA-N 2 1 324.871 4.017 20 0 DIADMP CCC[N@@H+](C[C@@H]1CC[NH2+]C1)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246971966 1059215894 /nfs/dbraw/zinc/21/58/94/1059215894.db2.gz CECCWWYTTAMZET-MISYRCLQSA-N 2 1 300.490 4.034 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CCC[NH2+]CC1 ZINC001246975375 1059216022 /nfs/dbraw/zinc/21/60/22/1059216022.db2.gz CVUXFSCMFAZGCA-PMACEKPBSA-N 2 1 302.506 4.252 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](CCC)C[C@H]1CC[NH2+]C1 ZINC001246972393 1059216478 /nfs/dbraw/zinc/21/64/78/1059216478.db2.gz DRAPOKRGAJPWSK-PMACEKPBSA-N 2 1 302.506 4.109 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@@H+](C[C@H]3CCC[NH2+]C3)C3CC3)C2)cc1 ZINC001246973546 1059216804 /nfs/dbraw/zinc/21/68/04/1059216804.db2.gz ODFMVARDZCVOJF-FBBABVLZSA-N 2 1 312.501 4.177 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@@H+](C[C@H]3CCC[NH2+]C3)C3CC3)C2)cc1 ZINC001246973545 1059217850 /nfs/dbraw/zinc/21/78/50/1059217850.db2.gz ODFMVARDZCVOJF-DSKINZAPSA-N 2 1 312.501 4.177 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246975270 1059219903 /nfs/dbraw/zinc/21/99/03/1059219903.db2.gz BNSDPRXJMGOJIA-DFQSSKMNSA-N 2 1 302.506 4.250 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](CCc3ccccc3)C2)CC[NH2+]1 ZINC001246980673 1059220706 /nfs/dbraw/zinc/22/07/06/1059220706.db2.gz RJICDHTUKNXQGQ-ACRUOGEOSA-N 2 1 314.517 4.108 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H](CCc3ccccc3)C2)CC[NH2+]1 ZINC001246980676 1059224862 /nfs/dbraw/zinc/22/48/62/1059224862.db2.gz RJICDHTUKNXQGQ-NJYVYQBISA-N 2 1 314.517 4.108 20 0 DIADMP CCC[N@@H+](C[C@H]1CC[NH2+]C1)[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246985722 1059226198 /nfs/dbraw/zinc/22/61/98/1059226198.db2.gz CECCWWYTTAMZET-SXLOBPIMSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984390 1059228466 /nfs/dbraw/zinc/22/84/66/1059228466.db2.gz FKXIYMJDQZDKPI-JKSUJKDBSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984390 1059228482 /nfs/dbraw/zinc/22/84/82/1059228482.db2.gz FKXIYMJDQZDKPI-JKSUJKDBSA-N 2 1 315.288 4.202 20 0 DIADMP Cc1ccc(C[C@H](C)[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)cc1 ZINC001246999803 1059230004 /nfs/dbraw/zinc/23/00/04/1059230004.db2.gz BWWKSMBQBKMLAK-SFHVURJKSA-N 2 1 320.480 4.021 20 0 DIADMP CC1(C)CCC([NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)CC1 ZINC001247006166 1059232321 /nfs/dbraw/zinc/23/23/21/1059232321.db2.gz TWNURUCKARHQNE-UHFFFAOYSA-N 2 1 312.501 4.092 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001247005830 1059232970 /nfs/dbraw/zinc/23/29/70/1059232970.db2.gz BXRPUVDDIIWNLY-HXUWFJFHSA-N 2 1 320.480 4.102 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247015290 1059244797 /nfs/dbraw/zinc/24/47/97/1059244797.db2.gz OBIBUYOZVYAWOR-WMZOPIPTSA-N 2 1 300.490 4.296 20 0 DIADMP CCCCCC[C@H](C)[N@H+]1Cc2ccccc2C12CC[NH2+]CC2 ZINC001247012316 1059244868 /nfs/dbraw/zinc/24/48/68/1059244868.db2.gz VRYKMRHOVWOQAK-KRWDZBQOSA-N 2 1 300.490 4.440 20 0 DIADMP CC[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492934 1059270216 /nfs/dbraw/zinc/27/02/16/1059270216.db2.gz JWOGWFAVMRDFNN-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492934 1059270229 /nfs/dbraw/zinc/27/02/29/1059270229.db2.gz JWOGWFAVMRDFNN-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492934 1059270236 /nfs/dbraw/zinc/27/02/36/1059270236.db2.gz JWOGWFAVMRDFNN-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492934 1059270252 /nfs/dbraw/zinc/27/02/52/1059270252.db2.gz JWOGWFAVMRDFNN-AWEZNQCLSA-N 2 1 315.288 4.300 20 0 DIADMP CCOc1ccc(C[N@@H+](CCC[NH+]2CCCCC2)C(C)C)cc1 ZINC001559509568 1059302516 /nfs/dbraw/zinc/30/25/16/1059302516.db2.gz ZINKORHJFLKHHL-UHFFFAOYSA-N 2 1 318.505 4.172 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CC1 ZINC001559510474 1059303381 /nfs/dbraw/zinc/30/33/81/1059303381.db2.gz IVQURWFSXMFUAA-SFHVURJKSA-N 2 1 300.490 4.295 20 0 DIADMP CCc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC001559524754 1059321594 /nfs/dbraw/zinc/32/15/94/1059321594.db2.gz PCLLZOIQXBYHDT-OAQYLSRUSA-N 2 1 314.517 4.337 20 0 DIADMP Cc1cc(C)cc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC001559525337 1059325009 /nfs/dbraw/zinc/32/50/09/1059325009.db2.gz JDIJJXBCKHRMFA-FQEVSTJZSA-N 2 1 314.517 4.391 20 0 DIADMP CCc1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001559546521 1059349872 /nfs/dbraw/zinc/34/98/72/1059349872.db2.gz YLFVJEMTHBWLTD-OALUTQOASA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001559546521 1059349896 /nfs/dbraw/zinc/34/98/96/1059349896.db2.gz YLFVJEMTHBWLTD-OALUTQOASA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001559546521 1059349920 /nfs/dbraw/zinc/34/99/20/1059349920.db2.gz YLFVJEMTHBWLTD-OALUTQOASA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC001559594117 1059427073 /nfs/dbraw/zinc/42/70/73/1059427073.db2.gz JKNMWNGOGKIIGM-SIKLNZKXSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC001559594117 1059427084 /nfs/dbraw/zinc/42/70/84/1059427084.db2.gz JKNMWNGOGKIIGM-SIKLNZKXSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC001559594117 1059427096 /nfs/dbraw/zinc/42/70/96/1059427096.db2.gz JKNMWNGOGKIIGM-SIKLNZKXSA-N 2 1 322.496 4.318 20 0 DIADMP CC(C)[C@@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001559595789 1059427547 /nfs/dbraw/zinc/42/75/47/1059427547.db2.gz GXDMJRMGOUTICJ-HXUWFJFHSA-N 2 1 300.490 4.150 20 0 DIADMP C[N@H+]1CCC[C@H]1CCN(Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635129 1059461703 /nfs/dbraw/zinc/46/17/03/1059461703.db2.gz LLSWPTSGOMBYCQ-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635129 1059461707 /nfs/dbraw/zinc/46/17/07/1059461707.db2.gz LLSWPTSGOMBYCQ-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635129 1059461712 /nfs/dbraw/zinc/46/17/12/1059461712.db2.gz LLSWPTSGOMBYCQ-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635129 1059461717 /nfs/dbraw/zinc/46/17/17/1059461717.db2.gz LLSWPTSGOMBYCQ-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635129 1059461720 /nfs/dbraw/zinc/46/17/20/1059461720.db2.gz LLSWPTSGOMBYCQ-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP CC[C@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001559718113 1059547941 /nfs/dbraw/zinc/54/79/41/1059547941.db2.gz JFGSCAITAZDUMB-SFHVURJKSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCCC1(C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737884 1059571157 /nfs/dbraw/zinc/57/11/57/1059571157.db2.gz PSVHPVQTJNQIBI-RCCFBDPRSA-N 2 1 306.538 4.445 20 0 DIADMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001559740617 1059572428 /nfs/dbraw/zinc/57/24/28/1059572428.db2.gz BUUVPIIJYXMDSJ-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001559740618 1059574020 /nfs/dbraw/zinc/57/40/20/1059574020.db2.gz BUUVPIIJYXMDSJ-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP C[C@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)CC(C)(C)C ZINC001559793216 1059629515 /nfs/dbraw/zinc/62/95/15/1059629515.db2.gz HQNJAZPMFRSPSW-INIZCTEOSA-N 2 1 317.521 4.471 20 0 DIADMP c1cc(C[N@H+]2CC[C@H](C3CCC3)C2)cc(C[NH+]2CCCCC2)c1 ZINC001559909657 1059726338 /nfs/dbraw/zinc/72/63/38/1059726338.db2.gz KHYZHLUFMMOXPN-NRFANRHFSA-N 2 1 312.501 4.295 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001559911515 1059727437 /nfs/dbraw/zinc/72/74/37/1059727437.db2.gz LTZDQYMPGDUGKC-WOJBJXKFSA-N 2 1 302.506 4.377 20 0 DIADMP CCCC[N@@H+](CCC(C)(C)OC)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001560036303 1059852355 /nfs/dbraw/zinc/85/23/55/1059852355.db2.gz ZAIHGFWDRLDPIK-UHFFFAOYSA-N 2 1 312.542 4.213 20 0 DIADMP CCC1([NH+](C)C)CC[NH+]([C@@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001560048158 1059862653 /nfs/dbraw/zinc/86/26/53/1059862653.db2.gz GMJIPUVSTAWLGD-INIZCTEOSA-N 2 1 300.490 4.043 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@H]2[C@@H](CC[NH+]2C)C1 ZINC001560077682 1059893216 /nfs/dbraw/zinc/89/32/16/1059893216.db2.gz UJIJPZDKVNCVAP-AYBZRNKSSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@H]2[C@@H](CC[N@@H+]2C)C1 ZINC001560077682 1059893240 /nfs/dbraw/zinc/89/32/40/1059893240.db2.gz UJIJPZDKVNCVAP-AYBZRNKSSA-N 2 1 300.490 4.071 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC001560077682 1059893259 /nfs/dbraw/zinc/89/32/59/1059893259.db2.gz UJIJPZDKVNCVAP-AYBZRNKSSA-N 2 1 300.490 4.071 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)C1(Cc2ccccc2)CCCC1 ZINC001560122936 1059927574 /nfs/dbraw/zinc/92/75/74/1059927574.db2.gz KSNIFWXCGHGNLZ-UHFFFAOYSA-N 2 1 302.506 4.206 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+]CCC[N@H+](C)C(C)C)c2)cc1 ZINC001560263061 1060029746 /nfs/dbraw/zinc/02/97/46/1060029746.db2.gz XHGYASLLEYQYIQ-UHFFFAOYSA-N 2 1 310.485 4.482 20 0 DIADMP CC(C)c1cnc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)s1 ZINC001560270609 1060045459 /nfs/dbraw/zinc/04/54/59/1060045459.db2.gz BMOHDYICDNXHGY-OAHLLOKOSA-N 2 1 309.523 4.011 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001560272233 1060045875 /nfs/dbraw/zinc/04/58/75/1060045875.db2.gz ZTMXDIYPIBCSTI-HOCLYGCPSA-N 2 1 304.478 4.064 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC001560272233 1060045896 /nfs/dbraw/zinc/04/58/96/1060045896.db2.gz ZTMXDIYPIBCSTI-HOCLYGCPSA-N 2 1 304.478 4.064 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+]C[C@H](CC)c1ccccc1 ZINC001560320745 1060108069 /nfs/dbraw/zinc/10/80/69/1060108069.db2.gz NAYIDYXDJUFQHJ-AZUAARDMSA-N 2 1 302.506 4.424 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+]C[C@H](CC)c1ccccc1 ZINC001560320745 1060108077 /nfs/dbraw/zinc/10/80/77/1060108077.db2.gz NAYIDYXDJUFQHJ-AZUAARDMSA-N 2 1 302.506 4.424 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC001560325576 1060112498 /nfs/dbraw/zinc/11/24/98/1060112498.db2.gz OGUIMZCCXKZSIJ-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CC1 ZINC001560325576 1060112503 /nfs/dbraw/zinc/11/25/03/1060112503.db2.gz OGUIMZCCXKZSIJ-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC001560349504 1060135781 /nfs/dbraw/zinc/13/57/81/1060135781.db2.gz NCCGAWDNHGUZBP-PKOBYXMFSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC001560349504 1060135789 /nfs/dbraw/zinc/13/57/89/1060135789.db2.gz NCCGAWDNHGUZBP-PKOBYXMFSA-N 2 1 314.498 4.229 20 0 DIADMP CC(C)[NH+](CCC[NH2+]C/C=C\c1ccc(F)c(F)c1)C(C)C ZINC001560366521 1060153556 /nfs/dbraw/zinc/15/35/56/1060153556.db2.gz HZAZMAJVBMMXNK-ALCCZGGFSA-N 2 1 310.432 4.077 20 0 DIADMP CCC(C)(C)c1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC001560411044 1060195011 /nfs/dbraw/zinc/19/50/11/1060195011.db2.gz QSQFEJDKFXOWLZ-RBUKOAKNSA-N 2 1 300.490 4.091 20 0 DIADMP CCC(C)(C)c1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC001560411040 1060195595 /nfs/dbraw/zinc/19/55/95/1060195595.db2.gz QSQFEJDKFXOWLZ-MOPGFXCFSA-N 2 1 300.490 4.091 20 0 DIADMP C[C@H](CC[NH2+]Cc1cnc(C2CCCC2)s1)[NH+]1CCCCC1 ZINC001560436743 1060226140 /nfs/dbraw/zinc/22/61/40/1060226140.db2.gz PLCPNKYGAPWUAL-OAHLLOKOSA-N 2 1 321.534 4.155 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001560444027 1060234626 /nfs/dbraw/zinc/23/46/26/1060234626.db2.gz ZVVRNKUGXCGQRK-IBGZPJMESA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001560444027 1060234645 /nfs/dbraw/zinc/23/46/45/1060234645.db2.gz ZVVRNKUGXCGQRK-IBGZPJMESA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC001560463677 1060255819 /nfs/dbraw/zinc/25/58/19/1060255819.db2.gz AAAYZNBWWDJXLF-KVPLUYHFSA-N 2 1 302.506 4.277 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC001560463677 1060255834 /nfs/dbraw/zinc/25/58/34/1060255834.db2.gz AAAYZNBWWDJXLF-KVPLUYHFSA-N 2 1 302.506 4.277 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H]3CCC[C@@H]3C3CC3)CC2)cc1 ZINC001560503480 1060298291 /nfs/dbraw/zinc/29/82/91/1060298291.db2.gz OAXAKHSFNHVYNT-TZIWHRDSSA-N 2 1 312.501 4.067 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3CCC[C@H]3C3CC3)CC2)cc1 ZINC001560503478 1060299115 /nfs/dbraw/zinc/29/91/15/1060299115.db2.gz OAXAKHSFNHVYNT-FPOVZHCZSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1cc(Nc2cc[nH+]cc2C(F)(F)F)c2ccccc2[nH+]1 ZINC001249583926 1060302340 /nfs/dbraw/zinc/30/23/40/1060302340.db2.gz MISZXDAHGPJUDE-UHFFFAOYSA-N 2 1 303.287 4.123 20 0 DIADMP C[C@@H](CC1CCC1)[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001560548790 1060357009 /nfs/dbraw/zinc/35/70/09/1060357009.db2.gz BMFVTXUFPUXLJO-KRWDZBQOSA-N 2 1 302.506 4.313 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCC[C@H]1C=CCC1 ZINC001560576983 1060390614 /nfs/dbraw/zinc/39/06/14/1060390614.db2.gz VUKMPRXJJHRVLB-IBGZPJMESA-N 2 1 314.517 4.481 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc2cc(C)c(C)cc2o1 ZINC001560624468 1060433987 /nfs/dbraw/zinc/43/39/87/1060433987.db2.gz PFYXHTJXDUXNMC-MRXNPFEDSA-N 2 1 302.462 4.260 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCCC[C@H]2/C=C\c2ccccc2)CC1 ZINC001560648422 1060471330 /nfs/dbraw/zinc/47/13/30/1060471330.db2.gz OYSOBRGVFPBWJI-GMGKOPGTSA-N 2 1 312.501 4.286 20 0 DIADMP CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CC2CC[NH+](CC)CC2)o1 ZINC001560647247 1060471436 /nfs/dbraw/zinc/47/14/36/1060471436.db2.gz SXCAXAYZXXNQDE-QFBILLFUSA-N 2 1 318.505 4.347 20 0 DIADMP Cc1cc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c(C)o1 ZINC001560690515 1060538294 /nfs/dbraw/zinc/53/82/94/1060538294.db2.gz WRRLZHGUWUEMDC-MRXNPFEDSA-N 2 1 318.505 4.373 20 0 DIADMP CC(C)C1(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700936 1060556196 /nfs/dbraw/zinc/55/61/96/1060556196.db2.gz VNYQSPKSDLKLEX-QUCCMNQESA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700936 1060556208 /nfs/dbraw/zinc/55/62/08/1060556208.db2.gz VNYQSPKSDLKLEX-QUCCMNQESA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700936 1060556218 /nfs/dbraw/zinc/55/62/18/1060556218.db2.gz VNYQSPKSDLKLEX-QUCCMNQESA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001560700936 1060556226 /nfs/dbraw/zinc/55/62/26/1060556226.db2.gz VNYQSPKSDLKLEX-QUCCMNQESA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001560703745 1060559224 /nfs/dbraw/zinc/55/92/24/1060559224.db2.gz LNRJGZODAFXROH-MJUUVYJYSA-N 2 1 314.517 4.311 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001560803540 1060662634 /nfs/dbraw/zinc/66/26/34/1060662634.db2.gz ZQRSWXMVYLIREP-QHGAOEGBSA-N 2 1 302.506 4.207 20 0 DIADMP CCCc1cccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC001560810483 1060668943 /nfs/dbraw/zinc/66/89/43/1060668943.db2.gz BDEZDRRONBNKJP-UHFFFAOYSA-N 2 1 310.485 4.333 20 0 DIADMP CC[N@@H+](C/C=C/c1cc(C)c(C)cc1C)CCC[NH+]1CCCC1 ZINC001560811656 1060671701 /nfs/dbraw/zinc/67/17/01/1060671701.db2.gz SKGYLOVHYMXFFY-CSKARUKUSA-N 2 1 314.517 4.433 20 0 DIADMP CC[N@H+](C/C=C/c1cc(C)c(C)cc1C)CCC[NH+]1CCCC1 ZINC001560811656 1060671713 /nfs/dbraw/zinc/67/17/13/1060671713.db2.gz SKGYLOVHYMXFFY-CSKARUKUSA-N 2 1 314.517 4.433 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001560834678 1060691030 /nfs/dbraw/zinc/69/10/30/1060691030.db2.gz ABZGNDVBJQZUTA-QIJZPMMNSA-N 2 1 312.501 4.236 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001560834678 1060691036 /nfs/dbraw/zinc/69/10/36/1060691036.db2.gz ABZGNDVBJQZUTA-QIJZPMMNSA-N 2 1 312.501 4.236 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001560861536 1060721058 /nfs/dbraw/zinc/72/10/58/1060721058.db2.gz QHIFZKKEZDNEAL-UONOGXRCSA-N 2 1 316.942 4.433 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC001560861536 1060721042 /nfs/dbraw/zinc/72/10/42/1060721042.db2.gz QHIFZKKEZDNEAL-UONOGXRCSA-N 2 1 316.942 4.433 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560864209 1060723294 /nfs/dbraw/zinc/72/32/94/1060723294.db2.gz NRBKAWGRDVGTCJ-YZGWKJHDSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560864209 1060723310 /nfs/dbraw/zinc/72/33/10/1060723310.db2.gz NRBKAWGRDVGTCJ-YZGWKJHDSA-N 2 1 302.506 4.207 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CC(C)(C)C[C@@H]2c2ccccc2)CC1 ZINC001560898670 1060763256 /nfs/dbraw/zinc/76/32/56/1060763256.db2.gz PLHAYCNFPGMUHF-LJQANCHMSA-N 2 1 300.490 4.192 20 0 DIADMP C[C@@H](CCC1CCCC1)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560900789 1060763406 /nfs/dbraw/zinc/76/34/06/1060763406.db2.gz ILTJXKNHVXPOLV-WMQCIHAUSA-N 2 1 314.517 4.280 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC001560932791 1060794684 /nfs/dbraw/zinc/79/46/84/1060794684.db2.gz TYZOSKZVTCSQCH-KKXNLOMOSA-N 2 1 300.490 4.034 20 0 DIADMP CCC[N@H+](C)CC(C)(C)[NH2+]CCCc1c(F)cccc1Cl ZINC001560943440 1060808562 /nfs/dbraw/zinc/80/85/62/1060808562.db2.gz RIZPHSCNPKNUGT-UHFFFAOYSA-N 2 1 314.876 4.122 20 0 DIADMP CCC[N@@H+](C)CC(C)(C)[NH2+]CCCc1c(F)cccc1Cl ZINC001560943440 1060808575 /nfs/dbraw/zinc/80/85/75/1060808575.db2.gz RIZPHSCNPKNUGT-UHFFFAOYSA-N 2 1 314.876 4.122 20 0 DIADMP C[C@H](C[N@@H+]1CCCC[C@H]1[C@@H](C)C[NH+](C)C)c1cccc(Cl)c1 ZINC001560948289 1060813424 /nfs/dbraw/zinc/81/34/24/1060813424.db2.gz SSHSTDNUBPMAMZ-GJYPPUQNSA-N 2 1 322.924 4.496 20 0 DIADMP c1ccc(C2CC([NH2+]C[C@@H]3CC[N@@H+]3C3CCCCCC3)C2)cc1 ZINC001560973586 1060837942 /nfs/dbraw/zinc/83/79/42/1060837942.db2.gz YQOIFMAJJDQLCJ-GRERDSQWSA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc(C2CC([NH2+]C[C@@H]3CC[N@H+]3C3CCCCCC3)C2)cc1 ZINC001560973586 1060837947 /nfs/dbraw/zinc/83/79/47/1060837947.db2.gz YQOIFMAJJDQLCJ-GRERDSQWSA-N 2 1 312.501 4.319 20 0 DIADMP CC(C)C1CCC(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)CC1 ZINC001561045036 1060896709 /nfs/dbraw/zinc/89/67/09/1060896709.db2.gz CGJWUDBRZRAAPN-PWKSQPCKSA-N 2 1 306.538 4.111 20 0 DIADMP CCSc1cccc(C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC001561052094 1060903023 /nfs/dbraw/zinc/90/30/23/1060903023.db2.gz RVEPCELANAJHMI-UHFFFAOYSA-N 2 1 306.519 4.151 20 0 DIADMP CCSc1cccc(C[N@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC001561052094 1060903043 /nfs/dbraw/zinc/90/30/43/1060903043.db2.gz RVEPCELANAJHMI-UHFFFAOYSA-N 2 1 306.519 4.151 20 0 DIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213105 1060986781 /nfs/dbraw/zinc/98/67/81/1060986781.db2.gz QWXUADBTTKCHCH-IBGZPJMESA-N 2 1 314.517 4.148 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213105 1060986792 /nfs/dbraw/zinc/98/67/92/1060986792.db2.gz QWXUADBTTKCHCH-IBGZPJMESA-N 2 1 314.517 4.148 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213105 1060986810 /nfs/dbraw/zinc/98/68/10/1060986810.db2.gz QWXUADBTTKCHCH-IBGZPJMESA-N 2 1 314.517 4.148 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001473213105 1060986827 /nfs/dbraw/zinc/98/68/27/1060986827.db2.gz QWXUADBTTKCHCH-IBGZPJMESA-N 2 1 314.517 4.148 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC001473220526 1060997865 /nfs/dbraw/zinc/99/78/65/1060997865.db2.gz WTAYHURTRGRBMN-ICSRJNTNSA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC001473220526 1060997888 /nfs/dbraw/zinc/99/78/88/1060997888.db2.gz WTAYHURTRGRBMN-ICSRJNTNSA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC001473220526 1060997911 /nfs/dbraw/zinc/99/79/11/1060997911.db2.gz WTAYHURTRGRBMN-ICSRJNTNSA-N 2 1 314.517 4.290 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](CC3CCC(C(C)(C)C)CC3)CC[C@@H]21 ZINC001473219452 1060998354 /nfs/dbraw/zinc/99/83/54/1060998354.db2.gz HRMITUMOAZZBFC-JEVOJNTISA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](CC3CCC(C(C)(C)C)CC3)CC[C@@H]21 ZINC001473219452 1060998375 /nfs/dbraw/zinc/99/83/75/1060998375.db2.gz HRMITUMOAZZBFC-JEVOJNTISA-N 2 1 306.538 4.255 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](CC3CCC(C(C)(C)C)CC3)CC[C@@H]21 ZINC001473219452 1060998394 /nfs/dbraw/zinc/99/83/94/1060998394.db2.gz HRMITUMOAZZBFC-JEVOJNTISA-N 2 1 306.538 4.255 20 0 DIADMP CC[N@@H+](Cc1csc(C)c1C)Cc1ccc(C[NH+](C)C)cc1 ZINC001462194261 1061015365 /nfs/dbraw/zinc/01/53/65/1061015365.db2.gz XERNPYSHHBVMEW-UHFFFAOYSA-N 2 1 316.514 4.449 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl ZINC001462223431 1061038781 /nfs/dbraw/zinc/03/87/81/1061038781.db2.gz PLTPGIKVEJYQIY-VDZJLULYSA-N 2 1 320.908 4.440 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl ZINC001462223431 1061038792 /nfs/dbraw/zinc/03/87/92/1061038792.db2.gz PLTPGIKVEJYQIY-VDZJLULYSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@H+]1CCC[C@@]2(CC[NH+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC001462278208 1061071235 /nfs/dbraw/zinc/07/12/35/1061071235.db2.gz LDJTYAGMBBTZKF-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC001462278208 1061071251 /nfs/dbraw/zinc/07/12/51/1061071251.db2.gz LDJTYAGMBBTZKF-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC001462278208 1061071264 /nfs/dbraw/zinc/07/12/64/1061071264.db2.gz LDJTYAGMBBTZKF-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCCC[C@H]1c1ccccc1)C1CC1 ZINC001462310016 1061096441 /nfs/dbraw/zinc/09/64/41/1061096441.db2.gz MEDKQQVMXCZKJD-VQTJNVASSA-N 2 1 300.490 4.177 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCCSC(C)(C)C ZINC001473378045 1061121419 /nfs/dbraw/zinc/12/14/19/1061121419.db2.gz RSFCHRYVCYDBCX-UHFFFAOYSA-N 2 1 311.539 4.079 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCCSC(C)(C)C ZINC001473378045 1061121434 /nfs/dbraw/zinc/12/14/34/1061121434.db2.gz RSFCHRYVCYDBCX-UHFFFAOYSA-N 2 1 311.539 4.079 20 0 DIADMP CCc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC001473410300 1061146108 /nfs/dbraw/zinc/14/61/08/1061146108.db2.gz WTWNZYLGRWKQOA-PGRDOPGGSA-N 2 1 322.496 4.249 20 0 DIADMP CCc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC001473410302 1061146607 /nfs/dbraw/zinc/14/66/07/1061146607.db2.gz WTWNZYLGRWKQOA-XMSQKQJNSA-N 2 1 322.496 4.249 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1cccn1C(F)F)C1CCCCC1 ZINC001462407568 1061153941 /nfs/dbraw/zinc/15/39/41/1061153941.db2.gz KHGRIRUFRYIJGG-UHFFFAOYSA-N 2 1 313.436 4.018 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cccn1C(F)F)C1CCCCC1 ZINC001462407568 1061153945 /nfs/dbraw/zinc/15/39/45/1061153945.db2.gz KHGRIRUFRYIJGG-UHFFFAOYSA-N 2 1 313.436 4.018 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001473427705 1061156045 /nfs/dbraw/zinc/15/60/45/1061156045.db2.gz GAKNCLUKWMTPTO-QGZVFWFLSA-N 2 1 304.478 4.450 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)c1 ZINC001473489935 1061187554 /nfs/dbraw/zinc/18/75/54/1061187554.db2.gz JVVMOLZIEWXZKM-QFIPXVFZSA-N 2 1 322.496 4.374 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c1 ZINC001473489935 1061187563 /nfs/dbraw/zinc/18/75/63/1061187563.db2.gz JVVMOLZIEWXZKM-QFIPXVFZSA-N 2 1 322.496 4.374 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c1 ZINC001473489935 1061187571 /nfs/dbraw/zinc/18/75/71/1061187571.db2.gz JVVMOLZIEWXZKM-QFIPXVFZSA-N 2 1 322.496 4.374 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001473501437 1061198146 /nfs/dbraw/zinc/19/81/46/1061198146.db2.gz JRUXRMDYKMKSDW-QFIPXVFZSA-N 2 1 322.496 4.366 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001473501437 1061198153 /nfs/dbraw/zinc/19/81/53/1061198153.db2.gz JRUXRMDYKMKSDW-QFIPXVFZSA-N 2 1 322.496 4.366 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c(C(C)C)c1 ZINC001473507777 1061200370 /nfs/dbraw/zinc/20/03/70/1061200370.db2.gz KHBDSOXQYYIUSE-OAQYLSRUSA-N 2 1 314.517 4.461 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)c(C(C)C)c1 ZINC001473507777 1061200387 /nfs/dbraw/zinc/20/03/87/1061200387.db2.gz KHBDSOXQYYIUSE-OAQYLSRUSA-N 2 1 314.517 4.461 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)c(C(C)C)c1 ZINC001473507777 1061200402 /nfs/dbraw/zinc/20/04/02/1061200402.db2.gz KHBDSOXQYYIUSE-OAQYLSRUSA-N 2 1 314.517 4.461 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC001462484417 1061203639 /nfs/dbraw/zinc/20/36/39/1061203639.db2.gz XBEDDEKBVUCDLN-LEWJYISDSA-N 2 1 324.512 4.377 20 0 DIADMP C[N@H+](C/C=C\c1ccc(F)cc1)CCCC[NH+]1CCCCC1 ZINC001462538321 1061245482 /nfs/dbraw/zinc/24/54/82/1061245482.db2.gz WZPNVETYHKUBLA-FPLPWBNLSA-N 2 1 304.453 4.037 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H](CC[NH+](C)C)c1cccnc1 ZINC001462587145 1061278569 /nfs/dbraw/zinc/27/85/69/1061278569.db2.gz FNDSTBMQNRDZTC-JENIJYKNSA-N 2 1 305.510 4.125 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462654824 1061319478 /nfs/dbraw/zinc/31/94/78/1061319478.db2.gz MUCSSAFRTZUWAR-XRULBBBTSA-N 2 1 310.485 4.299 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462654824 1061319498 /nfs/dbraw/zinc/31/94/98/1061319498.db2.gz MUCSSAFRTZUWAR-XRULBBBTSA-N 2 1 310.485 4.299 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462654815 1061321268 /nfs/dbraw/zinc/32/12/68/1061321268.db2.gz MUCSSAFRTZUWAR-DWIQEWEKSA-N 2 1 310.485 4.299 20 0 DIADMP C[C@@H]1CC=CC[C@H]1[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462654815 1061321282 /nfs/dbraw/zinc/32/12/82/1061321282.db2.gz MUCSSAFRTZUWAR-DWIQEWEKSA-N 2 1 310.485 4.299 20 0 DIADMP C[NH+](C)C1(C)CC[NH+](Cc2ccc(C3CCCC3)cc2)CC1 ZINC001473721767 1061371245 /nfs/dbraw/zinc/37/12/45/1061371245.db2.gz YMGDVCBWBHBNQO-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)C[C@H](C)[NH+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001473719606 1061371957 /nfs/dbraw/zinc/37/19/57/1061371957.db2.gz YCYYNTDQPOHCDO-JBACZVJFSA-N 2 1 314.517 4.265 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@]1(C)Cc1ccc(F)c(F)c1 ZINC001473730334 1061376611 /nfs/dbraw/zinc/37/66/11/1061376611.db2.gz QVBPPRBVYHOGNA-LJQANCHMSA-N 2 1 324.459 4.094 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@]1(C)Cc1ccc(F)c(F)c1 ZINC001473730334 1061376631 /nfs/dbraw/zinc/37/66/31/1061376631.db2.gz QVBPPRBVYHOGNA-LJQANCHMSA-N 2 1 324.459 4.094 20 0 DIADMP CC(C)C[N@@H+](CC1CC[NH+](C)CC1)CC1CCC2(CC2)CC1 ZINC001473739290 1061385145 /nfs/dbraw/zinc/38/51/45/1061385145.db2.gz MTCFZDRFAPFVSD-UHFFFAOYSA-N 2 1 306.538 4.257 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)CC1CCC(F)(F)CC1 ZINC001473749953 1061391834 /nfs/dbraw/zinc/39/18/34/1061391834.db2.gz RLFRZHKHONZEHP-UHFFFAOYSA-N 2 1 302.453 4.010 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC001473759939 1061396976 /nfs/dbraw/zinc/39/69/76/1061396976.db2.gz SJANJUWOHPZHDN-LSDHHAIUSA-N 2 1 315.848 4.007 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](CCOC2CCCCC2)CC1 ZINC001473756568 1061397269 /nfs/dbraw/zinc/39/72/69/1061397269.db2.gz CDOXPSJZKQRQDZ-UHFFFAOYSA-N 2 1 322.537 4.066 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c(Cl)c1 ZINC001473937117 1061482978 /nfs/dbraw/zinc/48/29/78/1061482978.db2.gz LVANMAROHGWAFT-MRXNPFEDSA-N 2 1 308.897 4.250 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)cc1F ZINC001473954840 1061497425 /nfs/dbraw/zinc/49/74/25/1061497425.db2.gz IBLVQNKGWGITHC-KBPBESRZSA-N 2 1 315.436 4.234 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC001473957222 1061500056 /nfs/dbraw/zinc/50/00/56/1061500056.db2.gz MZHMHMOZAJPPTJ-HLAWJBBLSA-N 2 1 314.517 4.424 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+]CCC[NH+]1CCC1 ZINC001474099920 1061646122 /nfs/dbraw/zinc/64/61/22/1061646122.db2.gz QVINYDUWQITNIY-UHFFFAOYSA-N 2 1 308.878 4.049 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)Nc1cc(C(C)C)nc(C(C)C)n1 ZINC001458402909 1061742560 /nfs/dbraw/zinc/74/25/60/1061742560.db2.gz CGEBXERXRMKYDY-OAHLLOKOSA-N 2 1 306.498 4.256 20 0 DIADMP C[C@@H](C[NH2+][C@@H](CC[NH+](C)C)c1cccnc1)CC1CCCCC1 ZINC001474275460 1061841247 /nfs/dbraw/zinc/84/12/47/1061841247.db2.gz RKDCJPYQXIZPDD-XLIONFOSSA-N 2 1 317.521 4.271 20 0 DIADMP CC[NH+](CC)CC[C@@H]([NH2+]CC1(OC)CCCC1)c1ccccc1 ZINC001474300158 1061870336 /nfs/dbraw/zinc/87/03/36/1061870336.db2.gz DTAVPUAAZOOQSU-LJQANCHMSA-N 2 1 318.505 4.008 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](C[C@H]4CC=CCC4)CC[C@H]32)cc1 ZINC001474320311 1061897193 /nfs/dbraw/zinc/89/71/93/1061897193.db2.gz CFMDCTZEHWNPPJ-ILWGZMRPSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]32)cc1 ZINC001474320311 1061897202 /nfs/dbraw/zinc/89/72/02/1061897202.db2.gz CFMDCTZEHWNPPJ-ILWGZMRPSA-N 2 1 324.512 4.329 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](C[C@H]4CC=CCC4)CC[C@H]32)cc1 ZINC001474320311 1061897211 /nfs/dbraw/zinc/89/72/11/1061897211.db2.gz CFMDCTZEHWNPPJ-ILWGZMRPSA-N 2 1 324.512 4.329 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)C/C=C\c2c(C)cc(C)cc2C)CC1 ZINC001474364158 1061989512 /nfs/dbraw/zinc/98/95/12/1061989512.db2.gz YYRNJNNJOOVRHD-FPLPWBNLSA-N 2 1 314.517 4.431 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)C/C=C\c2c(C)cc(C)cc2C)CC1 ZINC001474364158 1061989539 /nfs/dbraw/zinc/98/95/39/1061989539.db2.gz YYRNJNNJOOVRHD-FPLPWBNLSA-N 2 1 314.517 4.431 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCC[C@H](CCCc3ccccc3)C2)CC1 ZINC001474372818 1062015435 /nfs/dbraw/zinc/01/54/35/1062015435.db2.gz PWHRSDPHQTTXAE-FQEVSTJZSA-N 2 1 314.517 4.063 20 0 DIADMP CC(C)[C@H]1CCc2ccccc2[C@@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001474418391 1062087187 /nfs/dbraw/zinc/08/71/87/1062087187.db2.gz DHXJEMNIYZUOCP-TZIWHRDSSA-N 2 1 312.501 4.163 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CCC3(CC3)CC2)CC1 ZINC001254438085 1062102979 /nfs/dbraw/zinc/10/29/79/1062102979.db2.gz OVVAEIQEMMPJDA-WGSAOQKQSA-N 2 1 312.501 4.481 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCC[NH+]1C)[C@@H](C)c1cc2ccccc2o1 ZINC001459348565 1062105135 /nfs/dbraw/zinc/10/51/35/1062105135.db2.gz YVSZSJGQVZPNKQ-RDJZCZTQSA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@@H+]1C)[C@@H](C)c1cc2ccccc2o1 ZINC001459348565 1062105139 /nfs/dbraw/zinc/10/51/39/1062105139.db2.gz YVSZSJGQVZPNKQ-RDJZCZTQSA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@H+]1C)[C@@H](C)c1cc2ccccc2o1 ZINC001459348565 1062105148 /nfs/dbraw/zinc/10/51/48/1062105148.db2.gz YVSZSJGQVZPNKQ-RDJZCZTQSA-N 2 1 300.446 4.300 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCC[C@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442460 1062120226 /nfs/dbraw/zinc/12/02/26/1062120226.db2.gz NDCBSTVXBWJBCG-YDHLFZDLSA-N 2 1 310.532 4.090 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCC[C@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442460 1062120239 /nfs/dbraw/zinc/12/02/39/1062120239.db2.gz NDCBSTVXBWJBCG-YDHLFZDLSA-N 2 1 310.532 4.090 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001254486237 1062128321 /nfs/dbraw/zinc/12/83/21/1062128321.db2.gz WMLRKIJRTOOAQG-WOJBJXKFSA-N 2 1 302.506 4.109 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+](CCC)CCn1cc[nH+]c1C ZINC001459423016 1062137542 /nfs/dbraw/zinc/13/75/42/1062137542.db2.gz CGQPQWQOHSNJCT-FQEVSTJZSA-N 2 1 313.489 4.315 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)CCn1cc[nH+]c1C ZINC001459423016 1062137554 /nfs/dbraw/zinc/13/75/54/1062137554.db2.gz CGQPQWQOHSNJCT-FQEVSTJZSA-N 2 1 313.489 4.315 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCc2ccccc2)CC1 ZINC001459423045 1062137897 /nfs/dbraw/zinc/13/78/97/1062137897.db2.gz CPUXFQRYRFQFSM-UHFFFAOYSA-N 2 1 322.496 4.073 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+]1C[C@H]2C[NH+](CCC)C[C@H]2C1 ZINC001254497426 1062138403 /nfs/dbraw/zinc/13/84/03/1062138403.db2.gz CGOBCRBXSAZEAC-QHAWAJNXSA-N 2 1 314.517 4.062 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH+]1C[C@H]2C[N@@H+](CCC)C[C@H]2C1 ZINC001254497426 1062138410 /nfs/dbraw/zinc/13/84/10/1062138410.db2.gz CGOBCRBXSAZEAC-QHAWAJNXSA-N 2 1 314.517 4.062 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH+]1C[C@H]2C[N@H+](CCC)C[C@H]2C1 ZINC001254497426 1062138424 /nfs/dbraw/zinc/13/84/24/1062138424.db2.gz CGOBCRBXSAZEAC-QHAWAJNXSA-N 2 1 314.517 4.062 20 0 DIADMP CCC[C@@H](CCc1ccccc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001254497215 1062138731 /nfs/dbraw/zinc/13/87/31/1062138731.db2.gz ACAOVMVOESTRPD-IBGZPJMESA-N 2 1 311.473 4.324 20 0 DIADMP CCC[C@H](CCc1ccccc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001254497216 1062139291 /nfs/dbraw/zinc/13/92/91/1062139291.db2.gz ACAOVMVOESTRPD-LJQANCHMSA-N 2 1 311.473 4.324 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C(C)(C)Cc2ccc3ccccc3c2)CC1 ZINC001254500486 1062140552 /nfs/dbraw/zinc/14/05/52/1062140552.db2.gz IDFYKRXAISXQTJ-FQEVSTJZSA-N 2 1 310.485 4.235 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C2(c3cccc(F)c3)CCCCC2)CC1 ZINC001254510905 1062149644 /nfs/dbraw/zinc/14/96/44/1062149644.db2.gz ZBTDVIBCICDRIT-GOSISDBHSA-N 2 1 304.453 4.059 20 0 DIADMP Cc1ccc(C[C@H]([NH2+][C@H]2CCC[N@H+](C)CC2)c2ccccc2)cc1 ZINC001254510203 1062149816 /nfs/dbraw/zinc/14/98/16/1062149816.db2.gz SWLPZSPPNNQUTM-VXKWHMMOSA-N 2 1 322.496 4.353 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C(C)(C)c2ccccc2C(F)(F)F)CC1 ZINC001254510534 1062150368 /nfs/dbraw/zinc/15/03/68/1062150368.db2.gz XOEANYCZQLEWPT-ZDUSSCGKSA-N 2 1 314.395 4.014 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1CCC[NH+](C)CC1 ZINC001254529186 1062160074 /nfs/dbraw/zinc/16/00/74/1062160074.db2.gz FDDHHNWLMFLREO-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1CCC[N@H+](C)CC1 ZINC001254529186 1062160078 /nfs/dbraw/zinc/16/00/78/1062160078.db2.gz FDDHHNWLMFLREO-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1CCC[N@@H+](C)CC1 ZINC001254529186 1062160083 /nfs/dbraw/zinc/16/00/83/1062160083.db2.gz FDDHHNWLMFLREO-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP CC[C@H](CCC(F)(F)F)[NH2+][C@@H](CC(C)C)C[NH+]1CCCC1 ZINC001474536834 1062224869 /nfs/dbraw/zinc/22/48/69/1062224869.db2.gz FWJRMRBGTSRNMT-CABCVRRESA-N 2 1 308.432 4.208 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)c1 ZINC001474538188 1062226862 /nfs/dbraw/zinc/22/68/62/1062226862.db2.gz RVQOMLIOQNFIHD-ICSRJNTNSA-N 2 1 302.506 4.026 20 0 DIADMP CC(C)=CCC[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001459603187 1062240538 /nfs/dbraw/zinc/24/05/38/1062240538.db2.gz BVIHUFTZAAGAQV-QUCCMNQESA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001459603187 1062240555 /nfs/dbraw/zinc/24/05/55/1062240555.db2.gz BVIHUFTZAAGAQV-QUCCMNQESA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001459603187 1062240577 /nfs/dbraw/zinc/24/05/77/1062240577.db2.gz BVIHUFTZAAGAQV-QUCCMNQESA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001459603187 1062240596 /nfs/dbraw/zinc/24/05/96/1062240596.db2.gz BVIHUFTZAAGAQV-QUCCMNQESA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001474556197 1062257320 /nfs/dbraw/zinc/25/73/20/1062257320.db2.gz ATGQHYCTUYBIDJ-ZJRDLVKKSA-N 2 1 302.506 4.279 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001474556197 1062257337 /nfs/dbraw/zinc/25/73/37/1062257337.db2.gz ATGQHYCTUYBIDJ-ZJRDLVKKSA-N 2 1 302.506 4.279 20 0 DIADMP CC(C)[NH+](C(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255135859 1062329228 /nfs/dbraw/zinc/32/92/28/1062329228.db2.gz FWIOPKMASOCGAG-PMOLBWCYSA-N 2 1 300.490 4.301 20 0 DIADMP CC(C)[NH+](C(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135859 1062329248 /nfs/dbraw/zinc/32/92/48/1062329248.db2.gz FWIOPKMASOCGAG-PMOLBWCYSA-N 2 1 300.490 4.301 20 0 DIADMP C[N@@H+](C1CCCCC1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255137540 1062331396 /nfs/dbraw/zinc/33/13/96/1062331396.db2.gz UCZPVXNSBLPMLQ-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCCC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255137540 1062331412 /nfs/dbraw/zinc/33/14/12/1062331412.db2.gz UCZPVXNSBLPMLQ-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[NH+](C1CCCCC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255137540 1062331429 /nfs/dbraw/zinc/33/14/29/1062331429.db2.gz UCZPVXNSBLPMLQ-WKCHPHFGSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@@H+](CC(C)(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255142286 1062334456 /nfs/dbraw/zinc/33/44/56/1062334456.db2.gz BRKORYNUUDMBPE-BWTSREIZSA-N 2 1 300.490 4.160 20 0 DIADMP C[NH+](CC(C)(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255142286 1062334472 /nfs/dbraw/zinc/33/44/72/1062334472.db2.gz BRKORYNUUDMBPE-BWTSREIZSA-N 2 1 300.490 4.160 20 0 DIADMP C[NH+](CC(C)(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255142286 1062334492 /nfs/dbraw/zinc/33/44/92/1062334492.db2.gz BRKORYNUUDMBPE-BWTSREIZSA-N 2 1 300.490 4.160 20 0 DIADMP C[N@@H+](C[C@@H]1CC1(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146260 1062338124 /nfs/dbraw/zinc/33/81/24/1062338124.db2.gz FEKVYBGWKGRFQI-VNTMZGSJSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146260 1062338148 /nfs/dbraw/zinc/33/81/48/1062338148.db2.gz FEKVYBGWKGRFQI-VNTMZGSJSA-N 2 1 312.501 4.160 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146260 1062338173 /nfs/dbraw/zinc/33/81/73/1062338173.db2.gz FEKVYBGWKGRFQI-VNTMZGSJSA-N 2 1 312.501 4.160 20 0 DIADMP CC[C@@H](C)c1ccc([C@@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC001459730094 1062339171 /nfs/dbraw/zinc/33/91/71/1062339171.db2.gz KDAJQJHPDCGVAP-UZLBHIALSA-N 2 1 313.489 4.463 20 0 DIADMP C[C@H]1CCCCC[N@@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145124 1062339514 /nfs/dbraw/zinc/33/95/14/1062339514.db2.gz ZDTKULIPKRFBRK-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145124 1062339529 /nfs/dbraw/zinc/33/95/29/1062339529.db2.gz ZDTKULIPKRFBRK-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145124 1062339549 /nfs/dbraw/zinc/33/95/49/1062339549.db2.gz ZDTKULIPKRFBRK-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145124 1062339570 /nfs/dbraw/zinc/33/95/70/1062339570.db2.gz ZDTKULIPKRFBRK-WJMWBRGCSA-N 2 1 312.501 4.447 20 0 DIADMP CC(C)[N@H+](CC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145691 1062341321 /nfs/dbraw/zinc/34/13/21/1062341321.db2.gz SFDGCTJVICFKPH-AERCQKQUSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255145691 1062341350 /nfs/dbraw/zinc/34/13/50/1062341350.db2.gz SFDGCTJVICFKPH-AERCQKQUSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255145691 1062341372 /nfs/dbraw/zinc/34/13/72/1062341372.db2.gz SFDGCTJVICFKPH-AERCQKQUSA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255145691 1062341383 /nfs/dbraw/zinc/34/13/83/1062341383.db2.gz SFDGCTJVICFKPH-AERCQKQUSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150145 1062346552 /nfs/dbraw/zinc/34/65/52/1062346552.db2.gz MFUOHKUPEIKHPS-FFGOWVMKSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@@H]1C[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150145 1062346574 /nfs/dbraw/zinc/34/65/74/1062346574.db2.gz MFUOHKUPEIKHPS-FFGOWVMKSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150145 1062346591 /nfs/dbraw/zinc/34/65/91/1062346591.db2.gz MFUOHKUPEIKHPS-FFGOWVMKSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150145 1062346613 /nfs/dbraw/zinc/34/66/13/1062346613.db2.gz MFUOHKUPEIKHPS-FFGOWVMKSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001474634019 1062358351 /nfs/dbraw/zinc/35/83/51/1062358351.db2.gz OBQANPFCWNWSAR-PKOBYXMFSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001474634019 1062358372 /nfs/dbraw/zinc/35/83/72/1062358372.db2.gz OBQANPFCWNWSAR-PKOBYXMFSA-N 2 1 300.490 4.004 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC001459751354 1062361260 /nfs/dbraw/zinc/36/12/60/1062361260.db2.gz ZXAONUGSAUCGRY-LEWJYISDSA-N 2 1 308.469 4.044 20 0 DIADMP CC(C)c1cccc(C[N@@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)c1 ZINC001474646494 1062372585 /nfs/dbraw/zinc/37/25/85/1062372585.db2.gz FCSDZBFJXCISHA-FXAWDEMLSA-N 2 1 302.506 4.362 20 0 DIADMP CC1(C)CCC([N@@H+](Cc2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001255300940 1062386414 /nfs/dbraw/zinc/38/64/14/1062386414.db2.gz HFHUGECQYWSLAJ-SAABIXHNSA-N 2 1 315.505 4.122 20 0 DIADMP CCCC[C@@H](C)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001255329034 1062405369 /nfs/dbraw/zinc/40/53/69/1062405369.db2.gz HCTQNIIJOAODSP-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001255329034 1062405373 /nfs/dbraw/zinc/40/53/73/1062405373.db2.gz HCTQNIIJOAODSP-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001255329034 1062405381 /nfs/dbraw/zinc/40/53/81/1062405381.db2.gz HCTQNIIJOAODSP-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001255331932 1062407062 /nfs/dbraw/zinc/40/70/62/1062407062.db2.gz FJKRAHAMXCPVGA-MRXNPFEDSA-N 2 1 306.469 4.301 20 0 DIADMP CCCC[C@@H](C)[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001255331932 1062407074 /nfs/dbraw/zinc/40/70/74/1062407074.db2.gz FJKRAHAMXCPVGA-MRXNPFEDSA-N 2 1 306.469 4.301 20 0 DIADMP Cc1cccc2[nH]c(C[N@@H+](C)CCCC[NH+]3CCCCC3)cc21 ZINC001474681264 1062413124 /nfs/dbraw/zinc/41/31/24/1062413124.db2.gz AYTFWCAVGDQOTC-UHFFFAOYSA-N 2 1 313.489 4.174 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCC(C)(C)C[C@H]2c2ccccc2)CC1 ZINC001474680841 1062413698 /nfs/dbraw/zinc/41/36/98/1062413698.db2.gz WSCOFFKIPMJUDJ-OALUTQOASA-N 2 1 300.490 4.033 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255382187 1062421320 /nfs/dbraw/zinc/42/13/20/1062421320.db2.gz SSKDJEJITGXNEO-GOSISDBHSA-N 2 1 314.498 4.201 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255383323 1062421576 /nfs/dbraw/zinc/42/15/76/1062421576.db2.gz HIXYAQCIAIXSHL-QFIPXVFZSA-N 2 1 322.496 4.393 20 0 DIADMP Cc1ccnc([C@H](C)[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255384288 1062421845 /nfs/dbraw/zinc/42/18/45/1062421845.db2.gz XJPJIHFDNCNYGI-ICSRJNTNSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccnc([C@H](C)[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255384288 1062421854 /nfs/dbraw/zinc/42/18/54/1062421854.db2.gz XJPJIHFDNCNYGI-ICSRJNTNSA-N 2 1 323.484 4.095 20 0 DIADMP FC1(F)CC[C@H](C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383078 1062422572 /nfs/dbraw/zinc/42/25/72/1062422572.db2.gz ZOGZGIYQSJNMBP-ZWKOTPCHSA-N 2 1 322.443 4.066 20 0 DIADMP C(=C/c1ccccc1)\C[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255384037 1062423095 /nfs/dbraw/zinc/42/30/95/1062423095.db2.gz RROGRJOILPWQBW-ZCQBWMKESA-N 2 1 320.480 4.344 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccs1 ZINC001255376935 1062423168 /nfs/dbraw/zinc/42/31/68/1062423168.db2.gz CZHZXSHNAVKSOX-FUHWJXTLSA-N 2 1 314.498 4.453 20 0 DIADMP Cc1ccnc([C@@H](C)[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255384290 1062423964 /nfs/dbraw/zinc/42/39/64/1062423964.db2.gz XJPJIHFDNCNYGI-UYAOXDASSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccnc([C@@H](C)[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255384290 1062423971 /nfs/dbraw/zinc/42/39/71/1062423971.db2.gz XJPJIHFDNCNYGI-UYAOXDASSA-N 2 1 323.484 4.095 20 0 DIADMP CC1(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCCC1 ZINC001255377053 1062425120 /nfs/dbraw/zinc/42/51/20/1062425120.db2.gz DVERIFQHJFFJRW-IBGZPJMESA-N 2 1 300.490 4.211 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)C1CCCC1 ZINC001255390506 1062426855 /nfs/dbraw/zinc/42/68/55/1062426855.db2.gz CARKRUOPPRGFOO-YLJYHZDGSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@H]([NH2+][C@H]1CCC[N@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393218 1062428711 /nfs/dbraw/zinc/42/87/11/1062428711.db2.gz MMQCMHYOQUMUPL-PMACEKPBSA-N 2 1 323.484 4.177 20 0 DIADMP CC[C@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393218 1062428725 /nfs/dbraw/zinc/42/87/25/1062428725.db2.gz MMQCMHYOQUMUPL-PMACEKPBSA-N 2 1 323.484 4.177 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255393764 1062429362 /nfs/dbraw/zinc/42/93/62/1062429362.db2.gz QGKHYGQNVDNMCX-MISYRCLQSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC001255392777 1062429586 /nfs/dbraw/zinc/42/95/86/1062429586.db2.gz IFOOQAYJNADVCQ-BHIFYINESA-N 2 1 320.480 4.187 20 0 DIADMP C[C@H]1CCCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398224 1062431538 /nfs/dbraw/zinc/43/15/38/1062431538.db2.gz ISVCFFODAZWABX-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398224 1062431546 /nfs/dbraw/zinc/43/15/46/1062431546.db2.gz ISVCFFODAZWABX-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398224 1062431551 /nfs/dbraw/zinc/43/15/51/1062431551.db2.gz ISVCFFODAZWABX-ICSRJNTNSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)[C@@H]1C ZINC001255401529 1062432850 /nfs/dbraw/zinc/43/28/50/1062432850.db2.gz BASQXRSQLONARE-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@@H]1C ZINC001255401529 1062432867 /nfs/dbraw/zinc/43/28/67/1062432867.db2.gz BASQXRSQLONARE-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@@H]1C ZINC001255401529 1062432882 /nfs/dbraw/zinc/43/28/82/1062432882.db2.gz BASQXRSQLONARE-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP Cc1ccccc1C[N@H+](C)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255401432 1062433330 /nfs/dbraw/zinc/43/33/30/1062433330.db2.gz AEOVJLKFTJEOPP-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255401432 1062433337 /nfs/dbraw/zinc/43/33/37/1062433337.db2.gz AEOVJLKFTJEOPP-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255401432 1062433348 /nfs/dbraw/zinc/43/33/48/1062433348.db2.gz AEOVJLKFTJEOPP-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP CC[C@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccnc1 ZINC001255394549 1062434437 /nfs/dbraw/zinc/43/44/37/1062434437.db2.gz VUWQYJPSQXGAMP-SFTDATJTSA-N 2 1 323.484 4.177 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255398783 1062435256 /nfs/dbraw/zinc/43/52/56/1062435256.db2.gz XVFHMFGQHHYZCX-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255398783 1062435261 /nfs/dbraw/zinc/43/52/61/1062435261.db2.gz XVFHMFGQHHYZCX-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255398783 1062435269 /nfs/dbraw/zinc/43/52/69/1062435269.db2.gz XVFHMFGQHHYZCX-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398662 1062435932 /nfs/dbraw/zinc/43/59/32/1062435932.db2.gz LXKFRRBIYLIZPC-AEFFLSMTSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398662 1062435942 /nfs/dbraw/zinc/43/59/42/1062435942.db2.gz LXKFRRBIYLIZPC-AEFFLSMTSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398662 1062435952 /nfs/dbraw/zinc/43/59/52/1062435952.db2.gz LXKFRRBIYLIZPC-AEFFLSMTSA-N 2 1 322.443 4.018 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CCC[NH+](Cc3ccccc3)CC2)cc1 ZINC001255403850 1062440949 /nfs/dbraw/zinc/44/09/49/1062440949.db2.gz QIUSCYHIBQDAMB-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccc(C[NH+](C)[C@H]2CCC[N@H+](Cc3ccccc3)CC2)cc1 ZINC001255403850 1062440959 /nfs/dbraw/zinc/44/09/59/1062440959.db2.gz QIUSCYHIBQDAMB-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccc(C[NH+](C)[C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255403850 1062440969 /nfs/dbraw/zinc/44/09/69/1062440969.db2.gz QIUSCYHIBQDAMB-QFIPXVFZSA-N 2 1 322.496 4.482 20 0 DIADMP FC(F)[C@@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255406121 1062441063 /nfs/dbraw/zinc/44/10/63/1062441063.db2.gz PCSXIUBRWDOTAV-QZTJIDSGSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255406121 1062441069 /nfs/dbraw/zinc/44/10/69/1062441069.db2.gz PCSXIUBRWDOTAV-QZTJIDSGSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255406121 1062441080 /nfs/dbraw/zinc/44/10/80/1062441080.db2.gz PCSXIUBRWDOTAV-QZTJIDSGSA-N 2 1 322.443 4.018 20 0 DIADMP CC[N@@H+](CCC1CC1)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001459912392 1062491977 /nfs/dbraw/zinc/49/19/77/1062491977.db2.gz JWRKYOLACXZEDE-UHFFFAOYSA-N 2 1 300.490 4.295 20 0 DIADMP C[C@H](CC(F)(F)F)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255643585 1062494311 /nfs/dbraw/zinc/49/43/11/1062494311.db2.gz RKIUYINMIZYBDM-FVQBIDKESA-N 2 1 314.395 4.099 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001255668022 1062507592 /nfs/dbraw/zinc/50/75/92/1062507592.db2.gz CRCPVDJAYMXLFZ-XVLXNVKGSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001255668022 1062507607 /nfs/dbraw/zinc/50/76/07/1062507607.db2.gz CRCPVDJAYMXLFZ-XVLXNVKGSA-N 2 1 304.453 4.272 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(F)c1 ZINC001255672731 1062512152 /nfs/dbraw/zinc/51/21/52/1062512152.db2.gz QCEOOIKHUQESBW-KRWWSPQJSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(F)c1 ZINC001255672731 1062512173 /nfs/dbraw/zinc/51/21/73/1062512173.db2.gz QCEOOIKHUQESBW-KRWWSPQJSA-N 2 1 308.416 4.021 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C2CCC2)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255701213 1062527345 /nfs/dbraw/zinc/52/73/45/1062527345.db2.gz SJKXSHMKAMPQSI-RRCSTGOVSA-N 2 1 318.427 4.232 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC001459981321 1062544777 /nfs/dbraw/zinc/54/47/77/1062544777.db2.gz YDVZEDKAMIIOQB-HBMCJLEFSA-N 2 1 314.517 4.377 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255725991 1062546485 /nfs/dbraw/zinc/54/64/85/1062546485.db2.gz ZRGYCVYSOODSNY-GDBMZVCRSA-N 2 1 320.443 4.304 20 0 DIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCC2CCCCCC2)[C@H](C)C1 ZINC001459989655 1062550844 /nfs/dbraw/zinc/55/08/44/1062550844.db2.gz WFINOYKCQPLSCH-UYAOXDASSA-N 2 1 324.553 4.074 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCC2CCCCCC2)[C@H](C)C1 ZINC001459989653 1062551401 /nfs/dbraw/zinc/55/14/01/1062551401.db2.gz WFINOYKCQPLSCH-QUCCMNQESA-N 2 1 324.553 4.074 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255756186 1062575535 /nfs/dbraw/zinc/57/55/35/1062575535.db2.gz DWOUTSLWRZHKJC-BZSNNMDCSA-N 2 1 320.546 4.456 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CCC(C)(C)C2CC2)CC1 ZINC001460026573 1062581339 /nfs/dbraw/zinc/58/13/39/1062581339.db2.gz ZQLGONNUVXWHCK-UHFFFAOYSA-N 2 1 302.462 4.060 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH+]2CCC([NH+]3CCCC3)CC2)cc1 ZINC001255759942 1062582396 /nfs/dbraw/zinc/58/23/96/1062582396.db2.gz FFMZRIUVNORNEM-KRWDZBQOSA-N 2 1 318.530 4.036 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@H](C)CSc2ccc(C)cc2)CC1 ZINC001255765576 1062585181 /nfs/dbraw/zinc/58/51/81/1062585181.db2.gz GAPJJBAGORKDLG-QGZVFWFLSA-N 2 1 320.546 4.282 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@H]2CC[N@H+](C(C)C)C[C@H]2C)cc1 ZINC001255762647 1062585807 /nfs/dbraw/zinc/58/58/07/1062585807.db2.gz VUOACGWRIRNWBE-AOIWGVFYSA-N 2 1 320.546 4.184 20 0 DIADMP Cc1ccc(C[C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001255773187 1062596053 /nfs/dbraw/zinc/59/60/53/1062596053.db2.gz UUSIKOJFFMWQBS-IBGZPJMESA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccc(C[C@H](C)[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255783997 1062606237 /nfs/dbraw/zinc/60/62/37/1062606237.db2.gz SALOENBIAZQJHI-CUWPLCDZSA-N 2 1 314.517 4.441 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)cc1 ZINC001255793136 1062609650 /nfs/dbraw/zinc/60/96/50/1062609650.db2.gz AYQVIEZCAPUZFC-GIVPXCGWSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001255793136 1062609662 /nfs/dbraw/zinc/60/96/62/1062609662.db2.gz AYQVIEZCAPUZFC-GIVPXCGWSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001255793136 1062609672 /nfs/dbraw/zinc/60/96/72/1062609672.db2.gz AYQVIEZCAPUZFC-GIVPXCGWSA-N 2 1 314.517 4.265 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255838196 1062624670 /nfs/dbraw/zinc/62/46/70/1062624670.db2.gz LSAZJICWPPMTDJ-SZVBFZGTSA-N 2 1 318.480 4.271 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001255855346 1062631109 /nfs/dbraw/zinc/63/11/09/1062631109.db2.gz WOHBLGUZWDRVAI-NZSAHSFTSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255855346 1062631128 /nfs/dbraw/zinc/63/11/28/1062631128.db2.gz WOHBLGUZWDRVAI-NZSAHSFTSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001255855346 1062631144 /nfs/dbraw/zinc/63/11/44/1062631144.db2.gz WOHBLGUZWDRVAI-NZSAHSFTSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001255855348 1062633033 /nfs/dbraw/zinc/63/30/33/1062633033.db2.gz WOHBLGUZWDRVAI-YTQUADARSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255855348 1062633039 /nfs/dbraw/zinc/63/30/39/1062633039.db2.gz WOHBLGUZWDRVAI-YTQUADARSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001255855348 1062633053 /nfs/dbraw/zinc/63/30/53/1062633053.db2.gz WOHBLGUZWDRVAI-YTQUADARSA-N 2 1 318.480 4.096 20 0 DIADMP C[N@H+]1CCC[C@@H]1CCN1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100886 1062636696 /nfs/dbraw/zinc/63/66/96/1062636696.db2.gz XTFCYUHENVAQAW-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100886 1062636705 /nfs/dbraw/zinc/63/67/05/1062636705.db2.gz XTFCYUHENVAQAW-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100886 1062636713 /nfs/dbraw/zinc/63/67/13/1062636713.db2.gz XTFCYUHENVAQAW-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100886 1062636715 /nfs/dbraw/zinc/63/67/15/1062636715.db2.gz XTFCYUHENVAQAW-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100886 1062636724 /nfs/dbraw/zinc/63/67/24/1062636724.db2.gz XTFCYUHENVAQAW-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001255878199 1062651158 /nfs/dbraw/zinc/65/11/58/1062651158.db2.gz MTAKZYMMEIQGEI-VDGAXYAQSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255878199 1062651185 /nfs/dbraw/zinc/65/11/85/1062651185.db2.gz MTAKZYMMEIQGEI-VDGAXYAQSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001255878199 1062651210 /nfs/dbraw/zinc/65/12/10/1062651210.db2.gz MTAKZYMMEIQGEI-VDGAXYAQSA-N 2 1 318.480 4.096 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001255944923 1062666878 /nfs/dbraw/zinc/66/68/78/1062666878.db2.gz IAMAHZYZEVXECI-GFCCVEGCSA-N 2 1 303.277 4.203 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH+]1CCC(c2ccccc2F)CC1 ZINC001255959795 1062669216 /nfs/dbraw/zinc/66/92/16/1062669216.db2.gz AHWDMAYFRMMZGM-MRXNPFEDSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CCCC[C@@H]1c1ccccc1F ZINC001255962221 1062673103 /nfs/dbraw/zinc/67/31/03/1062673103.db2.gz SCHHDCOHMBGMTB-QFBILLFUSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CCCC[C@@H]1c1ccccc1F ZINC001255962221 1062673118 /nfs/dbraw/zinc/67/31/18/1062673118.db2.gz SCHHDCOHMBGMTB-QFBILLFUSA-N 2 1 306.469 4.473 20 0 DIADMP c1cc2c(o1)CCC[N@H+](Cc1ccc(C[NH+]3CCCCC3)cc1)C2 ZINC001460191915 1062691021 /nfs/dbraw/zinc/69/10/21/1062691021.db2.gz HTDVIHBKUFZQFJ-UHFFFAOYSA-N 2 1 324.468 4.214 20 0 DIADMP CC(C)(Cc1ccc2ccccc2c1)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001256067501 1062692258 /nfs/dbraw/zinc/69/22/58/1062692258.db2.gz SMJYJOFYAHBXFG-UHFFFAOYSA-N 2 1 322.496 4.377 20 0 DIADMP c1ccc2c(c1)cccc2C1([NH2+]C2CC[NH+](C3CC3)CC2)CC1 ZINC001256070714 1062695674 /nfs/dbraw/zinc/69/56/74/1062695674.db2.gz CRJPPTYFZRFUER-UHFFFAOYSA-N 2 1 306.453 4.045 20 0 DIADMP CC(C)CC[C@H](C)[NH2+]C1(C)CC[NH+](Cc2ccccc2)CC1 ZINC001256360111 1062785002 /nfs/dbraw/zinc/78/50/02/1062785002.db2.gz CUPYUAPMDTZCSH-SFHVURJKSA-N 2 1 302.506 4.455 20 0 DIADMP CC(C)CC[C@H](C)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001256371586 1062794695 /nfs/dbraw/zinc/79/46/95/1062794695.db2.gz RCXIBOOPZITCBA-AZUAARDMSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@H](C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001256371586 1062794715 /nfs/dbraw/zinc/79/47/15/1062794715.db2.gz RCXIBOOPZITCBA-AZUAARDMSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@H](C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001256371586 1062794734 /nfs/dbraw/zinc/79/47/34/1062794734.db2.gz RCXIBOOPZITCBA-AZUAARDMSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@@H](C)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001256371589 1062795670 /nfs/dbraw/zinc/79/56/70/1062795670.db2.gz RCXIBOOPZITCBA-UYAOXDASSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@@H](C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001256371589 1062795692 /nfs/dbraw/zinc/79/56/92/1062795692.db2.gz RCXIBOOPZITCBA-UYAOXDASSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)CC[C@@H](C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001256371589 1062795713 /nfs/dbraw/zinc/79/57/13/1062795713.db2.gz RCXIBOOPZITCBA-UYAOXDASSA-N 2 1 302.506 4.265 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256519706 1062841754 /nfs/dbraw/zinc/84/17/54/1062841754.db2.gz CJONQGWOGAIFFP-MJGOQNOKSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256519706 1062841777 /nfs/dbraw/zinc/84/17/77/1062841777.db2.gz CJONQGWOGAIFFP-MJGOQNOKSA-N 2 1 300.490 4.352 20 0 DIADMP Cc1csc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256520481 1062843913 /nfs/dbraw/zinc/84/39/13/1062843913.db2.gz PPPWXBVOESDHQK-SJLPKXTDSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1csc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256520481 1062843937 /nfs/dbraw/zinc/84/39/37/1062843937.db2.gz PPPWXBVOESDHQK-SJLPKXTDSA-N 2 1 314.498 4.199 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(F)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256524400 1062847709 /nfs/dbraw/zinc/84/77/09/1062847709.db2.gz UILHUWPADYFNGI-HKUYNNGSSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(F)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256524400 1062847727 /nfs/dbraw/zinc/84/77/27/1062847727.db2.gz UILHUWPADYFNGI-HKUYNNGSSA-N 2 1 318.480 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256525366 1062848233 /nfs/dbraw/zinc/84/82/33/1062848233.db2.gz BZKCHQGGRLDMAV-MNAPGUCWSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256525366 1062848259 /nfs/dbraw/zinc/84/82/59/1062848259.db2.gz BZKCHQGGRLDMAV-MNAPGUCWSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528218 1062849442 /nfs/dbraw/zinc/84/94/42/1062849442.db2.gz CMHKPILGQYXBEX-RAUXBKROSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528218 1062849472 /nfs/dbraw/zinc/84/94/72/1062849472.db2.gz CMHKPILGQYXBEX-RAUXBKROSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256528410 1062851708 /nfs/dbraw/zinc/85/17/08/1062851708.db2.gz FBDVJWMAZBOWSF-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256528410 1062851721 /nfs/dbraw/zinc/85/17/21/1062851721.db2.gz FBDVJWMAZBOWSF-JYBIWHBTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCC[C@@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540454 1062859884 /nfs/dbraw/zinc/85/98/84/1062859884.db2.gz HVDHOEZXGDYQRL-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCC[C@@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256540454 1062859914 /nfs/dbraw/zinc/85/99/14/1062859914.db2.gz HVDHOEZXGDYQRL-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540454 1062859943 /nfs/dbraw/zinc/85/99/43/1062859943.db2.gz HVDHOEZXGDYQRL-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCCC[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256540454 1062859966 /nfs/dbraw/zinc/85/99/66/1062859966.db2.gz HVDHOEZXGDYQRL-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP CCC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256541493 1062864037 /nfs/dbraw/zinc/86/40/37/1062864037.db2.gz MBXOEXORHYDGEQ-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP CCC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256541493 1062864057 /nfs/dbraw/zinc/86/40/57/1062864057.db2.gz MBXOEXORHYDGEQ-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP CCC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256541496 1062865080 /nfs/dbraw/zinc/86/50/80/1062865080.db2.gz MBXOEXORHYDGEQ-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP CCC1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256541496 1062865107 /nfs/dbraw/zinc/86/51/07/1062865107.db2.gz MBXOEXORHYDGEQ-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256552582 1062873586 /nfs/dbraw/zinc/87/35/86/1062873586.db2.gz COVOKMUQVSQGFB-YJBOKZPZSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC(C(F)F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256552582 1062873611 /nfs/dbraw/zinc/87/36/11/1062873611.db2.gz COVOKMUQVSQGFB-YJBOKZPZSA-N 2 1 322.443 4.017 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552391 1062874365 /nfs/dbraw/zinc/87/43/65/1062874365.db2.gz BWRGMXXNPFBFTL-NLWGTHIKSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552391 1062874383 /nfs/dbraw/zinc/87/43/83/1062874383.db2.gz BWRGMXXNPFBFTL-NLWGTHIKSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552391 1062874395 /nfs/dbraw/zinc/87/43/95/1062874395.db2.gz BWRGMXXNPFBFTL-NLWGTHIKSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001256552391 1062874412 /nfs/dbraw/zinc/87/44/12/1062874412.db2.gz BWRGMXXNPFBFTL-NLWGTHIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256552862 1062874664 /nfs/dbraw/zinc/87/46/64/1062874664.db2.gz FEZMYFLRWWIKCE-KBAYOESNSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256552862 1062874686 /nfs/dbraw/zinc/87/46/86/1062874686.db2.gz FEZMYFLRWWIKCE-KBAYOESNSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552862 1062874699 /nfs/dbraw/zinc/87/46/99/1062874699.db2.gz FEZMYFLRWWIKCE-KBAYOESNSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552862 1062874718 /nfs/dbraw/zinc/87/47/18/1062874718.db2.gz FEZMYFLRWWIKCE-KBAYOESNSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC3CCC(CC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256560897 1062882823 /nfs/dbraw/zinc/88/28/23/1062882823.db2.gz UJVMXQPXZWZNHH-WYNBGMTASA-N 2 1 312.501 4.162 20 0 DIADMP CCCC[N@@H+](C[C@@H]1CCC(C)(C)O1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001460541106 1062904351 /nfs/dbraw/zinc/90/43/51/1062904351.db2.gz IGBNJHSPUQHJGS-KRWDZBQOSA-N 2 1 324.553 4.355 20 0 DIADMP Fc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001256599511 1062910446 /nfs/dbraw/zinc/91/04/46/1062910446.db2.gz VOOPTWPPJHEDDC-NRFANRHFSA-N 2 1 324.443 4.067 20 0 DIADMP C=Cc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001256599215 1062910716 /nfs/dbraw/zinc/91/07/16/1062910716.db2.gz MCTZLQGTFHGGDO-UHFFFAOYSA-N 2 1 306.453 4.084 20 0 DIADMP C[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC001256604824 1062914031 /nfs/dbraw/zinc/91/40/31/1062914031.db2.gz WZSCQUBPWSXCOD-MSOLQXFVSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC001256604824 1062914053 /nfs/dbraw/zinc/91/40/53/1062914053.db2.gz WZSCQUBPWSXCOD-MSOLQXFVSA-N 2 1 300.490 4.019 20 0 DIADMP CC1(C)CC[C@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001256601877 1062916455 /nfs/dbraw/zinc/91/64/55/1062916455.db2.gz ITUPGEPAIVNREB-SFHVURJKSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001256616929 1062918722 /nfs/dbraw/zinc/91/87/22/1062918722.db2.gz DNEIPIBBZSVGQS-IPQPSQTFSA-N 2 1 304.453 4.128 20 0 DIADMP Cc1cc(C)cc(C[N@@H+]2CCC[C@@H]2CC[NH+]2CCC(C)CC2)c1 ZINC001460624265 1062944610 /nfs/dbraw/zinc/94/46/10/1062944610.db2.gz AGLFHZWIPXHFSD-OAQYLSRUSA-N 2 1 314.517 4.390 20 0 DIADMP CCc1ccc(C[NH+]2CCC(CC)([NH+]3CCCCC3)CC2)cc1 ZINC001460712379 1063006684 /nfs/dbraw/zinc/00/66/84/1063006684.db2.gz WJZKPJIEBTUYAE-UHFFFAOYSA-N 2 1 314.517 4.480 20 0 DIADMP Cc1ccc([C@H]2CCC[N@H+]2C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC001256861266 1063021097 /nfs/dbraw/zinc/02/10/97/1063021097.db2.gz VAKIOBHBHNMHRD-OAQYLSRUSA-N 2 1 321.468 4.196 20 0 DIADMP CC1(C[NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904339 1063033621 /nfs/dbraw/zinc/03/36/21/1063033621.db2.gz HBUAPIHOLUHQMI-OAHLLOKOSA-N 2 1 314.464 4.199 20 0 DIADMP CC1(C[NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904339 1063033643 /nfs/dbraw/zinc/03/36/43/1063033643.db2.gz HBUAPIHOLUHQMI-OAHLLOKOSA-N 2 1 314.464 4.199 20 0 DIADMP CC(C)(Cc1cccc(F)c1)[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256904838 1063038636 /nfs/dbraw/zinc/03/86/36/1063038636.db2.gz KWSRIYPUUQVSBP-GOSISDBHSA-N 2 1 318.480 4.143 20 0 DIADMP CC(C)(Cc1cccc(F)c1)[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256904838 1063038651 /nfs/dbraw/zinc/03/86/51/1063038651.db2.gz KWSRIYPUUQVSBP-GOSISDBHSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256905838 1063038920 /nfs/dbraw/zinc/03/89/20/1063038920.db2.gz UQASDKSLZPDIKX-QAPCUYQASA-N 2 1 320.908 4.268 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256905838 1063038946 /nfs/dbraw/zinc/03/89/46/1063038946.db2.gz UQASDKSLZPDIKX-QAPCUYQASA-N 2 1 320.908 4.268 20 0 DIADMP Fc1ccc(CC[NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)c(Cl)c1 ZINC001256906520 1063043602 /nfs/dbraw/zinc/04/36/02/1063043602.db2.gz BXGZWJVEISBSSQ-INIZCTEOSA-N 2 1 324.871 4.018 20 0 DIADMP Fc1ccc(CC[NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)c(Cl)c1 ZINC001256906520 1063043627 /nfs/dbraw/zinc/04/36/27/1063043627.db2.gz BXGZWJVEISBSSQ-INIZCTEOSA-N 2 1 324.871 4.018 20 0 DIADMP CCCCc1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)s1 ZINC001278988874 1063097812 /nfs/dbraw/zinc/09/78/12/1063097812.db2.gz ICCBDORTGGLKRK-GOSISDBHSA-N 2 1 306.519 4.008 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)s1 ZINC001278988874 1063097835 /nfs/dbraw/zinc/09/78/35/1063097835.db2.gz ICCBDORTGGLKRK-GOSISDBHSA-N 2 1 306.519 4.008 20 0 DIADMP CCCCc1ccc(C[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)s1 ZINC001278988874 1063097858 /nfs/dbraw/zinc/09/78/58/1063097858.db2.gz ICCBDORTGGLKRK-GOSISDBHSA-N 2 1 306.519 4.008 20 0 DIADMP CCCCc1ccc(C[NH+]2CCC[C@]3(CC[N@@H+](C)C3)C2)s1 ZINC001278988874 1063097879 /nfs/dbraw/zinc/09/78/79/1063097879.db2.gz ICCBDORTGGLKRK-GOSISDBHSA-N 2 1 306.519 4.008 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@@H+]1C1CC[NH+](C(C)C)CC1 ZINC001257223741 1063146427 /nfs/dbraw/zinc/14/64/27/1063146427.db2.gz AIIONHNYKVBWLD-SFHVURJKSA-N 2 1 318.530 4.418 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1C1CC[NH+](C(C)C)CC1 ZINC001257223741 1063146437 /nfs/dbraw/zinc/14/64/37/1063146437.db2.gz AIIONHNYKVBWLD-SFHVURJKSA-N 2 1 318.530 4.418 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001257221668 1063147974 /nfs/dbraw/zinc/14/79/74/1063147974.db2.gz BWHRVPNVPGTWBO-MRXNPFEDSA-N 2 1 306.881 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001257221668 1063147983 /nfs/dbraw/zinc/14/79/83/1063147983.db2.gz BWHRVPNVPGTWBO-MRXNPFEDSA-N 2 1 306.881 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC001257221649 1063149002 /nfs/dbraw/zinc/14/90/02/1063149002.db2.gz BJTAIHUDPDRCLU-MRXNPFEDSA-N 2 1 306.881 4.002 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257253884 1063158690 /nfs/dbraw/zinc/15/86/90/1063158690.db2.gz XNXCBTOIFJIVBK-FHWLQOOXSA-N 2 1 318.505 4.346 20 0 DIADMP CCC[C@H](CC)[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001257267987 1063169144 /nfs/dbraw/zinc/16/91/44/1063169144.db2.gz CPRXCBPXWNUWOB-SFHVURJKSA-N 2 1 306.469 4.301 20 0 DIADMP CCC[C@H](CC)[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001257267987 1063169165 /nfs/dbraw/zinc/16/91/65/1063169165.db2.gz CPRXCBPXWNUWOB-SFHVURJKSA-N 2 1 306.469 4.301 20 0 DIADMP CCC(CC)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001257300214 1063191092 /nfs/dbraw/zinc/19/10/92/1063191092.db2.gz SYASJXQIPFSRCI-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001257321901 1063204403 /nfs/dbraw/zinc/20/44/03/1063204403.db2.gz ZCGIJOLDKJVFLD-GOSISDBHSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035746 1063205071 /nfs/dbraw/zinc/20/50/71/1063205071.db2.gz CVLPZEFKQSSLSP-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035746 1063205092 /nfs/dbraw/zinc/20/50/92/1063205092.db2.gz CVLPZEFKQSSLSP-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)[C@@H](C[NH2+]C1CCC2(CCC2)CC1)[NH+]1CCC(C)CC1 ZINC001461042852 1063209672 /nfs/dbraw/zinc/20/96/72/1063209672.db2.gz GSKIZIRURHRRPZ-LJQANCHMSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001461045190 1063210346 /nfs/dbraw/zinc/21/03/46/1063210346.db2.gz QJCZIUYFGMPXRZ-UWVAXJGDSA-N 2 1 300.490 4.197 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001461045185 1063210844 /nfs/dbraw/zinc/21/08/44/1063210844.db2.gz QJCZIUYFGMPXRZ-FUHIMQAGSA-N 2 1 300.490 4.197 20 0 DIADMP Cc1cccc(C)c1C[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001461046657 1063211157 /nfs/dbraw/zinc/21/11/57/1063211157.db2.gz GJBOPUGORZBQHV-CALCHBBNSA-N 2 1 302.506 4.151 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](C3CCCC3)C[C@H]21 ZINC001257350534 1063225102 /nfs/dbraw/zinc/22/51/02/1063225102.db2.gz FBKGHWBSWLLGGT-ATZDWAIDSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](C3CCCC3)C[C@H]21 ZINC001257350534 1063225124 /nfs/dbraw/zinc/22/51/24/1063225124.db2.gz FBKGHWBSWLLGGT-ATZDWAIDSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](C3CCCC3)C[C@H]21 ZINC001257350534 1063225144 /nfs/dbraw/zinc/22/51/44/1063225144.db2.gz FBKGHWBSWLLGGT-ATZDWAIDSA-N 2 1 318.530 4.223 20 0 DIADMP CCCCCC[C@H](C)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001257365341 1063233882 /nfs/dbraw/zinc/23/38/82/1063233882.db2.gz KSXXOGSXCLVZIU-ZWKOTPCHSA-N 2 1 324.553 4.357 20 0 DIADMP CCC(C)(C)C1CCC([NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)CC1 ZINC001257407335 1063256130 /nfs/dbraw/zinc/25/61/30/1063256130.db2.gz GMVUMTFZCOBJMR-UHFFFAOYSA-N 2 1 318.549 4.399 20 0 DIADMP CCC(C)(C)C1CCC([NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)CC1 ZINC001257407335 1063256144 /nfs/dbraw/zinc/25/61/44/1063256144.db2.gz GMVUMTFZCOBJMR-UHFFFAOYSA-N 2 1 318.549 4.399 20 0 DIADMP CCCC[C@H](CC)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001257415996 1063264094 /nfs/dbraw/zinc/26/40/94/1063264094.db2.gz ZYVJHXNXIUJZSB-IBGZPJMESA-N 2 1 302.506 4.252 20 0 DIADMP CC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC001257433748 1063276734 /nfs/dbraw/zinc/27/67/34/1063276734.db2.gz KFAZVHUOZRQHAV-BWAGFHJFSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](C)[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001257438686 1063277556 /nfs/dbraw/zinc/27/75/56/1063277556.db2.gz BDMKTFWMCPBZQY-ONIAQPFYSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001257438686 1063277569 /nfs/dbraw/zinc/27/75/69/1063277569.db2.gz BDMKTFWMCPBZQY-ONIAQPFYSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001257438686 1063277589 /nfs/dbraw/zinc/27/75/89/1063277589.db2.gz BDMKTFWMCPBZQY-ONIAQPFYSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001257447171 1063281890 /nfs/dbraw/zinc/28/18/90/1063281890.db2.gz ALBQKMQTQZAQJS-ZDUSSCGKSA-N 2 1 314.395 4.058 20 0 DIADMP CCC[C@@H](C)CC[C@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257476160 1063295929 /nfs/dbraw/zinc/29/59/29/1063295929.db2.gz OFYROPWURCUNOP-FCGDIQPGSA-N 2 1 324.553 4.342 20 0 DIADMP CCCCCC(CCCCC)[NH2+]C1CC[NH+](CCOC)CC1 ZINC001257550464 1063333840 /nfs/dbraw/zinc/33/38/40/1063333840.db2.gz SLLVMLOBWZNUHL-UHFFFAOYSA-N 2 1 312.542 4.216 20 0 DIADMP FCc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001473148134 1063453373 /nfs/dbraw/zinc/45/33/73/1063453373.db2.gz NYBPWBIFLHDGAL-HXUWFJFHSA-N 2 1 318.480 4.244 20 0 DIADMP FCc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001473148134 1063453378 /nfs/dbraw/zinc/45/33/78/1063453378.db2.gz NYBPWBIFLHDGAL-HXUWFJFHSA-N 2 1 318.480 4.244 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+]C2(c3cccc(Cl)c3)CC2)CC1 ZINC001258003364 1063457450 /nfs/dbraw/zinc/45/74/50/1063457450.db2.gz HMICONDFYXMTKC-UHFFFAOYSA-N 2 1 306.881 4.039 20 0 DIADMP CC[NH+]1CCC([N@H+](C)C2CCC(c3ccccc3)CC2)CC1 ZINC001257999902 1063458941 /nfs/dbraw/zinc/45/89/41/1063458941.db2.gz QWGUCLYCBMWVCL-UHFFFAOYSA-N 2 1 300.490 4.129 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)C2CCC(c3ccccc3)CC2)CC1 ZINC001257999902 1063458949 /nfs/dbraw/zinc/45/89/49/1063458949.db2.gz QWGUCLYCBMWVCL-UHFFFAOYSA-N 2 1 300.490 4.129 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](c2ccccc2F)C2CCC2)CC1 ZINC001258007215 1063461807 /nfs/dbraw/zinc/46/18/07/1063461807.db2.gz RIHDPANKISAGGQ-FQEVSTJZSA-N 2 1 318.480 4.377 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+]Cc2ccc(OC(C)(C)C)cc2)CC1 ZINC001258005920 1063461898 /nfs/dbraw/zinc/46/18/98/1063461898.db2.gz XVMPBNKGOJELJY-UHFFFAOYSA-N 2 1 318.505 4.074 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001258017275 1063467300 /nfs/dbraw/zinc/46/73/00/1063467300.db2.gz YUBIHDWIJFGXHU-KRWDZBQOSA-N 2 1 320.908 4.250 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001258017275 1063467313 /nfs/dbraw/zinc/46/73/13/1063467313.db2.gz YUBIHDWIJFGXHU-KRWDZBQOSA-N 2 1 320.908 4.250 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](C)Cc2cccc3ccccc32)CC1 ZINC001258014486 1063468259 /nfs/dbraw/zinc/46/82/59/1063468259.db2.gz LWJQULVHZNCJIA-UHFFFAOYSA-N 2 1 310.485 4.392 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)c1 ZINC001473182421 1063490580 /nfs/dbraw/zinc/49/05/80/1063490580.db2.gz DAGNJSWENXFCEV-SFHVURJKSA-N 2 1 310.485 4.230 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)C[C@H]2CCC[N@H+](C)C2)c1 ZINC001473182421 1063490599 /nfs/dbraw/zinc/49/05/99/1063490599.db2.gz DAGNJSWENXFCEV-SFHVURJKSA-N 2 1 310.485 4.230 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)c1 ZINC001473182421 1063490606 /nfs/dbraw/zinc/49/06/06/1063490606.db2.gz DAGNJSWENXFCEV-SFHVURJKSA-N 2 1 310.485 4.230 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 ZINC001473184176 1063493474 /nfs/dbraw/zinc/49/34/74/1063493474.db2.gz CMTYFINQFGJTBC-UYAOXDASSA-N 2 1 302.506 4.500 20 0 DIADMP C[C@H]([NH2+]C/C=C/c1cccc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001461426269 1063494334 /nfs/dbraw/zinc/49/43/34/1063494334.db2.gz NKEBIPHZMNPXKQ-NQMAARMTSA-N 2 1 316.464 4.082 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC001461425898 1063494473 /nfs/dbraw/zinc/49/44/73/1063494473.db2.gz KTVUGFWYHIBWKT-LSDHHAIUSA-N 2 1 321.534 4.009 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC001461425898 1063494485 /nfs/dbraw/zinc/49/44/85/1063494485.db2.gz KTVUGFWYHIBWKT-LSDHHAIUSA-N 2 1 321.534 4.009 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258081175 1063506388 /nfs/dbraw/zinc/50/63/88/1063506388.db2.gz PDMIOXVGALMUMO-KRWDZBQOSA-N 2 1 301.478 4.083 20 0 DIADMP CC(C)=CCC[C@H](C)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258088197 1063510788 /nfs/dbraw/zinc/51/07/88/1063510788.db2.gz QUXUZULGULMMSO-IHPCNDPISA-N 2 1 315.505 4.288 20 0 DIADMP CC(C)=CCC[C@H](C)[N@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001258089298 1063512765 /nfs/dbraw/zinc/51/27/65/1063512765.db2.gz SQONFWYXQNCCIM-OKZBNKHCSA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)=CCC[C@H](C)[N@@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001258089298 1063512788 /nfs/dbraw/zinc/51/27/88/1063512788.db2.gz SQONFWYXQNCCIM-OKZBNKHCSA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)=CCC[C@H](C)[NH+]1C[C@H]2C[N@@H+](Cc3cccs3)C[C@H]2C1 ZINC001258089298 1063512807 /nfs/dbraw/zinc/51/28/07/1063512807.db2.gz SQONFWYXQNCCIM-OKZBNKHCSA-N 2 1 318.530 4.247 20 0 DIADMP CC(C)=CCC[C@H](C)[NH+]1C[C@H]2C[N@H+](Cc3cccs3)C[C@H]2C1 ZINC001258089298 1063512828 /nfs/dbraw/zinc/51/28/28/1063512828.db2.gz SQONFWYXQNCCIM-OKZBNKHCSA-N 2 1 318.530 4.247 20 0 DIADMP C[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1C ZINC001258141260 1063531504 /nfs/dbraw/zinc/53/15/04/1063531504.db2.gz WZZJFEBGICQYOO-RTBURBONSA-N 2 1 314.517 4.062 20 0 DIADMP C[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1C ZINC001258141260 1063531524 /nfs/dbraw/zinc/53/15/24/1063531524.db2.gz WZZJFEBGICQYOO-RTBURBONSA-N 2 1 314.517 4.062 20 0 DIADMP CCCC1([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CCC1 ZINC001258138071 1063533307 /nfs/dbraw/zinc/53/33/07/1063533307.db2.gz SDNCSICYARAWGX-UHFFFAOYSA-N 2 1 300.490 4.006 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@H](C)CCSC)CC1 ZINC001258219158 1063566829 /nfs/dbraw/zinc/56/68/29/1063566829.db2.gz DATBITIMFGVORE-QGZVFWFLSA-N 2 1 320.546 4.115 20 0 DIADMP [NH3+]C1(c2cccc(F)c2)CC[NH+](C2CCCCCCC2)CC1 ZINC001258237311 1063574897 /nfs/dbraw/zinc/57/48/97/1063574897.db2.gz HPQJHCBMSJEXRI-UHFFFAOYSA-N 2 1 304.453 4.188 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001461554252 1063578868 /nfs/dbraw/zinc/57/88/68/1063578868.db2.gz TXUFDXXCBIISTD-MRXNPFEDSA-N 2 1 320.496 4.247 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C1CCCC1 ZINC001461567472 1063585182 /nfs/dbraw/zinc/58/51/82/1063585182.db2.gz FVXARTOHKMAMJC-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C1CCCC1 ZINC001461567472 1063585193 /nfs/dbraw/zinc/58/51/93/1063585193.db2.gz FVXARTOHKMAMJC-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCCC(C)(C)C1 ZINC001258288596 1063587665 /nfs/dbraw/zinc/58/76/65/1063587665.db2.gz HGRWOUIRXNYXDZ-PMACEKPBSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCCC(C)(C)C1 ZINC001258288596 1063587673 /nfs/dbraw/zinc/58/76/73/1063587673.db2.gz HGRWOUIRXNYXDZ-PMACEKPBSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCC(C)(C)C1 ZINC001258288596 1063587684 /nfs/dbraw/zinc/58/76/84/1063587684.db2.gz HGRWOUIRXNYXDZ-PMACEKPBSA-N 2 1 314.517 4.409 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCCC(C)(C)C1 ZINC001258288597 1063590577 /nfs/dbraw/zinc/59/05/77/1063590577.db2.gz HGRWOUIRXNYXDZ-UXHICEINSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CCCC(C)(C)C1 ZINC001258288597 1063590579 /nfs/dbraw/zinc/59/05/79/1063590579.db2.gz HGRWOUIRXNYXDZ-UXHICEINSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCC(C)(C)C1 ZINC001258288597 1063590580 /nfs/dbraw/zinc/59/05/80/1063590580.db2.gz HGRWOUIRXNYXDZ-UXHICEINSA-N 2 1 314.517 4.409 20 0 DIADMP CCC[N@@H+](CCC[NH3+])[C@H](C)CC(C)(C)SCc1ccco1 ZINC001258293972 1063593527 /nfs/dbraw/zinc/59/35/27/1063593527.db2.gz FBULJRVNCNPDRD-OAHLLOKOSA-N 2 1 312.523 4.131 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001258303696 1063601244 /nfs/dbraw/zinc/60/12/44/1063601244.db2.gz WKABKDHSMNCXQO-JKSUJKDBSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)n1cc[nH+]c1CCC[NH3+] ZINC001258307624 1063602919 /nfs/dbraw/zinc/60/29/19/1063602919.db2.gz ZEYCTDBMUNCNNQ-AWEZNQCLSA-N 2 1 321.490 4.031 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258330162 1063612260 /nfs/dbraw/zinc/61/22/60/1063612260.db2.gz QRZXJIAIBUSQJH-ZOBUZTSGSA-N 2 1 312.567 4.421 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001258346561 1063620710 /nfs/dbraw/zinc/62/07/10/1063620710.db2.gz SZEWOGHJGCJKHU-YESZJQIVSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258346561 1063620717 /nfs/dbraw/zinc/62/07/17/1063620717.db2.gz SZEWOGHJGCJKHU-YESZJQIVSA-N 2 1 312.567 4.245 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001258346561 1063620730 /nfs/dbraw/zinc/62/07/30/1063620730.db2.gz SZEWOGHJGCJKHU-YESZJQIVSA-N 2 1 312.567 4.245 20 0 DIADMP CC(C)c1ccccc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461664433 1063644470 /nfs/dbraw/zinc/64/44/70/1063644470.db2.gz RACPGZZDJVNPBY-GOSISDBHSA-N 2 1 300.490 4.022 20 0 DIADMP CCCCC[C@H](CC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258433504 1063650770 /nfs/dbraw/zinc/65/07/70/1063650770.db2.gz GJFUMEYBFVMAHR-SFHVURJKSA-N 2 1 306.469 4.434 20 0 DIADMP CCCCC[C@@H](CC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258441055 1063654331 /nfs/dbraw/zinc/65/43/31/1063654331.db2.gz CMXPOAIOXXIZDE-QGZVFWFLSA-N 2 1 303.494 4.288 20 0 DIADMP c1ccc(C[C@@]2(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)C=CCCC2)cc1 ZINC001461688085 1063658109 /nfs/dbraw/zinc/65/81/09/1063658109.db2.gz VKCCGNVGYMEWIA-BHDDXSALSA-N 2 1 324.512 4.172 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001258471094 1063668780 /nfs/dbraw/zinc/66/87/80/1063668780.db2.gz WGSNSFFNHWUSSJ-OAHLLOKOSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001258471094 1063668784 /nfs/dbraw/zinc/66/87/84/1063668784.db2.gz WGSNSFFNHWUSSJ-OAHLLOKOSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H](CC1CC1)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001258471269 1063669963 /nfs/dbraw/zinc/66/99/63/1063669963.db2.gz XNZRTBTUFYXCAX-RXVVDRJESA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258471269 1063669969 /nfs/dbraw/zinc/66/99/69/1063669969.db2.gz XNZRTBTUFYXCAX-RXVVDRJESA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258471269 1063669974 /nfs/dbraw/zinc/66/99/74/1063669974.db2.gz XNZRTBTUFYXCAX-RXVVDRJESA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258598459 1063701339 /nfs/dbraw/zinc/70/13/39/1063701339.db2.gz SUFAMWNCALHYGD-FHWLQOOXSA-N 2 1 318.480 4.476 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001258600192 1063703121 /nfs/dbraw/zinc/70/31/21/1063703121.db2.gz NURRJZKSXVNWMM-GOSISDBHSA-N 2 1 300.490 4.209 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2CCC(C)(C)C2)CC1 ZINC001258609554 1063707956 /nfs/dbraw/zinc/70/79/56/1063707956.db2.gz WMBGCQCONUZGER-IBGZPJMESA-N 2 1 318.480 4.301 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+]([C@H]2CCC(C)(C)C2)CC1 ZINC001258609554 1063707969 /nfs/dbraw/zinc/70/79/69/1063707969.db2.gz WMBGCQCONUZGER-IBGZPJMESA-N 2 1 318.480 4.301 20 0 DIADMP CC1(C)CC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258608664 1063709421 /nfs/dbraw/zinc/70/94/21/1063709421.db2.gz MUJXHBZHMKWBNH-UFYCRDLUSA-N 2 1 312.501 4.019 20 0 DIADMP CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001258654172 1063727452 /nfs/dbraw/zinc/72/74/52/1063727452.db2.gz ITKVCOSILDJXRF-DFQSSKMNSA-N 2 1 302.506 4.106 20 0 DIADMP CCCCC[C@H](CCC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258668460 1063735378 /nfs/dbraw/zinc/73/53/78/1063735378.db2.gz VTYGUYBQLGSQBE-FHWLQOOXSA-N 2 1 324.553 4.486 20 0 DIADMP CCCCC[C@H](CCC)[NH+]1CCC([NH3+])(c2cccnc2)CC1 ZINC001258667724 1063735625 /nfs/dbraw/zinc/73/56/25/1063735625.db2.gz SFOWCTHQNSKRAK-SFHVURJKSA-N 2 1 303.494 4.080 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001258702104 1063760160 /nfs/dbraw/zinc/76/01/60/1063760160.db2.gz QLMIEXDHKJPJGJ-HAGHYFMRSA-N 2 1 300.490 4.003 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001258745023 1063794566 /nfs/dbraw/zinc/79/45/66/1063794566.db2.gz XJAUCHXRZWFRQS-HZPDHXFCSA-N 2 1 308.897 4.112 20 0 DIADMP CCCC[C@@H](CCC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258755848 1063801226 /nfs/dbraw/zinc/80/12/26/1063801226.db2.gz BCERTSLNDFEJOA-GOSISDBHSA-N 2 1 306.469 4.434 20 0 DIADMP CCCC[C@H](CCC)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258753026 1063801299 /nfs/dbraw/zinc/80/12/99/1063801299.db2.gz PKXIFCGZGLQNBG-PMACEKPBSA-N 2 1 302.506 4.457 20 0 DIADMP CCCC[C@@H](CCC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258763793 1063809231 /nfs/dbraw/zinc/80/92/31/1063809231.db2.gz CRUWACQMHMMMFU-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccc(OCC)cc2)CC1 ZINC001258775442 1063817332 /nfs/dbraw/zinc/81/73/32/1063817332.db2.gz PFJVPVNAEASHQZ-FQEVSTJZSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccc(OCC)cc2)CC1 ZINC001258775442 1063817346 /nfs/dbraw/zinc/81/73/46/1063817346.db2.gz PFJVPVNAEASHQZ-FQEVSTJZSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC001258778195 1063818290 /nfs/dbraw/zinc/81/82/90/1063818290.db2.gz ZFZTUJKNXNARBS-UHFFFAOYSA-N 2 1 315.288 4.300 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC001258778195 1063818302 /nfs/dbraw/zinc/81/83/02/1063818302.db2.gz ZFZTUJKNXNARBS-UHFFFAOYSA-N 2 1 315.288 4.300 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258782280 1063818876 /nfs/dbraw/zinc/81/88/76/1063818876.db2.gz NRYPCOKCEWFCST-RDJZCZTQSA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258784704 1063821129 /nfs/dbraw/zinc/82/11/29/1063821129.db2.gz BIVLKXKLZLCOCM-MAUKXSAKSA-N 2 1 306.469 4.290 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786143 1063824307 /nfs/dbraw/zinc/82/43/07/1063824307.db2.gz KPYAZFUIQRELCU-XEYPJELSSA-N 2 1 317.521 4.368 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813279 1063842567 /nfs/dbraw/zinc/84/25/67/1063842567.db2.gz JRENUTPMHGXWRW-NXWXRZEISA-N 2 1 318.480 4.476 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814400 1063844588 /nfs/dbraw/zinc/84/45/88/1063844588.db2.gz OSDDWADHKFHWSY-VBSBHUPXSA-N 2 1 300.490 4.337 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)CC1CC[NH+](C)CC1 ZINC001461969359 1063849064 /nfs/dbraw/zinc/84/90/64/1063849064.db2.gz QAKJKLJSSZLTPX-NRFANRHFSA-N 2 1 316.533 4.452 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828601 1063852321 /nfs/dbraw/zinc/85/23/21/1063852321.db2.gz OJGHNYHYQMYZJR-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828601 1063852328 /nfs/dbraw/zinc/85/23/28/1063852328.db2.gz OJGHNYHYQMYZJR-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828599 1063854542 /nfs/dbraw/zinc/85/45/42/1063854542.db2.gz OJGHNYHYQMYZJR-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828599 1063854555 /nfs/dbraw/zinc/85/45/55/1063854555.db2.gz OJGHNYHYQMYZJR-OXJNMPFZSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001258848495 1063864199 /nfs/dbraw/zinc/86/41/99/1063864199.db2.gz GDKRWNFRFGUKSE-LEWJYISDSA-N 2 1 314.517 4.348 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258904928 1063878640 /nfs/dbraw/zinc/87/86/40/1063878640.db2.gz NFMXXTBHMDCLOM-QWFCFKBJSA-N 3 1 323.569 4.011 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258904925 1063879079 /nfs/dbraw/zinc/87/90/79/1063879079.db2.gz NFMXXTBHMDCLOM-BJLQDIEVSA-N 3 1 323.569 4.011 20 0 DIADMP c1ccc([C@H]2c3ccccc3CC[N@@H+]2CCC2CC[NH2+]CC2)cc1 ZINC000479686023 1063881146 /nfs/dbraw/zinc/88/11/46/1063881146.db2.gz JINNOGPRDLKDBX-QFIPXVFZSA-N 2 1 320.480 4.024 20 0 DIADMP CCCCCC[C@@H]1CCC[C@@H]1[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC001462099565 1063929660 /nfs/dbraw/zinc/92/96/60/1063929660.db2.gz QAOLNSMOCNXWTM-ZCNNSNEGSA-N 2 1 324.553 4.216 20 0 DIADMP CCCCCC[C@@H]1CCC[C@@H]1[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC001462099565 1063929667 /nfs/dbraw/zinc/92/96/67/1063929667.db2.gz QAOLNSMOCNXWTM-ZCNNSNEGSA-N 2 1 324.553 4.216 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CC3CCC(F)(F)CC3)CC2)[nH+]c1C ZINC001262077995 1063954523 /nfs/dbraw/zinc/95/45/23/1063954523.db2.gz VXCJEXBHMXCOGG-UHFFFAOYSA-N 2 1 311.420 4.031 20 0 DIADMP C[C@@H](CC[NH2+][C@H]1C[C@H](C)C[C@H](C)C1)[N@@H+](C)Cc1ccccc1 ZINC000379641167 1063984659 /nfs/dbraw/zinc/98/46/59/1063984659.db2.gz CUILQDOWKUXLHS-HLNWXESRSA-N 2 1 302.506 4.311 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379632653 1063985013 /nfs/dbraw/zinc/98/50/13/1063985013.db2.gz NUODOBAHRSWFBC-SIKLNZKXSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379632653 1063985022 /nfs/dbraw/zinc/98/50/22/1063985022.db2.gz NUODOBAHRSWFBC-SIKLNZKXSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC000379654963 1063987864 /nfs/dbraw/zinc/98/78/64/1063987864.db2.gz KKZFJMZLDJOABJ-DENIHFKCSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC000379654963 1063987872 /nfs/dbraw/zinc/98/78/72/1063987872.db2.gz KKZFJMZLDJOABJ-DENIHFKCSA-N 2 1 322.496 4.446 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381819083 1063994323 /nfs/dbraw/zinc/99/43/23/1063994323.db2.gz DZVZOVGHGGCQJG-CMKODMSKSA-N 2 1 302.506 4.455 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CCCC1 ZINC000382773149 1063999615 /nfs/dbraw/zinc/99/96/15/1063999615.db2.gz ALCKZGRNXNQINP-OAQYLSRUSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@]1(C[NH2+]C/C=C\c2ccccc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000383360914 1064002273 /nfs/dbraw/zinc/00/22/73/1064002273.db2.gz SRQZMWMUIOLKCD-NSDWXSQCSA-N 2 1 320.480 4.202 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000390587240 1064164442 /nfs/dbraw/zinc/16/44/42/1064164442.db2.gz RHTAEVBOGDIJKD-UUKMXZOPSA-N 2 1 314.517 4.455 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CC1 ZINC000390587240 1064164444 /nfs/dbraw/zinc/16/44/44/1064164444.db2.gz RHTAEVBOGDIJKD-UUKMXZOPSA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612886 1064165121 /nfs/dbraw/zinc/16/51/21/1064165121.db2.gz XHXBBPNNGUUHLY-OALUTQOASA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612886 1064165128 /nfs/dbraw/zinc/16/51/28/1064165128.db2.gz XHXBBPNNGUUHLY-OALUTQOASA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612885 1064165267 /nfs/dbraw/zinc/16/52/67/1064165267.db2.gz XHXBBPNNGUUHLY-MOPGFXCFSA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612885 1064165271 /nfs/dbraw/zinc/16/52/71/1064165271.db2.gz XHXBBPNNGUUHLY-MOPGFXCFSA-N 2 1 314.517 4.455 20 0 DIADMP CCCCCC[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390773879 1064169197 /nfs/dbraw/zinc/16/91/97/1064169197.db2.gz LOZJVFABEGQPSE-AZUAARDMSA-N 2 1 302.506 4.457 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)C1 ZINC000390811815 1064170293 /nfs/dbraw/zinc/17/02/93/1064170293.db2.gz WHNMPOJXTWOHBH-BVJIBDCISA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000390800139 1064170605 /nfs/dbraw/zinc/17/06/05/1064170605.db2.gz XOEBGYKCLAEXKQ-HKUYNNGSSA-N 2 1 302.506 4.455 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390876397 1064173877 /nfs/dbraw/zinc/17/38/77/1064173877.db2.gz RESZAZQMLSQUOL-NRFANRHFSA-N 2 1 322.496 4.385 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390876397 1064173882 /nfs/dbraw/zinc/17/38/82/1064173882.db2.gz RESZAZQMLSQUOL-NRFANRHFSA-N 2 1 322.496 4.385 20 0 DIADMP Cc1ccc(Cl)c(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)c1F ZINC001279448024 1064351458 /nfs/dbraw/zinc/35/14/58/1064351458.db2.gz YKVLWPKHZVZPTM-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP Cc1ccc(Cl)c(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)c1F ZINC001279448024 1064351475 /nfs/dbraw/zinc/35/14/75/1064351475.db2.gz YKVLWPKHZVZPTM-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC2(CC[N@@H+](C)C2)CC1 ZINC001279494113 1064352545 /nfs/dbraw/zinc/35/25/45/1064352545.db2.gz FDNNWQJDAKIHQL-GOSISDBHSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001279496033 1064353397 /nfs/dbraw/zinc/35/33/97/1064353397.db2.gz ZJLGFRQPIAHELM-QUCCMNQESA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001279496033 1064353409 /nfs/dbraw/zinc/35/34/09/1064353409.db2.gz ZJLGFRQPIAHELM-QUCCMNQESA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001279496033 1064353419 /nfs/dbraw/zinc/35/34/19/1064353419.db2.gz ZJLGFRQPIAHELM-QUCCMNQESA-N 2 1 324.553 4.026 20 0 DIADMP CC/C=C\CC[NH+]1CCC2(CCC[N@@H+](Cc3ccc[nH]3)C2)CC1 ZINC001279520959 1064353957 /nfs/dbraw/zinc/35/39/57/1064353957.db2.gz JCPLIWCPKODRNR-ARJAWSKDSA-N 2 1 315.505 4.049 20 0 DIADMP CC/C=C\CCC[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccc[nH]3)C2)C1 ZINC001279485307 1064354009 /nfs/dbraw/zinc/35/40/09/1064354009.db2.gz AEBUIKKYAVXFBF-XQQSMPNESA-N 2 1 315.505 4.049 20 0 DIADMP CC/C=C\CCC[N@H+]1CCC[C@]2(CC[NH+](Cc3ccc[nH]3)C2)C1 ZINC001279485307 1064354024 /nfs/dbraw/zinc/35/40/24/1064354024.db2.gz AEBUIKKYAVXFBF-XQQSMPNESA-N 2 1 315.505 4.049 20 0 DIADMP CC/C=C\CCC[NH+]1CCC[C@]2(CC[N@H+](Cc3ccc[nH]3)C2)C1 ZINC001279485307 1064354034 /nfs/dbraw/zinc/35/40/34/1064354034.db2.gz AEBUIKKYAVXFBF-XQQSMPNESA-N 2 1 315.505 4.049 20 0 DIADMP CC/C=C\CCC[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccc[nH]3)C2)C1 ZINC001279485307 1064354046 /nfs/dbraw/zinc/35/40/46/1064354046.db2.gz AEBUIKKYAVXFBF-XQQSMPNESA-N 2 1 315.505 4.049 20 0 DIADMP C[NH+]1CCC2(CC1)C[N@@H+](CCC1CCCC1)Cc1ccccc12 ZINC001279511307 1064354712 /nfs/dbraw/zinc/35/47/12/1064354712.db2.gz SUHZPXLPZCIXQJ-UHFFFAOYSA-N 2 1 312.501 4.046 20 0 DIADMP CCCc1ccc(C[N@H+]2CCC[C@]3(CCC[NH+](C)C3)C2)s1 ZINC001279583285 1064360046 /nfs/dbraw/zinc/36/00/46/1064360046.db2.gz UXVMHSPIEGKDAN-SFHVURJKSA-N 2 1 306.519 4.008 20 0 DIADMP CCCc1ccc(C[NH+]2CCC[C@]3(CCC[N@H+](C)C3)C2)s1 ZINC001279583285 1064360053 /nfs/dbraw/zinc/36/00/53/1064360053.db2.gz UXVMHSPIEGKDAN-SFHVURJKSA-N 2 1 306.519 4.008 20 0 DIADMP CCCc1ccc(C[NH+]2CCC[C@]3(CCC[N@@H+](C)C3)C2)s1 ZINC001279583285 1064360060 /nfs/dbraw/zinc/36/00/60/1064360060.db2.gz UXVMHSPIEGKDAN-SFHVURJKSA-N 2 1 306.519 4.008 20 0 DIADMP Cc1csc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)c1Cl ZINC001279657235 1064361361 /nfs/dbraw/zinc/36/13/61/1064361361.db2.gz AHSNGYXJSQCOIK-UHFFFAOYSA-N 2 1 312.910 4.018 20 0 DIADMP c1ccc(CCCC[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000643458367 1064412307 /nfs/dbraw/zinc/41/23/07/1064412307.db2.gz QVVAOWFAMZOOPO-SFTDATJTSA-N 2 1 308.469 4.092 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1CC1CCCCC1 ZINC001307440762 1065401952 /nfs/dbraw/zinc/40/19/52/1065401952.db2.gz ROIBOQPSFGRKHP-IBGZPJMESA-N 2 1 303.494 4.407 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1CC1CCCCC1 ZINC001307440762 1065401957 /nfs/dbraw/zinc/40/19/57/1065401957.db2.gz ROIBOQPSFGRKHP-IBGZPJMESA-N 2 1 303.494 4.407 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)C[C@H]2CCC3(CCCCCC3)O2)CC1 ZINC001307450656 1065408385 /nfs/dbraw/zinc/40/83/85/1065408385.db2.gz RBQZCNMTYNTJAJ-LJQANCHMSA-N 2 1 322.537 4.063 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CC[C@H]2CCc3ccccc32)CC1 ZINC001307455514 1065410483 /nfs/dbraw/zinc/41/04/83/1065410483.db2.gz PUONJSINPGNGBX-HXUWFJFHSA-N 2 1 314.517 4.159 20 0 DIADMP CC(C)Cc1ccccc1C[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001307498767 1065441630 /nfs/dbraw/zinc/44/16/30/1065441630.db2.gz IPBWGDZFPIUABV-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccccc1C[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC001307498767 1065441638 /nfs/dbraw/zinc/44/16/38/1065441638.db2.gz IPBWGDZFPIUABV-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CC(C)Cc1ccccc1C[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC001307498767 1065441645 /nfs/dbraw/zinc/44/16/45/1065441645.db2.gz IPBWGDZFPIUABV-HXUWFJFHSA-N 2 1 302.506 4.191 20 0 DIADMP CC[C@H](C)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001307523983 1065462679 /nfs/dbraw/zinc/46/26/79/1065462679.db2.gz QYPGHDRIUSVMLT-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001307523983 1065462686 /nfs/dbraw/zinc/46/26/86/1065462686.db2.gz QYPGHDRIUSVMLT-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001307523983 1065462692 /nfs/dbraw/zinc/46/26/92/1065462692.db2.gz QYPGHDRIUSVMLT-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc([C@@]23CCCC[C@@H]2C[N@@H+]3CCC[NH+]2CCCCC2)cc1 ZINC001307534992 1065469553 /nfs/dbraw/zinc/46/95/53/1065469553.db2.gz QLOSKHVSKCMKEW-RTWAWAEBSA-N 2 1 312.501 4.264 20 0 DIADMP CC(C)Cc1ccc([C@H]([NH2+]CC[C@@H]2CCC[N@H+]2C)C2CC2)cc1 ZINC001307614337 1065518447 /nfs/dbraw/zinc/51/84/47/1065518447.db2.gz GEYZCXBTFBNKQH-SFTDATJTSA-N 2 1 314.517 4.410 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@H](CC1CCCC1)c1ccccc1 ZINC001307634472 1065531367 /nfs/dbraw/zinc/53/13/67/1065531367.db2.gz GRZLIUCWSODFLN-PMACEKPBSA-N 2 1 300.490 4.382 20 0 DIADMP Cc1ccc(CCC[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC001307642190 1065536697 /nfs/dbraw/zinc/53/66/97/1065536697.db2.gz CRWUELIIKKFZET-UHFFFAOYSA-N 2 1 310.485 4.121 20 0 DIADMP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670206 1065554196 /nfs/dbraw/zinc/55/41/96/1065554196.db2.gz QKMJEUAGTWHYLI-NVXWUHKLSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670206 1065554208 /nfs/dbraw/zinc/55/42/08/1065554208.db2.gz QKMJEUAGTWHYLI-NVXWUHKLSA-N 2 1 320.908 4.391 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccccc1C(C)C ZINC001307679771 1065558391 /nfs/dbraw/zinc/55/83/91/1065558391.db2.gz OHTHWNTVASSJNE-UHFFFAOYSA-N 2 1 313.489 4.481 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccccc1C(C)C ZINC001307679771 1065558404 /nfs/dbraw/zinc/55/84/04/1065558404.db2.gz OHTHWNTVASSJNE-UHFFFAOYSA-N 2 1 313.489 4.481 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2C[C@@H]2CCCC[C@@H]2C)CC1 ZINC001308001740 1065718560 /nfs/dbraw/zinc/71/85/60/1065718560.db2.gz HCWHZUOJADDBPY-UFYCRDLUSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1C[C@H]2CN(Cc3ccccc3)C[C@@]2(C)C1 ZINC001308058704 1065745258 /nfs/dbraw/zinc/74/52/58/1065745258.db2.gz DIPPOIDCJLXASR-QIJUGHKUSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308058704 1065745269 /nfs/dbraw/zinc/74/52/69/1065745269.db2.gz DIPPOIDCJLXASR-QIJUGHKUSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308058704 1065745281 /nfs/dbraw/zinc/74/52/81/1065745281.db2.gz DIPPOIDCJLXASR-QIJUGHKUSA-N 2 1 320.480 4.202 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC001308180604 1065792084 /nfs/dbraw/zinc/79/20/84/1065792084.db2.gz NHEFCKSPJMGDEP-NRFANRHFSA-N 2 1 320.480 4.282 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC001308180604 1065792096 /nfs/dbraw/zinc/79/20/96/1065792096.db2.gz NHEFCKSPJMGDEP-NRFANRHFSA-N 2 1 320.480 4.282 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)CC1 ZINC001308206397 1065814205 /nfs/dbraw/zinc/81/42/05/1065814205.db2.gz XYXNUFLIQSNGFR-DJPFJPOOSA-N 2 1 314.517 4.374 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CC(C)(C)C[C@@H]2C)CC1 ZINC001308205695 1065814234 /nfs/dbraw/zinc/81/42/34/1065814234.db2.gz AXEMPJSBDXXSQS-PXNSSMCTSA-N 2 1 314.517 4.374 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+]C[C@@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001308208944 1065816597 /nfs/dbraw/zinc/81/65/97/1065816597.db2.gz JLZJUXTXHUHLMA-HKUYNNGSSA-N 2 1 316.533 4.094 20 0 DIADMP C(C1CCCC1)[N@@H+]1CC[C@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001308293864 1065890979 /nfs/dbraw/zinc/89/09/79/1065890979.db2.gz XGTSICWUSHDMSS-MHJFOBGBSA-N 2 1 304.522 4.199 20 0 DIADMP C(C1CCCC1)[N@H+]1CC[C@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001308293864 1065890993 /nfs/dbraw/zinc/89/09/93/1065890993.db2.gz XGTSICWUSHDMSS-MHJFOBGBSA-N 2 1 304.522 4.199 20 0 DIADMP Cc1ccc2cc(C[NH2+]CCC[NH+](C(C)C)C(C)C)[nH]c2c1 ZINC001308299527 1065894405 /nfs/dbraw/zinc/89/44/05/1065894405.db2.gz BZPTUISHVMNASX-UHFFFAOYSA-N 2 1 301.478 4.075 20 0 DIADMP CC(C)CCC[NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001308333375 1065919129 /nfs/dbraw/zinc/91/91/29/1065919129.db2.gz LJPQCQBXJLWGRZ-UYAOXDASSA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)CCC[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001308333372 1065919572 /nfs/dbraw/zinc/91/95/72/1065919572.db2.gz LJPQCQBXJLWGRZ-ICSRJNTNSA-N 2 1 302.506 4.313 20 0 DIADMP CCC(CC)C[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC001308352294 1065933287 /nfs/dbraw/zinc/93/32/87/1065933287.db2.gz AWDCLTSTJXLNRC-UHFFFAOYSA-N 2 1 303.494 4.065 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC001308432740 1065984414 /nfs/dbraw/zinc/98/44/14/1065984414.db2.gz NHAYRNLHNNJNDU-GOSISDBHSA-N 2 1 308.469 4.175 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC001308432741 1065985231 /nfs/dbraw/zinc/98/52/31/1065985231.db2.gz NHAYRNLHNNJNDU-SFHVURJKSA-N 2 1 308.469 4.175 20 0 DIADMP CCOc1cccc(C[NH2+]CCC[N@H+](CC)C2CCCCC2)c1 ZINC001308455537 1065998743 /nfs/dbraw/zinc/99/87/43/1065998743.db2.gz MHWKNHXFYSRCGD-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP CCOc1cccc(C[NH2+]CCC[N@@H+](CC)C2CCCCC2)c1 ZINC001308455537 1065998753 /nfs/dbraw/zinc/99/87/53/1065998753.db2.gz MHWKNHXFYSRCGD-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCS1 ZINC001308539243 1066055216 /nfs/dbraw/zinc/05/52/16/1066055216.db2.gz CJQKVVMNQGOJAB-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559482 1066068990 /nfs/dbraw/zinc/06/89/90/1066068990.db2.gz CRKOZJIJYCRVND-WHXUGTBJSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559482 1066069004 /nfs/dbraw/zinc/06/90/04/1066069004.db2.gz CRKOZJIJYCRVND-WHXUGTBJSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559482 1066069014 /nfs/dbraw/zinc/06/90/14/1066069014.db2.gz CRKOZJIJYCRVND-WHXUGTBJSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559482 1066069023 /nfs/dbraw/zinc/06/90/23/1066069023.db2.gz CRKOZJIJYCRVND-WHXUGTBJSA-N 2 1 314.517 4.289 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2ccccc2)[C@@H]2CCCC2(C)C)CC1 ZINC001308583143 1066098575 /nfs/dbraw/zinc/09/85/75/1066098575.db2.gz SKKBHKVWBCLQPZ-HXUWFJFHSA-N 2 1 314.517 4.409 20 0 DIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597411 1066108209 /nfs/dbraw/zinc/10/82/09/1066108209.db2.gz AUGYJHLYXQDQQB-QGZVFWFLSA-N 2 1 312.501 4.215 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597411 1066108214 /nfs/dbraw/zinc/10/82/14/1066108214.db2.gz AUGYJHLYXQDQQB-QGZVFWFLSA-N 2 1 312.501 4.215 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597411 1066108217 /nfs/dbraw/zinc/10/82/17/1066108217.db2.gz AUGYJHLYXQDQQB-QGZVFWFLSA-N 2 1 312.501 4.215 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597411 1066108222 /nfs/dbraw/zinc/10/82/22/1066108222.db2.gz AUGYJHLYXQDQQB-QGZVFWFLSA-N 2 1 312.501 4.215 20 0 DIADMP CC(C)[C@H](C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1ccccc1 ZINC001308597512 1066108292 /nfs/dbraw/zinc/10/82/92/1066108292.db2.gz CHGHOZBUFBGCKH-FPOVZHCZSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@H](C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597512 1066108295 /nfs/dbraw/zinc/10/82/95/1066108295.db2.gz CHGHOZBUFBGCKH-FPOVZHCZSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@H](C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597512 1066108297 /nfs/dbraw/zinc/10/82/97/1066108297.db2.gz CHGHOZBUFBGCKH-FPOVZHCZSA-N 2 1 314.517 4.090 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001308729123 1066204070 /nfs/dbraw/zinc/20/40/70/1066204070.db2.gz DMSDWTFDZFJYRL-CTNGQTDRSA-N 2 1 322.496 4.210 20 0 DIADMP CC[N@@H+](CCc1ccc(C)c(C)c1)Cc1ccc(C[NH+](C)C)cc1 ZINC001308742892 1066215886 /nfs/dbraw/zinc/21/58/86/1066215886.db2.gz PCRROJWZUVKAGX-UHFFFAOYSA-N 2 1 324.512 4.430 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747184 1066220861 /nfs/dbraw/zinc/22/08/61/1066220861.db2.gz WDOGUABVXHTWCL-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747184 1066220869 /nfs/dbraw/zinc/22/08/69/1066220869.db2.gz WDOGUABVXHTWCL-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747184 1066220883 /nfs/dbraw/zinc/22/08/83/1066220883.db2.gz WDOGUABVXHTWCL-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747184 1066220897 /nfs/dbraw/zinc/22/08/97/1066220897.db2.gz WDOGUABVXHTWCL-MAUKXSAKSA-N 2 1 314.498 4.187 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C1CC(c2cccc(F)c2)C1 ZINC001308779562 1066252985 /nfs/dbraw/zinc/25/29/85/1066252985.db2.gz SFISUTNXZMOAIQ-UUKMXZOPSA-N 2 1 318.480 4.172 20 0 DIADMP CC/C=C\C[NH2+]C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001308782450 1066254059 /nfs/dbraw/zinc/25/40/59/1066254059.db2.gz NYQMHSHHLIXBOZ-RACPOZDESA-N 2 1 314.517 4.481 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H](C)Cc1ccc(F)cc1Cl ZINC001308794635 1066270907 /nfs/dbraw/zinc/27/09/07/1066270907.db2.gz ADPJQHNBUMIKDZ-KGLIPLIRSA-N 2 1 314.876 4.120 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H](C)Cc1ccc(F)cc1Cl ZINC001308794635 1066270916 /nfs/dbraw/zinc/27/09/16/1066270916.db2.gz ADPJQHNBUMIKDZ-KGLIPLIRSA-N 2 1 314.876 4.120 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H](C)CC12CC3CC(CC(C3)C1)C2 ZINC001308802846 1066278350 /nfs/dbraw/zinc/27/83/50/1066278350.db2.gz OVNJDQCXSAQJSR-SBXPZINTSA-N 2 1 306.538 4.300 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H](C)CC12CC3CC(CC(C3)C1)C2 ZINC001308802846 1066278367 /nfs/dbraw/zinc/27/83/67/1066278367.db2.gz OVNJDQCXSAQJSR-SBXPZINTSA-N 2 1 306.538 4.300 20 0 DIADMP CCC1C[NH+](C[C@@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001308804817 1066281833 /nfs/dbraw/zinc/28/18/33/1066281833.db2.gz WKPIBZKXOOLZAJ-OAQYLSRUSA-N 2 1 314.517 4.267 20 0 DIADMP Cc1ccc([C@H]2CCC[C@H]2[NH2+]CC[N@@H+]2CCCC2(C)C)cc1 ZINC001308816011 1066291459 /nfs/dbraw/zinc/29/14/59/1066291459.db2.gz UBKOJTIVXSQMFK-RTBURBONSA-N 2 1 300.490 4.095 20 0 DIADMP Cc1ccc([C@H]2CCC[C@H]2[NH2+]CC[N@H+]2CCCC2(C)C)cc1 ZINC001308816011 1066291475 /nfs/dbraw/zinc/29/14/75/1066291475.db2.gz UBKOJTIVXSQMFK-RTBURBONSA-N 2 1 300.490 4.095 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC001308823350 1066297810 /nfs/dbraw/zinc/29/78/10/1066297810.db2.gz NXWVMIUEPCWYTK-VQIMIIECSA-N 2 1 320.908 4.440 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC001308823346 1066298692 /nfs/dbraw/zinc/29/86/92/1066298692.db2.gz NXWVMIUEPCWYTK-LPHOPBHVSA-N 2 1 320.908 4.440 20 0 DIADMP CC[NH+]1CCC(C[N@H+](Cc2c(C)cccc2C)CC(C)C)CC1 ZINC001308835207 1066312651 /nfs/dbraw/zinc/31/26/51/1066312651.db2.gz WLSJTXGDHYJWLF-UHFFFAOYSA-N 2 1 316.533 4.493 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC001308863997 1066345487 /nfs/dbraw/zinc/34/54/87/1066345487.db2.gz OPQUYGDXAZVQLL-MNEFBYGVSA-N 2 1 320.908 4.298 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC001308920105 1066398176 /nfs/dbraw/zinc/39/81/76/1066398176.db2.gz ZJXDFJGOBGTCMB-QZTJIDSGSA-N 2 1 315.505 4.199 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCC[C@@H]3C3CCCCC3)[C@@H]2C1 ZINC001308985102 1066433583 /nfs/dbraw/zinc/43/35/83/1066433583.db2.gz SDBJXUGGPFZARB-UTBUEMAESA-N 2 1 304.522 4.055 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CC(C)(C)Cc3oc(C)cc32)CC1 ZINC000236796653 202012780 /nfs/dbraw/zinc/01/27/80/202012780.db2.gz VNDOGBXZNHCCMR-QGZVFWFLSA-N 2 1 304.478 4.066 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](c2ccccc2)C(C)C)cn1 ZINC000091288633 193032134 /nfs/dbraw/zinc/03/21/34/193032134.db2.gz LNLLIFDUCBVVCN-FQEVSTJZSA-N 2 1 320.440 4.063 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000274317579 130226123 /nfs/dbraw/zinc/22/61/23/130226123.db2.gz WGPPUYQYOWPDMV-HNNXBMFYSA-N 2 1 315.461 4.110 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Cl)ccc1Cl ZINC000275553030 130336350 /nfs/dbraw/zinc/33/63/50/130336350.db2.gz NLQPYXUGZHLXTN-NWDGAFQWSA-N 2 1 324.255 4.103 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000275648503 130353165 /nfs/dbraw/zinc/35/31/65/130353165.db2.gz UFMZYAAAFYGALF-NWDGAFQWSA-N 2 1 324.255 4.103 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(C)c(C)o2)c1 ZINC000282052750 130899216 /nfs/dbraw/zinc/89/92/16/130899216.db2.gz GMHYCDQGCKYIKO-OAHLLOKOSA-N 2 1 300.446 4.199 20 0 DIADMP FC1(F)CCC[C@@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000282147998 130903737 /nfs/dbraw/zinc/90/37/37/130903737.db2.gz WSHKEZOVJQSHCB-QGZVFWFLSA-N 2 1 322.443 4.066 20 0 DIADMP Cn1ccnc1[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000340202738 131152372 /nfs/dbraw/zinc/15/23/72/131152372.db2.gz PHWNWWHYYZQOTE-HXUWFJFHSA-N 2 1 317.436 4.077 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2csc(C)c2)c1 ZINC000297968046 132042996 /nfs/dbraw/zinc/04/29/96/132042996.db2.gz ZRLKZXQFTYWWHB-HNNXBMFYSA-N 2 1 302.487 4.359 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000119713370 132135305 /nfs/dbraw/zinc/13/53/05/132135305.db2.gz KUQDRPOIGOWTQL-KRWDZBQOSA-N 2 1 324.468 4.010 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000559295257 332018329 /nfs/dbraw/zinc/01/83/29/332018329.db2.gz VAGWXJZOHCSHBG-WBVHZDCISA-N 2 1 320.908 4.391 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1Cl ZINC000091268688 332102465 /nfs/dbraw/zinc/10/24/65/332102465.db2.gz LNKQLOQAARTIBQ-SFHVURJKSA-N 2 1 306.881 4.254 20 0 DIADMP c1csc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)c1 ZINC000564655992 332132542 /nfs/dbraw/zinc/13/25/42/332132542.db2.gz NZLXXVSMWNYJBV-QGZVFWFLSA-N 2 1 312.482 4.035 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cc2ccccc2o1 ZINC000215642752 332192903 /nfs/dbraw/zinc/19/29/03/332192903.db2.gz KRJOQMCWLHHDCH-CYBMUJFWSA-N 2 1 300.446 4.393 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000394272458 332207514 /nfs/dbraw/zinc/20/75/14/332207514.db2.gz AILNCKUMBOROOZ-PKOBYXMFSA-N 2 1 314.498 4.311 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H]2C[C@H](C)[N@@H+](C)C[C@H]2C)c2ccccc21 ZINC000448032714 332270576 /nfs/dbraw/zinc/27/05/76/332270576.db2.gz XKAHFOBOBJBVFU-DWXZBXMZSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(F)c2ccccc21 ZINC000559740340 332278382 /nfs/dbraw/zinc/27/83/82/332278382.db2.gz OJEBHKTWBDNSEI-GJZGRUSLSA-N 2 1 312.432 4.114 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[N@@H+](C(C)C)C3)o2)cc1 ZINC000559864944 332285951 /nfs/dbraw/zinc/28/59/51/332285951.db2.gz QZYFTJLVUMHBIV-KRWDZBQOSA-N 2 1 312.457 4.075 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[N@H+](C(C)C)C3)o2)cc1 ZINC000559864944 332285952 /nfs/dbraw/zinc/28/59/52/332285952.db2.gz QZYFTJLVUMHBIV-KRWDZBQOSA-N 2 1 312.457 4.075 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cccc(-c3ccccc3)c2)C1 ZINC000559862393 332286541 /nfs/dbraw/zinc/28/65/41/332286541.db2.gz BLZAWXAYWPVZBL-LJQANCHMSA-N 2 1 308.469 4.174 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CCCCc2ccc(Cl)s2)[C@@H](C)C1 ZINC000560235662 332321131 /nfs/dbraw/zinc/32/11/31/332321131.db2.gz MIIXJXVQWTVWSW-DZGCQCFKSA-N 2 1 314.926 4.044 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000560251969 332323689 /nfs/dbraw/zinc/32/36/89/332323689.db2.gz NELGXSKCYRNDED-IRXDYDNUSA-N 2 1 316.489 4.000 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000562020254 332532241 /nfs/dbraw/zinc/53/22/41/332532241.db2.gz VHQDHOYDZOFSQT-UXHICEINSA-N 2 1 314.517 4.108 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341719555 334473532 /nfs/dbraw/zinc/47/35/32/334473532.db2.gz CGBGIHMMPBBWTR-UXLLHSPISA-N 2 1 322.880 4.016 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1)c1c[nH+]ccc1N ZINC000562958872 332652220 /nfs/dbraw/zinc/65/22/20/332652220.db2.gz ZAVOKRZAANEIQH-JGGQBBKZSA-N 2 1 315.848 4.134 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCNCc1cccc(C(F)(F)F)c1 ZINC000314250626 333096171 /nfs/dbraw/zinc/09/61/71/333096171.db2.gz XLUZDGRVOSFBED-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000314250626 333096172 /nfs/dbraw/zinc/09/61/72/333096172.db2.gz XLUZDGRVOSFBED-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000314250626 333096174 /nfs/dbraw/zinc/09/61/74/333096174.db2.gz XLUZDGRVOSFBED-CQSZACIVSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000379037410 333098408 /nfs/dbraw/zinc/09/84/08/333098408.db2.gz DDDUOQBLCXTERI-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP CCC[N@H+](C)C[C@H]1CCN(c2cc(C)c3ccc(C)cc3[nH+]2)C1 ZINC000460958003 333105843 /nfs/dbraw/zinc/10/58/43/333105843.db2.gz OBYWVCBRPQWDQF-QGZVFWFLSA-N 2 1 311.473 4.020 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN(c2cc(C)c3ccc(C)cc3[nH+]2)C1 ZINC000460958003 333105844 /nfs/dbraw/zinc/10/58/44/333105844.db2.gz OBYWVCBRPQWDQF-QGZVFWFLSA-N 2 1 311.473 4.020 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](C/C=C/c2ccc(Cl)cc2)CC1 ZINC000526057261 333113819 /nfs/dbraw/zinc/11/38/19/333113819.db2.gz ANCCGOCRUVPUDN-SNAWJCMRSA-N 2 1 320.908 4.405 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497520798 333258348 /nfs/dbraw/zinc/25/83/48/333258348.db2.gz FHXCCQASPNPCSB-MRXNPFEDSA-N 2 1 306.453 4.078 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497520798 333258349 /nfs/dbraw/zinc/25/83/49/333258349.db2.gz FHXCCQASPNPCSB-MRXNPFEDSA-N 2 1 306.453 4.078 20 0 DIADMP C[C@H]([NH2+]C1CC(C(C)(C)C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000582112643 333272425 /nfs/dbraw/zinc/27/24/25/333272425.db2.gz OJXWSTIUGLVPMD-FVPXHTFXSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCCC1 ZINC000390583513 333303785 /nfs/dbraw/zinc/30/37/85/333303785.db2.gz FAXWEVJZQJFGLR-BRIRTLKKSA-N 2 1 312.501 4.350 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2ccc(Cl)cc2)C[C@H]1C ZINC000531378784 333347472 /nfs/dbraw/zinc/34/74/72/333347472.db2.gz YTDKGTMGQQEUSL-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2ccc(Cl)cc2)C[C@H]1C ZINC000531378784 333347473 /nfs/dbraw/zinc/34/74/73/333347473.db2.gz YTDKGTMGQQEUSL-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2ccc(Cl)cc2)C[C@H]1C ZINC000531378784 333347474 /nfs/dbraw/zinc/34/74/74/333347474.db2.gz YTDKGTMGQQEUSL-CRAIPNDOSA-N 2 1 308.897 4.077 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCC1(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390794904 333393925 /nfs/dbraw/zinc/39/39/25/333393925.db2.gz HRWCHUNBZAMPIY-QXAKKESOSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@H+](Cc1cnc(C2CCCCC2)s1)[C@@H]1CCC[NH2+]CC1 ZINC000567872312 333395401 /nfs/dbraw/zinc/39/54/01/333395401.db2.gz CRXFHSSBUYFHNN-MRXNPFEDSA-N 2 1 321.534 4.155 20 0 DIADMP CC[N@@H+](Cc1cnc(C2CCCCC2)s1)[C@@H]1CCC[NH2+]CC1 ZINC000567872312 333395403 /nfs/dbraw/zinc/39/54/03/333395403.db2.gz CRXFHSSBUYFHNN-MRXNPFEDSA-N 2 1 321.534 4.155 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C[C@@H](c2ccccc2)C1 ZINC000392003963 335149984 /nfs/dbraw/zinc/14/99/84/335149984.db2.gz RGMMSTLUDPSMOY-RQUKQETFSA-N 2 1 312.501 4.175 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000414065920 333890320 /nfs/dbraw/zinc/89/03/20/333890320.db2.gz GQVXOVJTKWQEKN-WMZOPIPTSA-N 2 1 317.864 4.161 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)C(C)(C)c1ccccc1 ZINC000415086010 334274680 /nfs/dbraw/zinc/27/46/80/334274680.db2.gz RDVKBQLSJOODOO-DZFGPLHGSA-N 2 1 322.496 4.436 20 0 DIADMP C[C@@H](N[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(Cl)ccc1Cl ZINC000187644157 334266368 /nfs/dbraw/zinc/26/63/68/334266368.db2.gz DWXIGQZEYMVZCM-NQBHXWOUSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(Cl)cc1 ZINC000415117066 334283834 /nfs/dbraw/zinc/28/38/34/334283834.db2.gz FWALRRLGILVVJB-GDIGMMSISA-N 2 1 314.860 4.484 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000531941218 334301698 /nfs/dbraw/zinc/30/16/98/334301698.db2.gz QOMDLYJBUQUUFG-LJQANCHMSA-N 2 1 314.517 4.418 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000534757352 334336705 /nfs/dbraw/zinc/33/67/05/334336705.db2.gz XWQLSJYKFZPFMY-FXAWDEMLSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000534757352 334336706 /nfs/dbraw/zinc/33/67/06/334336706.db2.gz XWQLSJYKFZPFMY-FXAWDEMLSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000534757352 334336708 /nfs/dbraw/zinc/33/67/08/334336708.db2.gz XWQLSJYKFZPFMY-FXAWDEMLSA-N 2 1 311.473 4.179 20 0 DIADMP Cc1nccn1CC[N@H+]1CCC[C@H]1c1ccc(C(C)(C)C)cc1 ZINC000534954346 334352437 /nfs/dbraw/zinc/35/24/37/334352437.db2.gz MKHCEGXAIQALTO-IBGZPJMESA-N 2 1 311.473 4.326 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000531988794 334363995 /nfs/dbraw/zinc/36/39/95/334363995.db2.gz SBKARNGXJPKJEH-HGHGUNKESA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000531988794 334363996 /nfs/dbraw/zinc/36/39/96/334363996.db2.gz SBKARNGXJPKJEH-HGHGUNKESA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000531988794 334363997 /nfs/dbraw/zinc/36/39/97/334363997.db2.gz SBKARNGXJPKJEH-HGHGUNKESA-N 2 1 308.469 4.317 20 0 DIADMP COc1ccc([C@@H](CCC(C)C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000344306446 335239241 /nfs/dbraw/zinc/23/92/41/335239241.db2.gz WPDWWUFTGWXONG-HXUWFJFHSA-N 2 1 316.489 4.024 20 0 DIADMP C[C@H](NCc1cccc(-n2ccnc2)c1)c1cccc(F)c1F ZINC000345186971 335306336 /nfs/dbraw/zinc/30/63/36/335306336.db2.gz OGHKLPMEJDBCOH-ZDUSSCGKSA-N 2 1 313.351 4.001 20 0 DIADMP Clc1ccc([C@@H](CC2CC2)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000345695464 335342571 /nfs/dbraw/zinc/34/25/71/335342571.db2.gz PUPYTLYPVKDTPF-LJQANCHMSA-N 2 1 318.892 4.398 20 0 DIADMP Clc1ccc([C@H](CC2CC2)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000345719160 335345578 /nfs/dbraw/zinc/34/55/78/335345578.db2.gz LFIUBWOIOOUJSM-QYZOEREBSA-N 2 1 318.892 4.398 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000346184502 335378902 /nfs/dbraw/zinc/37/89/02/335378902.db2.gz UILXLMWGTVZMQV-UHFFFAOYSA-N 2 1 324.472 4.119 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000346150792 335382161 /nfs/dbraw/zinc/38/21/61/335382161.db2.gz NGWRXDVKMHXVJL-KRWDZBQOSA-N 2 1 320.440 4.077 20 0 DIADMP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000346150801 335382244 /nfs/dbraw/zinc/38/22/44/335382244.db2.gz NGWRXDVKMHXVJL-QGZVFWFLSA-N 2 1 320.440 4.077 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000346305344 335398389 /nfs/dbraw/zinc/39/83/89/335398389.db2.gz HRHAUTRMEUNRJM-ZDUSSCGKSA-N 2 1 303.837 4.071 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000346305344 335398390 /nfs/dbraw/zinc/39/83/90/335398390.db2.gz HRHAUTRMEUNRJM-ZDUSSCGKSA-N 2 1 303.837 4.071 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000346319406 335399504 /nfs/dbraw/zinc/39/95/04/335399504.db2.gz XXSZHYZTDJIKAT-SFHVURJKSA-N 2 1 319.452 4.455 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000346319406 335399505 /nfs/dbraw/zinc/39/95/05/335399505.db2.gz XXSZHYZTDJIKAT-SFHVURJKSA-N 2 1 319.452 4.455 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ccccc2F)cc1 ZINC000347941870 335540609 /nfs/dbraw/zinc/54/06/09/335540609.db2.gz ANGMIIUABGWIQJ-HNNXBMFYSA-N 2 1 323.415 4.213 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cncs2)cc1 ZINC000166674519 335775986 /nfs/dbraw/zinc/77/59/86/335775986.db2.gz VKUNVYUBGDJGDG-OLZOCXBDSA-N 2 1 312.442 4.049 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cncs2)cc1 ZINC000166674606 335776102 /nfs/dbraw/zinc/77/61/02/335776102.db2.gz VKUNVYUBGDJGDG-STQMWFEESA-N 2 1 312.442 4.049 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cncc(F)c2)cc1 ZINC000166690352 335783886 /nfs/dbraw/zinc/78/38/86/335783886.db2.gz QVDUPSLVRQEAKK-KGLIPLIRSA-N 2 1 324.403 4.127 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(Cl)c(F)c1 ZINC000536626327 335845667 /nfs/dbraw/zinc/84/56/67/335845667.db2.gz ZTJRGUZTJDUCMM-GFCCVEGCSA-N 2 1 309.816 4.115 20 0 DIADMP CCC[C@@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccccc1 ZINC000520660110 336002828 /nfs/dbraw/zinc/00/28/28/336002828.db2.gz DWNJMAPPUUFXGY-GURQWTFNSA-N 2 1 300.490 4.127 20 0 DIADMP CCC[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC000520660110 336002829 /nfs/dbraw/zinc/00/28/29/336002829.db2.gz DWNJMAPPUUFXGY-GURQWTFNSA-N 2 1 300.490 4.127 20 0 DIADMP CCC[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000520660110 336002830 /nfs/dbraw/zinc/00/28/30/336002830.db2.gz DWNJMAPPUUFXGY-GURQWTFNSA-N 2 1 300.490 4.127 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2cc(C)ccc2C)C1 ZINC000324089835 336079630 /nfs/dbraw/zinc/07/96/30/336079630.db2.gz JCNZAESMXZYPIE-SIKLNZKXSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H](C)c2ccccc2)CC1 ZINC000352364507 336214332 /nfs/dbraw/zinc/21/43/32/336214332.db2.gz FCTVRXIYVHCNAA-QGZVFWFLSA-N 2 1 310.441 4.037 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](C)CC[C@H]1c1ccccc1 ZINC000352799814 336238510 /nfs/dbraw/zinc/23/85/10/336238510.db2.gz GMCUYFMCXDUXIE-XLIONFOSSA-N 2 1 311.473 4.445 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](C)CC[C@H]1c1ccccc1 ZINC000352799814 336238511 /nfs/dbraw/zinc/23/85/11/336238511.db2.gz GMCUYFMCXDUXIE-XLIONFOSSA-N 2 1 311.473 4.445 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000532441929 336247517 /nfs/dbraw/zinc/24/75/17/336247517.db2.gz LUBYYHSKUNWFQT-GOSISDBHSA-N 2 1 300.490 4.376 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)o1 ZINC000532457517 336248377 /nfs/dbraw/zinc/24/83/77/336248377.db2.gz ZATHSUIQHVXPKH-QGZVFWFLSA-N 2 1 312.457 4.425 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000532494006 336250829 /nfs/dbraw/zinc/25/08/29/336250829.db2.gz BJPZZFYPQPGSEK-JFIYKMOQSA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000532494006 336250830 /nfs/dbraw/zinc/25/08/30/336250830.db2.gz BJPZZFYPQPGSEK-JFIYKMOQSA-N 2 1 306.519 4.128 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000532485488 336251678 /nfs/dbraw/zinc/25/16/78/336251678.db2.gz RCGMXFZSPVFEMM-CTNGQTDRSA-N 2 1 322.496 4.210 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000532509411 336252885 /nfs/dbraw/zinc/25/28/85/336252885.db2.gz VAORGPSTAYIFTR-HKUYNNGSSA-N 2 1 322.924 4.229 20 0 DIADMP CCC(CC)(C[NH2+][C@@H]1C[C@H](C)[N@@H+](C)C[C@H]1C)c1ccccc1 ZINC000532532236 336253942 /nfs/dbraw/zinc/25/39/42/336253942.db2.gz TZUIVFIDUKXLHK-ZIFCJYIRSA-N 2 1 302.506 4.063 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)C(c2ccccc2)c2ccccc2)CC1 ZINC000325114303 336279371 /nfs/dbraw/zinc/27/93/71/336279371.db2.gz KJYBVWTYHBVDOM-GOSISDBHSA-N 2 1 322.496 4.281 20 0 DIADMP CCC[NH+]1CCC(Nc2cc[nH+]c3ccc(Cl)cc23)CC1 ZINC000301284304 336298736 /nfs/dbraw/zinc/29/87/36/336298736.db2.gz NSFZSJVOLLYVFY-UHFFFAOYSA-N 2 1 303.837 4.175 20 0 DIADMP C[NH+](C)[C@H](CNc1cc[nH+]c2ccsc21)c1cccs1 ZINC000301377429 336303390 /nfs/dbraw/zinc/30/33/90/336303390.db2.gz WRAWXSYGVMGOSK-CYBMUJFWSA-N 2 1 303.456 4.073 20 0 DIADMP CCc1cc(NCCCCn2cc[nH+]c2C)c2ccccc2[nH+]1 ZINC000301786648 336329875 /nfs/dbraw/zinc/32/98/75/336329875.db2.gz LMVMVGMVVYHKQJ-UHFFFAOYSA-N 2 1 308.429 4.194 20 0 DIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccoc1 ZINC000353400159 336415435 /nfs/dbraw/zinc/41/54/35/336415435.db2.gz DNVCEDOGAIFMRM-IBGZPJMESA-N 2 1 306.494 4.467 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H]2CC(C)(C)Cc3occc32)CC1 ZINC000358016665 336606187 /nfs/dbraw/zinc/60/61/87/336606187.db2.gz GXUAFUADUDGIIY-KRWDZBQOSA-N 2 1 304.478 4.003 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cc(C)ccn2)cc1 ZINC000367601861 336826306 /nfs/dbraw/zinc/82/63/06/336826306.db2.gz QADRMQAZVHQKRW-JKSUJKDBSA-N 2 1 320.440 4.296 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035885 337084108 /nfs/dbraw/zinc/08/41/08/337084108.db2.gz LIYWXSSPEPKRPN-JQHSSLGASA-N 2 1 310.441 4.224 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-c2ccccc2)o1 ZINC000360035885 337084109 /nfs/dbraw/zinc/08/41/09/337084109.db2.gz LIYWXSSPEPKRPN-JQHSSLGASA-N 2 1 310.441 4.224 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CC(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584365344 337102089 /nfs/dbraw/zinc/10/20/89/337102089.db2.gz QPPMUJLHEGMSGW-JRRMTSHWSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CC(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584365344 337102090 /nfs/dbraw/zinc/10/20/90/337102090.db2.gz QPPMUJLHEGMSGW-JRRMTSHWSA-N 2 1 320.480 4.358 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000180404232 337174158 /nfs/dbraw/zinc/17/41/58/337174158.db2.gz LOKQKHSMDMSRDT-CYBMUJFWSA-N 2 1 309.523 4.098 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000183190107 337190397 /nfs/dbraw/zinc/19/03/97/337190397.db2.gz RWEBBSUFGBSQKJ-HQRMLTQVSA-N 2 1 300.490 4.380 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@H]3CCCC34CCCC4)CC2)cc1 ZINC000392774111 337280556 /nfs/dbraw/zinc/28/05/56/337280556.db2.gz UGGGDWDRVFNOOY-FQEVSTJZSA-N 2 1 312.501 4.354 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000398017796 337303852 /nfs/dbraw/zinc/30/38/52/337303852.db2.gz IGCOJWUXCONTTL-ZPMCFJSWSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCc2ccccc21 ZINC000398017796 337303853 /nfs/dbraw/zinc/30/38/53/337303853.db2.gz IGCOJWUXCONTTL-ZPMCFJSWSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cc2ccccc2s1 ZINC000525952589 337309067 /nfs/dbraw/zinc/30/90/67/337309067.db2.gz YXBJCKZQDATNMC-ZBFHGGJFSA-N 2 1 302.487 4.426 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(OC)cc1 ZINC000422773964 337685962 /nfs/dbraw/zinc/68/59/62/337685962.db2.gz ZMCDAYBBKHGDNR-SESVDKBCSA-N 2 1 324.468 4.229 20 0 DIADMP CC(C)c1ccc([C@H]([NH2+][C@@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000422788745 337686494 /nfs/dbraw/zinc/68/64/94/337686494.db2.gz RINUPLNYWBDUIC-LIRRHRJNSA-N 2 1 314.498 4.158 20 0 DIADMP C[C@H]([NH2+]CCCc1ccc(Cl)cc1Cl)c1c[nH+]ccc1N ZINC000422817477 337688038 /nfs/dbraw/zinc/68/80/38/337688038.db2.gz DFKLAVLBQNREAC-NSHDSACASA-N 2 1 324.255 4.084 20 0 DIADMP Cc1ccc(C)c([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2ccccc2)c1 ZINC000423059597 337697749 /nfs/dbraw/zinc/69/77/49/337697749.db2.gz GBDKQYGEBHHMCQ-CZJMCEMMSA-N 2 1 320.480 4.265 20 0 DIADMP C[C@@]1(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000423140198 337701392 /nfs/dbraw/zinc/70/13/92/337701392.db2.gz XRYUZMKDVISRDR-MBDNFAEBSA-N 2 1 320.480 4.263 20 0 DIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cccc2ccccc21 ZINC000423184709 337702833 /nfs/dbraw/zinc/70/28/33/337702833.db2.gz IMXFYROCVAWFFS-KRWDZBQOSA-N 2 1 319.452 4.065 20 0 DIADMP c1ccc([C@H]([NH2+]CCC[NH2+]Cc2cccnc2)C2CCCC2)cc1 ZINC000423193284 337703171 /nfs/dbraw/zinc/70/31/71/337703171.db2.gz WWWUEGPTUOKDSJ-NRFANRHFSA-N 2 1 323.484 4.082 20 0 DIADMP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000423325858 337715412 /nfs/dbraw/zinc/71/54/12/337715412.db2.gz JWIWLIANJPDBFL-NHYWBVRUSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000423383992 337717854 /nfs/dbraw/zinc/71/78/54/337717854.db2.gz FVHAOTMRFYDPSF-NIKGAXFTSA-N 2 1 314.860 4.017 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527663171 337756894 /nfs/dbraw/zinc/75/68/94/337756894.db2.gz XUOWNEIOADTIDO-LRGYGIHKSA-N 2 1 312.501 4.236 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C[C@H](c2ccccc2)C1 ZINC000119735770 337863074 /nfs/dbraw/zinc/86/30/74/337863074.db2.gz SVFHVVWXOWUMJU-ILZDJORESA-N 2 1 312.501 4.175 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C[C@H](C)C[NH+]1CCCC1 ZINC000315505925 337988306 /nfs/dbraw/zinc/98/83/06/337988306.db2.gz HKUYJFKVLMWYSZ-GOEBONIOSA-N 2 1 300.446 4.124 20 0 DIADMP CCCn1cc[nH+]c1CCCN(C)c1cc[nH+]c2ccc(C)cc21 ZINC000428695184 338058662 /nfs/dbraw/zinc/05/86/62/338058662.db2.gz VEBKETRGNLWRQB-UHFFFAOYSA-N 2 1 322.456 4.219 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(C(F)(F)F)s1)[NH+]1CCCCC1 ZINC000428861181 338062896 /nfs/dbraw/zinc/06/28/96/338062896.db2.gz JCKSSIOXOYCYKG-GFCCVEGCSA-N 2 1 320.424 4.121 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429539675 338083201 /nfs/dbraw/zinc/08/32/01/338083201.db2.gz RNZNNKPAHUNRFW-BBRMVZONSA-N 2 1 314.395 4.183 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@H+](C2c3ccccc3-c3ccccc32)CC1 ZINC000429540515 338083461 /nfs/dbraw/zinc/08/34/61/338083461.db2.gz SVZNPPONBJQGKY-MRXNPFEDSA-N 2 1 306.453 4.173 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000429555189 338083908 /nfs/dbraw/zinc/08/39/08/338083908.db2.gz VQTMCXWNBDEQGQ-OAQYLSRUSA-N 2 1 308.469 4.270 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000432793720 338168053 /nfs/dbraw/zinc/16/80/53/338168053.db2.gz QGRRYESFSCSFDG-HNNXBMFYSA-N 2 1 316.420 4.002 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000432793720 338168054 /nfs/dbraw/zinc/16/80/54/338168054.db2.gz QGRRYESFSCSFDG-HNNXBMFYSA-N 2 1 316.420 4.002 20 0 DIADMP CCCCCOc1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000432801820 338168462 /nfs/dbraw/zinc/16/84/62/338168462.db2.gz XYECCUOVIBXEMJ-LJQANCHMSA-N 2 1 318.505 4.172 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000432801820 338168463 /nfs/dbraw/zinc/16/84/63/338168463.db2.gz XYECCUOVIBXEMJ-LJQANCHMSA-N 2 1 318.505 4.172 20 0 DIADMP CCc1ccc([C@@H]2CC[N@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000433069821 338180132 /nfs/dbraw/zinc/18/01/32/338180132.db2.gz WELRVGDZPBOYGI-HXUWFJFHSA-N 2 1 311.473 4.024 20 0 DIADMP CCc1ccc([C@@H]2CC[N@@H+](CCCCn3cc[nH+]c3C)C2)cc1 ZINC000433069821 338180133 /nfs/dbraw/zinc/18/01/33/338180133.db2.gz WELRVGDZPBOYGI-HXUWFJFHSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434613085 338221178 /nfs/dbraw/zinc/22/11/78/338221178.db2.gz ZSLVWPNYCNKNNI-SFHVURJKSA-N 2 1 303.425 4.050 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434613085 338221179 /nfs/dbraw/zinc/22/11/79/338221179.db2.gz ZSLVWPNYCNKNNI-SFHVURJKSA-N 2 1 303.425 4.050 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435056226 338231390 /nfs/dbraw/zinc/23/13/90/338231390.db2.gz FMUNKCKVPNMCIE-AEFFLSMTSA-N 2 1 315.505 4.225 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)C1 ZINC000436228249 338262478 /nfs/dbraw/zinc/26/24/78/338262478.db2.gz AYKZXFWQKZUQCE-NJYVYQBISA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437786841 338321487 /nfs/dbraw/zinc/32/14/87/338321487.db2.gz PEUBGAXNEKAISO-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(Cl)cc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000437786841 338321488 /nfs/dbraw/zinc/32/14/88/338321488.db2.gz PEUBGAXNEKAISO-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(Cl)cc2F)C1 ZINC000438089362 338330871 /nfs/dbraw/zinc/33/08/71/338330871.db2.gz UYJAZWNJDHSVLY-CQSZACIVSA-N 2 1 312.860 4.081 20 0 DIADMP C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438215243 338336872 /nfs/dbraw/zinc/33/68/72/338336872.db2.gz YRXXRZVCVGJKPE-XFIYOXNOSA-N 2 1 320.443 4.064 20 0 DIADMP C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438215243 338336873 /nfs/dbraw/zinc/33/68/73/338336873.db2.gz YRXXRZVCVGJKPE-XFIYOXNOSA-N 2 1 320.443 4.064 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438216544 338336948 /nfs/dbraw/zinc/33/69/48/338336948.db2.gz PHNLUEVJFPEYFX-QLFBSQMISA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438216544 338336949 /nfs/dbraw/zinc/33/69/49/338336949.db2.gz PHNLUEVJFPEYFX-QLFBSQMISA-N 2 1 320.443 4.208 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439313830 338366814 /nfs/dbraw/zinc/36/68/14/338366814.db2.gz DXOLNCZBKWKNDC-PXNSSMCTSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439313830 338366815 /nfs/dbraw/zinc/36/68/15/338366815.db2.gz DXOLNCZBKWKNDC-PXNSSMCTSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000449093711 338592865 /nfs/dbraw/zinc/59/28/65/338592865.db2.gz XEQWXHLYOJEQPY-SJLPKXTDSA-N 2 1 317.864 4.161 20 0 DIADMP c1[nH+]c(C2CC[NH+](CCC3=CCCCC3)CC2)n2c1CCCC2 ZINC000450871690 338709764 /nfs/dbraw/zinc/70/97/64/338709764.db2.gz ATFBOZANYNPMGI-UHFFFAOYSA-N 2 1 313.489 4.289 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CC[C@H](C)c2ccsc21 ZINC000453106339 338794511 /nfs/dbraw/zinc/79/45/11/338794511.db2.gz ISQFXMGQVAELPH-WWGRRREGSA-N 2 1 303.475 4.117 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CC[C@@H](C)c2ccsc21 ZINC000453109760 338794925 /nfs/dbraw/zinc/79/49/25/338794925.db2.gz AQOAIPBBNYSARS-CJNGLKHVSA-N 2 1 303.475 4.261 20 0 DIADMP Cc1cc(F)c(C[NH2+]Cc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC000459366483 339024807 /nfs/dbraw/zinc/02/48/07/339024807.db2.gz AXEIHGCDRDJRPE-UHFFFAOYSA-N 2 1 320.839 4.139 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC000459402957 339027307 /nfs/dbraw/zinc/02/73/07/339027307.db2.gz GGJHWNMYZJJKRM-UHFFFAOYSA-N 2 1 308.469 4.306 20 0 DIADMP c1ccc(-c2cccc(CC[NH2+]C3CC[NH+](C4CC4)CC3)c2)cc1 ZINC000459435020 339029110 /nfs/dbraw/zinc/02/91/10/339029110.db2.gz IFIJMEMMFBNDIG-UHFFFAOYSA-N 2 1 320.480 4.113 20 0 DIADMP CC(NC1CC[NH+](C2CC2)CC1)(c1ccccc1)c1ccccc1 ZINC000459464994 339030727 /nfs/dbraw/zinc/03/07/27/339030727.db2.gz MZHVCJNXDGBRHA-UHFFFAOYSA-N 2 1 320.480 4.167 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459568375 339036473 /nfs/dbraw/zinc/03/64/73/339036473.db2.gz BPXPVOSIUJLWJK-IBGZPJMESA-N 2 1 309.457 4.199 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459568375 339036474 /nfs/dbraw/zinc/03/64/74/339036474.db2.gz BPXPVOSIUJLWJK-IBGZPJMESA-N 2 1 309.457 4.199 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(C)n2)cc1 ZINC000459659548 339041191 /nfs/dbraw/zinc/04/11/91/339041191.db2.gz DIPZQFYWHAUUGK-MRXNPFEDSA-N 2 1 320.440 4.043 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000459689523 339043219 /nfs/dbraw/zinc/04/32/19/339043219.db2.gz GLJRKEYLNJWGJI-WOJBJXKFSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000459689523 339043220 /nfs/dbraw/zinc/04/32/20/339043220.db2.gz GLJRKEYLNJWGJI-WOJBJXKFSA-N 2 1 311.473 4.240 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082576 339058814 /nfs/dbraw/zinc/05/88/14/339058814.db2.gz IFYCSBTZNBGSSV-BBRMVZONSA-N 2 1 312.860 4.252 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cccc(Cl)c2F)C1 ZINC000461082576 339058815 /nfs/dbraw/zinc/05/88/15/339058815.db2.gz IFYCSBTZNBGSSV-BBRMVZONSA-N 2 1 312.860 4.252 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000462805957 339090315 /nfs/dbraw/zinc/09/03/15/339090315.db2.gz UFCGJSQVCWBCDJ-INIZCTEOSA-N 2 1 306.494 4.245 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000462805957 339090316 /nfs/dbraw/zinc/09/03/16/339090316.db2.gz UFCGJSQVCWBCDJ-INIZCTEOSA-N 2 1 306.494 4.245 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462837008 339093404 /nfs/dbraw/zinc/09/34/04/339093404.db2.gz VJMHPEDTPCVCBB-PHXBYCTMSA-N 2 1 300.490 4.018 20 0 DIADMP CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462837008 339093405 /nfs/dbraw/zinc/09/34/05/339093405.db2.gz VJMHPEDTPCVCBB-PHXBYCTMSA-N 2 1 300.490 4.018 20 0 DIADMP FC(F)c1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000462841426 339093710 /nfs/dbraw/zinc/09/37/10/339093710.db2.gz PGYQYUYDQQPAPD-UHFFFAOYSA-N 2 1 308.416 4.121 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000463082860 339105178 /nfs/dbraw/zinc/10/51/78/339105178.db2.gz PPLXTMISXUMSHD-SFTDATJTSA-N 2 1 314.517 4.234 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463138935 339106903 /nfs/dbraw/zinc/10/69/03/339106903.db2.gz FOYUSKKTYZNUMS-KNQAVFIVSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463138935 339106904 /nfs/dbraw/zinc/10/69/04/339106904.db2.gz FOYUSKKTYZNUMS-KNQAVFIVSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000463141516 339107092 /nfs/dbraw/zinc/10/70/92/339107092.db2.gz CCJVSHSZFWCPOF-OPYAIIAOSA-N 2 1 308.469 4.390 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC000463141516 339107093 /nfs/dbraw/zinc/10/70/93/339107093.db2.gz CCJVSHSZFWCPOF-OPYAIIAOSA-N 2 1 308.469 4.390 20 0 DIADMP CC1(C)CCC[C@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463187531 339108461 /nfs/dbraw/zinc/10/84/61/339108461.db2.gz CELLNMYVTQIKJL-LJQANCHMSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000463244072 339111573 /nfs/dbraw/zinc/11/15/73/339111573.db2.gz NKFKGHYSEMACJD-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000463244072 339111574 /nfs/dbraw/zinc/11/15/74/339111574.db2.gz NKFKGHYSEMACJD-UMGGQSCQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463279855 339112939 /nfs/dbraw/zinc/11/29/39/339112939.db2.gz GLRCGGMBYCXDFH-MBOZVWFJSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463279855 339112940 /nfs/dbraw/zinc/11/29/40/339112940.db2.gz GLRCGGMBYCXDFH-MBOZVWFJSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CSCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463281075 339113051 /nfs/dbraw/zinc/11/30/51/339113051.db2.gz JRKFTFMBQVWRSV-IEBWSBKVSA-N 2 1 320.546 4.018 20 0 DIADMP CC(C)CSCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463281075 339113052 /nfs/dbraw/zinc/11/30/52/339113052.db2.gz JRKFTFMBQVWRSV-IEBWSBKVSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463281494 339113069 /nfs/dbraw/zinc/11/30/69/339113069.db2.gz KUKPKMJRGASDLY-MRXNPFEDSA-N 2 1 318.480 4.001 20 0 DIADMP CC(C)C(C)(C)C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463284084 339113227 /nfs/dbraw/zinc/11/32/27/339113227.db2.gz GVLDAYKZTSKBTO-UHFFFAOYSA-N 2 1 320.496 4.104 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000464782036 339153277 /nfs/dbraw/zinc/15/32/77/339153277.db2.gz VBJYFMLEZBYFQR-MAUKXSAKSA-N 2 1 308.897 4.455 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C[NH+](CC)CC)C1 ZINC000464782036 339153278 /nfs/dbraw/zinc/15/32/78/339153278.db2.gz VBJYFMLEZBYFQR-MAUKXSAKSA-N 2 1 308.897 4.455 20 0 DIADMP C[N@@H+](CCCc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464834925 339156151 /nfs/dbraw/zinc/15/61/51/339156151.db2.gz HOJIMJKYLDGMJQ-QFIPXVFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCCc1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464834925 339156152 /nfs/dbraw/zinc/15/61/52/339156152.db2.gz HOJIMJKYLDGMJQ-QFIPXVFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCCc1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464834925 339156153 /nfs/dbraw/zinc/15/61/53/339156153.db2.gz HOJIMJKYLDGMJQ-QFIPXVFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[N@@H+](CCCc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464834923 339156201 /nfs/dbraw/zinc/15/62/01/339156201.db2.gz HOJIMJKYLDGMJQ-JOCHJYFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCCc1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000464834923 339156202 /nfs/dbraw/zinc/15/62/02/339156202.db2.gz HOJIMJKYLDGMJQ-JOCHJYFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCCc1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464834923 339156203 /nfs/dbraw/zinc/15/62/03/339156203.db2.gz HOJIMJKYLDGMJQ-JOCHJYFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCCC[C@H]1C ZINC000466357957 339200534 /nfs/dbraw/zinc/20/05/34/339200534.db2.gz ZYZWYJVONFGCRQ-WXLSXGNJSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCCC[C@H]1C ZINC000466357957 339200535 /nfs/dbraw/zinc/20/05/35/339200535.db2.gz ZYZWYJVONFGCRQ-WXLSXGNJSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000467435424 339238462 /nfs/dbraw/zinc/23/84/62/339238462.db2.gz YDQUSKDSGOWTNY-ZVFSYMKVSA-N 2 1 324.871 4.043 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000467769442 339246391 /nfs/dbraw/zinc/24/63/91/339246391.db2.gz OAHFUYZVYSKKSU-UHFFFAOYSA-N 2 1 316.411 4.304 20 0 DIADMP C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468229253 339256792 /nfs/dbraw/zinc/25/67/92/339256792.db2.gz FZLDQHWLWNORHU-UWJYYQICSA-N 2 1 312.501 4.187 20 0 DIADMP CCCCOc1ccccc1C[N@H+](C)[C@@H]1CC[NH+](CC)C[C@@H]1C ZINC000468392425 339261606 /nfs/dbraw/zinc/26/16/06/339261606.db2.gz LGWMMFDTJFIKTJ-PKOBYXMFSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[N@@H+](C)[C@@H]1CC[NH+](CC)C[C@@H]1C ZINC000468392425 339261607 /nfs/dbraw/zinc/26/16/07/339261607.db2.gz LGWMMFDTJFIKTJ-PKOBYXMFSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000468392425 339261608 /nfs/dbraw/zinc/26/16/08/339261608.db2.gz LGWMMFDTJFIKTJ-PKOBYXMFSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000468392425 339261609 /nfs/dbraw/zinc/26/16/09/339261609.db2.gz LGWMMFDTJFIKTJ-PKOBYXMFSA-N 2 1 318.505 4.028 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3cccs3)CCCCC2)[C@H](C)C1 ZINC000468766319 339270215 /nfs/dbraw/zinc/27/02/15/339270215.db2.gz AOBFMGWHGBKSIS-SJORKVTESA-N 2 1 320.546 4.270 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469744229 339297452 /nfs/dbraw/zinc/29/74/52/339297452.db2.gz ZIYIVLUSPSCYHX-ROUUACIJSA-N 2 1 316.832 4.339 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000469741833 339297589 /nfs/dbraw/zinc/29/75/89/339297589.db2.gz MMBDRXCVFJQYKW-SWLSCSKDSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000469741833 339297590 /nfs/dbraw/zinc/29/75/90/339297590.db2.gz MMBDRXCVFJQYKW-SWLSCSKDSA-N 2 1 320.795 4.088 20 0 DIADMP C[C@H]1C[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000469867350 339303210 /nfs/dbraw/zinc/30/32/10/339303210.db2.gz VIYFXMVVXFPBES-STQMWFEESA-N 2 1 320.889 4.238 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000470354694 339318008 /nfs/dbraw/zinc/31/80/08/339318008.db2.gz RPJQRCXVTQGIHS-HZPDHXFCSA-N 2 1 308.897 4.154 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)C1CCC(F)(F)CC1 ZINC000474029962 339397770 /nfs/dbraw/zinc/39/77/70/339397770.db2.gz GRDJHMIQEXYLDF-LSDHHAIUSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)C1CCC(F)(F)CC1 ZINC000474047185 339398998 /nfs/dbraw/zinc/39/89/98/339398998.db2.gz PEXYVHALPXFUIG-JKSUJKDBSA-N 2 1 316.480 4.302 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1CC[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000474055434 339399743 /nfs/dbraw/zinc/39/97/43/339399743.db2.gz LBGUGXCGNIFNBC-GOEBONIOSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1CC[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000474055434 339399744 /nfs/dbraw/zinc/39/97/44/339399744.db2.gz LBGUGXCGNIFNBC-GOEBONIOSA-N 2 1 302.453 4.055 20 0 DIADMP C[C@@H](C[NH+]1CCCCCC1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000479604771 339543337 /nfs/dbraw/zinc/54/33/37/339543337.db2.gz NREFFKFPTYPONG-FHERZECASA-N 2 1 320.443 4.209 20 0 DIADMP Cc1ccc(C[C@@H]([NH2+]C2CC[NH+](C)CC2)c2ccc(C)cc2)cc1 ZINC000480170414 339561855 /nfs/dbraw/zinc/56/18/55/339561855.db2.gz NEZAQIHKQIQFEA-JOCHJYFZSA-N 2 1 322.496 4.271 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1cnc2ccsc2c1)C(C)C ZINC000483848744 339676345 /nfs/dbraw/zinc/67/63/45/339676345.db2.gz GOVWEZGEBXESRV-OAHLLOKOSA-N 2 1 319.518 4.456 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccc(C)cc1 ZINC000484178118 339682560 /nfs/dbraw/zinc/68/25/60/339682560.db2.gz WWRZMQQHRGBYSY-HXUWFJFHSA-N 2 1 323.484 4.408 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000493279680 339921857 /nfs/dbraw/zinc/92/18/57/339921857.db2.gz ZMIGKCVDXBVKHG-PMACEKPBSA-N 2 1 308.469 4.238 20 0 DIADMP Cc1ccccc1[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000494882753 339963478 /nfs/dbraw/zinc/96/34/78/339963478.db2.gz KSCJXYAKRHZHTN-NRFANRHFSA-N 2 1 312.501 4.443 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](C/C=C\c3ccccc3)C2)CC1 ZINC000498842535 340024204 /nfs/dbraw/zinc/02/42/04/340024204.db2.gz FTNCTLHNGYUNIA-BHQIVLKMSA-N 2 1 312.501 4.144 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](C/C=C\c3ccccc3)C2)CC1 ZINC000498842535 340024205 /nfs/dbraw/zinc/02/42/05/340024205.db2.gz FTNCTLHNGYUNIA-BHQIVLKMSA-N 2 1 312.501 4.144 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000498928808 340026385 /nfs/dbraw/zinc/02/63/85/340026385.db2.gz JOCHOIQWCUZRGU-HZPDHXFCSA-N 2 1 306.453 4.219 20 0 DIADMP CCC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000499237059 340032945 /nfs/dbraw/zinc/03/29/45/340032945.db2.gz LHWMROCDEZEKKH-ACDBMABISA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)[C@@H](C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499251315 340033165 /nfs/dbraw/zinc/03/31/65/340033165.db2.gz OAUNNPAOTAGWOU-FFGOWVMKSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)(C)CCC[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000499758123 340044146 /nfs/dbraw/zinc/04/41/46/340044146.db2.gz PTVIBCVLFDNBPC-UHFFFAOYSA-N 2 1 303.494 4.225 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000500433493 340058464 /nfs/dbraw/zinc/05/84/64/340058464.db2.gz OERDUJKGDRXOAJ-CWWQYYKHSA-N 2 1 312.501 4.333 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000500433494 340058488 /nfs/dbraw/zinc/05/84/88/340058488.db2.gz OERDUJKGDRXOAJ-KQXORWHBSA-N 2 1 312.501 4.333 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCCNc1cc[nH+]c2cc(F)ccc12 ZINC000500466601 340059871 /nfs/dbraw/zinc/05/98/71/340059871.db2.gz LKLRNPYTGSAQQL-OAHLLOKOSA-N 2 1 315.436 4.440 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cc1C ZINC000502328355 340099901 /nfs/dbraw/zinc/09/99/01/340099901.db2.gz VRSVTVFGRYKVSD-IBGZPJMESA-N 2 1 323.484 4.216 20 0 DIADMP Cc1ccc2c(C3=CC[NH+](CC[C@@H]4CCC[N@@H+]4C)CC3)c[nH]c2c1 ZINC000503052758 340119730 /nfs/dbraw/zinc/11/97/30/340119730.db2.gz MBOUDJLREUJSRJ-SFHVURJKSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1ccc2c(C3=CC[N@H+](CC[C@@H]4CCC[NH+]4C)CC3)c[nH]c2c1 ZINC000503052758 340119731 /nfs/dbraw/zinc/11/97/31/340119731.db2.gz MBOUDJLREUJSRJ-SFHVURJKSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1ccc2c(C3=CC[N@@H+](CC[C@@H]4CCC[NH+]4C)CC3)c[nH]c2c1 ZINC000503052758 340119732 /nfs/dbraw/zinc/11/97/32/340119732.db2.gz MBOUDJLREUJSRJ-SFHVURJKSA-N 2 1 323.484 4.050 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000503065479 340120063 /nfs/dbraw/zinc/12/00/63/340120063.db2.gz VUWCJVDWBRJRGU-CYBMUJFWSA-N 2 1 313.272 4.056 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000503065479 340120064 /nfs/dbraw/zinc/12/00/64/340120064.db2.gz VUWCJVDWBRJRGU-CYBMUJFWSA-N 2 1 313.272 4.056 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483711 340195697 /nfs/dbraw/zinc/19/56/97/340195697.db2.gz WCTMRTKOWCJLLI-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483711 340195698 /nfs/dbraw/zinc/19/56/98/340195698.db2.gz WCTMRTKOWCJLLI-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506483711 340195699 /nfs/dbraw/zinc/19/56/99/340195699.db2.gz WCTMRTKOWCJLLI-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506483711 340195700 /nfs/dbraw/zinc/19/57/00/340195700.db2.gz WCTMRTKOWCJLLI-FGTMMUONSA-N 2 1 318.480 4.473 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(C(C)(C)C)cc2)CC1 ZINC000507370792 340218211 /nfs/dbraw/zinc/21/82/11/340218211.db2.gz NFNYJFQIDUEQPK-UHFFFAOYSA-N 2 1 302.506 4.289 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1csc(Cl)c1 ZINC000300422199 340225766 /nfs/dbraw/zinc/22/57/66/340225766.db2.gz WUMSNLMFPAEURA-CHWSQXEVSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1csc(Cl)c1 ZINC000300422199 340225767 /nfs/dbraw/zinc/22/57/67/340225767.db2.gz WUMSNLMFPAEURA-CHWSQXEVSA-N 2 1 300.899 4.317 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH+]1CCC([NH+](C)C)CC1 ZINC000507985256 340236836 /nfs/dbraw/zinc/23/68/36/340236836.db2.gz NJECCLWVBOOGEK-UHFFFAOYSA-N 2 1 314.473 4.301 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665835 340276353 /nfs/dbraw/zinc/27/63/53/340276353.db2.gz LXVANEPNBMVMMU-HIFRSBDPSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665835 340276354 /nfs/dbraw/zinc/27/63/54/340276354.db2.gz LXVANEPNBMVMMU-HIFRSBDPSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665835 340276355 /nfs/dbraw/zinc/27/63/55/340276355.db2.gz LXVANEPNBMVMMU-HIFRSBDPSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2C(F)(F)F)C[C@H]1C ZINC000509665835 340276356 /nfs/dbraw/zinc/27/63/56/340276356.db2.gz LXVANEPNBMVMMU-HIFRSBDPSA-N 2 1 314.395 4.010 20 0 DIADMP Fc1ccc2c(c1)[C@@H]([N@H+]1CC[C@H](C[NH+]3CCCCC3)C1)CCC2 ZINC000510359445 340296943 /nfs/dbraw/zinc/29/69/43/340296943.db2.gz SUMPBCONNFGMNI-UZLBHIALSA-N 2 1 316.464 4.011 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]C2CC(c3ccccc3Cl)C2)C1 ZINC000510874729 340313625 /nfs/dbraw/zinc/31/36/25/340313625.db2.gz PEUPWCAAUSEDQS-KLAILNCOSA-N 2 1 320.908 4.296 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(Cl)cc1F)C(C)C ZINC000510959834 340316399 /nfs/dbraw/zinc/31/63/99/340316399.db2.gz PZUYOYKOYIFFHL-KRWDZBQOSA-N 2 1 323.843 4.361 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511007313 340318023 /nfs/dbraw/zinc/31/80/23/340318023.db2.gz BFPGIWBDBOGUKP-LLUDDFSJSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@H]1C1CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511007871 340318072 /nfs/dbraw/zinc/31/80/72/340318072.db2.gz BFPGIWBDBOGUKP-NASSWSRMSA-N 2 1 312.501 4.065 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511092578 340320421 /nfs/dbraw/zinc/32/04/21/340320421.db2.gz OTNWOTJXSPQRNF-APWZRJJASA-N 2 1 322.443 4.033 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000511151099 340322515 /nfs/dbraw/zinc/32/25/15/340322515.db2.gz SKQPVPQIQPYNJK-GOSISDBHSA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000511151099 340322516 /nfs/dbraw/zinc/32/25/16/340322516.db2.gz SKQPVPQIQPYNJK-GOSISDBHSA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000511162697 340323030 /nfs/dbraw/zinc/32/30/30/340323030.db2.gz SFGRUQBKILBDQW-IEBWSBKVSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC000511162697 340323031 /nfs/dbraw/zinc/32/30/31/340323031.db2.gz SFGRUQBKILBDQW-IEBWSBKVSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC000511162697 340323032 /nfs/dbraw/zinc/32/30/32/340323032.db2.gz SFGRUQBKILBDQW-IEBWSBKVSA-N 2 1 318.530 4.103 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2ncc(C[NH+](C)C)s2)CC(C)(C)C1 ZINC000511772609 340337828 /nfs/dbraw/zinc/33/78/28/340337828.db2.gz MTPMPWKDFUZQMV-HUUCEWRRSA-N 2 1 323.550 4.147 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C/C=C\c2ccc(F)c(F)c2)C1 ZINC000512145340 340349898 /nfs/dbraw/zinc/34/98/98/340349898.db2.gz MZZRPPTZFYFZEV-OUOZUETKSA-N 2 1 322.443 4.080 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2F)C1 ZINC000512196200 340351805 /nfs/dbraw/zinc/35/18/05/340351805.db2.gz NMQNKPOMYSLSOV-JKSUJKDBSA-N 2 1 322.443 4.051 20 0 DIADMP Cc1ccsc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000512212668 340352541 /nfs/dbraw/zinc/35/25/41/340352541.db2.gz OBMYVIUSZGJFMR-DLBZAZTESA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000512212668 340352542 /nfs/dbraw/zinc/35/25/42/340352542.db2.gz OBMYVIUSZGJFMR-DLBZAZTESA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000512212668 340352543 /nfs/dbraw/zinc/35/25/43/340352543.db2.gz OBMYVIUSZGJFMR-DLBZAZTESA-N 2 1 306.519 4.143 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512316490 340356492 /nfs/dbraw/zinc/35/64/92/340356492.db2.gz ZKKPTLDHDPZVAK-FVJLSDCUSA-N 2 1 312.501 4.225 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512313504 340356641 /nfs/dbraw/zinc/35/66/41/340356641.db2.gz JSLBNMJFEKYFDP-OWCLPIDISA-N 2 1 306.519 4.360 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1cccnc1 ZINC000512327212 340357248 /nfs/dbraw/zinc/35/72/48/340357248.db2.gz XOYUBWZQJIHBPD-CMKODMSKSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512377704 340359402 /nfs/dbraw/zinc/35/94/02/340359402.db2.gz JXORJGPUKFKCJN-GOEBONIOSA-N 2 1 306.881 4.083 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173344861 340363013 /nfs/dbraw/zinc/36/30/13/340363013.db2.gz FHVSVSVNERQYDM-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP CN(Cc1ccc(Cl)c(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512568785 340367295 /nfs/dbraw/zinc/36/72/95/340367295.db2.gz JZIQLOJVLVCQDA-PBWFPOADSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512568785 340367296 /nfs/dbraw/zinc/36/72/96/340367296.db2.gz JZIQLOJVLVCQDA-PBWFPOADSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1ccc(Cl)c(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000512568785 340367299 /nfs/dbraw/zinc/36/72/99/340367299.db2.gz JZIQLOJVLVCQDA-PBWFPOADSA-N 2 1 313.272 4.050 20 0 DIADMP Cc1ccc(C)c(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000512809686 340378668 /nfs/dbraw/zinc/37/86/68/340378668.db2.gz NFAZLQGPLJXENR-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP C[NH+](CCCc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000513158097 340395445 /nfs/dbraw/zinc/39/54/45/340395445.db2.gz GAXUZQGLXKAMGF-WCRBZPEASA-N 2 1 322.496 4.329 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3ccc(C)c(C)c3)CC2)[nH+]1 ZINC000128131924 340861057 /nfs/dbraw/zinc/86/10/57/340861057.db2.gz QVZOTNWQGWHIFO-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000128142393 340861190 /nfs/dbraw/zinc/86/11/90/340861190.db2.gz HLNUSYXBLJAURT-OAHLLOKOSA-N 2 1 315.486 4.080 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)[NH+](C)C ZINC000069377807 340956854 /nfs/dbraw/zinc/95/68/54/340956854.db2.gz LPUORHMELGBLAM-ZNMIVQPWSA-N 2 1 308.432 4.064 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000130246118 341008414 /nfs/dbraw/zinc/00/84/14/341008414.db2.gz GRVGSBULLYFPTH-OWCLPIDISA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1ccc(Cl)s1)[NH+]1CCCCC1 ZINC000543417417 341043509 /nfs/dbraw/zinc/04/35/09/341043509.db2.gz KMSLGQFTJRSLAJ-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)CC[N@@H+]1C ZINC000543591389 341049675 /nfs/dbraw/zinc/04/96/75/341049675.db2.gz HLDOSFPUJPCMIW-SZXPJGKVSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)CC[N@H+]1C ZINC000543591389 341049676 /nfs/dbraw/zinc/04/96/76/341049676.db2.gz HLDOSFPUJPCMIW-SZXPJGKVSA-N 2 1 306.881 4.048 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC(C)C)CC2)cc1F ZINC000131189067 341064456 /nfs/dbraw/zinc/06/44/56/341064456.db2.gz QWLPBVWWEVKUEY-CQSZACIVSA-N 2 1 324.509 4.319 20 0 DIADMP C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000544010197 341066240 /nfs/dbraw/zinc/06/62/40/341066240.db2.gz ZMJBUEPCJOCTGO-HKUYNNGSSA-N 2 1 320.546 4.123 20 0 DIADMP CCOc1ccccc1[C@@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000544375222 341079038 /nfs/dbraw/zinc/07/90/38/341079038.db2.gz POHAFXGDTSRXJT-IAGOWNOFSA-N 2 1 304.478 4.000 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@H+](C)C[C@H]3C)cc2)c1 ZINC000544825686 341094922 /nfs/dbraw/zinc/09/49/22/341094922.db2.gz OPAWGDFPHJYASX-UTKZUKDTSA-N 2 1 308.469 4.092 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CCC(c1ccccc1)c1ccccc1 ZINC000131838346 341112513 /nfs/dbraw/zinc/11/25/13/341112513.db2.gz NHEINYFSDQUSGY-AVRDEDQJSA-N 2 1 322.496 4.138 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC000545521252 341128591 /nfs/dbraw/zinc/12/85/91/341128591.db2.gz QCEGHFLRSVWWNK-AWEZNQCLSA-N 2 1 323.550 4.348 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)c1 ZINC000546164586 341155321 /nfs/dbraw/zinc/15/53/21/341155321.db2.gz FKKZPDJUOOESGZ-UWJYYQICSA-N 2 1 308.469 4.234 20 0 DIADMP CCCCC/C(=C/c1ccccc1)C[NH2+]C1CC[NH+](C)CC1 ZINC000236817148 341201738 /nfs/dbraw/zinc/20/17/38/341201738.db2.gz YVNDMZFRCWHKTB-MNDPQUGUSA-N 2 1 300.490 4.334 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000564317220 341206300 /nfs/dbraw/zinc/20/63/00/341206300.db2.gz AKPCERBXWLFUOX-INIZCTEOSA-N 2 1 317.452 4.100 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000564317220 341206301 /nfs/dbraw/zinc/20/63/01/341206301.db2.gz AKPCERBXWLFUOX-INIZCTEOSA-N 2 1 317.452 4.100 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000564319775 341211391 /nfs/dbraw/zinc/21/13/91/341211391.db2.gz YUTARVFEIUWENL-SZVBFZGTSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000237426700 341213720 /nfs/dbraw/zinc/21/37/20/341213720.db2.gz CPZQVZPGUOAQQD-OXQOHEQNSA-N 2 1 312.457 4.190 20 0 DIADMP C[C@@H]([NH2+]C1CCC(F)(F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000547827887 341235738 /nfs/dbraw/zinc/23/57/38/341235738.db2.gz XKCBKJBUKKILDY-NVXWUHKLSA-N 2 1 322.443 4.065 20 0 DIADMP CC(C)SCC[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000549138970 341286998 /nfs/dbraw/zinc/28/69/98/341286998.db2.gz OSYYAMVUGHJIJO-MJGOQNOKSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC000549138970 341286999 /nfs/dbraw/zinc/28/69/99/341286999.db2.gz OSYYAMVUGHJIJO-MJGOQNOKSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000549138970 341287000 /nfs/dbraw/zinc/28/70/00/341287000.db2.gz OSYYAMVUGHJIJO-MJGOQNOKSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000549138970 341287001 /nfs/dbraw/zinc/28/70/01/341287001.db2.gz OSYYAMVUGHJIJO-MJGOQNOKSA-N 2 1 320.546 4.113 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000245453175 341294976 /nfs/dbraw/zinc/29/49/76/341294976.db2.gz FHVSVSVNERQYDM-KGLIPLIRSA-N 2 1 314.395 4.088 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+]Cc2sc3c(cccc3Cl)c2C)C1 ZINC000549710702 341301010 /nfs/dbraw/zinc/30/10/10/341301010.db2.gz ASAPCYGNSCCLER-ZDUSSCGKSA-N 2 1 322.905 4.295 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2CC=CCC2)C3)cc1 ZINC000245665589 341308422 /nfs/dbraw/zinc/30/84/22/341308422.db2.gz GOOSGWGNBQITPW-WJMWBRGCSA-N 2 1 310.485 4.128 20 0 DIADMP CC[NH+]1CCC([NH2+]Cc2sc3c(cccc3Cl)c2C)CC1 ZINC000550075315 341309609 /nfs/dbraw/zinc/30/96/09/341309609.db2.gz WOCOXGWPOSXSDH-UHFFFAOYSA-N 2 1 322.905 4.437 20 0 DIADMP Fc1cccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000245760679 341313912 /nfs/dbraw/zinc/31/39/12/341313912.db2.gz VMXADRCUPLKZHY-MZADTFQBSA-N 2 1 324.443 4.111 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000550621479 341319702 /nfs/dbraw/zinc/31/97/02/341319702.db2.gz CBPNBLDFCUWAIS-SFTDATJTSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000550621479 341319703 /nfs/dbraw/zinc/31/97/03/341319703.db2.gz CBPNBLDFCUWAIS-SFTDATJTSA-N 2 1 308.469 4.229 20 0 DIADMP CC1CCC(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550621550 341319711 /nfs/dbraw/zinc/31/97/11/341319711.db2.gz BAXSRZXXZHLWHF-OTGCGEFBSA-N 2 1 300.490 4.238 20 0 DIADMP CC1CCC(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550621550 341319712 /nfs/dbraw/zinc/31/97/12/341319712.db2.gz BAXSRZXXZHLWHF-OTGCGEFBSA-N 2 1 300.490 4.238 20 0 DIADMP CC1CCC(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550621553 341319758 /nfs/dbraw/zinc/31/97/58/341319758.db2.gz BAXSRZXXZHLWHF-ZYKFHVCXSA-N 2 1 300.490 4.238 20 0 DIADMP CC1CCC(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000550621553 341319759 /nfs/dbraw/zinc/31/97/59/341319759.db2.gz BAXSRZXXZHLWHF-ZYKFHVCXSA-N 2 1 300.490 4.238 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550644357 341320274 /nfs/dbraw/zinc/32/02/74/341320274.db2.gz SBIHGZMPWMMKCU-VSKRKVRLSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550644357 341320275 /nfs/dbraw/zinc/32/02/75/341320275.db2.gz SBIHGZMPWMMKCU-VSKRKVRLSA-N 2 1 322.496 4.433 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CCC(C)(C)CC2)C[C@@H]1c1ccccc1 ZINC000550665718 341320992 /nfs/dbraw/zinc/32/09/92/341320992.db2.gz NDRMKNJQZXMERW-RTBURBONSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CCC(C)(C)CC2)C[C@@H]1c1ccccc1 ZINC000550665718 341320993 /nfs/dbraw/zinc/32/09/93/341320993.db2.gz NDRMKNJQZXMERW-RTBURBONSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CCC(C)(C)CC2)C[C@@H]1c1ccccc1 ZINC000550665716 341321005 /nfs/dbraw/zinc/32/10/05/341321005.db2.gz NDRMKNJQZXMERW-RBUKOAKNSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CCC(C)(C)CC2)C[C@@H]1c1ccccc1 ZINC000550665716 341321006 /nfs/dbraw/zinc/32/10/06/341321006.db2.gz NDRMKNJQZXMERW-RBUKOAKNSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)[C@@](C)(Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000550919546 341326640 /nfs/dbraw/zinc/32/66/40/341326640.db2.gz SCDKKWUTNKCOFT-AYOQOUSVSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)[C@@](C)(Cc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000550919546 341326641 /nfs/dbraw/zinc/32/66/41/341326641.db2.gz SCDKKWUTNKCOFT-AYOQOUSVSA-N 2 1 322.924 4.370 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3c2cccc3F)C[C@@H]1c1ccccc1 ZINC000551013901 341329208 /nfs/dbraw/zinc/32/92/08/341329208.db2.gz FWVJYMCBRAXJHM-ZLGUVYLKSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3c2cccc3F)C[C@@H]1c1ccccc1 ZINC000551013901 341329209 /nfs/dbraw/zinc/32/92/09/341329209.db2.gz FWVJYMCBRAXJHM-ZLGUVYLKSA-N 2 1 324.443 4.238 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(C3CC3)c2)C1 ZINC000551030146 341329719 /nfs/dbraw/zinc/32/97/19/341329719.db2.gz YHTYDGUWUKKAFE-IAGOWNOFSA-N 2 1 300.490 4.335 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2coc3ccccc23)C[C@H]1c1ccccc1 ZINC000551084286 341331028 /nfs/dbraw/zinc/33/10/28/341331028.db2.gz VNZZGWUKLYBMAK-QUCCMNQESA-N 2 1 320.436 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2coc3ccccc23)C[C@H]1c1ccccc1 ZINC000551084286 341331029 /nfs/dbraw/zinc/33/10/29/341331029.db2.gz VNZZGWUKLYBMAK-QUCCMNQESA-N 2 1 320.436 4.358 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2coc3ccccc23)C[C@H]1c1ccccc1 ZINC000551084285 341331147 /nfs/dbraw/zinc/33/11/47/341331147.db2.gz VNZZGWUKLYBMAK-ICSRJNTNSA-N 2 1 320.436 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2coc3ccccc23)C[C@H]1c1ccccc1 ZINC000551084285 341331148 /nfs/dbraw/zinc/33/11/48/341331148.db2.gz VNZZGWUKLYBMAK-ICSRJNTNSA-N 2 1 320.436 4.358 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C[C@H]1c1ccccc1 ZINC000551085628 341331164 /nfs/dbraw/zinc/33/11/64/341331164.db2.gz DCAMDAOOZUOVTE-TYPHKJRUSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc(F)cc32)C[C@H]1c1ccccc1 ZINC000551085628 341331165 /nfs/dbraw/zinc/33/11/65/341331165.db2.gz DCAMDAOOZUOVTE-TYPHKJRUSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)[C@H]2CCC[C@H]21 ZINC000551308025 341338068 /nfs/dbraw/zinc/33/80/68/341338068.db2.gz IUCWJIUJABJHLD-FRFIEDCNSA-N 2 1 318.892 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC[N@@H+]1C ZINC000246893297 341358385 /nfs/dbraw/zinc/35/83/85/341358385.db2.gz DWVWNYPQFJZFAQ-XWIAVFTESA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC[N@H+]1C ZINC000246893297 341358386 /nfs/dbraw/zinc/35/83/86/341358386.db2.gz DWVWNYPQFJZFAQ-XWIAVFTESA-N 2 1 306.881 4.254 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Cl)s2)C1 ZINC000246989487 341359612 /nfs/dbraw/zinc/35/96/12/341359612.db2.gz KNXDNVZRMQPHIP-CHWSQXEVSA-N 2 1 300.899 4.173 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC[N@@H+]1C ZINC000247078231 341360838 /nfs/dbraw/zinc/36/08/38/341360838.db2.gz QPIVLGKDGSUXDF-ZMYBRWDISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC[N@H+]1C ZINC000247078231 341360839 /nfs/dbraw/zinc/36/08/39/341360839.db2.gz QPIVLGKDGSUXDF-ZMYBRWDISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccoc1 ZINC000247192697 341362089 /nfs/dbraw/zinc/36/20/89/341362089.db2.gz VVHZHSSVJRSYOR-DLBZAZTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccoc1 ZINC000247192697 341362090 /nfs/dbraw/zinc/36/20/90/341362090.db2.gz VVHZHSSVJRSYOR-DLBZAZTESA-N 2 1 312.457 4.362 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)s1 ZINC000247210129 341362204 /nfs/dbraw/zinc/36/22/04/341362204.db2.gz WWJKVJIXCKMAHL-CABCVRRESA-N 2 1 323.550 4.319 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3ccccc3s2)C[C@H]1C ZINC000552071416 341367456 /nfs/dbraw/zinc/36/74/56/341367456.db2.gz CWLKLCHGZIYRRO-ZBFHGGJFSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc3ccccc3s2)C[C@H]1C ZINC000552071416 341367457 /nfs/dbraw/zinc/36/74/57/341367457.db2.gz CWLKLCHGZIYRRO-ZBFHGGJFSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc3ccccc3s2)C[C@H]1C ZINC000552071416 341367458 /nfs/dbraw/zinc/36/74/58/341367458.db2.gz CWLKLCHGZIYRRO-ZBFHGGJFSA-N 2 1 302.487 4.206 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc2ccccc2n1 ZINC000248052095 341372800 /nfs/dbraw/zinc/37/28/00/341372800.db2.gz WOYAMCCBIGKPFZ-IAGOWNOFSA-N 2 1 311.473 4.150 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc2ccccc2n1 ZINC000248052095 341372801 /nfs/dbraw/zinc/37/28/01/341372801.db2.gz WOYAMCCBIGKPFZ-IAGOWNOFSA-N 2 1 311.473 4.150 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccs1 ZINC000248390657 341376278 /nfs/dbraw/zinc/37/62/78/341376278.db2.gz BOGHLGJOASQFFH-ZOBUZTSGSA-N 2 1 306.519 4.442 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)o1 ZINC000248392444 341376348 /nfs/dbraw/zinc/37/63/48/341376348.db2.gz DBAFEGDFLDAWQY-PMPSAXMXSA-N 2 1 304.478 4.146 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000248392444 341376349 /nfs/dbraw/zinc/37/63/49/341376349.db2.gz DBAFEGDFLDAWQY-PMPSAXMXSA-N 2 1 304.478 4.146 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccc(F)c1 ZINC000248407187 341376789 /nfs/dbraw/zinc/37/67/89/341376789.db2.gz UBSIFFWWGNISKC-ZOBUZTSGSA-N 2 1 304.453 4.129 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cccnc1 ZINC000248515277 341378986 /nfs/dbraw/zinc/37/89/86/341378986.db2.gz OAJJFAGUMYFDPS-IEBWSBKVSA-N 2 1 303.494 4.167 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3CC[C@@H](C[NH+](C)C)C3)c2)cc1 ZINC000552256620 341381867 /nfs/dbraw/zinc/38/18/67/341381867.db2.gz UMEZUHHZILKFNU-IBGZPJMESA-N 2 1 308.469 4.046 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248643861 341382536 /nfs/dbraw/zinc/38/25/36/341382536.db2.gz PJIMSYDLCKBJJH-ILXRZTDVSA-N 2 1 322.518 4.060 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248643861 341382537 /nfs/dbraw/zinc/38/25/37/341382537.db2.gz PJIMSYDLCKBJJH-ILXRZTDVSA-N 2 1 322.518 4.060 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000248682691 341384173 /nfs/dbraw/zinc/38/41/73/341384173.db2.gz DZMNORDPZFGKBQ-OLZOCXBDSA-N 2 1 300.899 4.173 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000248682691 341384174 /nfs/dbraw/zinc/38/41/74/341384174.db2.gz DZMNORDPZFGKBQ-OLZOCXBDSA-N 2 1 300.899 4.173 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000248749443 341385815 /nfs/dbraw/zinc/38/58/15/341385815.db2.gz BQOSSJTWHHPZRY-HBFSDRIKSA-N 2 1 314.517 4.423 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCCC3)[C@@H]1c1cccs1 ZINC000248968262 341390885 /nfs/dbraw/zinc/39/08/85/341390885.db2.gz CCRGOMZKZVPWHE-BPQIPLTHSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCCC3)[C@@H]1c1cccs1 ZINC000248968262 341390886 /nfs/dbraw/zinc/39/08/86/341390886.db2.gz CCRGOMZKZVPWHE-BPQIPLTHSA-N 2 1 318.530 4.443 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cs1 ZINC000248993546 341391463 /nfs/dbraw/zinc/39/14/63/341391463.db2.gz LMZZUKLXGOUZKK-JKSUJKDBSA-N 2 1 323.550 4.429 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000249275126 341395745 /nfs/dbraw/zinc/39/57/45/341395745.db2.gz LQCHHMKQGHZGDK-BZUAXINKSA-N 2 1 320.443 4.352 20 0 DIADMP CCC1CCC([NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)CC1 ZINC000552486960 341395913 /nfs/dbraw/zinc/39/59/13/341395913.db2.gz DQWOICRGNBCZGM-UHFFFAOYSA-N 2 1 315.436 4.378 20 0 DIADMP CC(F)(F)c1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000574469978 341759558 /nfs/dbraw/zinc/75/95/58/341759558.db2.gz WFTSCOHGYQHNDO-UHFFFAOYSA-N 2 1 322.443 4.295 20 0 DIADMP CC[C@@H]([NH2+]CCCn1cc[nH+]c1C)c1cccc(Cl)c1F ZINC000338013424 522834250 /nfs/dbraw/zinc/83/42/50/522834250.db2.gz RSPCTLJFIQZKHI-OAHLLOKOSA-N 2 1 309.816 4.115 20 0 DIADMP CSC1(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000368216733 525334615 /nfs/dbraw/zinc/33/46/15/525334615.db2.gz UANLNMCIXGERGQ-ZBFHGGJFSA-N 2 1 324.559 4.006 20 0 DIADMP CSC1(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CCC1 ZINC000368216733 525334626 /nfs/dbraw/zinc/33/46/26/525334626.db2.gz UANLNMCIXGERGQ-ZBFHGGJFSA-N 2 1 324.559 4.006 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000158651564 525461196 /nfs/dbraw/zinc/46/11/96/525461196.db2.gz FOHQHSLNNYYOSI-ROUUACIJSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000158651564 525461201 /nfs/dbraw/zinc/46/12/01/525461201.db2.gz FOHQHSLNNYYOSI-ROUUACIJSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)o1 ZINC000158142933 525739797 /nfs/dbraw/zinc/73/97/97/525739797.db2.gz DMYBHOXZQCZOQB-LSDHHAIUSA-N 2 1 309.413 4.494 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226326665 526045361 /nfs/dbraw/zinc/04/53/61/526045361.db2.gz ICLGBMMUXAAJND-NEPJUHHUSA-N 2 1 301.261 4.115 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]2C2CCC2)cc1 ZINC000337985663 527381815 /nfs/dbraw/zinc/38/18/15/527381815.db2.gz AOLOVCXNLQWILD-VHKYSDTDSA-N 2 1 309.457 4.410 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl ZINC000338009272 527422122 /nfs/dbraw/zinc/42/21/22/527422122.db2.gz TXMHWSQGTKECEU-FUHWJXTLSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC000338009274 527422691 /nfs/dbraw/zinc/42/26/91/527422691.db2.gz TXMHWSQGTKECEU-SJLPKXTDSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1 ZINC000338016101 527423091 /nfs/dbraw/zinc/42/30/91/527423091.db2.gz ZLMWABKKKXIHJR-LBPRGKRZSA-N 2 1 317.820 4.332 20 0 DIADMP Cc1cc2cc([C@H](C)[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)oc2cc1C ZINC000643546473 1035591312 /nfs/dbraw/zinc/59/13/12/1035591312.db2.gz PHGKQPQUMHPRAI-DOTOQJQBSA-N 2 1 312.457 4.375 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(-c2ccccc2)o1 ZINC000643546380 1035591591 /nfs/dbraw/zinc/59/15/91/1035591591.db2.gz NWARALHZFRESMD-RDJZCZTQSA-N 2 1 310.441 4.272 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1F ZINC000643547313 1035603208 /nfs/dbraw/zinc/60/32/08/1035603208.db2.gz CQRMCWOBABUDKS-IUODEOHRSA-N 2 1 310.844 4.195 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001206768716 1035660376 /nfs/dbraw/zinc/66/03/76/1035660376.db2.gz LUNPRKUFZYNNFP-CHWSQXEVSA-N 2 1 306.500 4.036 20 0 DIADMP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccco2)C1 ZINC000069708777 1035811106 /nfs/dbraw/zinc/81/11/06/1035811106.db2.gz DWJCBBUQNAYOST-IRXDYDNUSA-N 2 1 312.457 4.047 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000179398100 1035873006 /nfs/dbraw/zinc/87/30/06/1035873006.db2.gz BYQUQZMQMDCXPE-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000179398100 1035873023 /nfs/dbraw/zinc/87/30/23/1035873023.db2.gz BYQUQZMQMDCXPE-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](C2CC2)C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000705360871 1035882642 /nfs/dbraw/zinc/88/26/42/1035882642.db2.gz CERRPBNVWILJMS-HBGVWJBISA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](C2CC2)C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000705360871 1035882665 /nfs/dbraw/zinc/88/26/65/1035882665.db2.gz CERRPBNVWILJMS-HBGVWJBISA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC000314916498 1035930019 /nfs/dbraw/zinc/93/00/19/1035930019.db2.gz MLUXUGMOIVXOOP-MISYRCLQSA-N 2 1 300.490 4.033 20 0 DIADMP Fc1ccc(C2CC[NH+](CCC[NH+]3CCCCC3)CC2)c(F)c1 ZINC001209453352 1036193675 /nfs/dbraw/zinc/19/36/75/1036193675.db2.gz FNOADLYOPMRKDX-UHFFFAOYSA-N 2 1 322.443 4.020 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000109787888 1036220267 /nfs/dbraw/zinc/22/02/67/1036220267.db2.gz KFJUEXPPZSQVKZ-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000537952907 1036356186 /nfs/dbraw/zinc/35/61/86/1036356186.db2.gz XYBVSZBQKFMKFV-PXNSSMCTSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)o1 ZINC000237360783 1036366912 /nfs/dbraw/zinc/36/69/12/1036366912.db2.gz NSMVTUSSRXAKLQ-RYRKJORJSA-N 2 1 304.478 4.147 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cccc(Oc3ccccc3)c2)CC1(C)C ZINC001648802231 1036369916 /nfs/dbraw/zinc/36/99/16/1036369916.db2.gz AVPAVLOICVZELN-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cccc(Oc3ccccc3)c2)CC1(C)C ZINC001648802231 1036369934 /nfs/dbraw/zinc/36/99/34/1036369934.db2.gz AVPAVLOICVZELN-SFHVURJKSA-N 2 1 324.468 4.441 20 0 DIADMP C1C[C@H]2C[C@H]([NH2+]C3CCC(C4CCCCC4)CC3)CC[N@H+]2C1 ZINC000683471384 1036422868 /nfs/dbraw/zinc/42/28/68/1036422868.db2.gz HBSFVDZUHOCTJO-TUNPWDSISA-N 2 1 304.522 4.342 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000324627462 1036427792 /nfs/dbraw/zinc/42/77/92/1036427792.db2.gz PSOPVDBIFBAKOW-IERDGZPVSA-N 2 1 318.464 4.220 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CC[C@@H](C)SC2)CC1 ZINC000655715595 1036500459 /nfs/dbraw/zinc/50/04/59/1036500459.db2.gz MHNAUUORDCBPHQ-GJYPPUQNSA-N 2 1 318.530 4.086 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1Cl ZINC001648817062 1036575708 /nfs/dbraw/zinc/57/57/08/1036575708.db2.gz SHIPYNZYTAMACT-INIZCTEOSA-N 2 1 308.897 4.393 20 0 DIADMP CC(C)c1cccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC001648816647 1036575763 /nfs/dbraw/zinc/57/57/63/1036575763.db2.gz CHJXLMSABLBEJK-GOSISDBHSA-N 2 1 302.506 4.412 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c(Cl)c1 ZINC001648817195 1036579058 /nfs/dbraw/zinc/57/90/58/1036579058.db2.gz YIQMPLWRMQDEDL-MRXNPFEDSA-N 2 1 308.897 4.393 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001648832933 1036612115 /nfs/dbraw/zinc/61/21/15/1036612115.db2.gz SUISHBSZHGXQDA-UHFFFAOYSA-N 2 1 309.457 4.126 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(Cl)c(F)c1 ZINC000213739883 1036620015 /nfs/dbraw/zinc/62/00/15/1036620015.db2.gz ZOSYVKHLBIUAFY-GFCCVEGCSA-N 2 1 312.860 4.393 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC001648882415 1036669721 /nfs/dbraw/zinc/66/97/21/1036669721.db2.gz NDHOPNJDXQXHGH-HNNXBMFYSA-N 2 1 306.494 4.097 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC001648882416 1036670145 /nfs/dbraw/zinc/67/01/45/1036670145.db2.gz NDHOPNJDXQXHGH-OAHLLOKOSA-N 2 1 306.494 4.097 20 0 DIADMP COCCC1(C[NH2+]C[C@@]2([NH+](C)C)CCC[C@@H](C)C2)CCCCC1 ZINC001648895833 1036678698 /nfs/dbraw/zinc/67/86/98/1036678698.db2.gz ZREUMPKLFXRZIM-UYAOXDASSA-N 2 1 324.553 4.074 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H]2CCCC[C@H]2C)cc1F ZINC001648902910 1036682269 /nfs/dbraw/zinc/68/22/69/1036682269.db2.gz ARMJPDDPMBGDNV-PBHICJAKSA-N 2 1 315.436 4.236 20 0 DIADMP CCc1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001167321732 1036702768 /nfs/dbraw/zinc/70/27/68/1036702768.db2.gz JGQXSDLFUZCNBQ-IBGZPJMESA-N 2 1 314.517 4.337 20 0 DIADMP CC(C)(CC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)C1CC1 ZINC001167326593 1036741112 /nfs/dbraw/zinc/74/11/12/1036741112.db2.gz OFWNUMYGEMTYEE-SFHVURJKSA-N 2 1 306.538 4.401 20 0 DIADMP CC(C)(CC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)C1CC1 ZINC001167326592 1036742186 /nfs/dbraw/zinc/74/21/86/1036742186.db2.gz OFWNUMYGEMTYEE-GOSISDBHSA-N 2 1 306.538 4.401 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000539048773 1036787406 /nfs/dbraw/zinc/78/74/06/1036787406.db2.gz CWCJFYRIWNHQLL-JKSUJKDBSA-N 2 1 308.535 4.329 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC(C)(C)C1 ZINC000398014167 1037084050 /nfs/dbraw/zinc/08/40/50/1037084050.db2.gz FJPYLHDIXVHKNN-QRQLOZEOSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC(C)(C)C1 ZINC000398014167 1037084070 /nfs/dbraw/zinc/08/40/70/1037084070.db2.gz FJPYLHDIXVHKNN-QRQLOZEOSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398038580 1037104336 /nfs/dbraw/zinc/10/43/36/1037104336.db2.gz QXSYOUFZBGBRGA-NLWGTHIKSA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398038580 1037104345 /nfs/dbraw/zinc/10/43/45/1037104345.db2.gz QXSYOUFZBGBRGA-NLWGTHIKSA-N 2 1 302.506 4.169 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001167424233 1037225855 /nfs/dbraw/zinc/22/58/55/1037225855.db2.gz FDUZZPJIDIYLKQ-BRWVUGGUSA-N 2 1 316.480 4.254 20 0 DIADMP CC[C@H](CC(F)F)C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001167424233 1037225868 /nfs/dbraw/zinc/22/58/68/1037225868.db2.gz FDUZZPJIDIYLKQ-BRWVUGGUSA-N 2 1 316.480 4.254 20 0 DIADMP c1[nH+]c(C2CC[NH+]([C@@H]3CCc4ccccc43)CC2)n2c1CCCC2 ZINC000684004646 1037226136 /nfs/dbraw/zinc/22/61/36/1037226136.db2.gz AKLHHGDLTQDQNO-HXUWFJFHSA-N 2 1 321.468 4.086 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001167429134 1037245723 /nfs/dbraw/zinc/24/57/23/1037245723.db2.gz GVULMYQIGBNOLG-LJQANCHMSA-N 2 1 322.496 4.456 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000398189041 1037277335 /nfs/dbraw/zinc/27/73/35/1037277335.db2.gz MEPAYFOFOSLYPJ-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000398189041 1037277350 /nfs/dbraw/zinc/27/73/50/1037277350.db2.gz MEPAYFOFOSLYPJ-RLLQIKCJSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H](CSC)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000580824502 1037319664 /nfs/dbraw/zinc/31/96/64/1037319664.db2.gz UHXWWBOSWNRFHP-VIQWUECVSA-N 2 1 320.546 4.161 20 0 DIADMP Cc1ccc(N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)n1 ZINC000580979283 1037394323 /nfs/dbraw/zinc/39/43/23/1037394323.db2.gz PADJRARPRAFMIY-APWZRJJASA-N 2 1 309.457 4.021 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000580979382 1037394409 /nfs/dbraw/zinc/39/44/09/1037394409.db2.gz QHCJIPDLCCQJJR-VLGSPTGOSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C(C)=C\c1ccccc1 ZINC000580979382 1037394425 /nfs/dbraw/zinc/39/44/25/1037394425.db2.gz QHCJIPDLCCQJJR-VLGSPTGOSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000580979382 1037394438 /nfs/dbraw/zinc/39/44/38/1037394438.db2.gz QHCJIPDLCCQJJR-VLGSPTGOSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000580979380 1037394469 /nfs/dbraw/zinc/39/44/69/1037394469.db2.gz QHCJIPDLCCQJJR-FBMGVBCBSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C(C)=C/c1ccccc1 ZINC000580979380 1037394485 /nfs/dbraw/zinc/39/44/85/1037394485.db2.gz QHCJIPDLCCQJJR-FBMGVBCBSA-N 2 1 311.473 4.261 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000580979380 1037394501 /nfs/dbraw/zinc/39/45/01/1037394501.db2.gz QHCJIPDLCCQJJR-FBMGVBCBSA-N 2 1 311.473 4.261 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc3ccccc3s2)C1 ZINC000569347168 1037694699 /nfs/dbraw/zinc/69/46/99/1037694699.db2.gz PFRCVVRERWDSLX-MRXNPFEDSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC000569347168 1037694706 /nfs/dbraw/zinc/69/47/06/1037694706.db2.gz PFRCVVRERWDSLX-MRXNPFEDSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000569347168 1037694715 /nfs/dbraw/zinc/69/47/15/1037694715.db2.gz PFRCVVRERWDSLX-MRXNPFEDSA-N 2 1 314.498 4.065 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000581554134 1037731594 /nfs/dbraw/zinc/73/15/94/1037731594.db2.gz UOUJRTBWGUCPNW-SCWSEQNSSA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000581554134 1037731611 /nfs/dbraw/zinc/73/16/11/1037731611.db2.gz UOUJRTBWGUCPNW-SCWSEQNSSA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000581554133 1037732870 /nfs/dbraw/zinc/73/28/70/1037732870.db2.gz UOUJRTBWGUCPNW-NBHGPNQESA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000581554133 1037732885 /nfs/dbraw/zinc/73/28/85/1037732885.db2.gz UOUJRTBWGUCPNW-NBHGPNQESA-N 2 1 324.468 4.181 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477557 1037887355 /nfs/dbraw/zinc/88/73/55/1037887355.db2.gz GHEOGMNNRANONF-PXNSSMCTSA-N 2 1 311.473 4.134 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477557 1037887375 /nfs/dbraw/zinc/88/73/75/1037887375.db2.gz GHEOGMNNRANONF-PXNSSMCTSA-N 2 1 311.473 4.134 20 0 DIADMP CSCCCC[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000602556187 1038038168 /nfs/dbraw/zinc/03/81/68/1038038168.db2.gz JJHDDCNFECLFGD-HKUYNNGSSA-N 2 1 318.530 4.087 20 0 DIADMP CSCCCC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000602556187 1038038194 /nfs/dbraw/zinc/03/81/94/1038038194.db2.gz JJHDDCNFECLFGD-HKUYNNGSSA-N 2 1 318.530 4.087 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cnc2ccsc2c1 ZINC000126537488 1038106348 /nfs/dbraw/zinc/10/63/48/1038106348.db2.gz KNJMSDHDYNTLJV-ZDUSSCGKSA-N 2 1 317.502 4.210 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499147020 1038240892 /nfs/dbraw/zinc/24/08/92/1038240892.db2.gz ONLPRHOBCHNUOH-OWZKRDHZSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000604885064 1038462443 /nfs/dbraw/zinc/46/24/43/1038462443.db2.gz FFWWUABVLJJYNP-VAMGGRTRSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000604885064 1038462445 /nfs/dbraw/zinc/46/24/45/1038462445.db2.gz FFWWUABVLJJYNP-VAMGGRTRSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000604885064 1038462447 /nfs/dbraw/zinc/46/24/47/1038462447.db2.gz FFWWUABVLJJYNP-VAMGGRTRSA-N 2 1 314.517 4.377 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1 ZINC000707898412 1038498700 /nfs/dbraw/zinc/49/87/00/1038498700.db2.gz IPYHFWIPVATOLC-VAMGGRTRSA-N 2 1 321.468 4.021 20 0 DIADMP c1csc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)c1 ZINC000657294849 1038510669 /nfs/dbraw/zinc/51/06/69/1038510669.db2.gz GJWZMDNDYXCQBX-UHFFFAOYSA-N 2 1 312.482 4.132 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000606447736 1038603359 /nfs/dbraw/zinc/60/33/59/1038603359.db2.gz BJNWNSZUTLUYCO-FQEVSTJZSA-N 2 1 314.517 4.434 20 0 DIADMP CC(C)CCn1cccc1C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000606469317 1038607323 /nfs/dbraw/zinc/60/73/23/1038607323.db2.gz PPCONKHNRTXOLZ-IBGZPJMESA-N 2 1 319.537 4.278 20 0 DIADMP CC(C)CCC[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001167555121 1038613569 /nfs/dbraw/zinc/61/35/69/1038613569.db2.gz ZVYDJTINJJAKMZ-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)CCC[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001167555121 1038613570 /nfs/dbraw/zinc/61/35/70/1038613570.db2.gz ZVYDJTINJJAKMZ-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)CCC[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001167555121 1038613573 /nfs/dbraw/zinc/61/35/73/1038613573.db2.gz ZVYDJTINJJAKMZ-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([NH3+])C[C@H]3C)s2)cc1 ZINC000563350713 1038661464 /nfs/dbraw/zinc/66/14/64/1038661464.db2.gz QDUJNWQVGXSQON-GDBMZVCRSA-N 2 1 300.471 4.035 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000607358447 1038674924 /nfs/dbraw/zinc/67/49/24/1038674924.db2.gz DVTRYPSYLYZUIJ-OLZOCXBDSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000607358447 1038674930 /nfs/dbraw/zinc/67/49/30/1038674930.db2.gz DVTRYPSYLYZUIJ-OLZOCXBDSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000607358447 1038674932 /nfs/dbraw/zinc/67/49/32/1038674932.db2.gz DVTRYPSYLYZUIJ-OLZOCXBDSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000607358448 1038675028 /nfs/dbraw/zinc/67/50/28/1038675028.db2.gz DVTRYPSYLYZUIJ-QWHCGFSZSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000607358448 1038675034 /nfs/dbraw/zinc/67/50/34/1038675034.db2.gz DVTRYPSYLYZUIJ-QWHCGFSZSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000607358448 1038675039 /nfs/dbraw/zinc/67/50/39/1038675039.db2.gz DVTRYPSYLYZUIJ-QWHCGFSZSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000608061365 1038760524 /nfs/dbraw/zinc/76/05/24/1038760524.db2.gz RBELWGJWPYUHRT-KGLIPLIRSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000608061365 1038760529 /nfs/dbraw/zinc/76/05/29/1038760529.db2.gz RBELWGJWPYUHRT-KGLIPLIRSA-N 2 1 318.461 4.127 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)s2)cc1 ZINC000608061659 1038760856 /nfs/dbraw/zinc/76/08/56/1038760856.db2.gz XVPKYYUSVBKGEJ-NVXWUHKLSA-N 2 1 314.498 4.296 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H](C)C3)s2)cc1 ZINC000608061659 1038760860 /nfs/dbraw/zinc/76/08/60/1038760860.db2.gz XVPKYYUSVBKGEJ-NVXWUHKLSA-N 2 1 314.498 4.296 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)s2)cc1 ZINC000608061661 1038761504 /nfs/dbraw/zinc/76/15/04/1038761504.db2.gz XVPKYYUSVBKGEJ-WBVHZDCISA-N 2 1 314.498 4.296 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)s2)cc1 ZINC000608061661 1038761508 /nfs/dbraw/zinc/76/15/08/1038761508.db2.gz XVPKYYUSVBKGEJ-WBVHZDCISA-N 2 1 314.498 4.296 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000608061592 1038762042 /nfs/dbraw/zinc/76/20/42/1038762042.db2.gz ZJUQMEOIDQSMIR-CZUORRHYSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000608061592 1038762045 /nfs/dbraw/zinc/76/20/45/1038762045.db2.gz ZJUQMEOIDQSMIR-CZUORRHYSA-N 2 1 318.461 4.127 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC000608063179 1038762701 /nfs/dbraw/zinc/76/27/01/1038762701.db2.gz CDPQJHLESXKITO-QKNQBKEWSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H]2CCC[C@@H]21)C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564657 1038887508 /nfs/dbraw/zinc/88/75/08/1038887508.db2.gz YMUIVAWWYWCZAR-KNJMJIDISA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H](C[NH+]1CCC[C@@H]2CCC[C@@H]21)C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000608564657 1038887526 /nfs/dbraw/zinc/88/75/26/1038887526.db2.gz YMUIVAWWYWCZAR-KNJMJIDISA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H](C[NH+]1CCC[C@@H]2CCC[C@@H]21)C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000608564657 1038887549 /nfs/dbraw/zinc/88/75/49/1038887549.db2.gz YMUIVAWWYWCZAR-KNJMJIDISA-N 2 1 304.522 4.152 20 0 DIADMP Cc1nccn1CCC[N@@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000342858590 1038924646 /nfs/dbraw/zinc/92/46/46/1038924646.db2.gz BFBRMTKRNIHWOP-FQEVSTJZSA-N 2 1 309.457 4.124 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000342858590 1038924653 /nfs/dbraw/zinc/92/46/53/1038924653.db2.gz BFBRMTKRNIHWOP-FQEVSTJZSA-N 2 1 309.457 4.124 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000342858590 1038924669 /nfs/dbraw/zinc/92/46/69/1038924669.db2.gz BFBRMTKRNIHWOP-FQEVSTJZSA-N 2 1 309.457 4.124 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@]2(C)CC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000657670691 1038981533 /nfs/dbraw/zinc/98/15/33/1038981533.db2.gz NMJTZOOURUQGJZ-BPQIPLTHSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[C@]2(C)CC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000657670691 1038981553 /nfs/dbraw/zinc/98/15/53/1038981553.db2.gz NMJTZOOURUQGJZ-BPQIPLTHSA-N 2 1 322.443 4.065 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCSCc2ccccc2)C[C@@H]1C ZINC000534138982 1038992755 /nfs/dbraw/zinc/99/27/55/1038992755.db2.gz XKPRSTHLOYXUDK-HKUYNNGSSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCSCc2ccccc2)C[C@@H]1C ZINC000534138982 1038992770 /nfs/dbraw/zinc/99/27/70/1038992770.db2.gz XKPRSTHLOYXUDK-HKUYNNGSSA-N 2 1 320.546 4.115 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCSCc2ccccc2)C[C@@H]1C ZINC000534138982 1038992781 /nfs/dbraw/zinc/99/27/81/1038992781.db2.gz XKPRSTHLOYXUDK-HKUYNNGSSA-N 2 1 320.546 4.115 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH+]2CCC(Cc3ccccc3)CC2)c2ccccc21 ZINC000261618826 1039090398 /nfs/dbraw/zinc/09/03/98/1039090398.db2.gz BWTIBKQWHXCFSB-RTWAWAEBSA-N 2 1 306.453 4.086 20 0 DIADMP CC(C)COc1cccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000539409153 1039255936 /nfs/dbraw/zinc/25/59/36/1039255936.db2.gz USDLLIXYCKRMDC-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)COc1cccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000539409153 1039255950 /nfs/dbraw/zinc/25/59/50/1039255950.db2.gz USDLLIXYCKRMDC-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000539506985 1039276692 /nfs/dbraw/zinc/27/66/92/1039276692.db2.gz IQIXGVKNSNBWQF-OAHLLOKOSA-N 2 1 304.503 4.100 20 0 DIADMP CCCCCOc1ccc([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000539508780 1039282616 /nfs/dbraw/zinc/28/26/16/1039282616.db2.gz ZKMZYYPQQVALEK-QGZVFWFLSA-N 2 1 316.489 4.168 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)s1 ZINC000155811802 1039283835 /nfs/dbraw/zinc/28/38/35/1039283835.db2.gz SCQWEZYEFSABOY-CQSZACIVSA-N 2 1 311.539 4.173 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)CC[N@@H+]1C ZINC000539558575 1039289272 /nfs/dbraw/zinc/28/92/72/1039289272.db2.gz KOBOZIKTTJWHMK-OLMMMNRUSA-N 2 1 312.501 4.359 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)CC[N@H+]1C ZINC000539558575 1039289282 /nfs/dbraw/zinc/28/92/82/1039289282.db2.gz KOBOZIKTTJWHMK-OLMMMNRUSA-N 2 1 312.501 4.359 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2o1 ZINC000539556428 1039290930 /nfs/dbraw/zinc/29/09/30/1039290930.db2.gz DUQVTMLOMOQIPR-FOIQADDNSA-N 2 1 312.457 4.204 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000539817214 1039343612 /nfs/dbraw/zinc/34/36/12/1039343612.db2.gz BZFQVBKILOHYMU-IBGZPJMESA-N 2 1 324.468 4.397 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000539817214 1039343621 /nfs/dbraw/zinc/34/36/21/1039343621.db2.gz BZFQVBKILOHYMU-IBGZPJMESA-N 2 1 324.468 4.397 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CC3(CCC3)C2)[C@H]1c1cccs1 ZINC000448060844 1039343917 /nfs/dbraw/zinc/34/39/17/1039343917.db2.gz OYMSLZYCCOHXCX-PBHICJAKSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CC3(CCC3)C2)[C@H]1c1cccs1 ZINC000448060844 1039343930 /nfs/dbraw/zinc/34/39/30/1039343930.db2.gz OYMSLZYCCOHXCX-PBHICJAKSA-N 2 1 304.503 4.053 20 0 DIADMP Cc1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)o1 ZINC000539900229 1039385168 /nfs/dbraw/zinc/38/51/68/1039385168.db2.gz OOTNQRYRKVKIQD-FPOVZHCZSA-N 2 1 324.468 4.075 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000540083033 1039413969 /nfs/dbraw/zinc/41/39/69/1039413969.db2.gz IJYQOLCMYPJEIP-ZWKOTPCHSA-N 2 1 323.484 4.266 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000540083032 1039414649 /nfs/dbraw/zinc/41/46/49/1039414649.db2.gz IJYQOLCMYPJEIP-ROUUACIJSA-N 2 1 323.484 4.266 20 0 DIADMP C[C@H](CC1CC1)[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000540142648 1039425728 /nfs/dbraw/zinc/42/57/28/1039425728.db2.gz DDNMZIOGKCOCGX-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540150597 1039433128 /nfs/dbraw/zinc/43/31/28/1039433128.db2.gz GOTBCNYDGGPHJQ-IRXDYDNUSA-N 2 1 320.546 4.427 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccccc1Cl)C(C)C ZINC000540319339 1039473567 /nfs/dbraw/zinc/47/35/67/1039473567.db2.gz ZERAAWFPZRJVBK-KDOFPFPSSA-N 2 1 319.880 4.468 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000247883268 1039530952 /nfs/dbraw/zinc/53/09/52/1039530952.db2.gz CDJKADRKRXCEPK-DUXKGJEZSA-N 2 1 308.469 4.043 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000247883268 1039530962 /nfs/dbraw/zinc/53/09/62/1039530962.db2.gz CDJKADRKRXCEPK-DUXKGJEZSA-N 2 1 308.469 4.043 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000540653102 1039534587 /nfs/dbraw/zinc/53/45/87/1039534587.db2.gz QWGOEGDTNKNSCC-JXFKEZNVSA-N 2 1 314.473 4.451 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1cc2cnccc2o1 ZINC000657823923 1039586912 /nfs/dbraw/zinc/58/69/12/1039586912.db2.gz LVPUKSFSNGPPTC-INIZCTEOSA-N 2 1 323.440 4.001 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cc2cnccc2o1 ZINC000657823923 1039586919 /nfs/dbraw/zinc/58/69/19/1039586919.db2.gz LVPUKSFSNGPPTC-INIZCTEOSA-N 2 1 323.440 4.001 20 0 DIADMP CCc1ccc(CC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000541601812 1039715930 /nfs/dbraw/zinc/71/59/30/1039715930.db2.gz QJGCKEKIXSSDAV-PXNSSMCTSA-N 2 1 314.517 4.034 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccnc1 ZINC000541744395 1039738275 /nfs/dbraw/zinc/73/82/75/1039738275.db2.gz HDWILKBWFRQOMR-NSHGMRRFSA-N 2 1 317.521 4.271 20 0 DIADMP c1ccc2nc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc2c1 ZINC000541902277 1039758411 /nfs/dbraw/zinc/75/84/11/1039758411.db2.gz BWEMGDQSSFXZFP-UHFFFAOYSA-N 2 1 323.484 4.122 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915763 1039760224 /nfs/dbraw/zinc/76/02/24/1039760224.db2.gz ZBBIQHMLMQAWTA-CXAGYDPISA-N 2 1 312.860 4.108 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1F ZINC000541915763 1039760234 /nfs/dbraw/zinc/76/02/34/1039760234.db2.gz ZBBIQHMLMQAWTA-CXAGYDPISA-N 2 1 312.860 4.108 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H](C)CCc2cccc(F)c2)CC1 ZINC000542150324 1039801219 /nfs/dbraw/zinc/80/12/19/1039801219.db2.gz DKMLKOONEISJEG-KRWDZBQOSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](c2ccccc2OC)C2CCCC2)CC1 ZINC000091265300 1039838248 /nfs/dbraw/zinc/83/82/48/1039838248.db2.gz TUAPWPVYMTZDJY-HXUWFJFHSA-N 2 1 316.489 4.000 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]C[C@@]2(C)CCCS2)CC1 ZINC000628217231 1039968552 /nfs/dbraw/zinc/96/85/52/1039968552.db2.gz PGUXTPYAUKYRMJ-VQIMIIECSA-N 2 1 318.530 4.087 20 0 DIADMP C[C@@H](NC1CC[NH+](CCc2ccccc2)CC1)c1ccsc1 ZINC000171405371 1039997416 /nfs/dbraw/zinc/99/74/16/1039997416.db2.gz ASLPJPUFGHXROK-MRXNPFEDSA-N 2 1 314.498 4.106 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccsc1 ZINC000171405371 1039997429 /nfs/dbraw/zinc/99/74/29/1039997429.db2.gz ASLPJPUFGHXROK-MRXNPFEDSA-N 2 1 314.498 4.106 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCC(F)CC1 ZINC000647349370 1040024375 /nfs/dbraw/zinc/02/43/75/1040024375.db2.gz MHNJLIYNACLQAW-OQUMVOOASA-N 2 1 318.480 4.015 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C(C)(C)C(F)F ZINC000657889079 1040036435 /nfs/dbraw/zinc/03/64/35/1040036435.db2.gz PXOKJXNLFQZBGF-LSDHHAIUSA-N 2 1 324.459 4.481 20 0 DIADMP C[C@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCc3ccccc3CC2)C1 ZINC001648921154 1040053993 /nfs/dbraw/zinc/05/39/93/1040053993.db2.gz QOGJPVYOGLMBPA-KRWDZBQOSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCc3ccccc3CC2)C1 ZINC001648921154 1040054006 /nfs/dbraw/zinc/05/40/06/1040054006.db2.gz QOGJPVYOGLMBPA-KRWDZBQOSA-N 2 1 314.517 4.034 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000309684114 1040086153 /nfs/dbraw/zinc/08/61/53/1040086153.db2.gz BGLHJZPZFFIYRL-AOIWGVFYSA-N 2 1 312.457 4.149 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000309684114 1040086171 /nfs/dbraw/zinc/08/61/71/1040086171.db2.gz BGLHJZPZFFIYRL-AOIWGVFYSA-N 2 1 312.457 4.149 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1CCCC12CCC2 ZINC000708571055 1040087127 /nfs/dbraw/zinc/08/71/27/1040087127.db2.gz QBAHQPHIZZKVCJ-HOJAQTOUSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)C(C)(C)C(F)F ZINC000657900931 1040099086 /nfs/dbraw/zinc/09/90/86/1040099086.db2.gz UPDGAVBJZBTWQX-LSDHHAIUSA-N 2 1 312.448 4.166 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000685657923 1040198774 /nfs/dbraw/zinc/19/87/74/1040198774.db2.gz QCAMGROJWNLADG-QYZOEREBSA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000685657923 1040198782 /nfs/dbraw/zinc/19/87/82/1040198782.db2.gz QCAMGROJWNLADG-QYZOEREBSA-N 2 1 317.521 4.126 20 0 DIADMP CC(C[NH+]1CCC[C@@H]1C1CCC1)C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000605573266 1040243600 /nfs/dbraw/zinc/24/36/00/1040243600.db2.gz UGVDFCYUNCTGER-WOJBJXKFSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H](CC1CCC1)[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309741369 1040243960 /nfs/dbraw/zinc/24/39/60/1040243960.db2.gz RXEKMIUCYAFOIO-FXAWDEMLSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1 ZINC000658064698 1040287287 /nfs/dbraw/zinc/28/72/87/1040287287.db2.gz QDKSKZDRMNINLT-JKSUJKDBSA-N 2 1 320.440 4.030 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@]2(C)CC2(F)F)CC1 ZINC000658224738 1040366999 /nfs/dbraw/zinc/36/69/99/1040366999.db2.gz VNHSQNVUTYLPCW-DAWZGUTISA-N 2 1 322.443 4.065 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167685023 1040398512 /nfs/dbraw/zinc/39/85/12/1040398512.db2.gz HPKOJLIGQXLRTJ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167685023 1040398523 /nfs/dbraw/zinc/39/85/23/1040398523.db2.gz HPKOJLIGQXLRTJ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167685023 1040398534 /nfs/dbraw/zinc/39/85/34/1040398534.db2.gz HPKOJLIGQXLRTJ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC001167685023 1040398546 /nfs/dbraw/zinc/39/85/46/1040398546.db2.gz HPKOJLIGQXLRTJ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000280756449 1040721564 /nfs/dbraw/zinc/72/15/64/1040721564.db2.gz CEXRLOWLGZHXJC-KBAYOESNSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000280756449 1040721580 /nfs/dbraw/zinc/72/15/80/1040721580.db2.gz CEXRLOWLGZHXJC-KBAYOESNSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309811299 1040733276 /nfs/dbraw/zinc/73/32/76/1040733276.db2.gz WMQPYNWRFWXRLX-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCc4ccccc43)C2)cc1 ZINC000310074592 1040749944 /nfs/dbraw/zinc/74/99/44/1040749944.db2.gz FUWVUMCAKADQBW-SIKLNZKXSA-N 2 1 320.480 4.176 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+]Cc3ccccc3C3CC3)C2)cc1 ZINC000310069347 1040750493 /nfs/dbraw/zinc/75/04/93/1040750493.db2.gz CULGUGPKGYRNGU-LJQANCHMSA-N 2 1 320.480 4.176 20 0 DIADMP Clc1cccc([C@@H]2CC[C@@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)C2)c1 ZINC000414075129 1040825629 /nfs/dbraw/zinc/82/56/29/1040825629.db2.gz XJRGTGDPFYCDJO-YXJHDRRASA-N 2 1 318.892 4.050 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346508 1040906779 /nfs/dbraw/zinc/90/67/79/1040906779.db2.gz GVCBGZBDOOJJHD-PXNSSMCTSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1cccnc1 ZINC000282346508 1040906796 /nfs/dbraw/zinc/90/67/96/1040906796.db2.gz GVCBGZBDOOJJHD-PXNSSMCTSA-N 2 1 323.484 4.033 20 0 DIADMP Cc1cc(C(C)(C)C)cc(C)c1C[NH+]1CCC([NH+](C)C)CC1 ZINC000613417276 1040934246 /nfs/dbraw/zinc/93/42/46/1040934246.db2.gz KGKRBYFZLVBKRF-UHFFFAOYSA-N 2 1 302.506 4.127 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cc(Cl)sc1Cl ZINC000414168535 1040950819 /nfs/dbraw/zinc/95/08/19/1040950819.db2.gz AIUSIYLLICFEJC-WDEREUQCSA-N 2 1 321.317 4.437 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cc(Cl)sc1Cl ZINC000414168532 1040951698 /nfs/dbraw/zinc/95/16/98/1040951698.db2.gz AIUSIYLLICFEJC-GHMZBOCLSA-N 2 1 321.317 4.437 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000414172998 1040955020 /nfs/dbraw/zinc/95/50/20/1040955020.db2.gz FXWXOOSIAIBEFU-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000414175060 1040955644 /nfs/dbraw/zinc/95/56/44/1040955644.db2.gz IAQQKPCDWVPTDC-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000414172990 1040955987 /nfs/dbraw/zinc/95/59/87/1040955987.db2.gz FXWXOOSIAIBEFU-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000414175062 1040957902 /nfs/dbraw/zinc/95/79/02/1040957902.db2.gz IAQQKPCDWVPTDC-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000414179675 1040965591 /nfs/dbraw/zinc/96/55/91/1040965591.db2.gz LMTQDPXXWVFKCF-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccncc2)c1 ZINC000414183165 1040969473 /nfs/dbraw/zinc/96/94/73/1040969473.db2.gz NPOIBAQUFSCXDM-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000414188365 1040970659 /nfs/dbraw/zinc/97/06/59/1040970659.db2.gz QPABJJCHHNGHIZ-CVEARBPZSA-N 2 1 306.519 4.181 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000414194485 1040984226 /nfs/dbraw/zinc/98/42/26/1040984226.db2.gz UUSMVRVLUYJXOJ-HIFRSBDPSA-N 2 1 323.550 4.132 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCO[C@H]2CCCC[C@@H]2C)CC1 ZINC000613491441 1041001148 /nfs/dbraw/zinc/00/11/48/1041001148.db2.gz RTHBCEWYJMLLIK-ICSRJNTNSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000613491335 1041005354 /nfs/dbraw/zinc/00/53/54/1041005354.db2.gz OIQKAKIXXPHVGV-FLIBITNWSA-N 2 1 300.490 4.144 20 0 DIADMP CC(C)[NH+]1CCC(Nc2cc[nH+]c3cc(Cl)ccc23)CC1 ZINC000301074713 1041235939 /nfs/dbraw/zinc/23/59/39/1041235939.db2.gz XMMFSQBXGFJKEN-UHFFFAOYSA-N 2 1 303.837 4.173 20 0 DIADMP C[C@H](C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000809738641 1041240350 /nfs/dbraw/zinc/24/03/50/1041240350.db2.gz CRPVHVGVGCVVCA-MRXNPFEDSA-N 2 1 314.448 4.123 20 0 DIADMP CCCCCC[C@@H](CC)[NH+]1CCC([NH3+])(c2cccnc2)CC1 ZINC001170589762 1041274830 /nfs/dbraw/zinc/27/48/30/1041274830.db2.gz ANAHBXAPZDFVKG-GOSISDBHSA-N 2 1 303.494 4.080 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000624121327 1041336816 /nfs/dbraw/zinc/33/68/16/1041336816.db2.gz TZPKYLKXPQEJNN-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP CCCCCC[C@H](CC)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001170601979 1041367149 /nfs/dbraw/zinc/36/71/49/1041367149.db2.gz UXWMMBDIZKXCGL-AZUAARDMSA-N 2 1 324.553 4.311 20 0 DIADMP C[C@H](C1CC1)[NH+](C/C=C/C[N@H+]([C@@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615538 1041385113 /nfs/dbraw/zinc/38/51/13/1041385113.db2.gz BQCYIYVUHISCJG-ZOSBBBERSA-N 2 1 302.506 4.068 20 0 DIADMP C[C@H](C1CC1)[N@@H+](C/C=C/C[NH+]([C@@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615538 1041385126 /nfs/dbraw/zinc/38/51/26/1041385126.db2.gz BQCYIYVUHISCJG-ZOSBBBERSA-N 2 1 302.506 4.068 20 0 DIADMP C[C@H](C1CC1)[N@H+](C/C=C/C[NH+]([C@@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615538 1041385140 /nfs/dbraw/zinc/38/51/40/1041385140.db2.gz BQCYIYVUHISCJG-ZOSBBBERSA-N 2 1 302.506 4.068 20 0 DIADMP C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000309712037 1041591038 /nfs/dbraw/zinc/59/10/38/1041591038.db2.gz JQVXIZNJXFFEGY-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+](CC4CCCC4)C3)CC2)cc1 ZINC001170661430 1041593245 /nfs/dbraw/zinc/59/32/45/1041593245.db2.gz MNSBUTVYKREKMN-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP c1c[nH]c([C@H]2CCC[N@H+](C[C@@H]3CC[C@@H](c4ccccc4)C3)C2)n1 ZINC000660075646 1041600505 /nfs/dbraw/zinc/60/05/05/1041600505.db2.gz CHDVZWSVQDUHBR-QRQLOZEOSA-N 2 1 309.457 4.173 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+](CCC4CCC4)C3)CC2)cc1 ZINC001170668519 1041603344 /nfs/dbraw/zinc/60/33/44/1041603344.db2.gz DOQJLRYYINMEHK-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP CSc1cccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660258090 1041692194 /nfs/dbraw/zinc/69/21/94/1041692194.db2.gz ZWOPQBSHPHGBEN-RDJZCZTQSA-N 2 1 318.530 4.151 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000417872236 1041707629 /nfs/dbraw/zinc/70/76/29/1041707629.db2.gz NFMCPAFCFKLDGF-HOJAQTOUSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307865 1041708477 /nfs/dbraw/zinc/70/84/77/1041708477.db2.gz WWRYUABKGJLJGJ-HLRQEUIKSA-N 2 1 320.480 4.043 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307865 1041708482 /nfs/dbraw/zinc/70/84/82/1041708482.db2.gz WWRYUABKGJLJGJ-HLRQEUIKSA-N 2 1 320.480 4.043 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307872 1041709542 /nfs/dbraw/zinc/70/95/42/1041709542.db2.gz WWRYUABKGJLJGJ-ZHNGQKSSSA-N 2 1 320.480 4.043 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307872 1041709552 /nfs/dbraw/zinc/70/95/52/1041709552.db2.gz WWRYUABKGJLJGJ-ZHNGQKSSSA-N 2 1 320.480 4.043 20 0 DIADMP CC(C)(C)CC(C)(C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000390336029 1041713661 /nfs/dbraw/zinc/71/36/61/1041713661.db2.gz UFIKAOZTVRFIMZ-UHFFFAOYSA-N 2 1 316.533 4.498 20 0 DIADMP Clc1csc(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222166611 1041715084 /nfs/dbraw/zinc/71/50/84/1041715084.db2.gz ABLOXBBNFBXCJN-MRXNPFEDSA-N 2 1 312.910 4.147 20 0 DIADMP Clc1csc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222166611 1041715090 /nfs/dbraw/zinc/71/50/90/1041715090.db2.gz ABLOXBBNFBXCJN-MRXNPFEDSA-N 2 1 312.910 4.147 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc[nH]1 ZINC000925645333 1041720289 /nfs/dbraw/zinc/72/02/89/1041720289.db2.gz PJMHTQXZHGLZQS-OHSMVPPVSA-N 2 1 323.484 4.251 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813789784 1041732676 /nfs/dbraw/zinc/73/26/76/1041732676.db2.gz CURLXBVPKIBIMM-KXEVLKFVSA-N 2 1 312.501 4.350 20 0 DIADMP CCC[C@@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881378 1041742073 /nfs/dbraw/zinc/74/20/73/1041742073.db2.gz PKZKOFNFFDLKEW-VOBGVNJCSA-N 2 1 300.490 4.350 20 0 DIADMP CC(C)[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)CC1CC1 ZINC001167755595 1041755766 /nfs/dbraw/zinc/75/57/66/1041755766.db2.gz XMDPRRVOKJOHHL-UHFFFAOYSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001170720548 1041757916 /nfs/dbraw/zinc/75/79/16/1041757916.db2.gz MNPIKHGLBJPDIW-MTEHYEEQSA-N 2 1 312.501 4.064 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC[N@H+]1Cc1ccccc1 ZINC001170720548 1041757920 /nfs/dbraw/zinc/75/79/20/1041757920.db2.gz MNPIKHGLBJPDIW-MTEHYEEQSA-N 2 1 312.501 4.064 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc12 ZINC000364439477 1041790611 /nfs/dbraw/zinc/79/06/11/1041790611.db2.gz DZXFPKHNBNFTPQ-GVDBMIGSSA-N 2 1 324.468 4.126 20 0 DIADMP CC1(C)[C@@H]2C[C@@H]([NH2+]C3(C)CC[NH+](Cc4ccccc4)CC3)C[C@@H]21 ZINC001170736039 1041800114 /nfs/dbraw/zinc/80/01/14/1041800114.db2.gz DLBMJXIALSZAID-LDLYASANSA-N 2 1 312.501 4.065 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)cc1 ZINC000652136356 1041845377 /nfs/dbraw/zinc/84/53/77/1041845377.db2.gz MSEIFBAQEVMOIZ-LJQANCHMSA-N 2 1 304.453 4.129 20 0 DIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1cccs1 ZINC000123932154 1041891690 /nfs/dbraw/zinc/89/16/90/1041891690.db2.gz SBVCPRHUWDTYLE-QGZVFWFLSA-N 2 1 302.487 4.441 20 0 DIADMP C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(-c2ccccc2)cn1 ZINC000651822761 1041924388 /nfs/dbraw/zinc/92/43/88/1041924388.db2.gz JOWDYXSRDXVFEY-MIJOPJBOSA-N 2 1 321.468 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000164625007 1042025757 /nfs/dbraw/zinc/02/57/57/1042025757.db2.gz DPJDVJTYSLXBQH-SWLSCSKDSA-N 2 1 321.515 4.248 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000245744732 1042059054 /nfs/dbraw/zinc/05/90/54/1042059054.db2.gz SKGAHRLDEZLXIN-OWYHZJEWSA-N 2 1 300.490 4.206 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([NH2+]C[C@H]3CCC[N@@H+](CC4CC4)C3)C2)cc1 ZINC000663344062 1042126181 /nfs/dbraw/zinc/12/61/81/1042126181.db2.gz NHZAZFMBYZZHMX-NRSPTQNISA-N 2 1 312.501 4.034 20 0 DIADMP CCC(CC)(C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1 ZINC000663353851 1042130711 /nfs/dbraw/zinc/13/07/11/1042130711.db2.gz DMWSYDMQDLIOJJ-MOPGFXCFSA-N 2 1 318.480 4.100 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463782 1042177138 /nfs/dbraw/zinc/17/71/38/1042177138.db2.gz BKHWIFSGHHROOR-YLJYHZDGSA-N 2 1 316.489 4.141 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)C2CCC2)o1 ZINC000663463782 1042177140 /nfs/dbraw/zinc/17/71/40/1042177140.db2.gz BKHWIFSGHHROOR-YLJYHZDGSA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2c(s1)CCC2 ZINC000663467932 1042179331 /nfs/dbraw/zinc/17/93/31/1042179331.db2.gz IOYAUAUUHHWZOC-HOCLYGCPSA-N 2 1 318.530 4.009 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472209 1042182950 /nfs/dbraw/zinc/18/29/50/1042182950.db2.gz ZSQVJPKNOWOHQV-FUHWJXTLSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472209 1042182956 /nfs/dbraw/zinc/18/29/56/1042182956.db2.gz ZSQVJPKNOWOHQV-FUHWJXTLSA-N 2 1 323.484 4.007 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001167825837 1042214739 /nfs/dbraw/zinc/21/47/39/1042214739.db2.gz KZDSXNMZYWOIQF-QUCCMNQESA-N 2 1 318.505 4.040 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc2ccccc2s1 ZINC000278924061 1042216056 /nfs/dbraw/zinc/21/60/56/1042216056.db2.gz IFHBLWMJRQKXMO-KBPBESRZSA-N 2 1 311.454 4.011 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001167827267 1042218534 /nfs/dbraw/zinc/21/85/34/1042218534.db2.gz VKLCJNKVBVJIKQ-INIZCTEOSA-N 2 1 310.913 4.325 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1ccccc1OC ZINC001167827428 1042219123 /nfs/dbraw/zinc/21/91/23/1042219123.db2.gz VUHWDNMAZSFDOX-PKOBYXMFSA-N 2 1 318.505 4.343 20 0 DIADMP C[C@@H]([NH2+]CCCc1c[nH+]cn1C)c1ccc(Cl)cc1Cl ZINC000313881454 1042220578 /nfs/dbraw/zinc/22/05/78/1042220578.db2.gz AQJUEGUUKIBPIP-LLVKDONJSA-N 2 1 312.244 4.010 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000643522254 1042221408 /nfs/dbraw/zinc/22/14/08/1042221408.db2.gz KNSMXAXLFKUWPV-ONGXEEELSA-N 2 1 319.301 4.164 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000643521703 1042222537 /nfs/dbraw/zinc/22/25/37/1042222537.db2.gz XQKBNJLKNZKRNR-NXEZZACHSA-N 2 1 321.679 4.440 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H]1c1cccc(OC)c1 ZINC001167837481 1042249471 /nfs/dbraw/zinc/24/94/71/1042249471.db2.gz LIXACRFNKPSNSG-FXAWDEMLSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCc2c(Cl)cccc2C1 ZINC001167839403 1042249955 /nfs/dbraw/zinc/24/99/55/1042249955.db2.gz XPOQPKKOFBULFX-OAHLLOKOSA-N 2 1 308.897 4.209 20 0 DIADMP CC1(C)CC([NH2+]Cc2ccc(Cl)cc2Cl)CC(C)(C)[NH2+]1 ZINC000021803362 1042325532 /nfs/dbraw/zinc/32/55/32/1042325532.db2.gz BTODVJPXICQCON-UHFFFAOYSA-N 2 1 315.288 4.392 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000391414391 1042354613 /nfs/dbraw/zinc/35/46/13/1042354613.db2.gz XBXHXQSVFZYOMV-JKSUJKDBSA-N 2 1 314.473 4.348 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000391414391 1042354618 /nfs/dbraw/zinc/35/46/18/1042354618.db2.gz XBXHXQSVFZYOMV-JKSUJKDBSA-N 2 1 314.473 4.348 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000391414378 1042354813 /nfs/dbraw/zinc/35/48/13/1042354813.db2.gz XBXHXQSVFZYOMV-CVEARBPZSA-N 2 1 314.473 4.348 20 0 DIADMP CCCCc1oc2ccccc2c1C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000391414378 1042354818 /nfs/dbraw/zinc/35/48/18/1042354818.db2.gz XBXHXQSVFZYOMV-CVEARBPZSA-N 2 1 314.473 4.348 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)C1 ZINC000391478030 1042373794 /nfs/dbraw/zinc/37/37/94/1042373794.db2.gz XKHNXXJHLYUFCI-YHELAOLJSA-N 2 1 314.517 4.279 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000237536958 1042378060 /nfs/dbraw/zinc/37/80/60/1042378060.db2.gz VJYUNLGFJKDOFQ-AQRXXJNJSA-N 2 1 300.490 4.192 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)C1 ZINC000540989839 1042396341 /nfs/dbraw/zinc/39/63/41/1042396341.db2.gz XJFRINQGYYFQRI-SUMWQHHRSA-N 2 1 312.860 4.108 20 0 DIADMP Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[NH+](C)[C@@H](C)C1 ZINC000246101542 1042408388 /nfs/dbraw/zinc/40/83/88/1042408388.db2.gz LNOKQYWPXXVYIL-BZSNNMDCSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[NH+](C)[C@@H](C)C1 ZINC000246101542 1042408393 /nfs/dbraw/zinc/40/83/93/1042408393.db2.gz LNOKQYWPXXVYIL-BZSNNMDCSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000246101542 1042408396 /nfs/dbraw/zinc/40/83/96/1042408396.db2.gz LNOKQYWPXXVYIL-BZSNNMDCSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000246101542 1042408399 /nfs/dbraw/zinc/40/83/99/1042408399.db2.gz LNOKQYWPXXVYIL-BZSNNMDCSA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cccc(C[N@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)n1 ZINC000411396439 1042443125 /nfs/dbraw/zinc/44/31/25/1042443125.db2.gz XHZUGMHFCSYFRI-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP Cc1cccc(C[N@@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)n1 ZINC000411396439 1042443131 /nfs/dbraw/zinc/44/31/31/1042443131.db2.gz XHZUGMHFCSYFRI-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP CCc1ccc([C@@H]2CCC[N@H+](CCCn3cc[nH+]c3C)C2)cc1 ZINC000513371922 1042537069 /nfs/dbraw/zinc/53/70/69/1042537069.db2.gz QZOWOUHWZVOZSM-HXUWFJFHSA-N 2 1 311.473 4.024 20 0 DIADMP CCc1ccc([C@@H]2CCC[N@@H+](CCCn3cc[nH+]c3C)C2)cc1 ZINC000513371922 1042537074 /nfs/dbraw/zinc/53/70/74/1042537074.db2.gz QZOWOUHWZVOZSM-HXUWFJFHSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1ccccc1C[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513461794 1042544187 /nfs/dbraw/zinc/54/41/87/1042544187.db2.gz PUEKEFNFSSNIHX-UHFFFAOYSA-N 2 1 308.469 4.091 20 0 DIADMP Cc1ccccc1C[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000513461794 1042544189 /nfs/dbraw/zinc/54/41/89/1042544189.db2.gz PUEKEFNFSSNIHX-UHFFFAOYSA-N 2 1 308.469 4.091 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000513494120 1042547028 /nfs/dbraw/zinc/54/70/28/1042547028.db2.gz GEBKAWBLIYMRKX-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000513493470 1042547405 /nfs/dbraw/zinc/54/74/05/1042547405.db2.gz BAORHFPSKALTLP-BWPNAZKDSA-N 2 1 300.490 4.065 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000513495766 1042547827 /nfs/dbraw/zinc/54/78/27/1042547827.db2.gz UWPYXYVJKQZXMN-QVLZNTHTSA-N 2 1 318.892 4.348 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2ccccc2)C[N@H+]1Cc1ccccc1 ZINC000513511153 1042550107 /nfs/dbraw/zinc/55/01/07/1042550107.db2.gz HTZKHNVVQVDPEE-GHTZIAJQSA-N 2 1 308.469 4.077 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]C2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC000513545419 1042551943 /nfs/dbraw/zinc/55/19/43/1042551943.db2.gz QQGQINLDFJKZHC-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP Clc1cccc(CCN2CCC(n3ccnc3)CC2)c1Cl ZINC000280073816 1042563654 /nfs/dbraw/zinc/56/36/54/1042563654.db2.gz QQCXXUDRXFPXGQ-UHFFFAOYSA-N 2 1 324.255 4.070 20 0 DIADMP c1c2ccccc2[nH]c1[C@H]1CCCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420307650 1042599122 /nfs/dbraw/zinc/59/91/22/1042599122.db2.gz RPVSTQCPBKQUCE-OXJNMPFZSA-N 2 1 311.473 4.085 20 0 DIADMP Cc1ccc(N2CCC([NH2+]C3CC4(C3)CCCCC4)CC2)[nH+]c1 ZINC000421364241 1042632722 /nfs/dbraw/zinc/63/27/22/1042632722.db2.gz NSRLMDUNBKFILI-UHFFFAOYSA-N 2 1 313.489 4.061 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)[C@H]1CCC[NH2+]C1 ZINC000422770346 1042689741 /nfs/dbraw/zinc/68/97/41/1042689741.db2.gz WFASQVIHRIAXGV-WOPDTQHZSA-N 2 1 301.261 4.032 20 0 DIADMP Cc1[nH]c2ccc(C[NH2+][C@H]3C[C@H]([NH3+])c4ccccc43)cc2c1C ZINC000422724031 1042689201 /nfs/dbraw/zinc/68/92/01/1042689201.db2.gz UDWWRDKMEFFDBI-ICSRJNTNSA-N 2 1 305.425 4.019 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccc(OC(F)F)cc1 ZINC000422800517 1042691075 /nfs/dbraw/zinc/69/10/75/1042691075.db2.gz CBVFIIYIDWMZRE-MZPVMMEZSA-N 2 1 318.367 4.083 20 0 DIADMP C[C@H]([NH2+][C@@H](c1ccccc1)c1ccc2ccccc2c1)C1C[NH2+]C1 ZINC000422904606 1042692200 /nfs/dbraw/zinc/69/22/00/1042692200.db2.gz HBXKDGRJFHEWRR-AOMKIAJQSA-N 2 1 316.448 4.127 20 0 DIADMP C[C@@H]([NH2+][C@H](c1ccccc1)c1ccc2ccccc2c1)C1C[NH2+]C1 ZINC000422904611 1042692518 /nfs/dbraw/zinc/69/25/18/1042692518.db2.gz HBXKDGRJFHEWRR-OPAMFIHVSA-N 2 1 316.448 4.127 20 0 DIADMP Cc1ccccc1C([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1C ZINC000423041683 1042695944 /nfs/dbraw/zinc/69/59/44/1042695944.db2.gz XROQOQMASLHZAS-DFNIBXOVSA-N 2 1 320.480 4.265 20 0 DIADMP Cc1cccc(C)c1[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000423040373 1042696417 /nfs/dbraw/zinc/69/64/17/1042696417.db2.gz UANVYENSFTWFCR-YSIASYRMSA-N 2 1 308.469 4.447 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(Cl)c(Cl)c1Cl ZINC000423210047 1042699254 /nfs/dbraw/zinc/69/92/54/1042699254.db2.gz JMNGMNXDDHJJGF-VHSXEESVSA-N 2 1 321.679 4.297 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@@H]2[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000423202677 1042700233 /nfs/dbraw/zinc/70/02/33/1042700233.db2.gz BMILVQLECJMCOG-KOLCDFICSA-N 2 1 319.301 4.022 20 0 DIADMP C[C@@H]([NH2+][C@H](C[NH3+])C1CCCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423501058 1042715789 /nfs/dbraw/zinc/71/57/89/1042715789.db2.gz KWONXVWQGFZTFN-YXCITZCRSA-N 2 1 312.910 4.001 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167956399 1042780002 /nfs/dbraw/zinc/78/00/02/1042780002.db2.gz PLKZYBYRLZUYSP-MNZLEMJZSA-N 2 1 318.892 4.035 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+]([C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167956399 1042780009 /nfs/dbraw/zinc/78/00/09/1042780009.db2.gz PLKZYBYRLZUYSP-MNZLEMJZSA-N 2 1 318.892 4.035 20 0 DIADMP FC1(F)CCC[C@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000282147993 1042783589 /nfs/dbraw/zinc/78/35/89/1042783589.db2.gz WSHKEZOVJQSHCB-KRWDZBQOSA-N 2 1 322.443 4.066 20 0 DIADMP c1ccc2c(c1)CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167959025 1042802259 /nfs/dbraw/zinc/80/22/59/1042802259.db2.gz NEJWOCOYDBWUDO-SMLSOGCJSA-N 2 1 310.485 4.059 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000261938828 1042847391 /nfs/dbraw/zinc/84/73/91/1042847391.db2.gz UMQGKOQBCYNSBW-DFNIBXOVSA-N 2 1 322.452 4.194 20 0 DIADMP C[C@]1(C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@@H+](Cc2ccccc2)C1 ZINC000712458637 1042852009 /nfs/dbraw/zinc/85/20/09/1042852009.db2.gz VUTASKLGHOINHS-UWHLTILDSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@@H+]1Cc1ccccc1 ZINC000712517553 1042862222 /nfs/dbraw/zinc/86/22/22/1042862222.db2.gz NPPQEFGYPAFXPC-KPACCLEDSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)CC[N@H+]1Cc1ccccc1 ZINC000712517553 1042862227 /nfs/dbraw/zinc/86/22/27/1042862227.db2.gz NPPQEFGYPAFXPC-KPACCLEDSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000517068692 1042866287 /nfs/dbraw/zinc/86/62/87/1042866287.db2.gz NTOXCGFIPIBQMY-QAPCUYQASA-N 2 1 306.519 4.066 20 0 DIADMP CS[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)C(C)(C)C ZINC000517187492 1042870501 /nfs/dbraw/zinc/87/05/01/1042870501.db2.gz KJHLQDYKAVGZGW-FGTMMUONSA-N 2 1 320.546 4.189 20 0 DIADMP CS[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)C(C)(C)C ZINC000517187492 1042870505 /nfs/dbraw/zinc/87/05/05/1042870505.db2.gz KJHLQDYKAVGZGW-FGTMMUONSA-N 2 1 320.546 4.189 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000517205132 1042871849 /nfs/dbraw/zinc/87/18/49/1042871849.db2.gz NMBYQIYSGCKCKL-BEFAXECRSA-N 2 1 304.453 4.080 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000517205132 1042871852 /nfs/dbraw/zinc/87/18/52/1042871852.db2.gz NMBYQIYSGCKCKL-BEFAXECRSA-N 2 1 304.453 4.080 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)cs2)cs1 ZINC000425947642 1042883193 /nfs/dbraw/zinc/88/31/93/1042883193.db2.gz VVMNKOMABQIBDM-NEPJUHHUSA-N 2 1 323.531 4.028 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]C3CC[NH+](C4CCC4)CC3)oc2c1 ZINC000425959872 1042887818 /nfs/dbraw/zinc/88/78/18/1042887818.db2.gz UXXGVVDEURHCGU-OAHLLOKOSA-N 2 1 312.457 4.409 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)cc1 ZINC001167964507 1042919372 /nfs/dbraw/zinc/91/93/72/1042919372.db2.gz RJWPQDOPFDVVPO-RAFMOHDBSA-N 2 1 316.464 4.272 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cccc(C)c1 ZINC001167967931 1042955962 /nfs/dbraw/zinc/95/59/62/1042955962.db2.gz LOZHFKCSBTWVHT-OTYNDTSQSA-N 2 1 312.501 4.441 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1C ZINC001167969481 1042960361 /nfs/dbraw/zinc/96/03/61/1042960361.db2.gz CRYUSFHSHYLZNL-BRIRTLKKSA-N 2 1 312.501 4.359 20 0 DIADMP c1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CCC2)cc1 ZINC001167970919 1042961992 /nfs/dbraw/zinc/96/19/92/1042961992.db2.gz QBKOKIFOFIYBEK-IHWFROFDSA-N 2 1 310.485 4.061 20 0 DIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccccc1F ZINC001167973777 1042966871 /nfs/dbraw/zinc/96/68/71/1042966871.db2.gz NNFMGAUNORUXII-ALOPSCKCSA-N 2 1 316.464 4.056 20 0 DIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccc1F ZINC001167973777 1042966874 /nfs/dbraw/zinc/96/68/74/1042966874.db2.gz NNFMGAUNORUXII-ALOPSCKCSA-N 2 1 316.464 4.056 20 0 DIADMP CCCC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167974368 1042967264 /nfs/dbraw/zinc/96/72/64/1042967264.db2.gz YBLHMKKJNATGSR-ZHNYMBGRSA-N 2 1 304.522 4.340 20 0 DIADMP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)CC1CCC1 ZINC001167975639 1042971545 /nfs/dbraw/zinc/97/15/45/1042971545.db2.gz SUQOQEYQUILRQL-YQQQUEKLSA-N 2 1 304.522 4.198 20 0 DIADMP C[C@@H]([NH3+])c1cn(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc12 ZINC001167981863 1042975009 /nfs/dbraw/zinc/97/50/09/1042975009.db2.gz NNQNNASEFXWMJN-NAZJXLNTSA-N 2 1 323.484 4.239 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cccc(-c3ccccc3C)c2)C1 ZINC000520202504 1043023395 /nfs/dbraw/zinc/02/33/95/1043023395.db2.gz MMKXWUXSYNSLJP-HXUWFJFHSA-N 2 1 322.496 4.484 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2cccc(C)c2)CC1 ZINC000441201774 1043026931 /nfs/dbraw/zinc/02/69/31/1043026931.db2.gz DPRXETQFANCKIU-GOSISDBHSA-N 2 1 302.506 4.500 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2cccc(C)c2)CC1 ZINC000441201775 1043027098 /nfs/dbraw/zinc/02/70/98/1043027098.db2.gz DPRXETQFANCKIU-SFHVURJKSA-N 2 1 302.506 4.500 20 0 DIADMP CC[C@@H]1C[N@@H+](CCCn2ccnc2C)CC[C@@H]1c1ccccc1 ZINC000441319528 1043035508 /nfs/dbraw/zinc/03/55/08/1043035508.db2.gz VUALBAFZFHBQIT-QUCCMNQESA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@@H]1C[N@H+](CCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000441319528 1043035513 /nfs/dbraw/zinc/03/55/13/1043035513.db2.gz VUALBAFZFHBQIT-QUCCMNQESA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@@H]1C[N@@H+](CCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000441319528 1043035522 /nfs/dbraw/zinc/03/55/22/1043035522.db2.gz VUALBAFZFHBQIT-QUCCMNQESA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441411728 1043044563 /nfs/dbraw/zinc/04/45/63/1043044563.db2.gz HDWVUWASFNCXOC-PWIZWCRZSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441411728 1043044570 /nfs/dbraw/zinc/04/45/70/1043044570.db2.gz HDWVUWASFNCXOC-PWIZWCRZSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441411728 1043044574 /nfs/dbraw/zinc/04/45/74/1043044574.db2.gz HDWVUWASFNCXOC-PWIZWCRZSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441411728 1043044582 /nfs/dbraw/zinc/04/45/82/1043044582.db2.gz HDWVUWASFNCXOC-PWIZWCRZSA-N 2 1 316.464 4.226 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000112537903 1043048550 /nfs/dbraw/zinc/04/85/50/1043048550.db2.gz WECVGUHWMZLCFM-HXUWFJFHSA-N 2 1 300.490 4.083 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000112537903 1043048561 /nfs/dbraw/zinc/04/85/61/1043048561.db2.gz WECVGUHWMZLCFM-HXUWFJFHSA-N 2 1 300.490 4.083 20 0 DIADMP CC(C)[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)cc1F ZINC000541917377 1043053148 /nfs/dbraw/zinc/05/31/48/1043053148.db2.gz LWVWCTNJJLQWCC-QGZVFWFLSA-N 2 1 310.844 4.028 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000794827912 1043067135 /nfs/dbraw/zinc/06/71/35/1043067135.db2.gz MBGRMVYOVVQCOX-KNQAVFIVSA-N 2 1 320.480 4.094 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CC[C@@H](C3CCCCC3)C1)C2 ZINC001167994763 1043067999 /nfs/dbraw/zinc/06/79/99/1043067999.db2.gz NSTOQEHWAZWYSF-MQEZQYLSSA-N 2 1 316.533 4.294 20 0 DIADMP c1ccc2cc(CC[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000441446831 1043118730 /nfs/dbraw/zinc/11/87/30/1043118730.db2.gz JJZKFXPTQBWIQD-FQEVSTJZSA-N 2 1 322.496 4.190 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2ccccc2n1 ZINC000178294745 1043125621 /nfs/dbraw/zinc/12/56/21/1043125621.db2.gz YLYWXICTMZVSNT-MRXNPFEDSA-N 2 1 323.484 4.292 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1F ZINC000178699444 1043136934 /nfs/dbraw/zinc/13/69/34/1043136934.db2.gz FKTSOLCNEWGKQV-STQMWFEESA-N 2 1 321.465 4.039 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1oc2ccccc2c1C ZINC000178785365 1043137005 /nfs/dbraw/zinc/13/70/05/1043137005.db2.gz CVDYXPRXBUOJQV-OAHLLOKOSA-N 2 1 311.429 4.377 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(Cl)nc1 ZINC000179135659 1043143289 /nfs/dbraw/zinc/14/32/89/1043143289.db2.gz WSZYFGRKSSEYSL-CQSZACIVSA-N 2 1 321.896 4.183 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183999733 1043177210 /nfs/dbraw/zinc/17/72/10/1043177210.db2.gz FTMWBLRKQZVZFY-RHSMWYFYSA-N 2 1 322.443 4.367 20 0 DIADMP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382370 1043185387 /nfs/dbraw/zinc/18/53/87/1043185387.db2.gz JYROJYYUEKRLHW-LVCYWYKZSA-N 2 1 323.484 4.094 20 0 DIADMP Cc1cncc([C@H](C)[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000184382370 1043185390 /nfs/dbraw/zinc/18/53/90/1043185390.db2.gz JYROJYYUEKRLHW-LVCYWYKZSA-N 2 1 323.484 4.094 20 0 DIADMP CC1(C)C[N@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)Cc2ccccc21 ZINC001168003735 1043224758 /nfs/dbraw/zinc/22/47/58/1043224758.db2.gz QHGVGKWMKKIBII-YOFSQIOKSA-N 2 1 324.512 4.185 20 0 DIADMP CC1(C)C[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)Cc2ccccc21 ZINC001168003735 1043224767 /nfs/dbraw/zinc/22/47/67/1043224767.db2.gz QHGVGKWMKKIBII-YOFSQIOKSA-N 2 1 324.512 4.185 20 0 DIADMP CC1(C)C[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)Cc2ccccc21 ZINC001168003735 1043224774 /nfs/dbraw/zinc/22/47/74/1043224774.db2.gz QHGVGKWMKKIBII-YOFSQIOKSA-N 2 1 324.512 4.185 20 0 DIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]CCC[N@@H+](C)C(C)C)CCS2 ZINC000427611575 1043246004 /nfs/dbraw/zinc/24/60/04/1043246004.db2.gz GSSZVOXJHNUWQW-KRWDZBQOSA-N 2 1 306.519 4.160 20 0 DIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]CCC[N@H+](C)C(C)C)CCS2 ZINC000427611575 1043246015 /nfs/dbraw/zinc/24/60/15/1043246015.db2.gz GSSZVOXJHNUWQW-KRWDZBQOSA-N 2 1 306.519 4.160 20 0 DIADMP C[C@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1cccnc1 ZINC001168007006 1043259100 /nfs/dbraw/zinc/25/91/00/1043259100.db2.gz QKSVCTOBDVDLRT-KURKYZTESA-N 2 1 323.484 4.174 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC000192607653 1043273390 /nfs/dbraw/zinc/27/33/90/1043273390.db2.gz LFEXHVNDQYHAII-HQSKLWIPSA-N 2 1 304.865 4.006 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000268884796 1043340342 /nfs/dbraw/zinc/34/03/42/1043340342.db2.gz SGFOOBCOJNQFDD-OAHLLOKOSA-N 2 1 321.877 4.062 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCC(F)(F)F)cc1 ZINC000268983734 1043346194 /nfs/dbraw/zinc/34/61/94/1043346194.db2.gz PJTUUGIOFWORLU-LBPRGKRZSA-N 2 1 311.351 4.174 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(C)CCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168013727 1043373409 /nfs/dbraw/zinc/37/34/09/1043373409.db2.gz IXFOIQTTZJPFQQ-IZZQQSIFSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]([NH2+]C1CCC(C(F)F)CC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000442839796 1043434683 /nfs/dbraw/zinc/43/46/83/1043434683.db2.gz YEPOLZCPJMAHAK-UIDBIOKJSA-N 2 1 314.464 4.053 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000442854771 1043443735 /nfs/dbraw/zinc/44/37/35/1043443735.db2.gz JBTKAPHJHOILIH-HOTGVXAUSA-N 2 1 306.519 4.324 20 0 DIADMP FC(F)C1CCC([NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)CC1 ZINC000442857184 1043446372 /nfs/dbraw/zinc/44/63/72/1043446372.db2.gz PHIILJWSHJRRMM-VMBOVVBDSA-N 2 1 314.464 4.197 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+]([C@@H]2C=CCCCCC2)CC1 ZINC000339133577 1043454816 /nfs/dbraw/zinc/45/48/16/1043454816.db2.gz ZMAFWUHHFXFFHY-QGZVFWFLSA-N 2 1 300.446 4.122 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000521695256 1043455894 /nfs/dbraw/zinc/45/58/94/1043455894.db2.gz NMBYQIYSGCKCKL-KXBFYZLASA-N 2 1 304.453 4.080 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000521695256 1043455905 /nfs/dbraw/zinc/45/59/05/1043455905.db2.gz NMBYQIYSGCKCKL-KXBFYZLASA-N 2 1 304.453 4.080 20 0 DIADMP CCCOc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000521818210 1043485460 /nfs/dbraw/zinc/48/54/60/1043485460.db2.gz BGZURDFTWMAOKD-SFHVURJKSA-N 2 1 318.505 4.220 20 0 DIADMP Cc1nccn1CCC[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000349384416 1043506015 /nfs/dbraw/zinc/50/60/15/1043506015.db2.gz NYQPVLPPWFYHFB-UHFFFAOYSA-N 2 1 317.820 4.113 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000349384416 1043506031 /nfs/dbraw/zinc/50/60/31/1043506031.db2.gz NYQPVLPPWFYHFB-UHFFFAOYSA-N 2 1 317.820 4.113 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000349403051 1043508847 /nfs/dbraw/zinc/50/88/47/1043508847.db2.gz BHHLKZBQQDEAGJ-UXHICEINSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000349403051 1043508852 /nfs/dbraw/zinc/50/88/52/1043508852.db2.gz BHHLKZBQQDEAGJ-UXHICEINSA-N 2 1 311.473 4.024 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069265 1043568164 /nfs/dbraw/zinc/56/81/64/1043568164.db2.gz URDLHIYQAKDADX-PBHICJAKSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069265 1043568172 /nfs/dbraw/zinc/56/81/72/1043568172.db2.gz URDLHIYQAKDADX-PBHICJAKSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)CC(F)F ZINC000639284254 1043580658 /nfs/dbraw/zinc/58/06/58/1043580658.db2.gz WHXYPIQHCWHIQO-YXJHDRRASA-N 2 1 322.443 4.235 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)CC(F)F ZINC000639284254 1043580667 /nfs/dbraw/zinc/58/06/67/1043580667.db2.gz WHXYPIQHCWHIQO-YXJHDRRASA-N 2 1 322.443 4.235 20 0 DIADMP CC(C)[NH+]1CCC([NH2+]Cc2cccc(Oc3ccccc3)c2)CC1 ZINC000323921716 1043586313 /nfs/dbraw/zinc/58/63/13/1043586313.db2.gz VNGAZXRAFPXSOA-UHFFFAOYSA-N 2 1 324.468 4.441 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1csc(C(F)(F)F)c1 ZINC000926541133 1043597101 /nfs/dbraw/zinc/59/71/01/1043597101.db2.gz KYKCLBFSQYGJKV-SMHCIBLRSA-N 2 1 318.408 4.043 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1csc(C(F)(F)F)c1 ZINC000926541133 1043597113 /nfs/dbraw/zinc/59/71/13/1043597113.db2.gz KYKCLBFSQYGJKV-SMHCIBLRSA-N 2 1 318.408 4.043 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539983 1043615709 /nfs/dbraw/zinc/61/57/09/1043615709.db2.gz NUAUTAWWHWXHAC-UZLBHIALSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539983 1043615716 /nfs/dbraw/zinc/61/57/16/1043615716.db2.gz NUAUTAWWHWXHAC-UZLBHIALSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000926811242 1043638678 /nfs/dbraw/zinc/63/86/78/1043638678.db2.gz YOKNONYYZGRTNW-LIRRHRJNSA-N 2 1 318.411 4.249 20 0 DIADMP c1cc2cc(C[NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)ccc2o1 ZINC000665237597 1043643543 /nfs/dbraw/zinc/64/35/43/1043643543.db2.gz FHJJVZNXOGOGEW-RBUKOAKNSA-N 2 1 306.409 4.016 20 0 DIADMP c1cc2cc(C[NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)ccc2o1 ZINC000665237598 1043643929 /nfs/dbraw/zinc/64/39/29/1043643929.db2.gz FHJJVZNXOGOGEW-RTBURBONSA-N 2 1 306.409 4.016 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ccc(F)cc2)cc1 ZINC000354175456 1043685386 /nfs/dbraw/zinc/68/53/86/1043685386.db2.gz AZBGWRLXRKYOIG-OAHLLOKOSA-N 2 1 323.415 4.213 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CCC1 ZINC000354516282 1043704628 /nfs/dbraw/zinc/70/46/28/1043704628.db2.gz VBIXZIPITOBHTH-MRXNPFEDSA-N 2 1 312.457 4.190 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474269041 1043720282 /nfs/dbraw/zinc/72/02/82/1043720282.db2.gz YSOLGJLFVUQJRT-ICSRJNTNSA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474269041 1043720287 /nfs/dbraw/zinc/72/02/87/1043720287.db2.gz YSOLGJLFVUQJRT-ICSRJNTNSA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474269041 1043720294 /nfs/dbraw/zinc/72/02/94/1043720294.db2.gz YSOLGJLFVUQJRT-ICSRJNTNSA-N 2 1 302.506 4.090 20 0 DIADMP CCCCN(C)c1ccc(N[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000777683613 1043741580 /nfs/dbraw/zinc/74/15/80/1043741580.db2.gz GSAXHXLJFLHJIH-APWZRJJASA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@H+](C)c1ccc(N[C@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000777683613 1043741591 /nfs/dbraw/zinc/74/15/91/1043741591.db2.gz GSAXHXLJFLHJIH-APWZRJJASA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@@H+](C)c1ccc(N[C@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000777683613 1043741596 /nfs/dbraw/zinc/74/15/96/1043741596.db2.gz GSAXHXLJFLHJIH-APWZRJJASA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000777683613 1043741609 /nfs/dbraw/zinc/74/16/09/1043741609.db2.gz GSAXHXLJFLHJIH-APWZRJJASA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000777683613 1043741621 /nfs/dbraw/zinc/74/16/21/1043741621.db2.gz GSAXHXLJFLHJIH-APWZRJJASA-N 2 1 303.494 4.065 20 0 DIADMP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168033070 1043744389 /nfs/dbraw/zinc/74/43/89/1043744389.db2.gz JSEOSUSBEDOOTN-YFYQMDMQSA-N 2 1 314.517 4.452 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123945 1043746882 /nfs/dbraw/zinc/74/68/82/1043746882.db2.gz GSSNUOZRGQIBIN-KNBMTAEXSA-N 2 1 309.457 4.033 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123945 1043746895 /nfs/dbraw/zinc/74/68/95/1043746895.db2.gz GSSNUOZRGQIBIN-KNBMTAEXSA-N 2 1 309.457 4.033 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1 ZINC000474463250 1043790108 /nfs/dbraw/zinc/79/01/08/1043790108.db2.gz BQOMRKMTHZXINW-LSDHHAIUSA-N 2 1 319.518 4.108 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C[C@@H](CC(C)C)c1ccccc1 ZINC000474469954 1043793777 /nfs/dbraw/zinc/79/37/77/1043793777.db2.gz INRGJZNNLGGFJA-YLJYHZDGSA-N 2 1 313.489 4.247 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000474483396 1043799717 /nfs/dbraw/zinc/79/97/17/1043799717.db2.gz WFPXSQMHVUUUTP-KBPBESRZSA-N 2 1 306.881 4.048 20 0 DIADMP CC1([NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834846 1043803038 /nfs/dbraw/zinc/80/30/38/1043803038.db2.gz XUYRMSRXJIHDQB-WBVHZDCISA-N 2 1 320.427 4.132 20 0 DIADMP CC1([NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834846 1043803044 /nfs/dbraw/zinc/80/30/44/1043803044.db2.gz XUYRMSRXJIHDQB-WBVHZDCISA-N 2 1 320.427 4.132 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000536661828 1043808305 /nfs/dbraw/zinc/80/83/05/1043808305.db2.gz GLMSCEUFGMHVTG-RHSMWYFYSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000536661828 1043808319 /nfs/dbraw/zinc/80/83/19/1043808319.db2.gz GLMSCEUFGMHVTG-RHSMWYFYSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000536661828 1043808336 /nfs/dbraw/zinc/80/83/36/1043808336.db2.gz GLMSCEUFGMHVTG-RHSMWYFYSA-N 2 1 302.487 4.063 20 0 DIADMP C[C@@H]1CC([NH+]2Cc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039312 1043851822 /nfs/dbraw/zinc/85/18/22/1043851822.db2.gz CWJZABIYYIXEJS-QZTJIDSGSA-N 2 1 320.480 4.444 20 0 DIADMP CC1CC([N@H+](C)C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039719 1043856093 /nfs/dbraw/zinc/85/60/93/1043856093.db2.gz HQRPAWYGTBRFRC-VIHIWDAPSA-N 2 1 300.490 4.158 20 0 DIADMP CC1CC([N@@H+](C)C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039719 1043856106 /nfs/dbraw/zinc/85/61/06/1043856106.db2.gz HQRPAWYGTBRFRC-VIHIWDAPSA-N 2 1 300.490 4.158 20 0 DIADMP C[C@@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1cccc(Cl)c1 ZINC000289947898 1043900332 /nfs/dbraw/zinc/90/03/32/1043900332.db2.gz YPFAVYNFVHWMAX-BXEVVDMOSA-N 2 1 306.881 4.001 20 0 DIADMP C[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(Cl)c1 ZINC000289947898 1043900341 /nfs/dbraw/zinc/90/03/41/1043900341.db2.gz YPFAVYNFVHWMAX-BXEVVDMOSA-N 2 1 306.881 4.001 20 0 DIADMP C[C@@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1 ZINC000289947898 1043900345 /nfs/dbraw/zinc/90/03/45/1043900345.db2.gz YPFAVYNFVHWMAX-BXEVVDMOSA-N 2 1 306.881 4.001 20 0 DIADMP C[C@@H]1CC([NH+]2CCC(C)(F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041518 1043908650 /nfs/dbraw/zinc/90/86/50/1043908650.db2.gz SNTDTIPUJJQSLP-IAGOWNOFSA-N 2 1 318.480 4.252 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H]2CCc3cc(Cl)ccc32)CC1 ZINC000777896396 1043919007 /nfs/dbraw/zinc/91/90/07/1043919007.db2.gz JHKBOEWNDMWZIP-IBGZPJMESA-N 2 1 320.908 4.380 20 0 DIADMP CC(C)C[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC000474794538 1043919177 /nfs/dbraw/zinc/91/91/77/1043919177.db2.gz JYPIFNPIEVIXHH-AZUAARDMSA-N 2 1 324.553 4.070 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000474818101 1043929353 /nfs/dbraw/zinc/92/93/53/1043929353.db2.gz PTBLGZUBLBFHJO-GJZGRUSLSA-N 2 1 319.880 4.407 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000639378506 1043964829 /nfs/dbraw/zinc/96/48/29/1043964829.db2.gz FVPCCFIYRBAGQN-UHFFFAOYSA-N 2 1 323.484 4.055 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1nccc2ccccc21 ZINC000290770946 1043984279 /nfs/dbraw/zinc/98/42/79/1043984279.db2.gz SFSIFNVZMLSKRP-MRXNPFEDSA-N 2 1 323.484 4.292 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1 ZINC000358054985 1044011344 /nfs/dbraw/zinc/01/13/44/1044011344.db2.gz BIRHGJALKYCUAR-WSTZPKSXSA-N 2 1 318.505 4.007 20 0 DIADMP Fc1cccc(C2([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)c1 ZINC000561847172 1044013895 /nfs/dbraw/zinc/01/38/95/1044013895.db2.gz HHVIENROSLJLCA-UHFFFAOYSA-N 2 1 316.464 4.202 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000562023594 1044050427 /nfs/dbraw/zinc/05/04/27/1044050427.db2.gz LWMQOTBIKBMUTR-CGTJXYLNSA-N 2 1 320.546 4.374 20 0 DIADMP CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000562023594 1044050437 /nfs/dbraw/zinc/05/04/37/1044050437.db2.gz LWMQOTBIKBMUTR-CGTJXYLNSA-N 2 1 320.546 4.374 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3sccc32)C1 ZINC000358337938 1044058175 /nfs/dbraw/zinc/05/81/75/1044058175.db2.gz GEONCZFQVCBFAC-DOTOQJQBSA-N 2 1 306.519 4.083 20 0 DIADMP C[C@H]1CC([N@@H+]2CCC23CCCC3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168048180 1044080163 /nfs/dbraw/zinc/08/01/63/1044080163.db2.gz UJELKQUDAMCCDI-ROUUACIJSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CC([N@H+]2CCC23CCCC3)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168048180 1044080177 /nfs/dbraw/zinc/08/01/77/1044080177.db2.gz UJELKQUDAMCCDI-ROUUACIJSA-N 2 1 312.501 4.447 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](CNCc2cc(Cl)sc2Cl)C1 ZINC001649175938 1044112953 /nfs/dbraw/zinc/11/29/53/1044112953.db2.gz RXWFFJKKFWLZPW-LLVKDONJSA-N 2 1 321.317 4.265 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000359101717 1044130467 /nfs/dbraw/zinc/13/04/67/1044130467.db2.gz DLVGXFQWNUDNAY-KRWDZBQOSA-N 2 1 318.505 4.454 20 0 DIADMP CC[C@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccccc1OC ZINC000346865870 1044162353 /nfs/dbraw/zinc/16/23/53/1044162353.db2.gz ONLCXHLBUBAZSP-WMZOPIPTSA-N 2 1 304.478 4.000 20 0 DIADMP CC[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccccc1OC ZINC000346865866 1044163579 /nfs/dbraw/zinc/16/35/79/1044163579.db2.gz ONLCXHLBUBAZSP-FUHWJXTLSA-N 2 1 304.478 4.000 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCCOC(C)(C)C)C2)CC1 ZINC000475052654 1044169419 /nfs/dbraw/zinc/16/94/19/1044169419.db2.gz DZCPFTIKTOHCKW-LJQANCHMSA-N 2 1 324.553 4.026 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CCSc2ccc(F)cc21)C[NH+]1CCCCC1 ZINC000360151992 1044241725 /nfs/dbraw/zinc/24/17/25/1044241725.db2.gz XJKLDYFVUXNXFN-YOEHRIQHSA-N 2 1 322.493 4.074 20 0 DIADMP CC[NH+](CC)[C@H](CNc1cc[nH+]c2ccsc21)c1ccco1 ZINC000360519479 1044281914 /nfs/dbraw/zinc/28/19/14/1044281914.db2.gz BFALQQIFSSVWOX-OAHLLOKOSA-N 2 1 315.442 4.384 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2[C@@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000475133286 1044282857 /nfs/dbraw/zinc/28/28/57/1044282857.db2.gz ZAOUGMQZBWHCLF-UXHICEINSA-N 2 1 312.501 4.057 20 0 DIADMP C[C@@H](CSC(C)(C)C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000132336219 1044322212 /nfs/dbraw/zinc/32/22/12/1044322212.db2.gz WDZKLUXWUPVAKG-INIZCTEOSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000132336416 1044322629 /nfs/dbraw/zinc/32/26/29/1044322629.db2.gz WDZKLUXWUPVAKG-MRXNPFEDSA-N 2 1 320.546 4.161 20 0 DIADMP CC[C@H](C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000475284445 1044343178 /nfs/dbraw/zinc/34/31/78/1044343178.db2.gz DINWXLQWUDYEAZ-LEWJYISDSA-N 2 1 322.496 4.292 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC(C)(C)C2)[C@@H]1c1cccs1 ZINC000564125667 1044344775 /nfs/dbraw/zinc/34/47/75/1044344775.db2.gz IDHUHFAWUWNFHZ-BFYDXBDKSA-N 2 1 306.519 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC(C)(C)C2)[C@@H]1c1cccs1 ZINC000564125667 1044344785 /nfs/dbraw/zinc/34/47/85/1044344785.db2.gz IDHUHFAWUWNFHZ-BFYDXBDKSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H](C)c1ccccc1 ZINC000475288296 1044345888 /nfs/dbraw/zinc/34/58/88/1044345888.db2.gz RNIPDZZDENWVSM-DYXWJJEUSA-N 2 1 322.496 4.290 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069564 1044353643 /nfs/dbraw/zinc/35/36/43/1044353643.db2.gz RDEDKVLKJRMKQA-NVXWUHKLSA-N 2 1 304.478 4.003 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069564 1044353653 /nfs/dbraw/zinc/35/36/53/1044353653.db2.gz RDEDKVLKJRMKQA-NVXWUHKLSA-N 2 1 304.478 4.003 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069565 1044354476 /nfs/dbraw/zinc/35/44/76/1044354476.db2.gz RDEDKVLKJRMKQA-RDJZCZTQSA-N 2 1 304.478 4.003 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CC(C)(C)Cc3occc32)C1 ZINC000361069565 1044354490 /nfs/dbraw/zinc/35/44/90/1044354490.db2.gz RDEDKVLKJRMKQA-RDJZCZTQSA-N 2 1 304.478 4.003 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000361078471 1044355939 /nfs/dbraw/zinc/35/59/39/1044355939.db2.gz HWIDIJQRQIBAPM-LPHOPBHVSA-N 2 1 316.489 4.014 20 0 DIADMP C[NH+](C)[C@@H](CNc1cc[nH+]c2ccsc21)c1ccsc1 ZINC000361161885 1044367670 /nfs/dbraw/zinc/36/76/70/1044367670.db2.gz OQCMSTMUZSMXTA-AWEZNQCLSA-N 2 1 303.456 4.073 20 0 DIADMP C[C@@H]1CC([NH+]2CCC(CF)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168062698 1044386344 /nfs/dbraw/zinc/38/63/44/1044386344.db2.gz LTEAVDHKKQDDFW-IAGOWNOFSA-N 2 1 318.480 4.110 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+]Cc1cscc1C(F)(F)F)C(C)(C)C ZINC000564527789 1044389060 /nfs/dbraw/zinc/38/90/60/1044389060.db2.gz GELWTHNVOUKMKJ-ZDUSSCGKSA-N 2 1 322.440 4.223 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000564969452 1044408170 /nfs/dbraw/zinc/40/81/70/1044408170.db2.gz XMJWUNARWNXIPS-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000564969452 1044408177 /nfs/dbraw/zinc/40/81/77/1044408177.db2.gz XMJWUNARWNXIPS-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(F)c2ccccc21 ZINC000294377131 1044413436 /nfs/dbraw/zinc/41/34/36/1044413436.db2.gz RDFGNOUHQOXXLA-LSDHHAIUSA-N 2 1 323.415 4.089 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1(C)CC1 ZINC000361772889 1044440252 /nfs/dbraw/zinc/44/02/52/1044440252.db2.gz YZIXYYLQDFZTAE-INIZCTEOSA-N 2 1 312.457 4.190 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000294966350 1044476521 /nfs/dbraw/zinc/47/65/21/1044476521.db2.gz LJGBFRUKQSNSCX-MAUKXSAKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000294966350 1044476525 /nfs/dbraw/zinc/47/65/25/1044476525.db2.gz LJGBFRUKQSNSCX-MAUKXSAKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966350 1044476532 /nfs/dbraw/zinc/47/65/32/1044476532.db2.gz LJGBFRUKQSNSCX-MAUKXSAKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CC2CC(F)(F)C2)CC[NH+]1Cc1ccccc1 ZINC000294966350 1044476536 /nfs/dbraw/zinc/47/65/36/1044476536.db2.gz LJGBFRUKQSNSCX-MAUKXSAKSA-N 2 1 322.443 4.017 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000566394690 1044489593 /nfs/dbraw/zinc/48/95/93/1044489593.db2.gz LLFRXQJDKUGUHU-LJQANCHMSA-N 2 1 322.496 4.440 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148031 1044547561 /nfs/dbraw/zinc/54/75/61/1044547561.db2.gz AMPOZOSMWRJRCS-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148031 1044547575 /nfs/dbraw/zinc/54/75/75/1044547575.db2.gz AMPOZOSMWRJRCS-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148031 1044547591 /nfs/dbraw/zinc/54/75/91/1044547591.db2.gz AMPOZOSMWRJRCS-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1cccc(-c2ccccc2)c1 ZINC000567148031 1044547603 /nfs/dbraw/zinc/54/76/03/1044547603.db2.gz AMPOZOSMWRJRCS-UTKZUKDTSA-N 2 1 308.469 4.126 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C1CCC2(CC2)CC1 ZINC000362932641 1044567201 /nfs/dbraw/zinc/56/72/01/1044567201.db2.gz XRLCJIXIDXIXDA-UHFFFAOYSA-N 2 1 300.490 4.339 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](C)c2c[nH+]ccc2N)c2ccccc21 ZINC000567640549 1044577997 /nfs/dbraw/zinc/57/79/97/1044577997.db2.gz YNYBGWWRMJPOHR-MPGHIAIKSA-N 2 1 309.457 4.072 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CCN1C ZINC000444651973 1044584031 /nfs/dbraw/zinc/58/40/31/1044584031.db2.gz QPPFXGVGXLKVCM-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651973 1044584046 /nfs/dbraw/zinc/58/40/46/1044584046.db2.gz QPPFXGVGXLKVCM-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H](N(C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651973 1044584062 /nfs/dbraw/zinc/58/40/62/1044584062.db2.gz QPPFXGVGXLKVCM-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@@H+]1C ZINC000444651973 1044584076 /nfs/dbraw/zinc/58/40/76/1044584076.db2.gz QPPFXGVGXLKVCM-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccs3)cc2)CC[N@H+]1C ZINC000444651973 1044584088 /nfs/dbraw/zinc/58/40/88/1044584088.db2.gz QPPFXGVGXLKVCM-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651973 1044584104 /nfs/dbraw/zinc/58/41/04/1044584104.db2.gz QPPFXGVGXLKVCM-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CC[NH+]1C ZINC000444651973 1044584121 /nfs/dbraw/zinc/58/41/21/1044584121.db2.gz QPPFXGVGXLKVCM-MAUKXSAKSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000296133917 1044591917 /nfs/dbraw/zinc/59/19/17/1044591917.db2.gz URDJZPBYIMMWNW-RDJZCZTQSA-N 2 1 310.432 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCCC(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000296133917 1044591934 /nfs/dbraw/zinc/59/19/34/1044591934.db2.gz URDJZPBYIMMWNW-RDJZCZTQSA-N 2 1 310.432 4.065 20 0 DIADMP CCc1ccccc1CC[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000444669587 1044598795 /nfs/dbraw/zinc/59/87/95/1044598795.db2.gz GTJABBAYXQOIDA-XLIONFOSSA-N 2 1 314.517 4.034 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000444690409 1044603938 /nfs/dbraw/zinc/60/39/38/1044603938.db2.gz JSDZTNSNGYFGJM-IBGZPJMESA-N 2 1 314.498 4.331 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC000444692731 1044605829 /nfs/dbraw/zinc/60/58/29/1044605829.db2.gz MYDSYPULSQXITR-SFHVURJKSA-N 2 1 314.498 4.331 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000568166635 1044606623 /nfs/dbraw/zinc/60/66/23/1044606623.db2.gz PISBCDFXLPLNPI-HBMCJLEFSA-N 2 1 323.484 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000568166635 1044606633 /nfs/dbraw/zinc/60/66/33/1044606633.db2.gz PISBCDFXLPLNPI-HBMCJLEFSA-N 2 1 323.484 4.011 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000568408872 1044623200 /nfs/dbraw/zinc/62/32/00/1044623200.db2.gz DFJHLZSKYWSZAX-CQSZACIVSA-N 2 1 317.864 4.232 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000568408872 1044623207 /nfs/dbraw/zinc/62/32/07/1044623207.db2.gz DFJHLZSKYWSZAX-CQSZACIVSA-N 2 1 317.864 4.232 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1F ZINC000364088279 1044660707 /nfs/dbraw/zinc/66/07/07/1044660707.db2.gz XJGJBPNNJJTSBI-IOASZLSFSA-N 2 1 310.844 4.147 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1F ZINC000364088279 1044660712 /nfs/dbraw/zinc/66/07/12/1044660712.db2.gz XJGJBPNNJJTSBI-IOASZLSFSA-N 2 1 310.844 4.147 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@@H](C)c3nc4ccccc4o3)CC2)[nH+]c1C ZINC000886662952 1044676192 /nfs/dbraw/zinc/67/61/92/1044676192.db2.gz QEYYDEOBYQRHIC-AWEZNQCLSA-N 2 1 324.428 4.108 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@H](C)c3nc4ccccc4o3)CC2)[nH+]c1C ZINC000886662953 1044677203 /nfs/dbraw/zinc/67/72/03/1044677203.db2.gz QEYYDEOBYQRHIC-CQSZACIVSA-N 2 1 324.428 4.108 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3cccc(Cl)c3)CC2)[nH+]c1C ZINC000886660949 1044677579 /nfs/dbraw/zinc/67/75/79/1044677579.db2.gz IWKCNIJTAWKXJG-UHFFFAOYSA-N 2 1 303.837 4.060 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CC[C@H]3CCCC3(F)F)CC2)[nH+]c1C ZINC000886659325 1044677600 /nfs/dbraw/zinc/67/76/00/1044677600.db2.gz KAZMZTJTHYJGCP-OAHLLOKOSA-N 2 1 311.420 4.031 20 0 DIADMP CC(C)(C)[N@@H+]1CCCN(c2cc[nH+]c3ccc(Cl)cc32)CC1 ZINC000523704580 1044677636 /nfs/dbraw/zinc/67/76/36/1044677636.db2.gz BPCOEARYERPQFB-UHFFFAOYSA-N 2 1 317.864 4.199 20 0 DIADMP CC(C)(C)[N@H+]1CCCN(c2cc[nH+]c3ccc(Cl)cc32)CC1 ZINC000523704580 1044677640 /nfs/dbraw/zinc/67/76/40/1044677640.db2.gz BPCOEARYERPQFB-UHFFFAOYSA-N 2 1 317.864 4.199 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@@H]3CCc4ccc(F)cc43)CC2)[nH+]c1C ZINC000886666227 1044677808 /nfs/dbraw/zinc/67/78/08/1044677808.db2.gz PEFQPPPYHMJCBQ-GOSISDBHSA-N 2 1 313.420 4.033 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2ccccc2n1 ZINC000089512933 1044739114 /nfs/dbraw/zinc/73/91/14/1044739114.db2.gz BPEWITKHDRCIES-HNNXBMFYSA-N 2 1 311.473 4.148 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2ccccc2n1 ZINC000089512934 1044739899 /nfs/dbraw/zinc/73/98/99/1044739899.db2.gz BPEWITKHDRCIES-OAHLLOKOSA-N 2 1 311.473 4.148 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(C3CCCC3)cc2)CC1 ZINC000571359524 1044811470 /nfs/dbraw/zinc/81/14/70/1044811470.db2.gz PALZGJHZGMTOFU-HXUWFJFHSA-N 2 1 300.490 4.260 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000370671291 1044849671 /nfs/dbraw/zinc/84/96/71/1044849671.db2.gz PHQWQELLBVXPEK-XHSDSOJGSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1nccn1CCCC[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000371325859 1044868496 /nfs/dbraw/zinc/86/84/96/1044868496.db2.gz ITNVPKGJHMALIM-GOSISDBHSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000371325859 1044868519 /nfs/dbraw/zinc/86/85/19/1044868519.db2.gz ITNVPKGJHMALIM-GOSISDBHSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000371325859 1044868543 /nfs/dbraw/zinc/86/85/43/1044868543.db2.gz ITNVPKGJHMALIM-GOSISDBHSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(F)cc1)C(C)C ZINC000337430627 1044900153 /nfs/dbraw/zinc/90/01/53/1044900153.db2.gz UWNACHOHCWKAKG-GOSISDBHSA-N 2 1 303.425 4.098 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000524758105 1044918316 /nfs/dbraw/zinc/91/83/16/1044918316.db2.gz PRTRXUQGDIQGON-YJBOKZPZSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000524758105 1044918332 /nfs/dbraw/zinc/91/83/32/1044918332.db2.gz PRTRXUQGDIQGON-YJBOKZPZSA-N 2 1 306.881 4.209 20 0 DIADMP CN1CCC([N@@H+](C/C=C/c2ccccc2)Cc2ccccc2)CC1 ZINC000574320497 1044947054 /nfs/dbraw/zinc/94/70/54/1044947054.db2.gz XEIPEFGQJSPNKZ-MDWZMJQESA-N 2 1 320.480 4.296 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000121656356 1044963325 /nfs/dbraw/zinc/96/33/25/1044963325.db2.gz QZGRMWHJTOVBFF-ZDUSSCGKSA-N 2 1 314.395 4.230 20 0 DIADMP F[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045815 1044983684 /nfs/dbraw/zinc/98/36/84/1044983684.db2.gz SHYJMICTZFVQNB-QRVBRYPASA-N 2 1 316.464 4.054 20 0 DIADMP F[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045815 1044983699 /nfs/dbraw/zinc/98/36/99/1044983699.db2.gz SHYJMICTZFVQNB-QRVBRYPASA-N 2 1 316.464 4.054 20 0 DIADMP CSc1ccc(C[N@@H+](C)Cc2ccc(-n3ccnc3)cc2)cc1 ZINC000096965844 1044983927 /nfs/dbraw/zinc/98/39/27/1044983927.db2.gz MWCPDTJTCKCRTG-UHFFFAOYSA-N 2 1 323.465 4.226 20 0 DIADMP C[C@@H](c1ccccn1)[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411427401 1045006263 /nfs/dbraw/zinc/00/62/63/1045006263.db2.gz UHFRVCUZQBRCBJ-SFHVURJKSA-N 2 1 323.484 4.261 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525274303 1045023854 /nfs/dbraw/zinc/02/38/54/1045023854.db2.gz PBMQMTZHEYJWEM-ZWKOTPCHSA-N 2 1 308.469 4.319 20 0 DIADMP C[N@H+](C/C=C/c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268842 1045024988 /nfs/dbraw/zinc/02/49/88/1045024988.db2.gz BOHVTFCHTUCRAC-SYZXBLONSA-N 2 1 320.480 4.154 20 0 DIADMP C[N@@H+](C/C=C/c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000525268842 1045024999 /nfs/dbraw/zinc/02/49/99/1045024999.db2.gz BOHVTFCHTUCRAC-SYZXBLONSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C/c1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000525268842 1045025013 /nfs/dbraw/zinc/02/50/13/1045025013.db2.gz BOHVTFCHTUCRAC-SYZXBLONSA-N 2 1 320.480 4.154 20 0 DIADMP C[NH+](C/C=C/c1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000525268842 1045025027 /nfs/dbraw/zinc/02/50/27/1045025027.db2.gz BOHVTFCHTUCRAC-SYZXBLONSA-N 2 1 320.480 4.154 20 0 DIADMP C[C@@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623379471 1045064161 /nfs/dbraw/zinc/06/41/61/1045064161.db2.gz RWSKLCQGSZSPCP-FUHWJXTLSA-N 2 1 302.506 4.205 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)[C@H]2CCC[C@@H]21 ZINC000576774297 1045078056 /nfs/dbraw/zinc/07/80/56/1045078056.db2.gz DUBREGYITUNZGU-DBDQLMEASA-N 2 1 318.892 4.048 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771718 1045078294 /nfs/dbraw/zinc/07/82/94/1045078294.db2.gz CGXTZCOYNDPYPH-PWIZWCRZSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771718 1045078306 /nfs/dbraw/zinc/07/83/06/1045078306.db2.gz CGXTZCOYNDPYPH-PWIZWCRZSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H](C)Cc2ccccc2)CC1 ZINC000447093251 1045097927 /nfs/dbraw/zinc/09/79/27/1045097927.db2.gz IBSFAFHDOAEZKF-KRWDZBQOSA-N 2 1 324.468 4.112 20 0 DIADMP CCc1[nH+]c2ccccc2c(N2CCC3(CCC[N@H+]3C)CC2)c1C ZINC000577550430 1045135396 /nfs/dbraw/zinc/13/53/96/1045135396.db2.gz HRPMDNKRLOBNJI-UHFFFAOYSA-N 2 1 323.484 4.170 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000447527819 1045137897 /nfs/dbraw/zinc/13/78/97/1045137897.db2.gz GAQKBRRSFNCYAX-PMACEKPBSA-N 2 1 311.473 4.446 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCCc3occc32)C1 ZINC000447546910 1045145897 /nfs/dbraw/zinc/14/58/97/1045145897.db2.gz ZSXASVLXFQKLDI-SOLBZPMBSA-N 2 1 304.478 4.005 20 0 DIADMP Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000447560356 1045148959 /nfs/dbraw/zinc/14/89/59/1045148959.db2.gz VQPZZNMRXNXQAO-LZWOXQAQSA-N 2 1 314.395 4.061 20 0 DIADMP Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000447560341 1045149623 /nfs/dbraw/zinc/14/96/23/1045149623.db2.gz VQPZZNMRXNXQAO-DZKIICNBSA-N 2 1 314.395 4.061 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2CC24CCCC4)C3)cc1 ZINC000447600708 1045158538 /nfs/dbraw/zinc/15/85/38/1045158538.db2.gz NCNGCJXOVZEXJG-YRPNKDGESA-N 2 1 310.485 4.104 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC000300531039 1045161784 /nfs/dbraw/zinc/16/17/84/1045161784.db2.gz QEUNIHSHRUAIRJ-JKSUJKDBSA-N 2 1 308.897 4.125 20 0 DIADMP C[C@H](CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734233 1045172665 /nfs/dbraw/zinc/17/26/65/1045172665.db2.gz URUFGUPLLIFQRY-LMNJBCLMSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734233 1045172671 /nfs/dbraw/zinc/17/26/71/1045172671.db2.gz URUFGUPLLIFQRY-LMNJBCLMSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000447734233 1045172677 /nfs/dbraw/zinc/17/26/77/1045172677.db2.gz URUFGUPLLIFQRY-LMNJBCLMSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000447734233 1045172681 /nfs/dbraw/zinc/17/26/81/1045172681.db2.gz URUFGUPLLIFQRY-LMNJBCLMSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC000447823609 1045178195 /nfs/dbraw/zinc/17/81/95/1045178195.db2.gz WTGKTDGPINEEPV-RTBURBONSA-N 2 1 302.506 4.282 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccccc1SC(F)(F)F ZINC000924574498 1045178544 /nfs/dbraw/zinc/17/85/44/1045178544.db2.gz FCZGWHVSKQERQJ-NSHDSACASA-N 2 1 318.408 4.043 20 0 DIADMP COc1cc([C@H](C)[NH2+]CCCn2cc[nH+]c2C)cc2ccccc21 ZINC000924711115 1045193530 /nfs/dbraw/zinc/19/35/30/1045193530.db2.gz AEFQKFGCWMRXFC-HNNXBMFYSA-N 2 1 323.440 4.094 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527116154 1045198004 /nfs/dbraw/zinc/19/80/04/1045198004.db2.gz DDJDSOGMSHXUSP-CVEARBPZSA-N 2 1 308.897 4.107 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527116154 1045198008 /nfs/dbraw/zinc/19/80/08/1045198008.db2.gz DDJDSOGMSHXUSP-CVEARBPZSA-N 2 1 308.897 4.107 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000527115713 1045198081 /nfs/dbraw/zinc/19/80/81/1045198081.db2.gz JSCRULSQIYPSPQ-DAYGRLMNSA-N 2 1 308.897 4.106 20 0 DIADMP C[C@H](C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000527115759 1045198529 /nfs/dbraw/zinc/19/85/29/1045198529.db2.gz HLXRPRNQQHQAOR-SJORKVTESA-N 2 1 306.469 4.173 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)S3)c1 ZINC000924830218 1045201569 /nfs/dbraw/zinc/20/15/69/1045201569.db2.gz VVMKYYLTJGJVGI-YQQQUEKLSA-N 2 1 318.530 4.043 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ncccc1Cl ZINC000924949530 1045215543 /nfs/dbraw/zinc/21/55/43/1045215543.db2.gz GUUJUNVBQKVFBX-CZUORRHYSA-N 2 1 320.868 4.007 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000527631935 1045242430 /nfs/dbraw/zinc/24/24/30/1045242430.db2.gz DRKJJJIIGLAFHW-MOPGFXCFSA-N 2 1 312.501 4.319 20 0 DIADMP CC(C)C(C)(C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000578482876 1045246499 /nfs/dbraw/zinc/24/64/99/1045246499.db2.gz OYIGDEUKIVEJFP-OWZKRDHZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668269 1045246692 /nfs/dbraw/zinc/24/66/92/1045246692.db2.gz VHYSXUUHCQMTDR-CICISYLWSA-N 2 1 318.530 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668269 1045246708 /nfs/dbraw/zinc/24/67/08/1045246708.db2.gz VHYSXUUHCQMTDR-CICISYLWSA-N 2 1 318.530 4.155 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000579136487 1045296081 /nfs/dbraw/zinc/29/60/81/1045296081.db2.gz LWQRQHJJIQYYOQ-UHFFFAOYSA-N 2 1 323.843 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000579136487 1045296083 /nfs/dbraw/zinc/29/60/83/1045296083.db2.gz LWQRQHJJIQYYOQ-UHFFFAOYSA-N 2 1 323.843 4.150 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@@H]3CC[N@H+](C)C[C@@H]3C)CCCC2)c(C)c1 ZINC000579383091 1045311966 /nfs/dbraw/zinc/31/19/66/1045311966.db2.gz GJSCYQJTSRQVHJ-AZUAARDMSA-N 2 1 314.517 4.045 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000449086097 1045343028 /nfs/dbraw/zinc/34/30/28/1045343028.db2.gz AQSCCZRTAPFZEW-WOJBJXKFSA-N 2 1 320.480 4.378 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1cccnc1 ZINC000449068716 1045343143 /nfs/dbraw/zinc/34/31/43/1045343143.db2.gz UOSIZPPXCGPXRE-INIZCTEOSA-N 2 1 317.521 4.411 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccccc2-c2ccccc2C)C1 ZINC000449090754 1045348871 /nfs/dbraw/zinc/34/88/71/1045348871.db2.gz NWCDBRWRWRXVMQ-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)cs1 ZINC000449091959 1045349055 /nfs/dbraw/zinc/34/90/55/1045349055.db2.gz SBFWMNCSJXIARX-UHFFFAOYSA-N 2 1 314.498 4.119 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CCC3)[C@@H]1c1cccs1 ZINC000449155574 1045353125 /nfs/dbraw/zinc/35/31/25/1045353125.db2.gz BHYSKLTXTHCMMD-KBAYOESNSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CCC3)[C@@H]1c1cccs1 ZINC000449155574 1045353133 /nfs/dbraw/zinc/35/31/33/1045353133.db2.gz BHYSKLTXTHCMMD-KBAYOESNSA-N 2 1 318.530 4.443 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc2ccoc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000449234782 1045363211 /nfs/dbraw/zinc/36/32/11/1045363211.db2.gz RDAGPYDPLLXMSO-CRAIPNDOSA-N 2 1 312.457 4.175 20 0 DIADMP CSCC1CCC([NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000449231299 1045365220 /nfs/dbraw/zinc/36/52/20/1045365220.db2.gz DCUZWTHDMBVVOX-PBHCIXSXSA-N 2 1 324.578 4.151 20 0 DIADMP Cc1csc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000449478449 1045398463 /nfs/dbraw/zinc/39/84/63/1045398463.db2.gz KIIPPXJOQOBCAD-SJLPKXTDSA-N 2 1 314.498 4.057 20 0 DIADMP Cc1csc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000449478448 1045398845 /nfs/dbraw/zinc/39/88/45/1045398845.db2.gz KIIPPXJOQOBCAD-FUHWJXTLSA-N 2 1 314.498 4.057 20 0 DIADMP CC(C)C[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC000449560813 1045413684 /nfs/dbraw/zinc/41/36/84/1045413684.db2.gz PVZSVXPFEPCAEJ-UMQXSMKFSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000449561437 1045414939 /nfs/dbraw/zinc/41/49/39/1045414939.db2.gz VAQFLGQXTZAUKB-MNKFUTIGSA-N 2 1 324.921 4.108 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)C2CC(F)(F)C2)cc1 ZINC000529540625 1045490952 /nfs/dbraw/zinc/49/09/52/1045490952.db2.gz FJDASEQFBGZWKY-STQMWFEESA-N 2 1 319.399 4.265 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC2CC(F)(F)C2)CC1)CC(C)C ZINC000450655210 1045539451 /nfs/dbraw/zinc/53/94/51/1045539451.db2.gz WJPWEXPKJJMPAY-UHFFFAOYSA-N 2 1 316.480 4.112 20 0 DIADMP C[C@H]([NH2+]CC/C=C\c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450729085 1045554077 /nfs/dbraw/zinc/55/40/77/1045554077.db2.gz QZVBWZXESBVYED-SEIQDPLISA-N 2 1 312.501 4.333 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450728668 1045555275 /nfs/dbraw/zinc/55/52/75/1045555275.db2.gz PKEZILHOBBLSJU-XHSDSOJGSA-N 2 1 314.464 4.055 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C/c2ccc(Cl)cc2)C[C@H]1C ZINC000530335380 1045646755 /nfs/dbraw/zinc/64/67/55/1045646755.db2.gz NIFRGSYWKGIIIF-IJVDXJMESA-N 2 1 306.881 4.158 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C/c2ccc(Cl)cc2)C[C@H]1C ZINC000530335380 1045646759 /nfs/dbraw/zinc/64/67/59/1045646759.db2.gz NIFRGSYWKGIIIF-IJVDXJMESA-N 2 1 306.881 4.158 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C/c2ccc(Cl)cc2)C[C@H]1C ZINC000530335380 1045646766 /nfs/dbraw/zinc/64/67/66/1045646766.db2.gz NIFRGSYWKGIIIF-IJVDXJMESA-N 2 1 306.881 4.158 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C/c2ccc(Cl)cc2)C[C@H]1C ZINC000530335380 1045646771 /nfs/dbraw/zinc/64/67/71/1045646771.db2.gz NIFRGSYWKGIIIF-IJVDXJMESA-N 2 1 306.881 4.158 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c(C)s1 ZINC001138567405 1045663207 /nfs/dbraw/zinc/66/32/07/1045663207.db2.gz ABHOZNXRQDZOLX-GOSISDBHSA-N 2 1 306.519 4.205 20 0 DIADMP Clc1oc2ccccc2c1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000629522716 1045675939 /nfs/dbraw/zinc/67/59/39/1045675939.db2.gz HCDAOVDJJOMJGO-FVQBIDKESA-N 2 1 318.848 4.097 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cccc(C(F)(F)F)c2)C[C@@H]1C ZINC000530905611 1045750683 /nfs/dbraw/zinc/75/06/83/1045750683.db2.gz PXAGAUKGYJKEKP-BBRMVZONSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@@H]1C ZINC000530905611 1045750697 /nfs/dbraw/zinc/75/06/97/1045750697.db2.gz PXAGAUKGYJKEKP-BBRMVZONSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@@H]1C ZINC000530905611 1045750703 /nfs/dbraw/zinc/75/07/03/1045750703.db2.gz PXAGAUKGYJKEKP-BBRMVZONSA-N 2 1 314.395 4.010 20 0 DIADMP CCC[NH+]1CCC([NH2+]C(C)(c2ccccc2)c2ccccc2)CC1 ZINC000630343354 1045751995 /nfs/dbraw/zinc/75/19/95/1045751995.db2.gz KZPMSINDJBIUMX-UHFFFAOYSA-N 2 1 322.496 4.414 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000530949724 1045760333 /nfs/dbraw/zinc/76/03/33/1045760333.db2.gz JHOJIAVVUQPWQQ-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000530949724 1045760338 /nfs/dbraw/zinc/76/03/38/1045760338.db2.gz JHOJIAVVUQPWQQ-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949724 1045760344 /nfs/dbraw/zinc/76/03/44/1045760344.db2.gz JHOJIAVVUQPWQQ-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949724 1045760351 /nfs/dbraw/zinc/76/03/51/1045760351.db2.gz JHOJIAVVUQPWQQ-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C3CC(c4ccccc4)C3)CC2)cc1 ZINC000078898870 1045787357 /nfs/dbraw/zinc/78/73/57/1045787357.db2.gz JHVBFCUACXWWLL-UHFFFAOYSA-N 2 1 320.480 4.187 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000531140061 1045791466 /nfs/dbraw/zinc/79/14/66/1045791466.db2.gz HBRJNUWVCJMSHE-BBRMVZONSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000531140061 1045791496 /nfs/dbraw/zinc/79/14/96/1045791496.db2.gz HBRJNUWVCJMSHE-BBRMVZONSA-N 2 1 314.395 4.010 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000531140061 1045791504 /nfs/dbraw/zinc/79/15/04/1045791504.db2.gz HBRJNUWVCJMSHE-BBRMVZONSA-N 2 1 314.395 4.010 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000035047350 1045832166 /nfs/dbraw/zinc/83/21/66/1045832166.db2.gz SCZSRBSMPDKMJG-INIZCTEOSA-N 2 1 324.921 4.339 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc(C)ccn1 ZINC000631584014 1045876947 /nfs/dbraw/zinc/87/69/47/1045876947.db2.gz ASCKSUQGKNYKBL-LJQANCHMSA-N 2 1 315.505 4.228 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)CCc1c[nH]c2ccccc12 ZINC000631582714 1045877565 /nfs/dbraw/zinc/87/75/65/1045877565.db2.gz NJEYGDKOVIZUAD-INIZCTEOSA-N 2 1 324.472 4.064 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2CCCC24CC4)C3)cc1 ZINC000631665959 1045901016 /nfs/dbraw/zinc/90/10/16/1045901016.db2.gz VDGWASYYMZIGLK-IYWMVGAKSA-N 2 1 310.485 4.104 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000531717188 1045911017 /nfs/dbraw/zinc/91/10/17/1045911017.db2.gz GKIDFYJSVBSLHE-CRAIPNDOSA-N 2 1 308.897 4.359 20 0 DIADMP C[C@@H](CCCc1cccnc1)[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC000453057279 1045919777 /nfs/dbraw/zinc/91/97/77/1045919777.db2.gz HULLIYLIOHDRQZ-RBUKOAKNSA-N 2 1 317.521 4.037 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1csc2ccccc12 ZINC000754733980 1045919782 /nfs/dbraw/zinc/91/97/82/1045919782.db2.gz DRNJZZFUSVGBOA-GJZGRUSLSA-N 2 1 302.487 4.426 20 0 DIADMP C[C@@H](CCCc1cccnc1)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000453057278 1045921277 /nfs/dbraw/zinc/92/12/77/1045921277.db2.gz HULLIYLIOHDRQZ-OALUTQOASA-N 2 1 317.521 4.037 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1csc2ccccc12 ZINC000754740790 1045924110 /nfs/dbraw/zinc/92/41/10/1045924110.db2.gz UCNCWZPNDBIXML-ZIAGYGMSSA-N 2 1 313.470 4.393 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CC[C@H](C)c2ccsc21 ZINC000453109759 1045938758 /nfs/dbraw/zinc/93/87/58/1045938758.db2.gz AQOAIPBBNYSARS-BBRMVZONSA-N 2 1 303.475 4.261 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@H](C3CC3)C3CCC3)C2)c1 ZINC000453099763 1045949677 /nfs/dbraw/zinc/94/96/77/1045949677.db2.gz ZGQJFNLCNSWQIK-KXBFYZLASA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H](C3CC3)C3CCC3)C2)c1 ZINC000453099763 1045949689 /nfs/dbraw/zinc/94/96/89/1045949689.db2.gz ZGQJFNLCNSWQIK-KXBFYZLASA-N 2 1 318.530 4.128 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C1CCCC1)C1CCN(C)CC1 ZINC001137854215 1045985902 /nfs/dbraw/zinc/98/59/02/1045985902.db2.gz NFTOCKCYHPCKHH-UHFFFAOYSA-N 2 1 300.490 4.142 20 0 DIADMP Cc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1-c1ccccc1 ZINC000193314914 1045991457 /nfs/dbraw/zinc/99/14/57/1045991457.db2.gz IIPCYVCUNCXFJU-SEJPIABJSA-N 2 1 320.480 4.377 20 0 DIADMP COc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC000902406872 1045992286 /nfs/dbraw/zinc/99/22/86/1045992286.db2.gz VTPLYGSFDMEIKO-NSISKUIASA-N 2 1 324.468 4.148 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1cc(F)cc(C(F)(F)F)c1 ZINC001137866059 1045992628 /nfs/dbraw/zinc/99/26/28/1045992628.db2.gz WVVFFFDFMRVZCY-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(F)cc(C(F)(F)F)c1 ZINC001137866059 1045992636 /nfs/dbraw/zinc/99/26/36/1045992636.db2.gz WVVFFFDFMRVZCY-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[C@@H]2c2ccccc2)CC[N@H+]1C ZINC000453341083 1046044600 /nfs/dbraw/zinc/04/46/00/1046044600.db2.gz DWVKXJZQABPGIG-GSEOLPGOSA-N 2 1 300.490 4.033 20 0 DIADMP C[NH+]1CCC([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)CC1 ZINC001256201955 1046057180 /nfs/dbraw/zinc/05/71/80/1046057180.db2.gz UXBKDKSNIKMVPY-UHFFFAOYSA-N 3 1 300.471 4.139 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H](c1ccc(Cl)cc1)C1CC1)C1CC1 ZINC000453387104 1046062781 /nfs/dbraw/zinc/06/27/81/1046062781.db2.gz AVZYNSNIKZZGMB-SFHVURJKSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000453399277 1046076316 /nfs/dbraw/zinc/07/63/16/1046076316.db2.gz LFZHUOJTILLRLQ-CABCVRRESA-N 2 1 308.897 4.296 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2ccsc2S1 ZINC000453401368 1046076770 /nfs/dbraw/zinc/07/67/70/1046076770.db2.gz MTNNLMIVSJYDER-SWLSCSKDSA-N 2 1 310.532 4.138 20 0 DIADMP CC[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(Cl)s1 ZINC000453410770 1046079482 /nfs/dbraw/zinc/07/94/82/1046079482.db2.gz VDXAITDMQGXUFZ-CYBMUJFWSA-N 2 1 300.899 4.317 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1)C1CC1 ZINC000453393816 1046081175 /nfs/dbraw/zinc/08/11/75/1046081175.db2.gz GLRLSAYXYLHAFA-LJQANCHMSA-N 2 1 316.464 4.226 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCCOc2ccc(Cl)cc21)C1CC1 ZINC000453390763 1046082410 /nfs/dbraw/zinc/08/24/10/1046082410.db2.gz DMDKXXFBQRKWBJ-QGZVFWFLSA-N 2 1 322.880 4.018 20 0 DIADMP C[C@H](CCc1ccc(Cl)s1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453395299 1046084967 /nfs/dbraw/zinc/08/49/67/1046084967.db2.gz HQDYELGYPZFBMW-CYBMUJFWSA-N 2 1 314.926 4.187 20 0 DIADMP C[C@H]([NH2+][C@@H](C1CC1)C1CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000453445012 1046085772 /nfs/dbraw/zinc/08/57/72/1046085772.db2.gz ZNGFGJFKUUKOCM-ZLGUVYLKSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000453419052 1046087063 /nfs/dbraw/zinc/08/70/63/1046087063.db2.gz KWZXSXKVYJEQTL-CRAIPNDOSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000453419052 1046087077 /nfs/dbraw/zinc/08/70/77/1046087077.db2.gz KWZXSXKVYJEQTL-CRAIPNDOSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H]([NH2+][C@H](C1CC1)C1CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000453445006 1046087666 /nfs/dbraw/zinc/08/76/66/1046087666.db2.gz ZNGFGJFKUUKOCM-DQLDELGASA-N 2 1 312.501 4.065 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CC(c2ccccc2)c2ccccc2)[C@H](C)C1 ZINC000532203440 1046115078 /nfs/dbraw/zinc/11/50/78/1046115078.db2.gz ZJFMGRUUYDUEDF-XMSQKQJNSA-N 2 1 322.496 4.138 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(C(F)(F)F)s1 ZINC000903017363 1046143039 /nfs/dbraw/zinc/14/30/39/1046143039.db2.gz SAGRLSXULHMYDC-NSHDSACASA-N 2 1 320.424 4.292 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903015737 1046143188 /nfs/dbraw/zinc/14/31/88/1046143188.db2.gz BRBAXWXWOVQFNQ-NWDGAFQWSA-N 2 1 320.424 4.149 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c(C)s1 ZINC000903061882 1046152876 /nfs/dbraw/zinc/15/28/76/1046152876.db2.gz MCSHHLBKNHTPSL-IICXIOTHSA-N 2 1 304.503 4.173 20 0 DIADMP Cc1c2ccccc2[nH]c1C[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001138399473 1046164038 /nfs/dbraw/zinc/16/40/38/1046164038.db2.gz CWBQUKOGGFOSJP-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCc3ccc(C)cc3C2)cc1 ZINC001138543087 1046220395 /nfs/dbraw/zinc/22/03/95/1046220395.db2.gz JYVSAFYTRBQYCC-UHFFFAOYSA-N 2 1 317.436 4.047 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCc3ccc(C)cc3C2)cc1 ZINC001138543087 1046220404 /nfs/dbraw/zinc/22/04/04/1046220404.db2.gz JYVSAFYTRBQYCC-UHFFFAOYSA-N 2 1 317.436 4.047 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)cc1 ZINC001138544024 1046220497 /nfs/dbraw/zinc/22/04/97/1046220497.db2.gz AZWRRCJOPMTKJB-UHFFFAOYSA-N 2 1 319.399 4.048 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCC(F)(F)C(C)(C)C2)cc1 ZINC001138544024 1046220505 /nfs/dbraw/zinc/22/05/05/1046220505.db2.gz AZWRRCJOPMTKJB-UHFFFAOYSA-N 2 1 319.399 4.048 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cc(F)ccc2Cl)CC1 ZINC001138674108 1046263628 /nfs/dbraw/zinc/26/36/28/1046263628.db2.gz KWLKDUPINJZARH-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H](C)Cc2ccc(Cl)cc2)CC1 ZINC001168180559 1046292034 /nfs/dbraw/zinc/29/20/34/1046292034.db2.gz RTBFWPQRNPNIFG-INIZCTEOSA-N 2 1 322.924 4.323 20 0 DIADMP CCCC[N@@H+](CCCn1ccnc1)Cc1c(F)cccc1Cl ZINC000780564433 1046393041 /nfs/dbraw/zinc/39/30/41/1046393041.db2.gz BJMYZVHCZMEKQF-UHFFFAOYSA-N 2 1 323.843 4.368 20 0 DIADMP CCCCN(CCCn1ccnc1)Cc1c(F)cccc1Cl ZINC000780564433 1046393061 /nfs/dbraw/zinc/39/30/61/1046393061.db2.gz BJMYZVHCZMEKQF-UHFFFAOYSA-N 2 1 323.843 4.368 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001139197968 1046409367 /nfs/dbraw/zinc/40/93/67/1046409367.db2.gz CVBNJNPVLLUAJA-UHFFFAOYSA-N 2 1 321.468 4.218 20 0 DIADMP Cc1cc2ccccc2c(N[C@H]2CC[N@@H+](CC3CCCC3)C2)n1 ZINC001161186288 1046425255 /nfs/dbraw/zinc/42/52/55/1046425255.db2.gz INUGBJULTHOBPI-SFHVURJKSA-N 2 1 309.457 4.220 20 0 DIADMP CC1CCC([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)CC1 ZINC001168222045 1046432229 /nfs/dbraw/zinc/43/22/29/1046432229.db2.gz VUWJINGKNXDAII-WWFYLNGCSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)CC1 ZINC001168222045 1046432240 /nfs/dbraw/zinc/43/22/40/1046432240.db2.gz VUWJINGKNXDAII-WWFYLNGCSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)CC1 ZINC001168222045 1046432243 /nfs/dbraw/zinc/43/22/43/1046432243.db2.gz VUWJINGKNXDAII-WWFYLNGCSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([N@@H+](Cc2ccc(F)cc2)C2CCN(C)CC2)CC1 ZINC001168223916 1046432680 /nfs/dbraw/zinc/43/26/80/1046432680.db2.gz HJGMUNTXKZJEOK-UHFFFAOYSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H]1CCC[C@@H](C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202939854 1046454494 /nfs/dbraw/zinc/45/44/94/1046454494.db2.gz UJRLFDUQJHMKDP-UKAVVXHISA-N 2 1 314.517 4.138 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000124521554 1046455999 /nfs/dbraw/zinc/45/59/99/1046455999.db2.gz RMUWAWIPDYQWRX-DNVCBOLYSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000124521554 1046456007 /nfs/dbraw/zinc/45/60/07/1046456007.db2.gz RMUWAWIPDYQWRX-DNVCBOLYSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1csc2ccccc12 ZINC000125465118 1046468533 /nfs/dbraw/zinc/46/85/33/1046468533.db2.gz XZDQLOXIFQQZBJ-UHFFFAOYSA-N 2 1 313.470 4.318 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1csc2ccccc12 ZINC000125465118 1046468542 /nfs/dbraw/zinc/46/85/42/1046468542.db2.gz XZDQLOXIFQQZBJ-UHFFFAOYSA-N 2 1 313.470 4.318 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(F)cc1F ZINC000677239893 1046476554 /nfs/dbraw/zinc/47/65/54/1046476554.db2.gz OKKSGRAXBUYXJH-RLFYNMQTSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1F ZINC000677239893 1046476564 /nfs/dbraw/zinc/47/65/64/1046476564.db2.gz OKKSGRAXBUYXJH-RLFYNMQTSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)Cc1cccc(Cl)c1 ZINC000677242393 1046477309 /nfs/dbraw/zinc/47/73/09/1046477309.db2.gz ZYPDATVVEKCYFP-ROUUACIJSA-N 2 1 320.908 4.125 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)Cc1cccc(Cl)c1 ZINC000677242392 1046477328 /nfs/dbraw/zinc/47/73/28/1046477328.db2.gz ZYPDATVVEKCYFP-MSOLQXFVSA-N 2 1 320.908 4.125 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)C(C)(C)C ZINC000677241259 1046477763 /nfs/dbraw/zinc/47/77/63/1046477763.db2.gz OOVLEOOBXURJPB-LNLFQRSKSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-c2cccnc2)cc1 ZINC000677241690 1046477788 /nfs/dbraw/zinc/47/77/88/1046477788.db2.gz SZNPAZASGGRJSQ-DQLDELGASA-N 2 1 321.468 4.026 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c(OC)c2)CC1 ZINC001139616907 1046486769 /nfs/dbraw/zinc/48/67/69/1046486769.db2.gz SYRRWMZARJIBEV-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c(OC)c2)CC1 ZINC001139616907 1046486773 /nfs/dbraw/zinc/48/67/73/1046486773.db2.gz SYRRWMZARJIBEV-UHFFFAOYSA-N 2 1 324.896 4.045 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(Cl)c(F)c1 ZINC000536626328 1046538583 /nfs/dbraw/zinc/53/85/83/1046538583.db2.gz ZTJRGUZTJDUCMM-LBPRGKRZSA-N 2 1 309.816 4.115 20 0 DIADMP c1ccc2c(c1)cncc2C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001139895778 1046551058 /nfs/dbraw/zinc/55/10/58/1046551058.db2.gz MSOCAWXHZYQHFX-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP CC[N@H+](Cc1ccccc1F)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026980 1046572591 /nfs/dbraw/zinc/57/25/91/1046572591.db2.gz SEUWKLZFCFVTQE-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CC[N@@H+](Cc1ccccc1F)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026980 1046572605 /nfs/dbraw/zinc/57/26/05/1046572605.db2.gz SEUWKLZFCFVTQE-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139206 1046590621 /nfs/dbraw/zinc/59/06/21/1046590621.db2.gz BKKWRVHDXUVEQO-PMACEKPBSA-N 2 1 323.484 4.035 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139206 1046590633 /nfs/dbraw/zinc/59/06/33/1046590633.db2.gz BKKWRVHDXUVEQO-PMACEKPBSA-N 2 1 323.484 4.035 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc2cnccc21 ZINC001140144611 1046600397 /nfs/dbraw/zinc/60/03/97/1046600397.db2.gz FTQJQWNCILQBNL-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc2cnccc21 ZINC001140144611 1046600407 /nfs/dbraw/zinc/60/04/07/1046600407.db2.gz FTQJQWNCILQBNL-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc2cnccc21 ZINC001140144611 1046600413 /nfs/dbraw/zinc/60/04/13/1046600413.db2.gz FTQJQWNCILQBNL-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP c1ccc(C2CC2)c(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000678339454 1046620962 /nfs/dbraw/zinc/62/09/62/1046620962.db2.gz MNEPMXGUDYKEEJ-GHTZIAJQSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000678339454 1046620972 /nfs/dbraw/zinc/62/09/72/1046620972.db2.gz MNEPMXGUDYKEEJ-GHTZIAJQSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc(C2CC2)c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000678339454 1046620977 /nfs/dbraw/zinc/62/09/77/1046620977.db2.gz MNEPMXGUDYKEEJ-GHTZIAJQSA-N 2 1 310.485 4.013 20 0 DIADMP Fc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1F ZINC000642712916 1046631441 /nfs/dbraw/zinc/63/14/41/1046631441.db2.gz RTVXQERULBVHNU-UHFFFAOYSA-N 2 1 322.443 4.053 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)n1 ZINC000678427510 1046637693 /nfs/dbraw/zinc/63/76/93/1046637693.db2.gz LISBRRSUFDLJMM-QGZVFWFLSA-N 2 1 315.505 4.146 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H]2CCCc3ccc(F)cc32)CC1 ZINC000533114747 1046656042 /nfs/dbraw/zinc/65/60/42/1046656042.db2.gz DMAFUNOWMKLFLA-HXUWFJFHSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000245862337 1046661907 /nfs/dbraw/zinc/66/19/07/1046661907.db2.gz FOHQHSLNNYYOSI-ZWKOTPCHSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000245862337 1046661918 /nfs/dbraw/zinc/66/19/18/1046661918.db2.gz FOHQHSLNNYYOSI-ZWKOTPCHSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC000643468961 1046667763 /nfs/dbraw/zinc/66/77/63/1046667763.db2.gz RLYWEBNSIMGIQY-TYPHKJRUSA-N 2 1 306.453 4.065 20 0 DIADMP c1ccc(C([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643548030 1046673806 /nfs/dbraw/zinc/67/38/06/1046673806.db2.gz MBEXBVPSEZXOSW-LJQANCHMSA-N 2 1 306.453 4.040 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394592 1046716376 /nfs/dbraw/zinc/71/63/76/1046716376.db2.gz HILBCVFKVOLXNZ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394592 1046716387 /nfs/dbraw/zinc/71/63/87/1046716387.db2.gz HILBCVFKVOLXNZ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394592 1046716398 /nfs/dbraw/zinc/71/63/98/1046716398.db2.gz HILBCVFKVOLXNZ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394592 1046716410 /nfs/dbraw/zinc/71/64/10/1046716410.db2.gz HILBCVFKVOLXNZ-BLLLJJGKSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394593 1046716634 /nfs/dbraw/zinc/71/66/34/1046716634.db2.gz HILBCVFKVOLXNZ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394593 1046716648 /nfs/dbraw/zinc/71/66/48/1046716648.db2.gz HILBCVFKVOLXNZ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394593 1046716663 /nfs/dbraw/zinc/71/66/63/1046716663.db2.gz HILBCVFKVOLXNZ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)C1 ZINC000533394593 1046716678 /nfs/dbraw/zinc/71/66/78/1046716678.db2.gz HILBCVFKVOLXNZ-LRDDRELGSA-N 2 1 315.288 4.156 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(C)c(OC)c(Cl)c2)C1 ZINC000796703053 1046720482 /nfs/dbraw/zinc/72/04/82/1046720482.db2.gz QBQKYHCRPUCFMQ-HUUCEWRRSA-N 2 1 324.896 4.040 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533426205 1046720978 /nfs/dbraw/zinc/72/09/78/1046720978.db2.gz PNKIBNSQUUPOKY-OALUTQOASA-N 2 1 304.453 4.227 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(C)c(OC)c(Cl)c2)C1 ZINC000796703054 1046721219 /nfs/dbraw/zinc/72/12/19/1046721219.db2.gz QBQKYHCRPUCFMQ-LSDHHAIUSA-N 2 1 324.896 4.040 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533426205 1046720991 /nfs/dbraw/zinc/72/09/91/1046720991.db2.gz PNKIBNSQUUPOKY-OALUTQOASA-N 2 1 304.453 4.227 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC000533425952 1046721073 /nfs/dbraw/zinc/72/10/73/1046721073.db2.gz ULILGJMEJOZVMI-RBUKOAKNSA-N 2 1 300.490 4.091 20 0 DIADMP CC[N@@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860804 1046748368 /nfs/dbraw/zinc/74/83/68/1046748368.db2.gz YHIKTRUXCQLTQA-ZCNNSNEGSA-N 2 1 315.505 4.206 20 0 DIADMP CC[N@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860804 1046748377 /nfs/dbraw/zinc/74/83/77/1046748377.db2.gz YHIKTRUXCQLTQA-ZCNNSNEGSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@H+](C)[C@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860804 1046748390 /nfs/dbraw/zinc/74/83/90/1046748390.db2.gz YHIKTRUXCQLTQA-ZCNNSNEGSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@H]32)cc1)C(C)C ZINC000796860804 1046748400 /nfs/dbraw/zinc/74/84/00/1046748400.db2.gz YHIKTRUXCQLTQA-ZCNNSNEGSA-N 2 1 315.505 4.206 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1cccc(C(F)(F)F)c1 ZINC000678997713 1046752438 /nfs/dbraw/zinc/75/24/38/1046752438.db2.gz ISPPMXBIWXMDEX-BBRMVZONSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccncc1 ZINC000247493164 1046827877 /nfs/dbraw/zinc/82/78/77/1046827877.db2.gz WGRUHUUVUNZPQY-ZWKOTPCHSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1cc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)cc(Cl)n1 ZINC000797601204 1046866165 /nfs/dbraw/zinc/86/61/65/1046866165.db2.gz CEPGGUXRCCHFGU-UHFFFAOYSA-N 2 1 323.912 4.178 20 0 DIADMP CC(C)[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206581631 1046901663 /nfs/dbraw/zinc/90/16/63/1046901663.db2.gz KOZNGNDUVXRAAL-MRXNPFEDSA-N 2 1 315.288 4.346 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@H+](Cc1ccccn1)C1CCCCC1 ZINC001140805294 1046907884 /nfs/dbraw/zinc/90/78/84/1046907884.db2.gz ZSVAQGRKUKXUJE-UHFFFAOYSA-N 2 1 320.440 4.293 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@@H+](Cc1ccccn1)C1CCCCC1 ZINC001140805294 1046907892 /nfs/dbraw/zinc/90/78/92/1046907892.db2.gz ZSVAQGRKUKXUJE-UHFFFAOYSA-N 2 1 320.440 4.293 20 0 DIADMP Clc1ccc([C@H]2CC[N@H+](Cc3c[nH]c4cc[nH+]cc34)C2)cc1 ZINC001140805280 1046908009 /nfs/dbraw/zinc/90/80/09/1046908009.db2.gz ZDEYJHXKRUZIHM-AWEZNQCLSA-N 2 1 311.816 4.206 20 0 DIADMP Clc1ccc([C@H]2CC[N@@H+](Cc3c[nH]c4cc[nH+]cc34)C2)cc1 ZINC001140805280 1046908012 /nfs/dbraw/zinc/90/80/12/1046908012.db2.gz ZDEYJHXKRUZIHM-AWEZNQCLSA-N 2 1 311.816 4.206 20 0 DIADMP CC[N@H+](Cc1c[nH]c2cc[nH+]cc12)[C@@H](C)Cc1ccc(OC)cc1 ZINC001140801067 1046909235 /nfs/dbraw/zinc/90/92/35/1046909235.db2.gz AWUROIPYOGQLQG-HNNXBMFYSA-N 2 1 323.440 4.025 20 0 DIADMP CC[N@@H+](Cc1c[nH]c2cc[nH+]cc12)[C@@H](C)Cc1ccc(OC)cc1 ZINC001140801067 1046909243 /nfs/dbraw/zinc/90/92/43/1046909243.db2.gz AWUROIPYOGQLQG-HNNXBMFYSA-N 2 1 323.440 4.025 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2c[nH]c3cc[nH+]cc23)cc1 ZINC001140807350 1046911878 /nfs/dbraw/zinc/91/18/78/1046911878.db2.gz VZVGSUHFKQFEJG-FQEVSTJZSA-N 2 1 321.424 4.299 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2Cc2c[nH]c3cc[nH+]cc23)cc1 ZINC001140807350 1046911897 /nfs/dbraw/zinc/91/18/97/1046911897.db2.gz VZVGSUHFKQFEJG-FQEVSTJZSA-N 2 1 321.424 4.299 20 0 DIADMP C[C@H](CC[NH2+]C1CCC(F)(F)CC1)[N@@H+](C)Cc1ccccc1 ZINC000647188726 1046952078 /nfs/dbraw/zinc/95/20/78/1046952078.db2.gz GSTFPUSFJREIOD-OAHLLOKOSA-N 2 1 310.432 4.065 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274276 1046972690 /nfs/dbraw/zinc/97/26/90/1046972690.db2.gz CAWVGDHBOIXTGO-VXKWHMMOSA-N 2 1 320.480 4.270 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274276 1046972696 /nfs/dbraw/zinc/97/26/96/1046972696.db2.gz CAWVGDHBOIXTGO-VXKWHMMOSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274276 1046972704 /nfs/dbraw/zinc/97/27/04/1046972704.db2.gz CAWVGDHBOIXTGO-VXKWHMMOSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274276 1046972712 /nfs/dbraw/zinc/97/27/12/1046972712.db2.gz CAWVGDHBOIXTGO-VXKWHMMOSA-N 2 1 320.480 4.270 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccs1 ZINC000647343874 1046983845 /nfs/dbraw/zinc/98/38/45/1046983845.db2.gz FAFPDOPAWQOKFQ-FGTMMUONSA-N 2 1 314.498 4.134 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c2ccccc21 ZINC000647344457 1046985098 /nfs/dbraw/zinc/98/50/98/1046985098.db2.gz QXXUWRIJZRZVKS-DESBSMFKSA-N 2 1 320.480 4.170 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000647344634 1046985586 /nfs/dbraw/zinc/98/55/86/1046985586.db2.gz VWYZVFNNHCSSMA-RLLQIKCJSA-N 2 1 300.490 4.056 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c2ccccc21 ZINC000647344458 1046986638 /nfs/dbraw/zinc/98/66/38/1046986638.db2.gz QXXUWRIJZRZVKS-IIPCHUTBSA-N 2 1 320.480 4.170 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@]2(C)CC2(Cl)Cl)CC1 ZINC000827438619 1046989602 /nfs/dbraw/zinc/98/96/02/1046989602.db2.gz SOLPINCYVQISNP-HNNXBMFYSA-N 2 1 321.336 4.014 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)CC1CCC(C(C)(C)C)CC1 ZINC001168275718 1046992842 /nfs/dbraw/zinc/99/28/42/1046992842.db2.gz PEKLBAHKUQWZRB-UHFFFAOYSA-N 2 1 305.510 4.366 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)CC1CCC(C(C)(C)C)CC1 ZINC001168275718 1046992848 /nfs/dbraw/zinc/99/28/48/1046992848.db2.gz PEKLBAHKUQWZRB-UHFFFAOYSA-N 2 1 305.510 4.366 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3csc4ccccc34)C2)CC1 ZINC000798956863 1046993129 /nfs/dbraw/zinc/99/31/29/1046993129.db2.gz FEOMDEHJVNUJFJ-UHFFFAOYSA-N 2 1 314.498 4.209 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799179007 1047009137 /nfs/dbraw/zinc/00/91/37/1047009137.db2.gz XVAOLOBEPZTGLZ-AWEZNQCLSA-N 2 1 324.871 4.348 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1ccccn1 ZINC000270874992 1047009328 /nfs/dbraw/zinc/00/93/28/1047009328.db2.gz CTUDNOZIDBIOAO-QZTJIDSGSA-N 2 1 323.484 4.307 20 0 DIADMP Clc1ccccc1SCCC[N@@H+](C1CC1)C1CC[NH2+]CC1 ZINC000647814770 1047017206 /nfs/dbraw/zinc/01/72/06/1047017206.db2.gz FFDDSMARVWNOFV-UHFFFAOYSA-N 2 1 324.921 4.039 20 0 DIADMP CCc1ccccc1C[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001141226890 1047054053 /nfs/dbraw/zinc/05/40/53/1047054053.db2.gz OJVSXDQZBCAVIO-UHFFFAOYSA-N 2 1 322.496 4.345 20 0 DIADMP CCc1ccccc1C[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001141226890 1047054069 /nfs/dbraw/zinc/05/40/69/1047054069.db2.gz OJVSXDQZBCAVIO-UHFFFAOYSA-N 2 1 322.496 4.345 20 0 DIADMP CCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000536662653 1047055658 /nfs/dbraw/zinc/05/56/58/1047055658.db2.gz OWRKNMMFTBZTAK-XLIONFOSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000536662653 1047055669 /nfs/dbraw/zinc/05/56/69/1047055669.db2.gz OWRKNMMFTBZTAK-XLIONFOSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000536662653 1047055681 /nfs/dbraw/zinc/05/56/81/1047055681.db2.gz OWRKNMMFTBZTAK-XLIONFOSSA-N 2 1 318.505 4.028 20 0 DIADMP CC[N@H+](Cc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536711285 1047086143 /nfs/dbraw/zinc/08/61/43/1047086143.db2.gz YBIVWYGTRBRQCS-NRFANRHFSA-N 2 1 308.469 4.031 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536711285 1047086157 /nfs/dbraw/zinc/08/61/57/1047086157.db2.gz YBIVWYGTRBRQCS-NRFANRHFSA-N 2 1 308.469 4.031 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536711285 1047086171 /nfs/dbraw/zinc/08/61/71/1047086171.db2.gz YBIVWYGTRBRQCS-NRFANRHFSA-N 2 1 308.469 4.031 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379644651 1047089202 /nfs/dbraw/zinc/08/92/02/1047089202.db2.gz CMHKPILGQYXBEX-BWPNAZKDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379644651 1047089217 /nfs/dbraw/zinc/08/92/17/1047089217.db2.gz CMHKPILGQYXBEX-BWPNAZKDSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379646896 1047090037 /nfs/dbraw/zinc/09/00/37/1047090037.db2.gz JQRIKUFUDAJGET-NQIIRXRSSA-N 2 1 308.469 4.138 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379646896 1047090052 /nfs/dbraw/zinc/09/00/52/1047090052.db2.gz JQRIKUFUDAJGET-NQIIRXRSSA-N 2 1 308.469 4.138 20 0 DIADMP C[C@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccsc1 ZINC000379641848 1047094399 /nfs/dbraw/zinc/09/43/99/1047094399.db2.gz YPIMXLVTGUOUTA-HOTGVXAUSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccsc1 ZINC000379641848 1047094415 /nfs/dbraw/zinc/09/44/15/1047094415.db2.gz YPIMXLVTGUOUTA-HOTGVXAUSA-N 2 1 302.487 4.309 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841141 1047108083 /nfs/dbraw/zinc/10/80/83/1047108083.db2.gz WCQVJPRFMIJDOL-QAPCUYQASA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841141 1047108087 /nfs/dbraw/zinc/10/80/87/1047108087.db2.gz WCQVJPRFMIJDOL-QAPCUYQASA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841123 1047108107 /nfs/dbraw/zinc/10/81/07/1047108107.db2.gz WCQVJPRFMIJDOL-CRAIPNDOSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCC(F)(F)CC1 ZINC000536841123 1047108109 /nfs/dbraw/zinc/10/81/09/1047108109.db2.gz WCQVJPRFMIJDOL-CRAIPNDOSA-N 2 1 322.443 4.065 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+](C)C[C@H]1C)CCC2 ZINC000536847951 1047110062 /nfs/dbraw/zinc/11/00/62/1047110062.db2.gz UHKPUIPMKYEBCC-CDHQVMDDSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](C)C[C@H]1C)CCC2 ZINC000536847951 1047110068 /nfs/dbraw/zinc/11/00/68/1047110068.db2.gz UHKPUIPMKYEBCC-CDHQVMDDSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+](C)C[C@@H]1C)CCC2 ZINC000536847979 1047110100 /nfs/dbraw/zinc/11/01/00/1047110100.db2.gz UHKPUIPMKYEBCC-RYGJVYDSSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+](C)C[C@@H]1C)CCC2 ZINC000536847979 1047110103 /nfs/dbraw/zinc/11/01/03/1047110103.db2.gz UHKPUIPMKYEBCC-RYGJVYDSSA-N 2 1 300.490 4.117 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](C1c3ccccc3-c3ccccc31)CC2 ZINC000536994542 1047127775 /nfs/dbraw/zinc/12/77/75/1047127775.db2.gz FCZFHHSMBFHRPB-UHFFFAOYSA-N 2 1 318.464 4.317 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000537014112 1047131755 /nfs/dbraw/zinc/13/17/55/1047131755.db2.gz CBHAQBXVFRMXLD-XLIONFOSSA-N 2 1 300.490 4.095 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccccc1Oc1ccccc1 ZINC000537053160 1047134658 /nfs/dbraw/zinc/13/46/58/1047134658.db2.gz FQFCPGPTLIWOEN-MRXNPFEDSA-N 2 1 321.424 4.335 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](C)CSc1ccccc1 ZINC000649665585 1047158954 /nfs/dbraw/zinc/15/89/54/1047158954.db2.gz PLFZEZWEVPPIJP-INIZCTEOSA-N 2 1 317.502 4.084 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)CSc1ccccc1 ZINC000649665585 1047158963 /nfs/dbraw/zinc/15/89/63/1047158963.db2.gz PLFZEZWEVPPIJP-INIZCTEOSA-N 2 1 317.502 4.084 20 0 DIADMP CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537307871 1047165197 /nfs/dbraw/zinc/16/51/97/1047165197.db2.gz RPDVEBXDKCSRJI-IBGZPJMESA-N 2 1 320.908 4.149 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCc2ccccc21 ZINC000682068984 1047168249 /nfs/dbraw/zinc/16/82/49/1047168249.db2.gz BIQPSGOEALLWSS-DENIHFKCSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCc2ccccc21 ZINC000682068984 1047168253 /nfs/dbraw/zinc/16/82/53/1047168253.db2.gz BIQPSGOEALLWSS-DENIHFKCSA-N 2 1 320.480 4.128 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCc2ccccc21 ZINC000682068984 1047168259 /nfs/dbraw/zinc/16/82/59/1047168259.db2.gz BIQPSGOEALLWSS-DENIHFKCSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1csc2ccccc12 ZINC000838931347 1047177959 /nfs/dbraw/zinc/17/79/59/1047177959.db2.gz CEMMXYNIJIAKQQ-ZDUSSCGKSA-N 2 1 300.471 4.179 20 0 DIADMP CC(C)[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(F)ccc1F ZINC000650754906 1047279224 /nfs/dbraw/zinc/27/92/24/1047279224.db2.gz USNHETVNUBQALB-GOSISDBHSA-N 2 1 322.374 4.050 20 0 DIADMP C[N@H+](Cc1ccc2c(c1)Cc1ccccc1-2)CC1CC[NH+](C)CC1 ZINC001141740039 1047283585 /nfs/dbraw/zinc/28/35/85/1047283585.db2.gz SCCOGZYYTLOULF-UHFFFAOYSA-N 2 1 320.480 4.031 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390749241 1047300193 /nfs/dbraw/zinc/30/01/93/1047300193.db2.gz RMEMZJFWHYDYPY-AZUAARDMSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1cncs1 ZINC000897929875 1047302870 /nfs/dbraw/zinc/30/28/70/1047302870.db2.gz CTPCMIQBZNYCFW-AWEZNQCLSA-N 2 1 323.550 4.473 20 0 DIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808185 1047329699 /nfs/dbraw/zinc/32/96/99/1047329699.db2.gz IPPOMSAJAPTWRX-MSOLQXFVSA-N 2 1 323.484 4.130 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808185 1047329714 /nfs/dbraw/zinc/32/97/14/1047329714.db2.gz IPPOMSAJAPTWRX-MSOLQXFVSA-N 2 1 323.484 4.130 20 0 DIADMP CC[C@@H](CSc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623470841 1047420866 /nfs/dbraw/zinc/42/08/66/1047420866.db2.gz DYMPHOBUQFFAFV-HOTGVXAUSA-N 2 1 306.519 4.020 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccccc1-c1ccccc1 ZINC001142339137 1047433160 /nfs/dbraw/zinc/43/31/60/1047433160.db2.gz GQHJWIQGYBRYSX-UHFFFAOYSA-N 2 1 308.469 4.271 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001142383504 1047439982 /nfs/dbraw/zinc/43/99/82/1047439982.db2.gz IMXGRAMIGWTLSY-UHFFFAOYSA-N 2 1 308.469 4.066 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)o1 ZINC000119363781 1047452532 /nfs/dbraw/zinc/45/25/32/1047452532.db2.gz WSZFUNVUMLIHOY-OAHLLOKOSA-N 2 1 304.478 4.344 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C1CCC([NH+](C)C)CC1 ZINC001168328900 1047460551 /nfs/dbraw/zinc/46/05/51/1047460551.db2.gz MCWNCFPCEVFITD-LEOMRAHMSA-N 2 1 318.530 4.418 20 0 DIADMP C[NH+]1CCC([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001168334026 1047476898 /nfs/dbraw/zinc/47/68/98/1047476898.db2.gz IRRGVTLLOAQKAT-UHFFFAOYSA-N 2 1 306.881 4.050 20 0 DIADMP CC[NH+]1CCC([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001168333580 1047477993 /nfs/dbraw/zinc/47/79/93/1047477993.db2.gz ABGXUQQXMJVPPF-UHFFFAOYSA-N 2 1 320.908 4.440 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H](C2CCC2)C2CCCCC2)s1 ZINC000842762003 1047503476 /nfs/dbraw/zinc/50/34/76/1047503476.db2.gz DKLYRSJKCNYCEL-GOSISDBHSA-N 2 1 321.534 4.043 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168341746 1047509364 /nfs/dbraw/zinc/50/93/64/1047509364.db2.gz QXKVOESUYFQJAT-UHFFFAOYSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCCOc3c(C(C)C)cccc32)CC1 ZINC000121785850 1047524440 /nfs/dbraw/zinc/52/44/40/1047524440.db2.gz SSIPPVDTPGDZNH-IBGZPJMESA-N 2 1 316.489 4.098 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC001203136740 1047550342 /nfs/dbraw/zinc/55/03/42/1047550342.db2.gz SRGRAJXVGDLDLF-GSPCDJLXSA-N 2 1 306.881 4.065 20 0 DIADMP c1sc2ccccc2c1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000537649538 1047560834 /nfs/dbraw/zinc/56/08/34/1047560834.db2.gz ZAYKWCLTAYKKRJ-INIZCTEOSA-N 2 1 314.498 4.209 20 0 DIADMP COc1cccc([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)c1 ZINC000315100759 1047597898 /nfs/dbraw/zinc/59/78/98/1047597898.db2.gz NYUZJHUSCPFHAV-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP COc1cccc([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)c1 ZINC000315100759 1047597903 /nfs/dbraw/zinc/59/79/03/1047597903.db2.gz NYUZJHUSCPFHAV-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000315360000 1047604123 /nfs/dbraw/zinc/60/41/23/1047604123.db2.gz BNXBVJKLSYRDEI-CQSZACIVSA-N 2 1 323.550 4.276 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000315359997 1047604219 /nfs/dbraw/zinc/60/42/19/1047604219.db2.gz BNXBVJKLSYRDEI-AWEZNQCLSA-N 2 1 323.550 4.276 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(C(C)(C)C)cc1 ZINC000315556627 1047609767 /nfs/dbraw/zinc/60/97/67/1047609767.db2.gz XXFYFSUMFOMCJR-AQXGTKIOSA-N 2 1 300.490 4.260 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000537950236 1047645812 /nfs/dbraw/zinc/64/58/12/1047645812.db2.gz NOLNSTOZVAOUQA-CRAIPNDOSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000537950236 1047645815 /nfs/dbraw/zinc/64/58/15/1047645815.db2.gz NOLNSTOZVAOUQA-CRAIPNDOSA-N 2 1 322.443 4.207 20 0 DIADMP Cc1cc2[nH]ccc2c(N(CC[NH3+])c2cccc3ccccc32)[nH+]1 ZINC001154683981 1047655162 /nfs/dbraw/zinc/65/51/62/1047655162.db2.gz YMORSKUZJCCIKT-UHFFFAOYSA-N 2 1 316.408 4.121 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1 ZINC000538406768 1047674473 /nfs/dbraw/zinc/67/44/73/1047674473.db2.gz TXQWPBSTLOBKMA-SFHVURJKSA-N 2 1 304.453 4.155 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccc(F)c1F ZINC000538453657 1047679282 /nfs/dbraw/zinc/67/92/82/1047679282.db2.gz BBWCRXIFBNLOLJ-GJZGRUSLSA-N 2 1 310.432 4.128 20 0 DIADMP CC[C@H](C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000538719205 1047699482 /nfs/dbraw/zinc/69/94/82/1047699482.db2.gz RPVDLEBAZVFMRY-QUCCMNQESA-N 2 1 300.490 4.131 20 0 DIADMP CCCCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC)C2)cc1 ZINC000538750213 1047708062 /nfs/dbraw/zinc/70/80/62/1047708062.db2.gz LACFAFLGMWYOKS-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC)C2)cc1 ZINC000538750213 1047708066 /nfs/dbraw/zinc/70/80/66/1047708066.db2.gz LACFAFLGMWYOKS-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCOc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC)C2)cc1 ZINC000538750213 1047708069 /nfs/dbraw/zinc/70/80/69/1047708069.db2.gz LACFAFLGMWYOKS-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCOc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC)C2)cc1 ZINC000538750213 1047708073 /nfs/dbraw/zinc/70/80/73/1047708073.db2.gz LACFAFLGMWYOKS-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP C[N@H+]1CCC[C@@H](CCNc2nccc3cc(Cl)ccc32)C1 ZINC001156380187 1047709004 /nfs/dbraw/zinc/70/90/04/1047709004.db2.gz YJWZJXKERIWEDA-ZDUSSCGKSA-N 2 1 303.837 4.032 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2csc3ccccc23)C1 ZINC000538752231 1047709011 /nfs/dbraw/zinc/70/90/11/1047709011.db2.gz RYZGCWMIFGJKMM-INIZCTEOSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2csc3ccccc23)C1 ZINC000538752231 1047709016 /nfs/dbraw/zinc/70/90/16/1047709016.db2.gz RYZGCWMIFGJKMM-INIZCTEOSA-N 2 1 314.498 4.065 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000538752231 1047709026 /nfs/dbraw/zinc/70/90/26/1047709026.db2.gz RYZGCWMIFGJKMM-INIZCTEOSA-N 2 1 314.498 4.065 20 0 DIADMP CC[C@@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCCn1cc[nH+]c1C ZINC000538781411 1047709748 /nfs/dbraw/zinc/70/97/48/1047709748.db2.gz ACAYHWITSQFGRV-VQTJNVASSA-N 2 1 311.473 4.240 20 0 DIADMP CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1CCCn1cc[nH+]c1C ZINC000538781411 1047709756 /nfs/dbraw/zinc/70/97/56/1047709756.db2.gz ACAYHWITSQFGRV-VQTJNVASSA-N 2 1 311.473 4.240 20 0 DIADMP CC[C@H](C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000538796163 1047711755 /nfs/dbraw/zinc/71/17/55/1047711755.db2.gz STGCCZBGWICQBC-LMNJBCLMSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000538796163 1047711760 /nfs/dbraw/zinc/71/17/60/1047711760.db2.gz STGCCZBGWICQBC-LMNJBCLMSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000538796163 1047711763 /nfs/dbraw/zinc/71/17/63/1047711763.db2.gz STGCCZBGWICQBC-LMNJBCLMSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1cc(C)ccc1OC ZINC000538985564 1047722394 /nfs/dbraw/zinc/72/23/94/1047722394.db2.gz NLSGXYSFRAGNNW-HKUYNNGSSA-N 2 1 318.505 4.165 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000539062562 1047730246 /nfs/dbraw/zinc/73/02/46/1047730246.db2.gz ZEFOGVLXBPKANR-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000539062562 1047730250 /nfs/dbraw/zinc/73/02/50/1047730250.db2.gz ZEFOGVLXBPKANR-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000539048765 1047732818 /nfs/dbraw/zinc/73/28/18/1047732818.db2.gz CWCJFYRIWNHQLL-CVEARBPZSA-N 2 1 308.535 4.329 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000539069706 1047733968 /nfs/dbraw/zinc/73/39/68/1047733968.db2.gz SQIDUDDOSGKPGJ-FXAWDEMLSA-N 2 1 313.489 4.219 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477913616 1047757956 /nfs/dbraw/zinc/75/79/56/1047757956.db2.gz HFPCQBFYXZGBSW-AWEZNQCLSA-N 2 1 323.550 4.348 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cnc2ccsc2c1 ZINC000477920181 1047759760 /nfs/dbraw/zinc/75/97/60/1047759760.db2.gz FJJSJDUFORDUFO-CQSZACIVSA-N 2 1 317.502 4.069 20 0 DIADMP Cc1cccc2cc[nH+]c(N(CC(C)(C)C)C3CC[NH2+]CC3)c12 ZINC001157892539 1047762417 /nfs/dbraw/zinc/76/24/17/1047762417.db2.gz YVTDWQQJQLAKKE-UHFFFAOYSA-N 2 1 311.473 4.148 20 0 DIADMP FC(F)(F)c1ccc2c(NC=CC3CC[NH2+]CC3)cc[nH+]c2c1 ZINC001159144755 1047816681 /nfs/dbraw/zinc/81/66/81/1047816681.db2.gz KNKMZANWTLAMFL-WEVVVXLNSA-N 2 1 321.346 4.179 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961464 1047867841 /nfs/dbraw/zinc/86/78/41/1047867841.db2.gz YYHIHPOSONXJPZ-KDOFPFPSSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961464 1047867855 /nfs/dbraw/zinc/86/78/55/1047867855.db2.gz YYHIHPOSONXJPZ-KDOFPFPSSA-N 2 1 322.443 4.065 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)C2)c1 ZINC001182960165 1047868321 /nfs/dbraw/zinc/86/83/21/1047868321.db2.gz PISGKTFYXZJUAR-CUYAVPTFSA-N 2 1 316.464 4.068 20 0 DIADMP Fc1cccc(C2CC([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)C2)c1 ZINC001182960165 1047868338 /nfs/dbraw/zinc/86/83/38/1047868338.db2.gz PISGKTFYXZJUAR-CUYAVPTFSA-N 2 1 316.464 4.068 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961462 1047868522 /nfs/dbraw/zinc/86/85/22/1047868522.db2.gz YYHIHPOSONXJPZ-KBXCAEBGSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961462 1047868534 /nfs/dbraw/zinc/86/85/34/1047868534.db2.gz YYHIHPOSONXJPZ-KBXCAEBGSA-N 2 1 322.443 4.065 20 0 DIADMP CSc1ccc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001204142749 1047890479 /nfs/dbraw/zinc/89/04/79/1047890479.db2.gz UXSXCJPJDULCLX-SFHVURJKSA-N 2 1 318.530 4.249 20 0 DIADMP CSc1ccc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001204142749 1047890499 /nfs/dbraw/zinc/89/04/99/1047890499.db2.gz UXSXCJPJDULCLX-SFHVURJKSA-N 2 1 318.530 4.249 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)c1C ZINC001183268167 1047913033 /nfs/dbraw/zinc/91/30/33/1047913033.db2.gz GFBSSHJLSSMZOO-LIRRHRJNSA-N 2 1 320.546 4.498 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000479510562 1047914621 /nfs/dbraw/zinc/91/46/21/1047914621.db2.gz JJNXZTZUNKDHJW-ZYJFZYNKSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479510562 1047914624 /nfs/dbraw/zinc/91/46/24/1047914624.db2.gz JJNXZTZUNKDHJW-ZYJFZYNKSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000479537148 1047920839 /nfs/dbraw/zinc/92/08/39/1047920839.db2.gz GMFJSSXBYKLPHX-MLZLACJZSA-N 2 1 312.501 4.208 20 0 DIADMP Clc1ccc([C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)C2CC2)cc1 ZINC000479536475 1047921695 /nfs/dbraw/zinc/92/16/95/1047921695.db2.gz LTJOUEGKUSELLT-ACBHZAAOSA-N 2 1 318.892 4.398 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479558874 1047930309 /nfs/dbraw/zinc/93/03/09/1047930309.db2.gz YTEOQHFBZOCYEL-DZIBYMRMSA-N 2 1 300.490 4.478 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001183570523 1047942098 /nfs/dbraw/zinc/94/20/98/1047942098.db2.gz BWLWDIRZZQPAES-HFSMHLIXSA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001183570523 1047942107 /nfs/dbraw/zinc/94/21/07/1047942107.db2.gz BWLWDIRZZQPAES-HFSMHLIXSA-N 2 1 312.501 4.380 20 0 DIADMP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3[nH+]c(C)cc4[nH]ccc43)c2c1 ZINC001160013372 1047968521 /nfs/dbraw/zinc/96/85/21/1047968521.db2.gz WJMYIQYSNLBMHW-ZDUSSCGKSA-N 2 1 318.424 4.013 20 0 DIADMP c1cc(Nc2ccc3c[nH+]ccc3c2)cc(O[C@@H]2CCC[NH2+]C2)c1 ZINC001160217759 1048001032 /nfs/dbraw/zinc/00/10/32/1048001032.db2.gz AUHAVWSSONFOHB-HXUWFJFHSA-N 2 1 319.408 4.109 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000479911704 1048005078 /nfs/dbraw/zinc/00/50/78/1048005078.db2.gz LDYCLOYWXWGBNZ-IEBWSBKVSA-N 2 1 303.494 4.023 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000479911704 1048005093 /nfs/dbraw/zinc/00/50/93/1048005093.db2.gz LDYCLOYWXWGBNZ-IEBWSBKVSA-N 2 1 303.494 4.023 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@@H+](C)CCc1cc(Cl)cc(Cl)c1 ZINC001184196465 1048006596 /nfs/dbraw/zinc/00/65/96/1048006596.db2.gz HLIAQCPOXWFRTE-UHFFFAOYSA-N 2 1 317.304 4.056 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C/C=C/c1cc(C)c(C)cc1C ZINC001199219768 1048045680 /nfs/dbraw/zinc/04/56/80/1048045680.db2.gz OIRXPFHIBPZQDO-LFAOLKIESA-N 2 1 311.473 4.056 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C/C=C\c1cc(C)c(C)cc1C ZINC001199219770 1048046306 /nfs/dbraw/zinc/04/63/06/1048046306.db2.gz OIRXPFHIBPZQDO-XHPSBEMXSA-N 2 1 311.473 4.056 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cscc2Cl)C1 ZINC001199336167 1048058544 /nfs/dbraw/zinc/05/85/44/1048058544.db2.gz IHAJVQZLMBVNLO-CYBMUJFWSA-N 2 1 300.899 4.003 20 0 DIADMP CC(C)[C@@H](C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1 ZINC001199329335 1048058652 /nfs/dbraw/zinc/05/86/52/1048058652.db2.gz QRUBWTJISWMQSP-SVFBPWRDSA-N 2 1 316.533 4.384 20 0 DIADMP CCCC[N@@H+](Cc1cc(C)ccn1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174983099 1048080580 /nfs/dbraw/zinc/08/05/80/1048080580.db2.gz CLTSDKWDQYYGNB-UHFFFAOYSA-N 2 1 317.521 4.301 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC000480226198 1048097310 /nfs/dbraw/zinc/09/73/10/1048097310.db2.gz LMRAHOLMTXCBRM-UONOGXRCSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000480226198 1048097327 /nfs/dbraw/zinc/09/73/27/1048097327.db2.gz LMRAHOLMTXCBRM-UONOGXRCSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000480234306 1048098980 /nfs/dbraw/zinc/09/89/80/1048098980.db2.gz WCFCZRDGACFSEZ-CABCVRRESA-N 2 1 308.432 4.352 20 0 DIADMP CCc1nc(C)c([C@@H](C)NCCC[N@@H+](C)C2CCCCC2)s1 ZINC000480249803 1048104375 /nfs/dbraw/zinc/10/43/75/1048104375.db2.gz QHIVGMJPFUEEIP-CQSZACIVSA-N 2 1 323.550 4.319 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)s1 ZINC000480249803 1048104387 /nfs/dbraw/zinc/10/43/87/1048104387.db2.gz QHIVGMJPFUEEIP-CQSZACIVSA-N 2 1 323.550 4.319 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)s1 ZINC000480249803 1048104394 /nfs/dbraw/zinc/10/43/94/1048104394.db2.gz QHIVGMJPFUEEIP-CQSZACIVSA-N 2 1 323.550 4.319 20 0 DIADMP CCc1[nH+]c2ccccc2c(N2CCC(c3[nH]cc[nH+]3)CC2)c1C ZINC000554515018 1048120689 /nfs/dbraw/zinc/12/06/89/1048120689.db2.gz PCKMPCMBGTUDSD-UHFFFAOYSA-N 2 1 320.440 4.213 20 0 DIADMP CC(C)(C)CCNc1ccc2c(c1)[nH+]cn2[C@@H]1CCC[NH2+]CC1 ZINC001161677622 1048153805 /nfs/dbraw/zinc/15/38/05/1048153805.db2.gz ZXMOSPNZNLZCKR-MRXNPFEDSA-N 2 1 314.477 4.199 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H](Cc2ccccc2)C2CC2)C1 ZINC000480613486 1048191153 /nfs/dbraw/zinc/19/11/53/1048191153.db2.gz JPDOIXNCQZBPBT-NQIIRXRSSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1F ZINC000480611143 1048191654 /nfs/dbraw/zinc/19/16/54/1048191654.db2.gz KEPAVDHLWMVUGO-HUUCEWRRSA-N 2 1 310.432 4.128 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1F ZINC000480611137 1048192114 /nfs/dbraw/zinc/19/21/14/1048192114.db2.gz KEPAVDHLWMVUGO-CABCVRRESA-N 2 1 310.432 4.128 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000480618009 1048193417 /nfs/dbraw/zinc/19/34/17/1048193417.db2.gz ZZTLTTIFSYCREE-SJORKVTESA-N 2 1 304.478 4.000 20 0 DIADMP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000480630666 1048194907 /nfs/dbraw/zinc/19/49/07/1048194907.db2.gz MUVQZWJTNAAHMR-SJORKVTESA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1F ZINC000480625719 1048199384 /nfs/dbraw/zinc/19/93/84/1048199384.db2.gz NOTBYDKJFLMOJC-CABCVRRESA-N 2 1 310.432 4.270 20 0 DIADMP Cc1[nH]c2ccc(N(CC[NH3+])c3cccc4ccccc43)cc2[nH+]1 ZINC001162005341 1048212054 /nfs/dbraw/zinc/21/20/54/1048212054.db2.gz GSSXCNWUVWMLFP-UHFFFAOYSA-N 2 1 316.408 4.121 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(-c2ccccc2)c1 ZINC000480741754 1048233227 /nfs/dbraw/zinc/23/32/27/1048233227.db2.gz ACDFYPNSBXPSPS-MSOLQXFVSA-N 2 1 320.480 4.489 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000554991935 1048245297 /nfs/dbraw/zinc/24/52/97/1048245297.db2.gz SDRMYIURFSQIHO-RFQIPJPRSA-N 2 1 314.926 4.212 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000554991935 1048245310 /nfs/dbraw/zinc/24/53/10/1048245310.db2.gz SDRMYIURFSQIHO-RFQIPJPRSA-N 2 1 314.926 4.212 20 0 DIADMP C(CC[N@H+]1CCC[C@@H]1C1CCC1)C[NH+]1CCC[C@H]1C1CCC1 ZINC000555033324 1048256114 /nfs/dbraw/zinc/25/61/14/1048256114.db2.gz PKBLKPCQLJVOBS-BGYRXZFFSA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@@H+]1CCC[C@H]1C1CCC1)C[NH+]1CCC[C@@H]1C1CCC1 ZINC000555033324 1048256122 /nfs/dbraw/zinc/25/61/22/1048256122.db2.gz PKBLKPCQLJVOBS-BGYRXZFFSA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@H+]1CCC[C@H]1C1CCC1)C[NH+]1CCC[C@@H]1C1CCC1 ZINC000555033324 1048256134 /nfs/dbraw/zinc/25/61/34/1048256134.db2.gz PKBLKPCQLJVOBS-BGYRXZFFSA-N 2 1 304.522 4.296 20 0 DIADMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)C[C@@H]1CC=CCC1 ZINC001201421452 1048262374 /nfs/dbraw/zinc/26/23/74/1048262374.db2.gz BVAWWPCJCLISGD-LJQANCHMSA-N 2 1 312.501 4.187 20 0 DIADMP [NH3+][C@H]1CCC[C@@H](Nc2[nH+]ccc3cc(-c4ccc(F)cc4)[nH]c32)C1 ZINC001162394248 1048272678 /nfs/dbraw/zinc/27/26/78/1048272678.db2.gz OLPCKMNQEUFJCK-JKSUJKDBSA-N 2 1 324.403 4.051 20 0 DIADMP CC(C)(C)C[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001201441385 1048274525 /nfs/dbraw/zinc/27/45/25/1048274525.db2.gz DNFKHWDVMFEJDF-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)C[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001201441385 1048274532 /nfs/dbraw/zinc/27/45/32/1048274532.db2.gz DNFKHWDVMFEJDF-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)C[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001201441385 1048274542 /nfs/dbraw/zinc/27/45/42/1048274542.db2.gz DNFKHWDVMFEJDF-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)Cc2cccc(Cl)c2)CC1(C)C ZINC001201442050 1048275583 /nfs/dbraw/zinc/27/55/83/1048275583.db2.gz GPOOZKBTMKMLFR-KRWDZBQOSA-N 2 1 322.924 4.371 20 0 DIADMP Cn1c2ccccc2[nH+]c1Nc1ccc(C[NH+]2CCCCC2)cc1 ZINC001175361686 1048277398 /nfs/dbraw/zinc/27/73/98/1048277398.db2.gz UFQYSECHIXNMLP-UHFFFAOYSA-N 2 1 320.440 4.303 20 0 DIADMP Cn1c[nH+]c2cccc(Nc3ccc(C[NH+]4CCCCC4)cc3)c21 ZINC001175364029 1048280616 /nfs/dbraw/zinc/28/06/16/1048280616.db2.gz SXLZNLJXBRYGBS-UHFFFAOYSA-N 2 1 320.440 4.303 20 0 DIADMP CC[C@@H](C)C[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001201511770 1048291063 /nfs/dbraw/zinc/29/10/63/1048291063.db2.gz XQGTYUPMZOMPBK-GOSISDBHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026111 1048293874 /nfs/dbraw/zinc/29/38/74/1048293874.db2.gz SBHUHBFYYONIMJ-IAGOWNOFSA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026111 1048293888 /nfs/dbraw/zinc/29/38/88/1048293888.db2.gz SBHUHBFYYONIMJ-IAGOWNOFSA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030179 1048296009 /nfs/dbraw/zinc/29/60/09/1048296009.db2.gz AIVJOTNWLORECS-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030179 1048296022 /nfs/dbraw/zinc/29/60/22/1048296022.db2.gz AIVJOTNWLORECS-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccncc3)cc2)C1 ZINC000481045784 1048297062 /nfs/dbraw/zinc/29/70/62/1048297062.db2.gz GTDNOOUHBDPBCV-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccccc2SCC)C1 ZINC000481041832 1048299101 /nfs/dbraw/zinc/29/91/01/1048299101.db2.gz AXPLQJLHRCEGFN-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP CN(C)c1cc[nH+]cc1C[NH2+]C[C@@H]1CCC(C)(C)c2ccccc21 ZINC001201481556 1048300062 /nfs/dbraw/zinc/30/00/62/1048300062.db2.gz RMMLURMUASOCBF-INIZCTEOSA-N 2 1 323.484 4.092 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201541179 1048300529 /nfs/dbraw/zinc/30/05/29/1048300529.db2.gz DFFAWXUSRJPJCD-HKUYNNGSSA-N 2 1 318.505 4.392 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201541185 1048300911 /nfs/dbraw/zinc/30/09/11/1048300911.db2.gz DFFAWXUSRJPJCD-PKOBYXMFSA-N 2 1 318.505 4.392 20 0 DIADMP C[C@H]([NH2+]CCCCc1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000481051748 1048303479 /nfs/dbraw/zinc/30/34/79/1048303479.db2.gz CLZQACVAJDMNFH-AZUAARDMSA-N 2 1 314.517 4.252 20 0 DIADMP CC(C)CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)C1CC1 ZINC000555235892 1048305247 /nfs/dbraw/zinc/30/52/47/1048305247.db2.gz OGTUJHCXNOSMCB-KPFFTGBYSA-N 2 1 306.538 4.444 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC001201557455 1048314797 /nfs/dbraw/zinc/31/47/97/1048314797.db2.gz IUYGJPCYXUZCJA-LJQANCHMSA-N 2 1 314.517 4.412 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CCCC2)CC[N@H+]1C ZINC000481163112 1048315992 /nfs/dbraw/zinc/31/59/92/1048315992.db2.gz DNLPUJWRDRFQDF-YJBOKZPZSA-N 2 1 320.908 4.224 20 0 DIADMP CCC[C@@H](C)C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001201562942 1048316394 /nfs/dbraw/zinc/31/63/94/1048316394.db2.gz JMJXAQHRAVAWEZ-MRXNPFEDSA-N 2 1 306.469 4.158 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001201562942 1048316414 /nfs/dbraw/zinc/31/64/14/1048316414.db2.gz JMJXAQHRAVAWEZ-MRXNPFEDSA-N 2 1 306.469 4.158 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Cl)c2)CCCC1 ZINC000481184005 1048324165 /nfs/dbraw/zinc/32/41/65/1048324165.db2.gz RVWNKNVAUDIWJE-QAPCUYQASA-N 2 1 320.908 4.082 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Cl)c2)CCCC1 ZINC000481184007 1048324866 /nfs/dbraw/zinc/32/48/66/1048324866.db2.gz RVWNKNVAUDIWJE-YJBOKZPZSA-N 2 1 320.908 4.082 20 0 DIADMP CC(C)CC[N@@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001201620088 1048335405 /nfs/dbraw/zinc/33/54/05/1048335405.db2.gz GCSRJXICWPNBER-UFYCRDLUSA-N 2 1 300.490 4.143 20 0 DIADMP CC(C)CC[NH+]1C[C@H]2c3ccccc3[C@H]([N@H+](C)C(C)C)[C@H]2C1 ZINC001201620088 1048335421 /nfs/dbraw/zinc/33/54/21/1048335421.db2.gz GCSRJXICWPNBER-UFYCRDLUSA-N 2 1 300.490 4.143 20 0 DIADMP CC(C)CC[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001201620088 1048335437 /nfs/dbraw/zinc/33/54/37/1048335437.db2.gz GCSRJXICWPNBER-UFYCRDLUSA-N 2 1 300.490 4.143 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](CCc2ccccc2)c2ccccc2)C1 ZINC000481324276 1048367884 /nfs/dbraw/zinc/36/78/84/1048367884.db2.gz YATOKPFQGBZMBE-IRLDBZIGSA-N 2 1 322.496 4.292 20 0 DIADMP CC(C)C[N@@H+](CC[C@@H]1CCCC1(F)F)CC1CC[NH+](C)CC1 ZINC001175601279 1048368145 /nfs/dbraw/zinc/36/81/45/1048368145.db2.gz IYNUPYFULGIJCE-KRWDZBQOSA-N 2 1 316.480 4.112 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCCC(C)C)cc2)C1 ZINC000481337694 1048372964 /nfs/dbraw/zinc/37/29/64/1048372964.db2.gz NLRPILRSEOIJRW-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000481432026 1048400863 /nfs/dbraw/zinc/40/08/63/1048400863.db2.gz JASKDSQWGYUVTL-OAHLLOKOSA-N 2 1 318.530 4.466 20 0 DIADMP CCc1ccc[nH+]c1N[C@@H]1CC2(CC[NH2+]CC2)c2ccc(C)cc21 ZINC001163023257 1048403732 /nfs/dbraw/zinc/40/37/32/1048403732.db2.gz AQJXCYNAODOHEW-LJQANCHMSA-N 2 1 321.468 4.131 20 0 DIADMP Cc1c(C)n(-c2cc[nH+]cc2C(F)(F)F)c2ccc(C[NH3+])cc12 ZINC001163761682 1048521277 /nfs/dbraw/zinc/52/12/77/1048521277.db2.gz SSNGSFJHDWMNJD-UHFFFAOYSA-N 2 1 319.330 4.120 20 0 DIADMP C[NH+](C)C=Cc1ccncc1NC(=[NH2+])C12CC3CC(CC(C3)C1)C2 ZINC001163851545 1048538860 /nfs/dbraw/zinc/53/88/60/1048538860.db2.gz XYARCRFBDVHXAP-GQCTYLIASA-N 2 1 324.472 4.219 20 0 DIADMP CC[C@H]1CCC[C@@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001202456742 1048555716 /nfs/dbraw/zinc/55/57/16/1048555716.db2.gz LZHNXHRLAGEEHY-RBUKOAKNSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000482339860 1048590132 /nfs/dbraw/zinc/59/01/32/1048590132.db2.gz XQIMPKMJACCLQF-KBXCAEBGSA-N 2 1 306.881 4.037 20 0 DIADMP Cc1cccc(C[C@@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)c1 ZINC000482341724 1048591041 /nfs/dbraw/zinc/59/10/41/1048591041.db2.gz CFSDVNCPSZFLKN-PZJWPPBQSA-N 2 1 314.517 4.026 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CC(C)(C)c3ccccc32)C1 ZINC000482330516 1048591701 /nfs/dbraw/zinc/59/17/01/1048591701.db2.gz UTKVOPUYXPFVAE-QFBILLFUSA-N 2 1 300.490 4.119 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3F)c1 ZINC000482353744 1048593490 /nfs/dbraw/zinc/59/34/90/1048593490.db2.gz RZKRBKUVTQCSLQ-FQEVSTJZSA-N 2 1 312.432 4.055 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccnc(Cl)c1 ZINC000781426479 1048605105 /nfs/dbraw/zinc/60/51/05/1048605105.db2.gz OUEYGDVEKOPVOY-OFQRWUPVSA-N 2 1 321.896 4.039 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000482448289 1048608292 /nfs/dbraw/zinc/60/82/92/1048608292.db2.gz FSCJAPCJWSDSRQ-PZJWPPBQSA-N 2 1 322.496 4.210 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482438075 1048609690 /nfs/dbraw/zinc/60/96/90/1048609690.db2.gz LESARQUQTXOFHI-CTNGQTDRSA-N 2 1 322.496 4.210 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2CCC(C3CCC3)CC2)cn1 ZINC000850038821 1048613106 /nfs/dbraw/zinc/61/31/06/1048613106.db2.gz QSLNPCMPHXEVGA-UHFFFAOYSA-N 2 1 324.472 4.024 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC001176282418 1048617327 /nfs/dbraw/zinc/61/73/27/1048617327.db2.gz XLZRGNUEWIFZKF-GJZGRUSLSA-N 2 1 315.848 4.007 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC001176282418 1048617335 /nfs/dbraw/zinc/61/73/35/1048617335.db2.gz XLZRGNUEWIFZKF-GJZGRUSLSA-N 2 1 315.848 4.007 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000482862485 1048691355 /nfs/dbraw/zinc/69/13/55/1048691355.db2.gz DVMIANAHCMIFMV-SJLPKXTDSA-N 2 1 318.530 4.021 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC000668168750 1048706306 /nfs/dbraw/zinc/70/63/06/1048706306.db2.gz ABGBKPSEDOLUQG-UHFFFAOYSA-N 2 1 324.472 4.147 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC000668168750 1048706316 /nfs/dbraw/zinc/70/63/16/1048706316.db2.gz ABGBKPSEDOLUQG-UHFFFAOYSA-N 2 1 324.472 4.147 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@H]3CCC(C)(C)C[C@@H]3C)CC2)[nH+]1 ZINC000483159000 1048744251 /nfs/dbraw/zinc/74/42/51/1048744251.db2.gz MTRXVPRMJYOTAP-YJBOKZPZSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc2ccccc2n1 ZINC000483149794 1048747966 /nfs/dbraw/zinc/74/79/66/1048747966.db2.gz BNCOXWMRXMCHJA-DNVCBOLYSA-N 2 1 313.489 4.252 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000194608044 1048761377 /nfs/dbraw/zinc/76/13/77/1048761377.db2.gz BQOSSJTWHHPZRY-WSTZPKSXSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734589 1048848668 /nfs/dbraw/zinc/84/86/68/1048848668.db2.gz WAMQYIHBFHJYFO-ZETOZRRWSA-N 2 1 301.261 4.127 20 0 DIADMP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC001191071518 1048837288 /nfs/dbraw/zinc/83/72/88/1048837288.db2.gz WVJIUVYXOPPODS-IBGZPJMESA-N 2 1 314.517 4.292 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC001191071518 1048837300 /nfs/dbraw/zinc/83/73/00/1048837300.db2.gz WVJIUVYXOPPODS-IBGZPJMESA-N 2 1 314.517 4.292 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206295192 1048840133 /nfs/dbraw/zinc/84/01/33/1048840133.db2.gz LTHJLLKQMITLBY-IEBWSBKVSA-N 2 1 312.542 4.059 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000483700744 1048842886 /nfs/dbraw/zinc/84/28/86/1048842886.db2.gz KYVABEKGWSCREY-LNLFQRSKSA-N 2 1 318.505 4.245 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000483700744 1048842907 /nfs/dbraw/zinc/84/29/07/1048842907.db2.gz KYVABEKGWSCREY-LNLFQRSKSA-N 2 1 318.505 4.245 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734589 1048848662 /nfs/dbraw/zinc/84/86/62/1048848662.db2.gz WAMQYIHBFHJYFO-ZETOZRRWSA-N 2 1 301.261 4.127 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483737217 1048853098 /nfs/dbraw/zinc/85/30/98/1048853098.db2.gz UBIWGHYQEAGBOS-JLSDUUJJSA-N 2 1 308.897 4.500 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483737217 1048853113 /nfs/dbraw/zinc/85/31/13/1048853113.db2.gz UBIWGHYQEAGBOS-JLSDUUJJSA-N 2 1 308.897 4.500 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC001177245010 1048853559 /nfs/dbraw/zinc/85/35/59/1048853559.db2.gz KLHVFPOYPTWSLT-CTNGQTDRSA-N 2 1 314.517 4.239 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC001177245010 1048853574 /nfs/dbraw/zinc/85/35/74/1048853574.db2.gz KLHVFPOYPTWSLT-CTNGQTDRSA-N 2 1 314.517 4.239 20 0 DIADMP CC[C@H]1CCC[C@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001177245507 1048853832 /nfs/dbraw/zinc/85/38/32/1048853832.db2.gz UCZACFDLGKLDOK-RXVVDRJESA-N 2 1 314.517 4.383 20 0 DIADMP CC[C@H]1CCC[C@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001177245507 1048853849 /nfs/dbraw/zinc/85/38/49/1048853849.db2.gz UCZACFDLGKLDOK-RXVVDRJESA-N 2 1 314.517 4.383 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC[N@@H+]1C ZINC000483747993 1048855972 /nfs/dbraw/zinc/85/59/72/1048855972.db2.gz QARTVXOZCCZFJT-JKIFEVAISA-N 2 1 314.498 4.351 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC[N@H+]1C ZINC000483747993 1048855982 /nfs/dbraw/zinc/85/59/82/1048855982.db2.gz QARTVXOZCCZFJT-JKIFEVAISA-N 2 1 314.498 4.351 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001177299556 1048859602 /nfs/dbraw/zinc/85/96/02/1048859602.db2.gz VQCJGRAOARNREN-KKXNLOMOSA-N 2 1 306.538 4.447 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC001177299535 1048859889 /nfs/dbraw/zinc/85/98/89/1048859889.db2.gz UKVKKVIKGQFQDE-UXHICEINSA-N 2 1 316.533 4.500 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cscc1Cl ZINC001177299268 1048862054 /nfs/dbraw/zinc/86/20/54/1048862054.db2.gz MYPOPESGXOVUBY-CYBMUJFWSA-N 2 1 300.899 4.146 20 0 DIADMP CCc1nc2c(s1)[C@H]([NH2+]CCC[NH+](C(C)C)C(C)C)CCC2 ZINC000483858160 1048876486 /nfs/dbraw/zinc/87/64/86/1048876486.db2.gz DGYXHWAHMJJJQX-OAHLLOKOSA-N 2 1 323.550 4.181 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2CC[C@@H]2CCC[NH+]2C)cc1 ZINC001191180962 1048889998 /nfs/dbraw/zinc/88/99/98/1048889998.db2.gz BRTUERIMGSBRBY-IHPCNDPISA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[NH+]2CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001191180962 1048890017 /nfs/dbraw/zinc/89/00/17/1048890017.db2.gz BRTUERIMGSBRBY-IHPCNDPISA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@@H](C)CCC[NH+]2CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001191180962 1048890037 /nfs/dbraw/zinc/89/00/37/1048890037.db2.gz BRTUERIMGSBRBY-IHPCNDPISA-N 2 1 300.490 4.252 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000163371308 1048890590 /nfs/dbraw/zinc/89/05/90/1048890590.db2.gz TUACGYSINCKOHU-AWEZNQCLSA-N 2 1 308.432 4.352 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)C[NH2+]C2CCC3(CCC3)CC2)C1 ZINC001177491790 1048898800 /nfs/dbraw/zinc/89/88/00/1048898800.db2.gz GSQKPFSUCLUUEF-CALCHBBNSA-N 2 1 306.538 4.445 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206304587 1048900434 /nfs/dbraw/zinc/90/04/34/1048900434.db2.gz NACIRPCJKCSRSA-GOSISDBHSA-N 2 1 302.487 4.161 20 0 DIADMP C[N@@H+](CCCC1CCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191235118 1048905560 /nfs/dbraw/zinc/90/55/60/1048905560.db2.gz YNQUBNUHCACGMD-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCCC1CCC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001191235118 1048905577 /nfs/dbraw/zinc/90/55/77/1048905577.db2.gz YNQUBNUHCACGMD-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CCCC1CCC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001191235118 1048905595 /nfs/dbraw/zinc/90/55/95/1048905595.db2.gz YNQUBNUHCACGMD-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cc(C)cc(C)c3)CC2)[nH+]c1 ZINC000484174872 1048910214 /nfs/dbraw/zinc/91/02/14/1048910214.db2.gz KRXDRAGNRXCHIK-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001191382390 1048930494 /nfs/dbraw/zinc/93/04/94/1048930494.db2.gz WQVJDEBPIKLVTI-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001191382390 1048930495 /nfs/dbraw/zinc/93/04/95/1048930495.db2.gz WQVJDEBPIKLVTI-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382390 1048930502 /nfs/dbraw/zinc/93/05/02/1048930502.db2.gz WQVJDEBPIKLVTI-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382390 1048930509 /nfs/dbraw/zinc/93/05/09/1048930509.db2.gz WQVJDEBPIKLVTI-PXNSSMCTSA-N 2 1 300.490 4.162 20 0 DIADMP CCCc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)s1 ZINC001177737614 1048939400 /nfs/dbraw/zinc/93/94/00/1048939400.db2.gz UKCQKDLJZJDPST-UHFFFAOYSA-N 2 1 316.514 4.442 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000484486700 1048944777 /nfs/dbraw/zinc/94/47/77/1048944777.db2.gz FCRABZDRBBVSHN-XHSDSOJGSA-N 2 1 300.446 4.265 20 0 DIADMP Cc1ccc(C[NH+]2CCC([N@H+](C)Cc3ccccc3)CC2)c(C)c1 ZINC001203735659 1048985894 /nfs/dbraw/zinc/98/58/94/1048985894.db2.gz FPMSGTZYSKPKOS-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1ccc(C[NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)c(C)c1 ZINC001203735659 1048985906 /nfs/dbraw/zinc/98/59/06/1048985906.db2.gz FPMSGTZYSKPKOS-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCSC(C)(C)C ZINC001178272413 1049010064 /nfs/dbraw/zinc/01/00/64/1049010064.db2.gz SRKWULHNRVROOX-UHFFFAOYSA-N 2 1 322.562 4.266 20 0 DIADMP c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]([NH2+]C[C@H]4CC=CCC4)[C@@H]3C2)cc1 ZINC001178285414 1049012676 /nfs/dbraw/zinc/01/26/76/1049012676.db2.gz QELSUCHLRVGEFG-VXSCBNMQSA-N 2 1 324.512 4.233 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001203856546 1049015608 /nfs/dbraw/zinc/01/56/08/1049015608.db2.gz LDQDOMIEOZNOPG-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001203856546 1049015623 /nfs/dbraw/zinc/01/56/23/1049015623.db2.gz LDQDOMIEOZNOPG-QFBILLFUSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1c2ccccc2sc1[C@@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001178436286 1049032146 /nfs/dbraw/zinc/03/21/46/1049032146.db2.gz HMUJGASCWFEOOG-BZUAXINKSA-N 2 1 314.498 4.487 20 0 DIADMP CCc1cccc(Cl)c1C[NH2+]CC1(C[NH+](C)C)CCCC1 ZINC001178449213 1049032860 /nfs/dbraw/zinc/03/28/60/1049032860.db2.gz LWPWULCLZVYAJH-UHFFFAOYSA-N 2 1 308.897 4.114 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](C2CCCCC2)CC1 ZINC001203918423 1049032976 /nfs/dbraw/zinc/03/29/76/1049032976.db2.gz XKILVVBLZJFNHI-UHFFFAOYSA-N 2 1 304.453 4.055 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](C2CCCCC2)CC1 ZINC001203918423 1049032986 /nfs/dbraw/zinc/03/29/86/1049032986.db2.gz XKILVVBLZJFNHI-UHFFFAOYSA-N 2 1 304.453 4.055 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC001178408933 1049035459 /nfs/dbraw/zinc/03/54/59/1049035459.db2.gz KFFMAZYOSJWDMG-UHFFFAOYSA-N 2 1 320.908 4.393 20 0 DIADMP COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)C[C@H]2C[C@@H]([NH3+])C2)cc1 ZINC000904340639 1049036448 /nfs/dbraw/zinc/03/64/48/1049036448.db2.gz AOGAHJAMUASEEK-MDZRGWNJSA-N 2 1 324.468 4.092 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc3ccccc3c2)CC1 ZINC001204000299 1049058612 /nfs/dbraw/zinc/05/86/12/1049058612.db2.gz CNLYXRWTXWFMFQ-UHFFFAOYSA-N 2 1 310.485 4.392 20 0 DIADMP c1[nH]c2ccccc2c1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001204043750 1049071309 /nfs/dbraw/zinc/07/13/09/1049071309.db2.gz YMXVRCIYOSKCJU-SFHVURJKSA-N 2 1 311.473 4.008 20 0 DIADMP C[C@@H]1CCC[C@H](CC[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC001192325503 1049078338 /nfs/dbraw/zinc/07/83/38/1049078338.db2.gz ONYDWBAYCLLBIL-FTEYMNFISA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001192325503 1049078353 /nfs/dbraw/zinc/07/83/53/1049078353.db2.gz ONYDWBAYCLLBIL-FTEYMNFISA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001192325503 1049078370 /nfs/dbraw/zinc/07/83/70/1049078370.db2.gz ONYDWBAYCLLBIL-FTEYMNFISA-N 2 1 304.522 4.152 20 0 DIADMP Cn1c2ccccc2[nH+]c1Nc1cccc(C[NH+]2CCCCC2)c1 ZINC001204088145 1049080892 /nfs/dbraw/zinc/08/08/92/1049080892.db2.gz XFGKTSNSQASQQE-UHFFFAOYSA-N 2 1 320.440 4.303 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001178811783 1049092429 /nfs/dbraw/zinc/09/24/29/1049092429.db2.gz XXXKLKVXJHZUCR-IHJVYAAUSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CC(C(C)(C)C)C2)CC[N@H+]1Cc1ccccc1 ZINC001178811783 1049092444 /nfs/dbraw/zinc/09/24/44/1049092444.db2.gz XXXKLKVXJHZUCR-IHJVYAAUSA-N 2 1 314.517 4.454 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H]1CCCc2ccccc2C1 ZINC001178774220 1049094367 /nfs/dbraw/zinc/09/43/67/1049094367.db2.gz HDQHJFKBJVOHFB-SFTDATJTSA-N 2 1 314.517 4.034 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001204174652 1049105414 /nfs/dbraw/zinc/10/54/14/1049105414.db2.gz ZMOSXPYDDAAHCB-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC001204174652 1049105420 /nfs/dbraw/zinc/10/54/20/1049105420.db2.gz ZMOSXPYDDAAHCB-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC001204174652 1049105424 /nfs/dbraw/zinc/10/54/24/1049105424.db2.gz ZMOSXPYDDAAHCB-QFIPXVFZSA-N 2 1 320.480 4.093 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001178916697 1049109919 /nfs/dbraw/zinc/10/99/19/1049109919.db2.gz NAJCMPWJOOXPSW-KSVUCXBSSA-N 2 1 306.881 4.065 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCc2cccs2)CC1)CC(C)C ZINC001192491058 1049111120 /nfs/dbraw/zinc/11/11/20/1049111120.db2.gz ZKZDPCDSYFIMCK-UHFFFAOYSA-N 2 1 322.562 4.371 20 0 DIADMP C[N@H+]1C[C@@H](C[NH2+][C@@H]2CCCC(C)(C)CC2)[C@H](c2ccccc2)C1 ZINC001179015752 1049122426 /nfs/dbraw/zinc/12/24/26/1049122426.db2.gz LGDPWMKNDTUCJN-AQNXPRMDSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)CC(C)(C)C1 ZINC001179015839 1049122668 /nfs/dbraw/zinc/12/26/68/1049122668.db2.gz ONKXPMKVEQHDSV-RNQOJCNYSA-N 2 1 314.517 4.136 20 0 DIADMP CCC[N@@H+](Cc1ccc(OCCC[NH+](C)C)cc1)[C@H](C)CC ZINC001204266954 1049126479 /nfs/dbraw/zinc/12/64/79/1049126479.db2.gz NYCPIAXHMBGWCN-QGZVFWFLSA-N 2 1 306.494 4.028 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCc2ccc(Cl)cc2)cc1 ZINC001192917881 1049149214 /nfs/dbraw/zinc/14/92/14/1049149214.db2.gz HDPLCCYEYLQQSG-UHFFFAOYSA-N 2 1 316.876 4.076 20 0 DIADMP CC(C)[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Cl)cc1F ZINC001193260142 1049192403 /nfs/dbraw/zinc/19/24/03/1049192403.db2.gz GADBHMBMXKXUDT-RHSMWYFYSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[C@@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(Cl)cc1F ZINC001193260142 1049192407 /nfs/dbraw/zinc/19/24/07/1049192407.db2.gz GADBHMBMXKXUDT-RHSMWYFYSA-N 2 1 312.860 4.250 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@@H+]1C ZINC001204608908 1049198891 /nfs/dbraw/zinc/19/88/91/1049198891.db2.gz LIGDXASZJRXRCP-BEFAXECRSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@H+]1C ZINC001204608908 1049198896 /nfs/dbraw/zinc/19/88/96/1049198896.db2.gz LIGDXASZJRXRCP-BEFAXECRSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608908 1049198901 /nfs/dbraw/zinc/19/89/01/1049198901.db2.gz LIGDXASZJRXRCP-BEFAXECRSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608908 1049198902 /nfs/dbraw/zinc/19/89/02/1049198902.db2.gz LIGDXASZJRXRCP-BEFAXECRSA-N 2 1 312.501 4.356 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615534 1049200313 /nfs/dbraw/zinc/20/03/13/1049200313.db2.gz IVEJXWGIJBITOC-CSNYQSHPSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001204615534 1049200326 /nfs/dbraw/zinc/20/03/26/1049200326.db2.gz IVEJXWGIJBITOC-CSNYQSHPSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001204615534 1049200342 /nfs/dbraw/zinc/20/03/42/1049200342.db2.gz IVEJXWGIJBITOC-CSNYQSHPSA-N 2 1 314.517 4.431 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+](C)CC[C@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204615534 1049200349 /nfs/dbraw/zinc/20/03/49/1049200349.db2.gz IVEJXWGIJBITOC-CSNYQSHPSA-N 2 1 314.517 4.431 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc(C[NH+](C)C)cc2)nc1 ZINC001204625356 1049205078 /nfs/dbraw/zinc/20/50/78/1049205078.db2.gz HENCTPLMFVZNLK-OAQYLSRUSA-N 2 1 323.484 4.357 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@@H]3CC[C@@H]4C[N@H+](C)C[C@H]34)c2)cc1 ZINC001179815314 1049210584 /nfs/dbraw/zinc/21/05/84/1049210584.db2.gz FXQWNFBTOPEUNU-BHIFYINESA-N 2 1 320.480 4.092 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001204657160 1049214837 /nfs/dbraw/zinc/21/48/37/1049214837.db2.gz AJCCSYXWUGFOLE-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001179878333 1049225948 /nfs/dbraw/zinc/22/59/48/1049225948.db2.gz OIVJZOHLSATOHT-QUCCMNQESA-N 2 1 306.538 4.401 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000195614666 1049241301 /nfs/dbraw/zinc/24/13/01/1049241301.db2.gz CJUXCIHEZQDXEV-HNNXBMFYSA-N 2 1 300.490 4.262 20 0 DIADMP C[C@@H](C[N@H+]1CCCC2(CC[NH2+]CC2)C1)c1cccc2ccccc21 ZINC001204727831 1049243039 /nfs/dbraw/zinc/24/30/39/1049243039.db2.gz REFKLDIYWUBCRQ-SFHVURJKSA-N 2 1 322.496 4.409 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)s1 ZINC001204734751 1049243597 /nfs/dbraw/zinc/24/35/97/1049243597.db2.gz DHXMUUCJFYWVAS-UHFFFAOYSA-N 2 1 306.519 4.056 20 0 DIADMP c1cc(C[N@H+]2CCC[C@H]2CC2CCCCC2)n(-c2cc[nH+]cc2)n1 ZINC001204730244 1049243769 /nfs/dbraw/zinc/24/37/69/1049243769.db2.gz OKCYOLIERDFCBM-IBGZPJMESA-N 2 1 324.472 4.202 20 0 DIADMP c1cc(C[N@@H+]2CCC[C@H]2CC2CCCCC2)n(-c2cc[nH+]cc2)n1 ZINC001204730244 1049243781 /nfs/dbraw/zinc/24/37/81/1049243781.db2.gz OKCYOLIERDFCBM-IBGZPJMESA-N 2 1 324.472 4.202 20 0 DIADMP CC(C)(C)C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000195651634 1049245072 /nfs/dbraw/zinc/24/50/72/1049245072.db2.gz AYGFKBGUGFIVOD-APWZRJJASA-N 2 1 300.490 4.238 20 0 DIADMP c1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000195651602 1049245421 /nfs/dbraw/zinc/24/54/21/1049245421.db2.gz PDMUWXNQHQIYHH-UWJYYQICSA-N 2 1 312.501 4.382 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H](C)C2CCCCC2)CC1 ZINC001193869985 1049276132 /nfs/dbraw/zinc/27/61/32/1049276132.db2.gz CAHSRMSKXCQXJP-KRWDZBQOSA-N 2 1 316.489 4.450 20 0 DIADMP C[C@H]1C[C@H](N(C)CC[C@H]2CCCC[N@H+]2C)c2ccsc2S1 ZINC001180099258 1049285202 /nfs/dbraw/zinc/28/52/02/1049285202.db2.gz XIKGBECDBUWRAY-LZWOXQAQSA-N 2 1 324.559 4.480 20 0 DIADMP CC1(C)CCC(c2ccc(C[N@@H+]3C[C@@H]4[C@@H](C[NH3+])[C@@H]4C3)cc2)CC1 ZINC001204918893 1049311068 /nfs/dbraw/zinc/31/10/68/1049311068.db2.gz OSCADKAKMMRTKS-OWZKRDHZSA-N 2 1 312.501 4.007 20 0 DIADMP CC[C@H](C)[C@H](C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1)OC ZINC001180225659 1049311298 /nfs/dbraw/zinc/31/12/98/1049311298.db2.gz VNKUMVOOPTWAMG-BJLQDIEVSA-N 2 1 324.553 4.024 20 0 DIADMP C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000485698074 1049321736 /nfs/dbraw/zinc/32/17/36/1049321736.db2.gz XUBYLWHFHJICDG-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000485698074 1049321744 /nfs/dbraw/zinc/32/17/44/1049321744.db2.gz XUBYLWHFHJICDG-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP CCC(CC)C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC001194152468 1049329928 /nfs/dbraw/zinc/32/99/28/1049329928.db2.gz BNKSVPIBWZBRPX-QGZVFWFLSA-N 2 1 308.535 4.246 20 0 DIADMP CCC(CC)C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C)s2)C1 ZINC001194152468 1049329937 /nfs/dbraw/zinc/32/99/37/1049329937.db2.gz BNKSVPIBWZBRPX-QGZVFWFLSA-N 2 1 308.535 4.246 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](C[C@@H]2CC=C(CCC=C(C)C)CC2)C1 ZINC001205001193 1049337534 /nfs/dbraw/zinc/33/75/34/1049337534.db2.gz PBSSNCHGUXDPHL-UXHICEINSA-N 2 1 304.522 4.391 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cccc(Oc3ccc(C)cc3)c2)C1 ZINC001205009568 1049339359 /nfs/dbraw/zinc/33/93/59/1049339359.db2.gz XIOMADILBWDTKM-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccc(Oc3ccc(C)cc3)c2)C1 ZINC001205009568 1049339374 /nfs/dbraw/zinc/33/93/74/1049339374.db2.gz XIOMADILBWDTKM-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccc(-c3c(C)cccc3C)c2)C1 ZINC001205018706 1049343538 /nfs/dbraw/zinc/34/35/38/1049343538.db2.gz YIRPQWLFPVSGNR-FQEVSTJZSA-N 2 1 322.496 4.402 20 0 DIADMP Cc1ccccc1[C@H](C)[N@@H+](CCCc1c[nH+]cn1C)CC(C)C ZINC001194299128 1049354133 /nfs/dbraw/zinc/35/41/33/1049354133.db2.gz DEOFEEUBDXGMHI-SFHVURJKSA-N 2 1 313.489 4.380 20 0 DIADMP Cc1ccccc1[C@H](C)[N@H+](CCCc1c[nH+]cn1C)CC(C)C ZINC001194299128 1049354140 /nfs/dbraw/zinc/35/41/40/1049354140.db2.gz DEOFEEUBDXGMHI-SFHVURJKSA-N 2 1 313.489 4.380 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000485871606 1049359133 /nfs/dbraw/zinc/35/91/33/1049359133.db2.gz QDKALBRYKRIHOZ-NJYVYQBISA-N 2 1 323.484 4.240 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000485871606 1049359140 /nfs/dbraw/zinc/35/91/40/1049359140.db2.gz QDKALBRYKRIHOZ-NJYVYQBISA-N 2 1 323.484 4.240 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2[C@@H](C)CC[C@H]2C[NH3+])c1 ZINC001205082644 1049368395 /nfs/dbraw/zinc/36/83/95/1049368395.db2.gz HRQCKXGBPHXUNJ-PXNSSMCTSA-N 2 1 308.469 4.282 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2[C@@H](C)CC[C@H]2C[NH3+])c1 ZINC001205082644 1049368409 /nfs/dbraw/zinc/36/84/09/1049368409.db2.gz HRQCKXGBPHXUNJ-PXNSSMCTSA-N 2 1 308.469 4.282 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2Cl)CC1 ZINC001205101464 1049377914 /nfs/dbraw/zinc/37/79/14/1049377914.db2.gz FTKYOJQHELVLRK-MRXNPFEDSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)CC1 ZINC001205116484 1049383511 /nfs/dbraw/zinc/38/35/11/1049383511.db2.gz AENOKSSEVLVISO-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@H]([NH3+])CC2)c1 ZINC001205124432 1049386663 /nfs/dbraw/zinc/38/66/63/1049386663.db2.gz RLXVGXASXMJYOF-FQEVSTJZSA-N 2 1 308.469 4.284 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)C[C@H]1C[NH3+] ZINC001205156456 1049396531 /nfs/dbraw/zinc/39/65/31/1049396531.db2.gz XHUBHTDNHSFXLX-KBXCAEBGSA-N 2 1 314.860 4.034 20 0 DIADMP CC(C)[C@@](C)(Cc1ccc(Cl)cc1)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001194625031 1049397104 /nfs/dbraw/zinc/39/71/04/1049397104.db2.gz JNAFQTMPPZTOPV-RTBURBONSA-N 2 1 322.924 4.371 20 0 DIADMP c1ccc([C@@H]2CCCC[N@@H+]2Cc2ccc3c(c2)C[NH2+]CC3)cc1 ZINC001205171627 1049402059 /nfs/dbraw/zinc/40/20/59/1049402059.db2.gz USLXFDWMSOCMKD-NRFANRHFSA-N 2 1 306.453 4.060 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001205265283 1049421942 /nfs/dbraw/zinc/42/19/42/1049421942.db2.gz PMDQMHPHFMNSMC-FQEVSTJZSA-N 2 1 310.441 4.182 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)CC1 ZINC001205296304 1049430955 /nfs/dbraw/zinc/43/09/55/1049430955.db2.gz LOTBMVBUCJHZQP-FQEVSTJZSA-N 2 1 300.490 4.438 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)cc1 ZINC001205303339 1049432862 /nfs/dbraw/zinc/43/28/62/1049432862.db2.gz CRHZPNCPVHKFQL-PKOBYXMFSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C[C@H]1C[NH3+] ZINC001205304777 1049433037 /nfs/dbraw/zinc/43/30/37/1049433037.db2.gz PQUYSVDVFUFLLP-DZGCQCFKSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@H]1CC[NH2+]CC[N@@H+]1Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001205333200 1049441056 /nfs/dbraw/zinc/44/10/56/1049441056.db2.gz XPRLMHRQJLPRRK-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1CC[NH2+]CC[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001205332846 1049441567 /nfs/dbraw/zinc/44/15/67/1049441567.db2.gz UTGJXRABSRRDPP-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP CC(C)[C@@H]1CCC[C@@H]1[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001181314797 1049465063 /nfs/dbraw/zinc/46/50/63/1049465063.db2.gz ICIPSVWQCCLRNB-ACRUOGEOSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1ccc(CC[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001181314279 1049465314 /nfs/dbraw/zinc/46/53/14/1049465314.db2.gz CTJHIPFIZQECTC-JOCHJYFZSA-N 2 1 322.496 4.039 20 0 DIADMP CN(CCC[N@@H+](C)C[C@@H]1CCCC(C)(C)C1)Cc1ccco1 ZINC001181590626 1049491125 /nfs/dbraw/zinc/49/11/25/1049491125.db2.gz OVYUHNDWDCUBIY-QGZVFWFLSA-N 2 1 306.494 4.250 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(Cl)cs2)C1 ZINC000486951725 1049496684 /nfs/dbraw/zinc/49/66/84/1049496684.db2.gz UKFLGGCYJTVQKW-CYBMUJFWSA-N 2 1 300.899 4.003 20 0 DIADMP Clc1ccc(CC[NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001205555913 1049496916 /nfs/dbraw/zinc/49/69/16/1049496916.db2.gz XYGBWKTXWHOZSH-IBGZPJMESA-N 2 1 320.908 4.269 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc(F)cc1 ZINC001205555064 1049497609 /nfs/dbraw/zinc/49/76/09/1049497609.db2.gz OGFAXVNYDYQMOY-OXJNMPFZSA-N 2 1 318.480 4.316 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001205554471 1049497780 /nfs/dbraw/zinc/49/77/80/1049497780.db2.gz GPGLBOVKVKPOFJ-OXJNMPFZSA-N 2 1 318.480 4.143 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)cc1 ZINC001205603088 1049509351 /nfs/dbraw/zinc/50/93/51/1049509351.db2.gz NQIMLPKVZPOHQM-IEBWSBKVSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccs3)s2)CC[C@H]1C[NH3+] ZINC001205618119 1049510741 /nfs/dbraw/zinc/51/07/41/1049510741.db2.gz RQQFCKRFYIRAFZ-KGLIPLIRSA-N 2 1 320.527 4.283 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2Oc2ccccc2)CC[C@H]1C[NH3+] ZINC001205616437 1049512320 /nfs/dbraw/zinc/51/23/20/1049512320.db2.gz FPYQHHSPZMXHIJ-MSOLQXFVSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC[C@H]1C[NH3+] ZINC001205626979 1049513513 /nfs/dbraw/zinc/51/35/13/1049513513.db2.gz LDLBRRSRKSNVBA-UTKZUKDTSA-N 2 1 308.469 4.160 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)C1 ZINC001205622410 1049513564 /nfs/dbraw/zinc/51/35/64/1049513564.db2.gz SAVONTWBRLWPEG-MSOLQXFVSA-N 2 1 316.489 4.450 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC[C@H]1C[NH3+] ZINC001205625352 1049513591 /nfs/dbraw/zinc/51/35/91/1049513591.db2.gz BBYDDHXRLPSFQG-YJBOKZPZSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)CC[C@H]1C[NH3+] ZINC001205626733 1049514138 /nfs/dbraw/zinc/51/41/38/1049514138.db2.gz IRQUZQQVTMVZLB-HKUYNNGSSA-N 2 1 308.469 4.160 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205638356 1049517483 /nfs/dbraw/zinc/51/74/83/1049517483.db2.gz MZEGBSMZCSCCNP-DZGCQCFKSA-N 2 1 302.487 4.017 20 0 DIADMP Cc1cc(Cl)c(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)c(Cl)c1 ZINC001205639446 1049518442 /nfs/dbraw/zinc/51/84/42/1049518442.db2.gz ZAMVSLCNOPTXBY-QWHCGFSZSA-N 2 1 315.288 4.109 20 0 DIADMP CC[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205677452 1049530022 /nfs/dbraw/zinc/53/00/22/1049530022.db2.gz CPAVCSWIVJZFTL-VQTJNVASSA-N 2 1 302.506 4.396 20 0 DIADMP CC1=CCC[C@@H](C)[C@@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205678916 1049530329 /nfs/dbraw/zinc/53/03/29/1049530329.db2.gz WKPGSNCNNJNUIC-YLJYHZDGSA-N 2 1 300.490 4.172 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703141 1049536923 /nfs/dbraw/zinc/53/69/23/1049536923.db2.gz WTCWQDQUDHBVHY-HNAYVOBHSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703141 1049536930 /nfs/dbraw/zinc/53/69/30/1049536930.db2.gz WTCWQDQUDHBVHY-HNAYVOBHSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703141 1049536943 /nfs/dbraw/zinc/53/69/43/1049536943.db2.gz WTCWQDQUDHBVHY-HNAYVOBHSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc2oc3ccccc3c2c1 ZINC001205703141 1049536955 /nfs/dbraw/zinc/53/69/55/1049536955.db2.gz WTCWQDQUDHBVHY-HNAYVOBHSA-N 2 1 322.452 4.358 20 0 DIADMP C[C@H](C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1)C(C)(C)C ZINC001205702803 1049538003 /nfs/dbraw/zinc/53/80/03/1049538003.db2.gz OPRROTLIHHBADD-QGZVFWFLSA-N 2 1 302.506 4.265 20 0 DIADMP C[C@H](C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1)C(C)(C)C ZINC001205702803 1049538016 /nfs/dbraw/zinc/53/80/16/1049538016.db2.gz OPRROTLIHHBADD-QGZVFWFLSA-N 2 1 302.506 4.265 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)C1 ZINC001181932897 1049549762 /nfs/dbraw/zinc/54/97/62/1049549762.db2.gz JVUJIKOWLMLGFF-MHJFOBGBSA-N 2 1 314.517 4.341 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]C1CCC(C(F)(F)F)CC1 ZINC001181934218 1049551924 /nfs/dbraw/zinc/55/19/24/1049551924.db2.gz ROHFASNYPZXDOD-GPANFISMSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@@H](C)CC[C@@H]1C[NH3+] ZINC001205826927 1049577308 /nfs/dbraw/zinc/57/73/08/1049577308.db2.gz DMXNXRIUUBAYRI-QFBILLFUSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1C[C@@H](C)CC[C@@H]1C[NH3+] ZINC001205826927 1049577322 /nfs/dbraw/zinc/57/73/22/1049577322.db2.gz DMXNXRIUUBAYRI-QFBILLFUSA-N 2 1 308.469 4.221 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@H](C[NH3+])[C@@H]2C)cc1 ZINC001205904512 1049597011 /nfs/dbraw/zinc/59/70/11/1049597011.db2.gz VQMRIFVGQLSADU-PKOBYXMFSA-N 2 1 318.505 4.205 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC001205927411 1049604349 /nfs/dbraw/zinc/60/43/49/1049604349.db2.gz WOMLQCIYUBHYCU-VSZNYVQBSA-N 2 1 320.546 4.340 20 0 DIADMP Cc1cccc(N(C)c2ccc(C[N@@H+]3CCCC[C@H]([NH3+])C3)cc2)c1 ZINC001205937582 1049605991 /nfs/dbraw/zinc/60/59/91/1049605991.db2.gz ARAVAJSWESDJFL-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP Cc1cccc(N(C)c2ccc(C[N@H+]3CCCC[C@H]([NH3+])C3)cc2)c1 ZINC001205937582 1049606001 /nfs/dbraw/zinc/60/60/01/1049606001.db2.gz ARAVAJSWESDJFL-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP Cc1cccc(N(C)c2ccc(C[N@@H+]3CCCC[C@@H]([NH3+])C3)cc2)c1 ZINC001205937583 1049606020 /nfs/dbraw/zinc/60/60/20/1049606020.db2.gz ARAVAJSWESDJFL-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP Cc1cccc(N(C)c2ccc(C[N@H+]3CCCC[C@@H]([NH3+])C3)cc2)c1 ZINC001205937583 1049606027 /nfs/dbraw/zinc/60/60/27/1049606027.db2.gz ARAVAJSWESDJFL-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP [NH3+][C@@H]1CCCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001205932326 1049606072 /nfs/dbraw/zinc/60/60/72/1049606072.db2.gz QNEYTRPWVGTHQT-OAHLLOKOSA-N 2 1 310.466 4.368 20 0 DIADMP [NH3+][C@H]1CCCC[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001205932034 1049606267 /nfs/dbraw/zinc/60/62/67/1049606267.db2.gz NSQXILGTXPLQMK-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@H]1CCCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001205932034 1049606268 /nfs/dbraw/zinc/60/62/68/1049606268.db2.gz NSQXILGTXPLQMK-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP Cc1ccccc1N(C)c1ccc(C[N@@H+]2CCCC[C@@H]([NH3+])C2)cc1 ZINC001205937590 1049607196 /nfs/dbraw/zinc/60/71/96/1049607196.db2.gz ASYATYMWLDQBLZ-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CCCC[C@@H]([NH3+])C2)cc1 ZINC001205937590 1049607200 /nfs/dbraw/zinc/60/72/00/1049607200.db2.gz ASYATYMWLDQBLZ-LJQANCHMSA-N 2 1 323.484 4.076 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)c2)c1 ZINC000774167309 1049617662 /nfs/dbraw/zinc/61/76/62/1049617662.db2.gz BZHKURJALLVVCL-FRIKZZABSA-N 2 1 320.480 4.377 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2Oc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206005981 1049627695 /nfs/dbraw/zinc/62/76/95/1049627695.db2.gz ZTLVNYKKSUKHOP-ZWKOTPCHSA-N 2 1 324.468 4.286 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@H](C[NH3+])[C@@H](C)C3)cc2)o1 ZINC001206011275 1049627916 /nfs/dbraw/zinc/62/79/16/1049627916.db2.gz BETURMQMRDRHCU-HNAYVOBHSA-N 2 1 312.457 4.062 20 0 DIADMP C[C@H]1C[N@@H+](Cc2sc(Cl)c3ccccc32)CCC[C@H]1C[NH3+] ZINC001206037877 1049636033 /nfs/dbraw/zinc/63/60/33/1049636033.db2.gz YSJBKEURSHLAFL-STQMWFEESA-N 2 1 322.905 4.362 20 0 DIADMP CC1(C)CCC[C@H]1[C@@H]1CC[N@@H+](Cc2cc3c(s2)CC[NH2+]C3)C1 ZINC000864049196 1049638250 /nfs/dbraw/zinc/63/82/50/1049638250.db2.gz CYXXXGSHERKCEL-PBHICJAKSA-N 2 1 318.530 4.042 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC001206056131 1049642212 /nfs/dbraw/zinc/64/22/12/1049642212.db2.gz PIACNGRPOBCMED-RLLQIKCJSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC001206056131 1049642216 /nfs/dbraw/zinc/64/22/16/1049642216.db2.gz PIACNGRPOBCMED-RLLQIKCJSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1 ZINC000488435856 1049655042 /nfs/dbraw/zinc/65/50/42/1049655042.db2.gz SNUJIGCYEZUUEA-IXDOHACOSA-N 2 1 312.567 4.151 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)CC1 ZINC001206154151 1049670905 /nfs/dbraw/zinc/67/09/05/1049670905.db2.gz GWOHPRDVWJHDKW-GBESFXJTSA-N 2 1 308.485 4.221 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)CC1 ZINC001206154151 1049670917 /nfs/dbraw/zinc/67/09/17/1049670917.db2.gz GWOHPRDVWJHDKW-GBESFXJTSA-N 2 1 308.485 4.221 20 0 DIADMP CC[N@@H+](CCCCOC(C)(C)C)Cc1ccc(C[NH+](C)C)cc1 ZINC001196623693 1049676635 /nfs/dbraw/zinc/67/66/35/1049676635.db2.gz SVRFHECYKUJGPF-UHFFFAOYSA-N 2 1 320.521 4.165 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@](C)(C[NH3+])CC1)c1cccc2ccccc21 ZINC001206296798 1049703248 /nfs/dbraw/zinc/70/32/48/1049703248.db2.gz UTTJSWOIJUOMRO-UWJYYQICSA-N 2 1 310.485 4.394 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001206311724 1049707501 /nfs/dbraw/zinc/70/75/01/1049707501.db2.gz SSSMCOYVKSORDP-JOCHJYFZSA-N 2 1 320.480 4.209 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@@H](C)CCc1ccco1)C1CCCCC1 ZINC001182743744 1049709513 /nfs/dbraw/zinc/70/95/13/1049709513.db2.gz RTCLVGKILJAYIH-KRWDZBQOSA-N 2 1 306.494 4.235 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@](C)(C[NH3+])CC3)cc2)o1 ZINC001206317262 1049710347 /nfs/dbraw/zinc/71/03/47/1049710347.db2.gz DZTMNVZTGNMARF-HXUWFJFHSA-N 2 1 312.457 4.206 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC001206318470 1049710573 /nfs/dbraw/zinc/71/05/73/1049710573.db2.gz PZRIDPSVSYRDDD-OAQYLSRUSA-N 2 1 308.469 4.305 20 0 DIADMP CC[N@@H+](CCC[NH2+]C[C@H](OC)C1CCCCC1)C1CCCCC1 ZINC001182743331 1049710841 /nfs/dbraw/zinc/71/08/41/1049710841.db2.gz OXQXBTWORWOPIE-FQEVSTJZSA-N 2 1 324.553 4.216 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC001206335310 1049714451 /nfs/dbraw/zinc/71/44/51/1049714451.db2.gz GDNXKOOKHXSJIU-SKWUIDRYSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC001206335310 1049714457 /nfs/dbraw/zinc/71/44/57/1049714457.db2.gz GDNXKOOKHXSJIU-SKWUIDRYSA-N 2 1 320.908 4.439 20 0 DIADMP C[N@H+](CCCCc1ccccc1)CCCC[NH+]1CCCCC1 ZINC001197285128 1049738417 /nfs/dbraw/zinc/73/84/17/1049738417.db2.gz NTLFOHZWRTUTAT-UHFFFAOYSA-N 2 1 302.506 4.207 20 0 DIADMP [NH3+]CCC1CC[NH+](Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001206506621 1049744089 /nfs/dbraw/zinc/74/40/89/1049744089.db2.gz HPWDVGSNFJRWAB-UHFFFAOYSA-N 2 1 321.679 4.208 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@@](C)(C[NH3+])C1)c1cccc2ccccc21 ZINC001206542077 1049752842 /nfs/dbraw/zinc/75/28/42/1049752842.db2.gz QVMJPUOYJZBNAB-UTKZUKDTSA-N 2 1 310.485 4.394 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@@](C)(C[NH3+])C1)c1cccc2ccccc21 ZINC001206542078 1049753654 /nfs/dbraw/zinc/75/36/54/1049753654.db2.gz QVMJPUOYJZBNAB-UWJYYQICSA-N 2 1 310.485 4.394 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206548792 1049753676 /nfs/dbraw/zinc/75/36/76/1049753676.db2.gz JCGMJEOWQFDWTA-SFHVURJKSA-N 2 1 302.487 4.161 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206548791 1049754063 /nfs/dbraw/zinc/75/40/63/1049754063.db2.gz JCGMJEOWQFDWTA-GOSISDBHSA-N 2 1 302.487 4.161 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1(C)C ZINC001197483951 1049754229 /nfs/dbraw/zinc/75/42/29/1049754229.db2.gz TXLLFGFWRHASDR-KRWDZBQOSA-N 2 1 317.864 4.113 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1(C)C ZINC001197483951 1049754240 /nfs/dbraw/zinc/75/42/40/1049754240.db2.gz TXLLFGFWRHASDR-KRWDZBQOSA-N 2 1 317.864 4.113 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)C1 ZINC001206556089 1049755865 /nfs/dbraw/zinc/75/58/65/1049755865.db2.gz NSGJAPCZRXPVCD-QFIPXVFZSA-N 2 1 320.480 4.209 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)C1 ZINC001206566300 1049756787 /nfs/dbraw/zinc/75/67/87/1049756787.db2.gz ZHDJBDRSAWGIBE-JOCHJYFZSA-N 2 1 322.496 4.228 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206565561 1049757277 /nfs/dbraw/zinc/75/72/77/1049757277.db2.gz ULFAOWJWJCYZBH-GOSISDBHSA-N 2 1 302.487 4.161 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3cccs3)cc2)C1 ZINC001206563729 1049757408 /nfs/dbraw/zinc/75/74/08/1049757408.db2.gz IBJNSQYCEVZLRG-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP CC(C)[N@@H+](Cc1cc2c(cccc2Cl)[nH]1)[C@H]1CCC[NH2+]CC1 ZINC001206579921 1049760715 /nfs/dbraw/zinc/76/07/15/1049760715.db2.gz AZKZPLCJYUZANF-HNNXBMFYSA-N 2 1 319.880 4.174 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206575337 1049760930 /nfs/dbraw/zinc/76/09/30/1049760930.db2.gz WBHQOGWQJYEGGP-MRXNPFEDSA-N 2 1 315.288 4.253 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206575337 1049760935 /nfs/dbraw/zinc/76/09/35/1049760935.db2.gz WBHQOGWQJYEGGP-MRXNPFEDSA-N 2 1 315.288 4.253 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1C(F)(F)F)[C@@H]1CCC[NH2+]CC1 ZINC001206582701 1049762670 /nfs/dbraw/zinc/76/26/70/1049762670.db2.gz OMXRGJDLRFQEIB-OAHLLOKOSA-N 2 1 314.395 4.058 20 0 DIADMP CC(C)COc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001206591065 1049763488 /nfs/dbraw/zinc/76/34/88/1049763488.db2.gz QCKCNZYWFGPITL-IBGZPJMESA-N 2 1 318.505 4.074 20 0 DIADMP CCCCOc1cccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1 ZINC001206588576 1049763918 /nfs/dbraw/zinc/76/39/18/1049763918.db2.gz BXEGCHFZWDCFOV-LJQANCHMSA-N 2 1 318.505 4.218 20 0 DIADMP CCn1ccc2ccc(C[N@@H+](C(C)C)[C@H]3CCC[NH2+]CC3)cc21 ZINC001206590000 1049764064 /nfs/dbraw/zinc/76/40/64/1049764064.db2.gz KETTUVSRCUNWPX-IBGZPJMESA-N 2 1 313.489 4.014 20 0 DIADMP CCc1cccc2c(C[N@@H+](C(C)C)[C@H]3CCC[NH2+]CC3)c[nH]c21 ZINC001206591692 1049764217 /nfs/dbraw/zinc/76/42/17/1049764217.db2.gz VIGVWNSNAIRZMF-SFHVURJKSA-N 2 1 313.489 4.083 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2cccnc2)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206591827 1049764358 /nfs/dbraw/zinc/76/43/58/1049764358.db2.gz WLWXZPANLYTTEN-OAQYLSRUSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2c(F)cccc12)[C@@H]1CCC[NH2+]CC1 ZINC001206597403 1049765803 /nfs/dbraw/zinc/76/58/03/1049765803.db2.gz CBCXFVMGDSRGCH-QGZVFWFLSA-N 2 1 314.448 4.331 20 0 DIADMP CC(C)[N@@H+](Cc1ccc2ccsc2c1)[C@H]1CCC[NH2+]CC1 ZINC001206599300 1049766234 /nfs/dbraw/zinc/76/62/34/1049766234.db2.gz QMHPVVKRTBRQHJ-KRWDZBQOSA-N 2 1 302.487 4.254 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2sccc21)[C@H]1CCC[NH2+]CC1 ZINC001206599744 1049767179 /nfs/dbraw/zinc/76/71/79/1049767179.db2.gz WVBOQDYHZYLPLW-INIZCTEOSA-N 2 1 302.487 4.254 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001206647152 1049774426 /nfs/dbraw/zinc/77/44/26/1049774426.db2.gz FWNAUONRVHOTFU-SFHVURJKSA-N 2 1 300.490 4.295 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]C2CCC(C)(c3ccccc3)CC2)C1 ZINC001206680441 1049778549 /nfs/dbraw/zinc/77/85/49/1049778549.db2.gz JXPMFUDRCRMIQS-PELRDEGISA-N 2 1 314.517 4.208 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001206727474 1049784721 /nfs/dbraw/zinc/78/47/21/1049784721.db2.gz IMUJPJIXCUNDEC-JBACZVJFSA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)C1CC1 ZINC001206727474 1049784730 /nfs/dbraw/zinc/78/47/30/1049784730.db2.gz IMUJPJIXCUNDEC-JBACZVJFSA-N 2 1 312.501 4.379 20 0 DIADMP Cc1csc2sc(C[N@@H+]3C[C@H](C[NH3+])CC[C@@H]3C)c(C)c12 ZINC001206769078 1049794891 /nfs/dbraw/zinc/79/48/91/1049794891.db2.gz NHKGILVOTFWFGJ-AAEUAGOBSA-N 2 1 308.516 4.139 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001206771394 1049797230 /nfs/dbraw/zinc/79/72/30/1049797230.db2.gz WOFSRTUYHITINI-GJZGRUSLSA-N 2 1 308.425 4.145 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490058951 1049797133 /nfs/dbraw/zinc/79/71/33/1049797133.db2.gz TYVLFGICNNOSKP-PXNSSMCTSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490058951 1049797139 /nfs/dbraw/zinc/79/71/39/1049797139.db2.gz TYVLFGICNNOSKP-PXNSSMCTSA-N 2 1 311.473 4.158 20 0 DIADMP CC[C@H](C[N@H+]1CCCC[C@@H]1[C@H](C)C[NH+](C)C)c1ccccc1 ZINC001206800783 1049801400 /nfs/dbraw/zinc/80/14/00/1049801400.db2.gz MYKZHJDACAQCSD-QWFCFKBJSA-N 2 1 302.506 4.232 20 0 DIADMP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC001206799788 1049801671 /nfs/dbraw/zinc/80/16/71/1049801671.db2.gz GBFYBYJYGLAZEE-AYWYSENESA-N 2 1 314.517 4.232 20 0 DIADMP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1ccc2c(c1)CCCC2 ZINC001206800100 1049802494 /nfs/dbraw/zinc/80/24/94/1049802494.db2.gz HWPOLKGGFPJEML-LAUBAEHRSA-N 2 1 314.517 4.118 20 0 DIADMP Cc1c(C[N@@H+]2C[C@H](C[NH3+])CC[C@H]2C)cccc1-c1ccccc1 ZINC001206805286 1049802980 /nfs/dbraw/zinc/80/29/80/1049802980.db2.gz BQTVGRXESIJMGL-AEFFLSMTSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1C[C@H](C[NH3+])CC[C@H]1C ZINC001206808147 1049803614 /nfs/dbraw/zinc/80/36/14/1049803614.db2.gz JVUSKSYXGIKUBY-MSOLQXFVSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccccc1CCc1ccccc1 ZINC001206805677 1049804622 /nfs/dbraw/zinc/80/46/22/1049804622.db2.gz CGQOVGXQGSTJDB-AZUAARDMSA-N 2 1 322.496 4.031 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@@H]3C)cc2)c1 ZINC001206809703 1049804765 /nfs/dbraw/zinc/80/47/65/1049804765.db2.gz MJLNSJOBBDCTKY-PKOBYXMFSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001206810542 1049806284 /nfs/dbraw/zinc/80/62/84/1049806284.db2.gz NUXWHHYTCGIELQ-NWDGAFQWSA-N 2 1 308.878 4.114 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cccc(C(F)F)c2)CC1 ZINC001207132463 1049842539 /nfs/dbraw/zinc/84/25/39/1049842539.db2.gz HWKRMZYYDTYQAZ-UHFFFAOYSA-N 2 1 310.432 4.321 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cccc(C(F)F)c2)CC1 ZINC001207132463 1049842548 /nfs/dbraw/zinc/84/25/48/1049842548.db2.gz HWKRMZYYDTYQAZ-UHFFFAOYSA-N 2 1 310.432 4.321 20 0 DIADMP CSCC1CCC([NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)CC1 ZINC001207186915 1049856316 /nfs/dbraw/zinc/85/63/16/1049856316.db2.gz YJEHDOOCLYJYIA-TVPLGVNVSA-N 2 1 324.578 4.295 20 0 DIADMP CSCC1CCC([NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)CC1 ZINC001207186915 1049856326 /nfs/dbraw/zinc/85/63/26/1049856326.db2.gz YJEHDOOCLYJYIA-TVPLGVNVSA-N 2 1 324.578 4.295 20 0 DIADMP C[N@H+](C1CC1)C1CC[NH+](C[C@@H]2C[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001207198392 1049863379 /nfs/dbraw/zinc/86/33/79/1049863379.db2.gz SQGQXAGGPPAYMP-HNAYVOBHSA-N 2 1 318.892 4.002 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+](C[C@@H]2C[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001207198392 1049863388 /nfs/dbraw/zinc/86/33/88/1049863388.db2.gz SQGQXAGGPPAYMP-HNAYVOBHSA-N 2 1 318.892 4.002 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001207252302 1049869909 /nfs/dbraw/zinc/86/99/09/1049869909.db2.gz DMUDEOHRFSRGCS-ICSRJNTNSA-N 2 1 306.538 4.279 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CCC[C@@H]4CCC[C@@H]43)CC2)cc1 ZINC001207290720 1049875257 /nfs/dbraw/zinc/87/52/57/1049875257.db2.gz BFMKAWWAFDVAAR-SFTDATJTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CC[C@H]3c3ccccc3)CC2)cc1 ZINC001207292737 1049876372 /nfs/dbraw/zinc/87/63/72/1049876372.db2.gz YDVYNCIXRULNQA-QFIPXVFZSA-N 2 1 320.480 4.346 20 0 DIADMP c1coc(C[N@H+](CC2CC[NH+](Cc3ccccc3)CC2)C2CC2)c1 ZINC001207294245 1049876529 /nfs/dbraw/zinc/87/65/29/1049876529.db2.gz OEZYLDQDCXQWJH-UHFFFAOYSA-N 2 1 324.468 4.156 20 0 DIADMP CC[C@H]1CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207292135 1049876802 /nfs/dbraw/zinc/87/68/02/1049876802.db2.gz KWWCOJYBAWGBFM-SFHVURJKSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000491033527 1049880449 /nfs/dbraw/zinc/88/04/49/1049880449.db2.gz FCDCVUAFOBFQON-IBGZPJMESA-N 2 1 322.496 4.486 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000491033527 1049880451 /nfs/dbraw/zinc/88/04/51/1049880451.db2.gz FCDCVUAFOBFQON-IBGZPJMESA-N 2 1 322.496 4.486 20 0 DIADMP C[N@@H+](CC1CC[NH+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC001207391357 1049887862 /nfs/dbraw/zinc/88/78/62/1049887862.db2.gz HUIGTGDSQTXURD-UHFFFAOYSA-N 2 1 308.469 4.050 20 0 DIADMP Clc1cccc(CC[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001207422281 1049891074 /nfs/dbraw/zinc/89/10/74/1049891074.db2.gz FNCRKKBWUMRAJW-IBGZPJMESA-N 2 1 320.908 4.223 20 0 DIADMP Clc1cccc(CC[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001207422281 1049891080 /nfs/dbraw/zinc/89/10/80/1049891080.db2.gz FNCRKKBWUMRAJW-IBGZPJMESA-N 2 1 320.908 4.223 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)CC1CC[NH2+]CC1 ZINC001207441645 1049893374 /nfs/dbraw/zinc/89/33/74/1049893374.db2.gz HXCJUSGQBXFCSJ-HXUWFJFHSA-N 2 1 302.506 4.109 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@H]2c2ccc(Cl)s2)CC1 ZINC001207483927 1049897404 /nfs/dbraw/zinc/89/74/04/1049897404.db2.gz JEDZZZRADYWJQF-AWEZNQCLSA-N 2 1 312.910 4.270 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001207487593 1049897977 /nfs/dbraw/zinc/89/79/77/1049897977.db2.gz NBSYKDBWVXLSRI-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1CCCc1ccccc1F ZINC001207494785 1049898711 /nfs/dbraw/zinc/89/87/11/1049898711.db2.gz JSGHPLJMHNDDLN-OALUTQOASA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCCc1ccccc1F ZINC001207494785 1049898714 /nfs/dbraw/zinc/89/87/14/1049898714.db2.gz JSGHPLJMHNDDLN-OALUTQOASA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCCc1ccccc1F ZINC001207494785 1049898717 /nfs/dbraw/zinc/89/87/17/1049898717.db2.gz JSGHPLJMHNDDLN-OALUTQOASA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CCCc1cccc(F)c1 ZINC001207605938 1049915918 /nfs/dbraw/zinc/91/59/18/1049915918.db2.gz YICJMJXOEXZGKN-VQTJNVASSA-N 2 1 318.480 4.097 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1CCCc1cccc(F)c1 ZINC001207605938 1049915922 /nfs/dbraw/zinc/91/59/22/1049915922.db2.gz YICJMJXOEXZGKN-VQTJNVASSA-N 2 1 318.480 4.097 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)c1ccccc1 ZINC001207907762 1049952847 /nfs/dbraw/zinc/95/28/47/1049952847.db2.gz XPJZAOKEIDQFGN-QUCCMNQESA-N 2 1 300.490 4.131 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000588177728 1049971480 /nfs/dbraw/zinc/97/14/80/1049971480.db2.gz APGIKBFAGHUQOG-BBDWDQMGSA-N 2 1 300.490 4.334 20 0 DIADMP CC[N@H+](Cc1c(F)cccc1Cl)CC1(C)CC[NH+](C)CC1 ZINC001208109883 1049974004 /nfs/dbraw/zinc/97/40/04/1049974004.db2.gz UWLKNZUWKUCZEV-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)CC1(C)CC[NH+](C)CC1 ZINC001208109883 1049974008 /nfs/dbraw/zinc/97/40/08/1049974008.db2.gz UWLKNZUWKUCZEV-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP C[C@H]1C[N@@H+](CC2(C)CC[NH+](C)CC2)CCc2ccc(Cl)cc21 ZINC001208109039 1049974293 /nfs/dbraw/zinc/97/42/93/1049974293.db2.gz KJZFDMGSPQEPAB-HNNXBMFYSA-N 2 1 320.908 4.034 20 0 DIADMP CC/C=C\CCC[NH+]1CCC([N@H+](C)Cc2ccc(F)cc2)CC1 ZINC001208137288 1049976527 /nfs/dbraw/zinc/97/65/27/1049976527.db2.gz GLJZQQBDWBZZII-PLNGDYQASA-N 2 1 318.480 4.468 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+](C)CC2CC[NH+](C(C)C)CC2)o1 ZINC001208152963 1049977489 /nfs/dbraw/zinc/97/74/89/1049977489.db2.gz BSLXXWROBFOKHY-MRXNPFEDSA-N 2 1 306.494 4.134 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)CC[C@H](C)c2ccc(C)o2)CC1 ZINC001208165608 1049980488 /nfs/dbraw/zinc/98/04/88/1049980488.db2.gz SEZGPHGUTXCICI-INIZCTEOSA-N 2 1 306.494 4.278 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)o1 ZINC001208170448 1049981619 /nfs/dbraw/zinc/98/16/19/1049981619.db2.gz XDSOCSHGOSKXRR-NZSAHSFTSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@H](C)CC[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)o1 ZINC001208170448 1049981622 /nfs/dbraw/zinc/98/16/22/1049981622.db2.gz XDSOCSHGOSKXRR-NZSAHSFTSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@H](C)CC[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)o1 ZINC001208170448 1049981627 /nfs/dbraw/zinc/98/16/27/1049981627.db2.gz XDSOCSHGOSKXRR-NZSAHSFTSA-N 2 1 318.505 4.420 20 0 DIADMP C[NH+](C)CC1(C[N@H+]2CCC[C@@H]2c2ccccc2F)CCCC1 ZINC001208192703 1049983430 /nfs/dbraw/zinc/98/34/30/1049983430.db2.gz XHYBVVINVIVLFN-GOSISDBHSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@H](CCc1ccco1)N[C@@H](C[NH3+])c1ccc2ccccc2c1 ZINC000572112042 1049994561 /nfs/dbraw/zinc/99/45/61/1049994561.db2.gz AIGHHHBOMIIIKS-QRWLVFNGSA-N 2 1 308.425 4.044 20 0 DIADMP CC[NH+]1CCC(C[N@H+](C)Cc2c(Cl)cccc2Cl)CC1 ZINC001208597968 1049998013 /nfs/dbraw/zinc/99/80/13/1049998013.db2.gz OFFYPURAXDLZJL-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)Cc2c(Cl)cccc2Cl)CC1 ZINC001208597968 1049998019 /nfs/dbraw/zinc/99/80/19/1049998019.db2.gz OFFYPURAXDLZJL-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C[C@H](C[N@H+]1CCC2(C1)CC[NH+](C)CC2)c1cccc2ccccc21 ZINC001208709288 1050004914 /nfs/dbraw/zinc/00/49/14/1050004914.db2.gz KYERYMIXUCBWAP-GOSISDBHSA-N 2 1 322.496 4.361 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](C[C@@H](C)c2cccc3ccccc32)CC1 ZINC001208711642 1050005333 /nfs/dbraw/zinc/00/53/33/1050005333.db2.gz WHODZRVWEALLLF-QGZVFWFLSA-N 2 1 310.485 4.359 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](C[C@H](C)c2cccc3ccccc32)CC1 ZINC001208711640 1050006298 /nfs/dbraw/zinc/00/62/98/1050006298.db2.gz WHODZRVWEALLLF-KRWDZBQOSA-N 2 1 310.485 4.359 20 0 DIADMP CC1(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)CCCCC1 ZINC001208896669 1050021002 /nfs/dbraw/zinc/02/10/02/1050021002.db2.gz OBQVCIVPGYGTOY-UHFFFAOYSA-N 2 1 304.522 4.297 20 0 DIADMP Clc1ccc([C@H]2CC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168387799 1050023733 /nfs/dbraw/zinc/02/37/33/1050023733.db2.gz UUXBEQWASBAUGB-KRWDZBQOSA-N 2 1 318.892 4.004 20 0 DIADMP CCC[N@H+](C[C@H]1CCC[NH+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929417 1050024464 /nfs/dbraw/zinc/02/44/64/1050024464.db2.gz RTMZWYJBCYBXJY-ICSRJNTNSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[N@@H+](C[C@H]1CCC[NH+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929417 1050024470 /nfs/dbraw/zinc/02/44/70/1050024470.db2.gz RTMZWYJBCYBXJY-ICSRJNTNSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929417 1050024476 /nfs/dbraw/zinc/02/44/76/1050024476.db2.gz RTMZWYJBCYBXJY-ICSRJNTNSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H](C)CC ZINC001208929417 1050024480 /nfs/dbraw/zinc/02/44/80/1050024480.db2.gz RTMZWYJBCYBXJY-ICSRJNTNSA-N 2 1 302.506 4.409 20 0 DIADMP C[N@@H+](Cc1cccs1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208932070 1050025047 /nfs/dbraw/zinc/02/50/47/1050025047.db2.gz FARGZJHHEUNLNJ-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[N@H+](Cc1cccs1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208932070 1050025054 /nfs/dbraw/zinc/02/50/54/1050025054.db2.gz FARGZJHHEUNLNJ-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1cccs1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208932070 1050025060 /nfs/dbraw/zinc/02/50/60/1050025060.db2.gz FARGZJHHEUNLNJ-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[NH+](Cc1cccs1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208932070 1050025065 /nfs/dbraw/zinc/02/50/65/1050025065.db2.gz FARGZJHHEUNLNJ-SFHVURJKSA-N 2 1 314.498 4.092 20 0 DIADMP C[C@H]1C[N@@H+](C[C@H]2CC[NH+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208940341 1050028389 /nfs/dbraw/zinc/02/83/89/1050028389.db2.gz BOEMXHYJNKKXSU-ICSRJNTNSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1C[NH+](C[C@H]2CC[N@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208940341 1050028394 /nfs/dbraw/zinc/02/83/94/1050028394.db2.gz BOEMXHYJNKKXSU-ICSRJNTNSA-N 2 1 320.480 4.128 20 0 DIADMP C[C@H]1C[NH+](C[C@H]2CC[N@@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208940341 1050028401 /nfs/dbraw/zinc/02/84/01/1050028401.db2.gz BOEMXHYJNKKXSU-ICSRJNTNSA-N 2 1 320.480 4.128 20 0 DIADMP CCC[C@H]1CCCC[N@H+]1C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949326 1050030384 /nfs/dbraw/zinc/03/03/84/1050030384.db2.gz LBCJGSRQGHSFGR-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H]1CCCC[NH+]1C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949326 1050030388 /nfs/dbraw/zinc/03/03/88/1050030388.db2.gz LBCJGSRQGHSFGR-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H]1CCCC[NH+]1C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949326 1050030392 /nfs/dbraw/zinc/03/03/92/1050030392.db2.gz LBCJGSRQGHSFGR-PMACEKPBSA-N 2 1 300.490 4.163 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@@H+](C2CC[NH+](CC3CC3)CC2)C1 ZINC001168391818 1050042214 /nfs/dbraw/zinc/04/22/14/1050042214.db2.gz OKQJTRPNJLSGOT-INIZCTEOSA-N 2 1 318.892 4.004 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@H+](C2CC[NH+](CC3CC3)CC2)C1 ZINC001168391818 1050042218 /nfs/dbraw/zinc/04/22/18/1050042218.db2.gz OKQJTRPNJLSGOT-INIZCTEOSA-N 2 1 318.892 4.004 20 0 DIADMP C(=C/C[N@H+]1CCC[C@@H]1C1CCC1)\C[NH+]1CCC[C@H]1C1CCC1 ZINC000590598447 1050098861 /nfs/dbraw/zinc/09/88/61/1050098861.db2.gz BTUWNVJLHGUENQ-FWDLARJDSA-N 2 1 302.506 4.072 20 0 DIADMP C(=C/C[N@@H+]1CCC[C@H]1C1CCC1)\C[NH+]1CCC[C@@H]1C1CCC1 ZINC000590598447 1050098865 /nfs/dbraw/zinc/09/88/65/1050098865.db2.gz BTUWNVJLHGUENQ-FWDLARJDSA-N 2 1 302.506 4.072 20 0 DIADMP C(=C/C[N@H+]1CCC[C@H]1C1CCC1)\C[NH+]1CCC[C@@H]1C1CCC1 ZINC000590598447 1050098867 /nfs/dbraw/zinc/09/88/67/1050098867.db2.gz BTUWNVJLHGUENQ-FWDLARJDSA-N 2 1 302.506 4.072 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@@H](C)CCc2ccccc2)CC1 ZINC000590786888 1050106519 /nfs/dbraw/zinc/10/65/19/1050106519.db2.gz IVHAQPSQSYALAL-SFHVURJKSA-N 2 1 302.506 4.060 20 0 DIADMP CCC1CC([NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000573986942 1050299760 /nfs/dbraw/zinc/29/97/60/1050299760.db2.gz JBGLSLYZQSSKCL-YMPIPDKKSA-N 2 1 300.490 4.065 20 0 DIADMP CC[NH+](CC)c1ccc(NC2=CC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC001210707472 1050342100 /nfs/dbraw/zinc/34/21/00/1050342100.db2.gz BHKQUVKGUFSSLJ-FQEVSTJZSA-N 2 1 313.489 4.477 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143812571 1050373958 /nfs/dbraw/zinc/37/39/58/1050373958.db2.gz VWULGZDZWMOFAC-UHFFFAOYSA-N 2 1 322.802 4.132 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)c(Cl)c1 ZINC001143812571 1050373966 /nfs/dbraw/zinc/37/39/66/1050373966.db2.gz VWULGZDZWMOFAC-UHFFFAOYSA-N 2 1 322.802 4.132 20 0 DIADMP Cc1c(F)cc(F)cc1C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001143767560 1050353603 /nfs/dbraw/zinc/35/36/03/1050353603.db2.gz BJRPDZRMZWOEEA-ROUUACIJSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(F)cc(F)cc1C[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001143767560 1050353617 /nfs/dbraw/zinc/35/36/17/1050353617.db2.gz BJRPDZRMZWOEEA-ROUUACIJSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001143767560 1050353624 /nfs/dbraw/zinc/35/36/24/1050353624.db2.gz BJRPDZRMZWOEEA-ROUUACIJSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001143767560 1050353631 /nfs/dbraw/zinc/35/36/31/1050353631.db2.gz BJRPDZRMZWOEEA-ROUUACIJSA-N 2 1 322.443 4.112 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000574204190 1050376240 /nfs/dbraw/zinc/37/62/40/1050376240.db2.gz UBGOKCKHXHXZGU-CEXWTWQISA-N 2 1 317.521 4.126 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000574204190 1050376248 /nfs/dbraw/zinc/37/62/48/1050376248.db2.gz UBGOKCKHXHXZGU-CEXWTWQISA-N 2 1 317.521 4.126 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@H]2CCc3cc(Cl)ccc3C2)C1 ZINC001171113166 1050385714 /nfs/dbraw/zinc/38/57/14/1050385714.db2.gz OYHDCLAHVCLZHI-KXBFYZLASA-N 2 1 320.908 4.038 20 0 DIADMP Fc1cccc(C2CC[NH+](CCC[NH+]3CCCCC3)CC2)c1F ZINC000574476282 1050475787 /nfs/dbraw/zinc/47/57/87/1050475787.db2.gz PBOGJYWLXJQWIC-UHFFFAOYSA-N 2 1 322.443 4.020 20 0 DIADMP CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1 ZINC000766223731 1050503406 /nfs/dbraw/zinc/50/34/06/1050503406.db2.gz LWIINITWCSIJBS-FDQGKXFDSA-N 2 1 315.486 4.115 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000786678996 1050511405 /nfs/dbraw/zinc/51/14/05/1050511405.db2.gz VJWGUDNGVMOJGP-HKUYNNGSSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000786678996 1050511421 /nfs/dbraw/zinc/51/14/21/1050511421.db2.gz VJWGUDNGVMOJGP-HKUYNNGSSA-N 2 1 318.892 4.278 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000574782673 1050567893 /nfs/dbraw/zinc/56/78/93/1050567893.db2.gz MFVUTWRDHNCAQK-LJQANCHMSA-N 2 1 322.496 4.440 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000574782673 1050567897 /nfs/dbraw/zinc/56/78/97/1050567897.db2.gz MFVUTWRDHNCAQK-LJQANCHMSA-N 2 1 322.496 4.440 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000574782673 1050567904 /nfs/dbraw/zinc/56/79/04/1050567904.db2.gz MFVUTWRDHNCAQK-LJQANCHMSA-N 2 1 322.496 4.440 20 0 DIADMP Cc1[nH]c2ccc(Nc3ccccc3C[NH+]3CCCC3)cc2[nH+]1 ZINC001213074100 1050577840 /nfs/dbraw/zinc/57/78/40/1050577840.db2.gz CRQPWXUTMBHQFU-UHFFFAOYSA-N 2 1 306.413 4.211 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(-c2ccccc2)cn1 ZINC000845941158 1050637270 /nfs/dbraw/zinc/63/72/70/1050637270.db2.gz CSKXNQJTMCATGP-PWIZWCRZSA-N 2 1 323.484 4.272 20 0 DIADMP CC[N@@H+](CC1CC[NH+](C)CC1)[C@H](C)c1cc2ccccc2o1 ZINC000788477779 1050687928 /nfs/dbraw/zinc/68/79/28/1050687928.db2.gz FXMMNTBUQADBCQ-OAHLLOKOSA-N 2 1 300.446 4.158 20 0 DIADMP CC[N@@H+](CC1CC[NH+](C)CC1)[C@@H](C)c1cc2ccccc2o1 ZINC000788477775 1050688039 /nfs/dbraw/zinc/68/80/39/1050688039.db2.gz FXMMNTBUQADBCQ-HNNXBMFYSA-N 2 1 300.446 4.158 20 0 DIADMP C[NH+](C)CC1CC[NH+](c2ccc(NC3CC(C)(C)C3)cc2)CC1 ZINC000788596494 1050710591 /nfs/dbraw/zinc/71/05/91/1050710591.db2.gz ROPFXIDUWUCEMP-UHFFFAOYSA-N 2 1 315.505 4.065 20 0 DIADMP CCCCCCOc1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000742374901 1050835389 /nfs/dbraw/zinc/83/53/89/1050835389.db2.gz KCVFPRDJEKSQOB-HKUYNNGSSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170119497 1050881332 /nfs/dbraw/zinc/88/13/32/1050881332.db2.gz XLVPMVQRFMPFOR-DDBAPUKQSA-N 2 1 304.453 4.086 20 0 DIADMP Cc1ccc(C[N@H+]([C@@H]2CC[C@@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001170119446 1050882353 /nfs/dbraw/zinc/88/23/53/1050882353.db2.gz ASFPUHJHIKSHAB-VBSBHUPXSA-N 2 1 300.490 4.256 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000348188637 1051003077 /nfs/dbraw/zinc/00/30/77/1051003077.db2.gz RMUWAWIPDYQWRX-BEFAXECRSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000348188637 1051003089 /nfs/dbraw/zinc/00/30/89/1051003089.db2.gz RMUWAWIPDYQWRX-BEFAXECRSA-N 2 1 315.436 4.194 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+]([C@@H]3CC[C@H](C)C3)C[C@@H]21 ZINC001170145900 1051006527 /nfs/dbraw/zinc/00/65/27/1051006527.db2.gz WVMXJYPONKVETJ-LPKWFMKBSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+]([C@@H]3CC[C@H](C)C3)C[C@@H]21 ZINC001170145900 1051006542 /nfs/dbraw/zinc/00/65/42/1051006542.db2.gz WVMXJYPONKVETJ-LPKWFMKBSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+]([C@@H]3CC[C@H](C)C3)C[C@@H]21 ZINC001170145900 1051006554 /nfs/dbraw/zinc/00/65/54/1051006554.db2.gz WVMXJYPONKVETJ-LPKWFMKBSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001170151288 1051038184 /nfs/dbraw/zinc/03/81/84/1051038184.db2.gz QLOUWWXWBLNKMA-YLJYHZDGSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1ccccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170260312 1051166214 /nfs/dbraw/zinc/16/62/14/1051166214.db2.gz HVSBORHDVRQPNK-DJIMGWMZSA-N 2 1 308.897 4.251 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170260505 1051166381 /nfs/dbraw/zinc/16/63/81/1051166381.db2.gz KHQNBGKNOQBDAW-ZVZYQTTQSA-N 2 1 320.908 4.395 20 0 DIADMP C[C@@H]1C[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)Cc2ccccc21 ZINC001171631611 1051174524 /nfs/dbraw/zinc/17/45/24/1051174524.db2.gz KZJQKUGMLFWAJH-OAHLLOKOSA-N 2 1 300.490 4.257 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@H](c3ccccc3)C2)CC1(C)C ZINC001171631185 1051175368 /nfs/dbraw/zinc/17/53/68/1051175368.db2.gz GCVLNLJUZUGMSJ-KRWDZBQOSA-N 2 1 300.490 4.127 20 0 DIADMP Cc1ccc2c(c1)C[N@@H+](C1CC(C)(C)[NH+](C)C(C)(C)C1)CC2 ZINC001171631893 1051175726 /nfs/dbraw/zinc/17/57/26/1051175726.db2.gz PASSHGFMPKWICW-UHFFFAOYSA-N 2 1 300.490 4.005 20 0 DIADMP COc1ccc(Cl)cc1C[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171619067 1051177514 /nfs/dbraw/zinc/17/75/14/1051177514.db2.gz GKWILRUWQRDZIC-UHFFFAOYSA-N 2 1 324.896 4.090 20 0 DIADMP Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@H+](C(C)C)C[C@H]2C)cc1 ZINC001171666548 1051188979 /nfs/dbraw/zinc/18/89/79/1051188979.db2.gz ZFFYKCDHKQUKQT-WSTZPKSXSA-N 2 1 302.506 4.025 20 0 DIADMP Cc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@H+](C(C)C)C[C@H]2C)cc1 ZINC001171666547 1051189376 /nfs/dbraw/zinc/18/93/76/1051189376.db2.gz ZFFYKCDHKQUKQT-HBFSDRIKSA-N 2 1 302.506 4.025 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCSc3ccccc3C2)CC1(C)C ZINC001171640598 1051194103 /nfs/dbraw/zinc/19/41/03/1051194103.db2.gz HBIBRQODPDRJFQ-UHFFFAOYSA-N 2 1 318.530 4.246 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@H](Cc3ccccc3)C2)CC1(C)C ZINC001171638503 1051194924 /nfs/dbraw/zinc/19/49/24/1051194924.db2.gz ZQXNNTNREPHUOS-GOSISDBHSA-N 2 1 314.517 4.202 20 0 DIADMP COc1ccccc1[C@@H](C)[N@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642266 1051197385 /nfs/dbraw/zinc/19/73/85/1051197385.db2.gz IDWYTFUEBWYOSS-OAHLLOKOSA-N 2 1 318.505 4.339 20 0 DIADMP COc1ccccc1[C@@H](C)[N@@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642266 1051197390 /nfs/dbraw/zinc/19/73/90/1051197390.db2.gz IDWYTFUEBWYOSS-OAHLLOKOSA-N 2 1 318.505 4.339 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@]1(C)Cc1ccccc1Cl ZINC001171900192 1051235699 /nfs/dbraw/zinc/23/56/99/1051235699.db2.gz ITGMKKKMRDVXDN-IBGZPJMESA-N 2 1 322.924 4.469 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171963709 1051248286 /nfs/dbraw/zinc/24/82/86/1051248286.db2.gz ISQKDUUCTBSSSD-YLJYHZDGSA-N 2 1 323.484 4.175 20 0 DIADMP CC1(C)C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2C3)CC[N@H+]1Cc1ccccc1 ZINC001171970906 1051260208 /nfs/dbraw/zinc/26/02/08/1051260208.db2.gz GEZRDSYOQCVQSW-ZGXWSNOMSA-N 2 1 312.501 4.208 20 0 DIADMP CC1(C)C[C@H]([NH2+]C(C2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001171972309 1051260476 /nfs/dbraw/zinc/26/04/76/1051260476.db2.gz PQJCMBKIUOUMQF-LJQANCHMSA-N 2 1 312.501 4.208 20 0 DIADMP CC1(C)CCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171976116 1051264670 /nfs/dbraw/zinc/26/46/70/1051264670.db2.gz IDSAQVOLDBKPPD-GOSISDBHSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)CCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171976116 1051264680 /nfs/dbraw/zinc/26/46/80/1051264680.db2.gz IDSAQVOLDBKPPD-GOSISDBHSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)CCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171976116 1051264694 /nfs/dbraw/zinc/26/46/94/1051264694.db2.gz IDSAQVOLDBKPPD-GOSISDBHSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)CCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171976116 1051264703 /nfs/dbraw/zinc/26/47/03/1051264703.db2.gz IDSAQVOLDBKPPD-GOSISDBHSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@@H](F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171978530 1051267011 /nfs/dbraw/zinc/26/70/11/1051267011.db2.gz ZBDZDTADZNWUGN-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@@H](F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978530 1051267022 /nfs/dbraw/zinc/26/70/22/1051267022.db2.gz ZBDZDTADZNWUGN-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978530 1051267028 /nfs/dbraw/zinc/26/70/28/1051267028.db2.gz ZBDZDTADZNWUGN-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC[C@@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978530 1051267037 /nfs/dbraw/zinc/26/70/37/1051267037.db2.gz ZBDZDTADZNWUGN-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001171976671 1051267806 /nfs/dbraw/zinc/26/78/06/1051267806.db2.gz MGQZGBMNCNRODI-LJQANCHMSA-N 2 1 300.490 4.306 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001171976671 1051267815 /nfs/dbraw/zinc/26/78/15/1051267815.db2.gz MGQZGBMNCNRODI-LJQANCHMSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C1CCC1 ZINC001171981217 1051269052 /nfs/dbraw/zinc/26/90/52/1051269052.db2.gz ZSGCLMVDMLDZOV-VQIMIIECSA-N 2 1 300.490 4.208 20 0 DIADMP CC1(C)C[C@H]([NH+]2C[C@@H]3CCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001171978162 1051269797 /nfs/dbraw/zinc/26/97/97/1051269797.db2.gz WTHLHWSODMOVRC-HSALFYBXSA-N 2 1 312.501 4.162 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171978162 1051269814 /nfs/dbraw/zinc/26/98/14/1051269814.db2.gz WTHLHWSODMOVRC-HSALFYBXSA-N 2 1 312.501 4.162 20 0 DIADMP CC1(C)C[C@H]([N@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171978162 1051269826 /nfs/dbraw/zinc/26/98/26/1051269826.db2.gz WTHLHWSODMOVRC-HSALFYBXSA-N 2 1 312.501 4.162 20 0 DIADMP CC[C@@H]1CCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985326 1051271492 /nfs/dbraw/zinc/27/14/92/1051271492.db2.gz VEZWMMIGABKSQR-RTBURBONSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985326 1051271507 /nfs/dbraw/zinc/27/15/07/1051271507.db2.gz VEZWMMIGABKSQR-RTBURBONSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985326 1051271519 /nfs/dbraw/zinc/27/15/19/1051271519.db2.gz VEZWMMIGABKSQR-RTBURBONSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985326 1051271530 /nfs/dbraw/zinc/27/15/30/1051271530.db2.gz VEZWMMIGABKSQR-RTBURBONSA-N 2 1 300.490 4.304 20 0 DIADMP C[Si](C)(C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172073184 1051274789 /nfs/dbraw/zinc/27/47/89/1051274789.db2.gz OZLKXBUKTZJBBC-LDLYASANSA-N 2 1 316.565 4.039 20 0 DIADMP C[Si](C)(C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172073184 1051274799 /nfs/dbraw/zinc/27/47/99/1051274799.db2.gz OZLKXBUKTZJBBC-LDLYASANSA-N 2 1 316.565 4.039 20 0 DIADMP CCC[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172073235 1051275385 /nfs/dbraw/zinc/27/53/85/1051275385.db2.gz PKZKOFNFFDLKEW-RSPOEFSDSA-N 2 1 300.490 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2CC24CCCC4)C3)cc1 ZINC001172077620 1051279023 /nfs/dbraw/zinc/27/90/23/1051279023.db2.gz ULNIJQMXXPUDOB-MXEMCNAFSA-N 2 1 324.512 4.494 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1 ZINC001172101631 1051279582 /nfs/dbraw/zinc/27/95/82/1051279582.db2.gz GOMWURPSWILHAD-FJIDUMEYSA-N 2 1 306.881 4.396 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC001172101631 1051279598 /nfs/dbraw/zinc/27/95/98/1051279598.db2.gz GOMWURPSWILHAD-FJIDUMEYSA-N 2 1 306.881 4.396 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082437 1051279849 /nfs/dbraw/zinc/27/98/49/1051279849.db2.gz JYCMSDIWZSUNDN-WJMWBRGCSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1C[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082437 1051279859 /nfs/dbraw/zinc/27/98/59/1051279859.db2.gz JYCMSDIWZSUNDN-WJMWBRGCSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082437 1051279872 /nfs/dbraw/zinc/27/98/72/1051279872.db2.gz JYCMSDIWZSUNDN-WJMWBRGCSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082437 1051279886 /nfs/dbraw/zinc/27/98/86/1051279886.db2.gz JYCMSDIWZSUNDN-WJMWBRGCSA-N 2 1 324.512 4.447 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C(c1ccccc1)c1ccccc1)C2 ZINC001172101102 1051280566 /nfs/dbraw/zinc/28/05/66/1051280566.db2.gz WFKOUECUEDCOIK-MZADTFQBSA-N 2 1 320.480 4.381 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2CC24CCC4)C3)cc1 ZINC001172065840 1051286464 /nfs/dbraw/zinc/28/64/64/1051286464.db2.gz ACPDCHXUSSISLW-IYWMVGAKSA-N 2 1 310.485 4.104 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CC4(C2)CCCC4)C3)cc1 ZINC001172070122 1051287220 /nfs/dbraw/zinc/28/72/20/1051287220.db2.gz XBPJFDGRORFJHY-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130994 1051293517 /nfs/dbraw/zinc/29/35/17/1051293517.db2.gz SRPUEHICLHWENW-LDDOYCOJSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130994 1051293527 /nfs/dbraw/zinc/29/35/27/1051293527.db2.gz SRPUEHICLHWENW-LDDOYCOJSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130994 1051293539 /nfs/dbraw/zinc/29/35/39/1051293539.db2.gz SRPUEHICLHWENW-LDDOYCOJSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1c(F)cccc1F)C2 ZINC001172130994 1051293561 /nfs/dbraw/zinc/29/35/61/1051293561.db2.gz SRPUEHICLHWENW-LDDOYCOJSA-N 2 1 320.427 4.117 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)c(F)c1 ZINC001172108131 1051297256 /nfs/dbraw/zinc/29/72/56/1051297256.db2.gz QECDEWNJMXMRTE-NGFQHRJXSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(F)c1 ZINC001172108131 1051297262 /nfs/dbraw/zinc/29/72/62/1051297262.db2.gz QECDEWNJMXMRTE-NGFQHRJXSA-N 2 1 310.844 4.145 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104789 1051298028 /nfs/dbraw/zinc/29/80/28/1051298028.db2.gz CWZVOFCEXPGZIO-AKHDSKFASA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104789 1051298038 /nfs/dbraw/zinc/29/80/38/1051298038.db2.gz CWZVOFCEXPGZIO-AKHDSKFASA-N 2 1 304.453 4.128 20 0 DIADMP Cc1ccc(CC(C)(C)C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172110912 1051299628 /nfs/dbraw/zinc/29/96/28/1051299628.db2.gz LXDDEAKGQJFDTD-ACDBMABISA-N 2 1 314.517 4.169 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C)c1C ZINC001172110430 1051299976 /nfs/dbraw/zinc/29/99/76/1051299976.db2.gz MTWQFCQNIOTTTG-FTEYMNFISA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1C ZINC001172110430 1051299988 /nfs/dbraw/zinc/29/99/88/1051299988.db2.gz MTWQFCQNIOTTTG-FTEYMNFISA-N 2 1 300.490 4.359 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001172108813 1051300353 /nfs/dbraw/zinc/30/03/53/1051300353.db2.gz ZRAXRQNGIVUPCO-IYWMVGAKSA-N 2 1 300.490 4.379 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001172108813 1051300369 /nfs/dbraw/zinc/30/03/69/1051300369.db2.gz ZRAXRQNGIVUPCO-IYWMVGAKSA-N 2 1 300.490 4.379 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001172112693 1051301632 /nfs/dbraw/zinc/30/16/32/1051301632.db2.gz YUDQZSSMPFKWRF-RCJHGTSTSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172112693 1051301647 /nfs/dbraw/zinc/30/16/47/1051301647.db2.gz YUDQZSSMPFKWRF-RCJHGTSTSA-N 2 1 304.453 4.128 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(C)ccc1C ZINC001172111579 1051302466 /nfs/dbraw/zinc/30/24/66/1051302466.db2.gz VQKABOZXUPHRNZ-AJYBTWMASA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(C)ccc1C ZINC001172111579 1051302473 /nfs/dbraw/zinc/30/24/73/1051302473.db2.gz VQKABOZXUPHRNZ-AJYBTWMASA-N 2 1 300.490 4.359 20 0 DIADMP Cc1ccccc1CC(C)(C)C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172111275 1051302589 /nfs/dbraw/zinc/30/25/89/1051302589.db2.gz PKSJSIWIBIDQGL-OWZKRDHZSA-N 2 1 314.517 4.169 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110318 1051302709 /nfs/dbraw/zinc/30/27/09/1051302709.db2.gz MKYWHGLZIDHXFK-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110318 1051302713 /nfs/dbraw/zinc/30/27/13/1051302713.db2.gz MKYWHGLZIDHXFK-YSTOQKLRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)C2 ZINC001172108722 1051302903 /nfs/dbraw/zinc/30/29/03/1051302903.db2.gz YMKLSWURPDRSCU-ZSOGYDGISA-N 2 1 313.272 4.098 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120180 1051303939 /nfs/dbraw/zinc/30/39/39/1051303939.db2.gz ACOFIOWAGBQKSZ-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120180 1051303946 /nfs/dbraw/zinc/30/39/46/1051303946.db2.gz ACOFIOWAGBQKSZ-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120180 1051303956 /nfs/dbraw/zinc/30/39/56/1051303956.db2.gz ACOFIOWAGBQKSZ-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CC[C@H](c3cccc(Cl)c3)C1)C2 ZINC001172120180 1051303961 /nfs/dbraw/zinc/30/39/61/1051303961.db2.gz ACOFIOWAGBQKSZ-KANFNMMFSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120270 1051304935 /nfs/dbraw/zinc/30/49/35/1051304935.db2.gz CEHVPUIIPBXLEG-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120270 1051304943 /nfs/dbraw/zinc/30/49/43/1051304943.db2.gz CEHVPUIIPBXLEG-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120270 1051304953 /nfs/dbraw/zinc/30/49/53/1051304953.db2.gz CEHVPUIIPBXLEG-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120270 1051304956 /nfs/dbraw/zinc/30/49/56/1051304956.db2.gz CEHVPUIIPBXLEG-YSHGAJCASA-N 2 1 318.892 4.145 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1C ZINC001172116212 1051306192 /nfs/dbraw/zinc/30/61/92/1051306192.db2.gz YDNOAJPFHOYQTA-FTEYMNFISA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1C ZINC001172116212 1051306207 /nfs/dbraw/zinc/30/62/07/1051306207.db2.gz YDNOAJPFHOYQTA-FTEYMNFISA-N 2 1 300.490 4.359 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1cc(F)ccc1F)C2 ZINC001172124352 1051306497 /nfs/dbraw/zinc/30/64/97/1051306497.db2.gz KTNJFEUGUWBKEK-MKSNKDDYSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1cc(F)ccc1F)C2 ZINC001172124352 1051306506 /nfs/dbraw/zinc/30/65/06/1051306506.db2.gz KTNJFEUGUWBKEK-MKSNKDDYSA-N 2 1 320.427 4.117 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(Nc2[nH+]c3ccccc3n2C)cc1 ZINC001215742255 1051337640 /nfs/dbraw/zinc/33/76/40/1051337640.db2.gz AXIWDWUZNIYTBT-UHFFFAOYSA-N 2 1 308.429 4.063 20 0 DIADMP Cc1[nH+]c2c(Nc3ccc(C[NH2+]CC(C)C)cc3)cccn2c1C ZINC001215745501 1051340311 /nfs/dbraw/zinc/34/03/11/1051340311.db2.gz ZNAPVLLJUBMZBT-UHFFFAOYSA-N 2 1 322.456 4.440 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H]2CCSc3c(F)cccc32)CC1 ZINC000193023427 1051370209 /nfs/dbraw/zinc/37/02/09/1051370209.db2.gz NBHAUCLGVDDBEK-KRWDZBQOSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C[C@H]1C ZINC001172369400 1051377800 /nfs/dbraw/zinc/37/78/00/1051377800.db2.gz LXEXAMRCLIGVNQ-IIDMSEBBSA-N 2 1 320.908 4.415 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC001172370113 1051379049 /nfs/dbraw/zinc/37/90/49/1051379049.db2.gz VOAGHUARVYUKMA-GGPKGHCWSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001172403642 1051380733 /nfs/dbraw/zinc/38/07/33/1051380733.db2.gz NGSXTQUWAIJGHD-WOJBJXKFSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@H](CC(C)C)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001172403642 1051380743 /nfs/dbraw/zinc/38/07/43/1051380743.db2.gz NGSXTQUWAIJGHD-WOJBJXKFSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@H](CC(C)C)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001172403642 1051380752 /nfs/dbraw/zinc/38/07/52/1051380752.db2.gz NGSXTQUWAIJGHD-WOJBJXKFSA-N 2 1 302.506 4.265 20 0 DIADMP CC[C@H](CC(C)C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172387935 1051392356 /nfs/dbraw/zinc/39/23/56/1051392356.db2.gz ZJPIIJCYYUDFOE-VQTJNVASSA-N 2 1 302.506 4.313 20 0 DIADMP CCC(CC)[N@@H+]([C@H](C)CCOCC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172467096 1051414295 /nfs/dbraw/zinc/41/42/95/1051414295.db2.gz HTYBXRIWTFPACO-ZHALLVOQSA-N 2 1 312.542 4.198 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c(C)c1 ZINC001170452290 1051416001 /nfs/dbraw/zinc/41/60/01/1051416001.db2.gz UXEKSVOEHGRYMI-QUCCMNQESA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)c(C)c1 ZINC001170452290 1051416009 /nfs/dbraw/zinc/41/60/09/1051416009.db2.gz UXEKSVOEHGRYMI-QUCCMNQESA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+]2CCC[C@@]3(CC[N@@H+](C)C3)C2)c(C)c1 ZINC001170452290 1051416014 /nfs/dbraw/zinc/41/60/14/1051416014.db2.gz UXEKSVOEHGRYMI-QUCCMNQESA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c(C)c1 ZINC001170452289 1051416289 /nfs/dbraw/zinc/41/62/89/1051416289.db2.gz UXEKSVOEHGRYMI-ICSRJNTNSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)c(C)c1 ZINC001170452289 1051416310 /nfs/dbraw/zinc/41/63/10/1051416310.db2.gz UXEKSVOEHGRYMI-ICSRJNTNSA-N 2 1 300.490 4.091 20 0 DIADMP Cc1cc(C)c([C@H](C)[NH+]2CCC[C@@]3(CC[N@@H+](C)C3)C2)c(C)c1 ZINC001170452289 1051416316 /nfs/dbraw/zinc/41/63/16/1051416316.db2.gz UXEKSVOEHGRYMI-ICSRJNTNSA-N 2 1 300.490 4.091 20 0 DIADMP C[NH+]1CCC2(CC[N@H+]([C@H]3CCC[C@@H](c4ccccc4)C3)C2)CC1 ZINC001172551478 1051435711 /nfs/dbraw/zinc/43/57/11/1051435711.db2.gz HKZVCQCZOQWHGX-UXHICEINSA-N 2 1 312.501 4.131 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@@H](c2ccccc2)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172556658 1051438817 /nfs/dbraw/zinc/43/88/17/1051438817.db2.gz MVOYZCZBQOSHFY-WTGUMLROSA-N 2 1 300.490 4.303 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172546957 1051457373 /nfs/dbraw/zinc/45/73/73/1051457373.db2.gz SWLXRLQXTNNHKD-PBASOCQRSA-N 2 1 314.517 4.421 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169099576 1051509665 /nfs/dbraw/zinc/50/96/65/1051509665.db2.gz BTENAESUJNSTES-OKYOBFRVSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169100674 1051511489 /nfs/dbraw/zinc/51/14/89/1051511489.db2.gz LFEXHVNDQYHAII-MHORFTMASA-N 2 1 304.865 4.006 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(Cl)cc(Cl)c1 ZINC001169101484 1051511667 /nfs/dbraw/zinc/51/16/67/1051511667.db2.gz SQAPFDRKIXSPSS-LTTZEQNMSA-N 2 1 313.272 4.269 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(Cl)cc(Cl)c1 ZINC001169101483 1051512100 /nfs/dbraw/zinc/51/21/00/1051512100.db2.gz SQAPFDRKIXSPSS-KCXZSRPNSA-N 2 1 313.272 4.269 20 0 DIADMP CC[NH+]1CCC([N@H+](C)C2CCC(Cc3ccccc3)CC2)CC1 ZINC001172823055 1051513584 /nfs/dbraw/zinc/51/35/84/1051513584.db2.gz WFUOBWAKNNTKQR-UHFFFAOYSA-N 2 1 314.517 4.204 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)C2CCC(Cc3ccccc3)CC2)CC1 ZINC001172823055 1051513594 /nfs/dbraw/zinc/51/35/94/1051513594.db2.gz WFUOBWAKNNTKQR-UHFFFAOYSA-N 2 1 314.517 4.204 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001169140129 1051527040 /nfs/dbraw/zinc/52/70/40/1051527040.db2.gz HNACMMNRAXQYQL-XMTFNYHQSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001169140129 1051527046 /nfs/dbraw/zinc/52/70/46/1051527046.db2.gz HNACMMNRAXQYQL-XMTFNYHQSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccc(Cl)cc1)C2 ZINC001169140129 1051527054 /nfs/dbraw/zinc/52/70/54/1051527054.db2.gz HNACMMNRAXQYQL-XMTFNYHQSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142625 1051532764 /nfs/dbraw/zinc/53/27/64/1051532764.db2.gz DRTACHJURWTTNI-DGAVXFQQSA-N 2 1 310.894 4.164 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142625 1051532774 /nfs/dbraw/zinc/53/27/74/1051532774.db2.gz DRTACHJURWTTNI-DGAVXFQQSA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142625 1051532785 /nfs/dbraw/zinc/53/27/85/1051532785.db2.gz DRTACHJURWTTNI-DGAVXFQQSA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccc(Cl)s1)C2 ZINC001169142625 1051532789 /nfs/dbraw/zinc/53/27/89/1051532789.db2.gz DRTACHJURWTTNI-DGAVXFQQSA-N 2 1 310.894 4.164 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172857581 1051543115 /nfs/dbraw/zinc/54/31/15/1051543115.db2.gz XFSVPRKKKBEITC-SJWGOKEGSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172857581 1051543126 /nfs/dbraw/zinc/54/31/26/1051543126.db2.gz XFSVPRKKKBEITC-SJWGOKEGSA-N 2 1 324.871 4.015 20 0 DIADMP CC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001169261650 1051560646 /nfs/dbraw/zinc/56/06/46/1051560646.db2.gz KEXJFXCJXOKCND-KRWDZBQOSA-N 2 1 304.503 4.030 20 0 DIADMP CC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccccc2SC)CC1 ZINC001169261650 1051560660 /nfs/dbraw/zinc/56/06/60/1051560660.db2.gz KEXJFXCJXOKCND-KRWDZBQOSA-N 2 1 304.503 4.030 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2ccsc2)CC1 ZINC000178166834 1051562362 /nfs/dbraw/zinc/56/23/62/1051562362.db2.gz WBJCSEMXWNMRMG-INIZCTEOSA-N 2 1 314.498 4.372 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc2ccccc2n1 ZINC000178371402 1051569563 /nfs/dbraw/zinc/56/95/63/1051569563.db2.gz WOYAMCCBIGKPFZ-SJORKVTESA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc2ccccc2n1 ZINC000178371402 1051569572 /nfs/dbraw/zinc/56/95/72/1051569572.db2.gz WOYAMCCBIGKPFZ-SJORKVTESA-N 2 1 311.473 4.150 20 0 DIADMP CCCOC1CCC([N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173094423 1051599892 /nfs/dbraw/zinc/59/98/92/1051599892.db2.gz YPVHXRFUXKLUPT-POSCCBCBSA-N 2 1 324.553 4.342 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)CCCc2ccccc2)CC1 ZINC001173111360 1051610096 /nfs/dbraw/zinc/61/00/96/1051610096.db2.gz CBWUWDZNJJFWAO-UHFFFAOYSA-N 2 1 302.506 4.204 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2ccccc2F)CC1 ZINC001173113164 1051611545 /nfs/dbraw/zinc/61/15/45/1051611545.db2.gz JUQVGPJHUFNNBT-UHFFFAOYSA-N 2 1 306.469 4.301 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCSc3ccccc3C2)CC1 ZINC001173112744 1051611582 /nfs/dbraw/zinc/61/15/82/1051611582.db2.gz CURMGTOAXQYXHE-UHFFFAOYSA-N 2 1 318.530 4.247 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3cc(Cl)ccc3C2)CC1 ZINC001173114569 1051611891 /nfs/dbraw/zinc/61/18/91/1051611891.db2.gz PNUMWDPDNPODLX-UHFFFAOYSA-N 2 1 320.908 4.351 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+]2CC=C(c3ccccc3)CC2)CC1 ZINC001173113233 1051612017 /nfs/dbraw/zinc/61/20/17/1051612017.db2.gz LOLAPKCEIRKBTG-UHFFFAOYSA-N 2 1 312.501 4.429 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2ccc(C)cc2)CC1 ZINC001173112670 1051612031 /nfs/dbraw/zinc/61/20/31/1051612031.db2.gz BMKJHRHWMIVAFE-UHFFFAOYSA-N 2 1 302.506 4.470 20 0 DIADMP CCC[N@@H+]1C[C@@H]2C[NH+](C3CCC4(CCCCC4)CC3)C[C@@H]2C1 ZINC001173120505 1051615942 /nfs/dbraw/zinc/61/59/42/1051615942.db2.gz FULGCHNCSVCFPM-HDICACEKSA-N 2 1 304.522 4.153 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@H+](C3CCC4(CCCCC4)CC3)C[C@@H]2C1 ZINC001173120505 1051615948 /nfs/dbraw/zinc/61/59/48/1051615948.db2.gz FULGCHNCSVCFPM-HDICACEKSA-N 2 1 304.522 4.153 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@@H+](C3CCC4(CCCCC4)CC3)C[C@@H]2C1 ZINC001173120505 1051615953 /nfs/dbraw/zinc/61/59/53/1051615953.db2.gz FULGCHNCSVCFPM-HDICACEKSA-N 2 1 304.522 4.153 20 0 DIADMP CCCC[N@@H+](C)CCC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173198265 1051628597 /nfs/dbraw/zinc/62/85/97/1051628597.db2.gz RLPRHVIBZSQAIA-UHFFFAOYSA-N 2 1 318.505 4.088 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(Cl)c1Cl ZINC001206013100 1051650517 /nfs/dbraw/zinc/65/05/17/1051650517.db2.gz PFCBTCANWFVLAZ-OLZOCXBDSA-N 2 1 315.288 4.109 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173249176 1051652875 /nfs/dbraw/zinc/65/28/75/1051652875.db2.gz KBHNEPPVEVNNTF-DUXKGJEZSA-N 2 1 316.533 4.408 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173248441 1051652928 /nfs/dbraw/zinc/65/29/28/1051652928.db2.gz GUGLUHKLCMXSIM-NDXORKPFSA-N 2 1 314.517 4.162 20 0 DIADMP CCCC[C@H](CC(C)C)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001173254066 1051657201 /nfs/dbraw/zinc/65/72/01/1051657201.db2.gz BGDXXWCNTVGTIV-UXHICEINSA-N 2 1 324.553 4.167 20 0 DIADMP CCCC[C@H](CC(C)C)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001173254068 1051657632 /nfs/dbraw/zinc/65/76/32/1051657632.db2.gz BGDXXWCNTVGTIV-WOJBJXKFSA-N 2 1 324.553 4.167 20 0 DIADMP CC[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173265367 1051665760 /nfs/dbraw/zinc/66/57/60/1051665760.db2.gz SSLCWTOHNDBEMO-OSTWSGHESA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001173270348 1051667798 /nfs/dbraw/zinc/66/77/98/1051667798.db2.gz NRFWOEPBLIWSMG-WMLDXEAASA-N 2 1 306.881 4.169 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001206014298 1051667837 /nfs/dbraw/zinc/66/78/37/1051667837.db2.gz WJERYCNUZIKRQB-OALUTQOASA-N 2 1 322.496 4.469 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173270612 1051669260 /nfs/dbraw/zinc/66/92/60/1051669260.db2.gz NZDBHXRSCKHULA-XLNTUCKNSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272248 1051669262 /nfs/dbraw/zinc/66/92/62/1051669262.db2.gz UIIAPSOZDPCPIU-VBSBHUPXSA-N 2 1 300.490 4.337 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)C1 ZINC001173273488 1051670573 /nfs/dbraw/zinc/67/05/73/1051670573.db2.gz FGZBHDDODWKUKW-QCFAMHMHSA-N 2 1 314.517 4.313 20 0 DIADMP CCSC[C@@H](C)[N@@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173297970 1051678570 /nfs/dbraw/zinc/67/85/70/1051678570.db2.gz IWMYLGRJLRMTDW-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1NC(C)(C)CC[NH+](C)C ZINC001169718581 1051681515 /nfs/dbraw/zinc/68/15/15/1051681515.db2.gz XMHUMVMAIXIDCE-UHFFFAOYSA-N 2 1 303.494 4.128 20 0 DIADMP CC[C@H]1CC[C@@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001173276395 1051683492 /nfs/dbraw/zinc/68/34/92/1051683492.db2.gz QHEJVBIMSCVSEI-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC001173289055 1051690911 /nfs/dbraw/zinc/69/09/11/1051690911.db2.gz QMLZBVBLCAEJNM-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC001173289049 1051690964 /nfs/dbraw/zinc/69/09/64/1051690964.db2.gz QMLZBVBLCAEJNM-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183103903 1051707214 /nfs/dbraw/zinc/70/72/14/1051707214.db2.gz ZXBRGVGSQSKPOU-OLMMMNRUSA-N 2 1 316.489 4.146 20 0 DIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183103903 1051707229 /nfs/dbraw/zinc/70/72/29/1051707229.db2.gz ZXBRGVGSQSKPOU-OLMMMNRUSA-N 2 1 316.489 4.146 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183197324 1051709303 /nfs/dbraw/zinc/70/93/03/1051709303.db2.gz XIBVETZKLCZBTH-YYFZDKIDSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183185058 1051711249 /nfs/dbraw/zinc/71/12/49/1051711249.db2.gz UBSIFFWWGNISKC-ZMSDIMECSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183192234 1051712246 /nfs/dbraw/zinc/71/22/46/1051712246.db2.gz KXZSJJQURGJYMZ-WSTZPKSXSA-N 2 1 314.517 4.250 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH3+])[C@H](C)C2)c(Cl)cc1Cl ZINC001206023588 1051717090 /nfs/dbraw/zinc/71/70/90/1051717090.db2.gz FXSNOVFMDBXDSR-OLZOCXBDSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001206025683 1051731693 /nfs/dbraw/zinc/73/16/93/1051731693.db2.gz OZBSLYSRKBAJHF-QWHCGFSZSA-N 2 1 315.288 4.109 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000185518496 1051772342 /nfs/dbraw/zinc/77/23/42/1051772342.db2.gz GEZCNUWEERLILB-PCKAHOCUSA-N 2 1 320.443 4.019 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000185518496 1051772355 /nfs/dbraw/zinc/77/23/55/1051772355.db2.gz GEZCNUWEERLILB-PCKAHOCUSA-N 2 1 320.443 4.019 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000185518496 1051772363 /nfs/dbraw/zinc/77/23/63/1051772363.db2.gz GEZCNUWEERLILB-PCKAHOCUSA-N 2 1 320.443 4.019 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000219149681 1051773084 /nfs/dbraw/zinc/77/30/84/1051773084.db2.gz KAVCKJKOFGZWPI-CYBMUJFWSA-N 2 1 302.384 4.086 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000219149681 1051773099 /nfs/dbraw/zinc/77/30/99/1051773099.db2.gz KAVCKJKOFGZWPI-CYBMUJFWSA-N 2 1 302.384 4.086 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)s1 ZINC001206214177 1051789348 /nfs/dbraw/zinc/78/93/48/1051789348.db2.gz XNRMJWQUZRTZLK-DLBZAZTESA-N 2 1 312.498 4.132 20 0 DIADMP CC(C)c1nc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cs1 ZINC000186248574 1051803391 /nfs/dbraw/zinc/80/33/91/1051803391.db2.gz LMZZUKLXGOUZKK-CVEARBPZSA-N 2 1 323.550 4.429 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000186299936 1051808633 /nfs/dbraw/zinc/80/86/33/1051808633.db2.gz JPALNPSUSBGLLT-DOTOQJQBSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000186299936 1051808647 /nfs/dbraw/zinc/80/86/47/1051808647.db2.gz JPALNPSUSBGLLT-DOTOQJQBSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000186357273 1051810778 /nfs/dbraw/zinc/81/07/78/1051810778.db2.gz IXHZZRGVKUZQGF-KYJSFNMBSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000186357273 1051810789 /nfs/dbraw/zinc/81/07/89/1051810789.db2.gz IXHZZRGVKUZQGF-KYJSFNMBSA-N 2 1 306.519 4.299 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)C2CCSCC2)c1 ZINC000187096599 1051836341 /nfs/dbraw/zinc/83/63/41/1051836341.db2.gz WSVPELVKVRVURO-MRXNPFEDSA-N 2 1 320.546 4.148 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768215381 1051904724 /nfs/dbraw/zinc/90/47/24/1051904724.db2.gz FBMZEHNWVWUDEI-OAHLLOKOSA-N 2 1 300.421 4.080 20 0 DIADMP c1ccc2c(Nc3ccc(CC[NH+]4CCCC4)cc3)cc[nH+]c2c1 ZINC001174038216 1051961581 /nfs/dbraw/zinc/96/15/81/1051961581.db2.gz JSPOMFCYBPWXSX-UHFFFAOYSA-N 2 1 317.436 4.039 20 0 DIADMP Clc1csc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000193136482 1052030700 /nfs/dbraw/zinc/03/07/00/1052030700.db2.gz WIIUQPBFVGLRER-UHFFFAOYSA-N 2 1 312.910 4.288 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)cc1 ZINC000769530993 1052075483 /nfs/dbraw/zinc/07/54/83/1052075483.db2.gz QBVROPNTXQXPGS-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP c1cn2cc(Nc3cccc(C[NH+]4CCCCC4)c3)ccc2[nH+]1 ZINC001174278354 1052087007 /nfs/dbraw/zinc/08/70/07/1052087007.db2.gz ATJPBMRTUGWIQB-UHFFFAOYSA-N 2 1 306.413 4.064 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168474596 1052186770 /nfs/dbraw/zinc/18/67/70/1052186770.db2.gz SLJUNNRVXIXGSP-QSFXBCCZSA-N 2 1 318.480 4.271 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)C1CCCC1 ZINC000495052955 1052203398 /nfs/dbraw/zinc/20/33/98/1052203398.db2.gz ZYSBBHYJRQFEHO-IMFGXOCKSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)C1CCCC1 ZINC000495052955 1052203406 /nfs/dbraw/zinc/20/34/06/1052203406.db2.gz ZYSBBHYJRQFEHO-IMFGXOCKSA-N 2 1 300.490 4.299 20 0 DIADMP CCCCCC[C@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218213718 1052208136 /nfs/dbraw/zinc/20/81/36/1052208136.db2.gz GYVKNBXPDABVJA-KRWDZBQOSA-N 2 1 318.505 4.347 20 0 DIADMP CCC[C@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)[C@@H](C)CC ZINC001218292271 1052217090 /nfs/dbraw/zinc/21/70/90/1052217090.db2.gz POBJXJLTQNKEQZ-JXFKEZNVSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@H](C[C@@H](C)CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218297187 1052219147 /nfs/dbraw/zinc/21/91/47/1052219147.db2.gz ZYDDZVBLSCOEIU-QFBILLFUSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@@H](C)C[C@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218294183 1052219445 /nfs/dbraw/zinc/21/94/45/1052219445.db2.gz ISMVKRQIKPYYAM-APWZRJJASA-N 2 1 318.505 4.203 20 0 DIADMP Cc1cccc([C@H](C)Oc2ccccc2C[NH+]2CCC([NH3+])CC2)c1 ZINC001218326597 1052225456 /nfs/dbraw/zinc/22/54/56/1052225456.db2.gz UXBFDGZIWPGBSS-KRWDZBQOSA-N 2 1 324.468 4.058 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000250257272 1052225585 /nfs/dbraw/zinc/22/55/85/1052225585.db2.gz REWYCUAQYPZIOX-OKZBNKHCSA-N 2 1 304.865 4.008 20 0 DIADMP Cc1ccc([C@@H](C)Oc2ccccc2C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218343870 1052228877 /nfs/dbraw/zinc/22/88/77/1052228877.db2.gz LWYYRGVFHKITAG-QGZVFWFLSA-N 2 1 324.468 4.058 20 0 DIADMP CC[C@H](C)CC[C@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218358206 1052230963 /nfs/dbraw/zinc/23/09/63/1052230963.db2.gz PYKZSKBQTXYYDP-IRXDYDNUSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309716077 1052236029 /nfs/dbraw/zinc/23/60/29/1052236029.db2.gz KVDUGXHJARSGQP-MISYRCLQSA-N 2 1 300.490 4.067 20 0 DIADMP CC/C=C(\C)[C@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218437677 1052238790 /nfs/dbraw/zinc/23/87/90/1052238790.db2.gz DQYOJVYKOQLGGD-UOUFMIKHSA-N 2 1 316.489 4.123 20 0 DIADMP CCC[C@@H](C)[C@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218439790 1052240527 /nfs/dbraw/zinc/24/05/27/1052240527.db2.gz WSYFMXXNIULCML-APWZRJJASA-N 2 1 318.505 4.203 20 0 DIADMP CC1(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000309787667 1052246050 /nfs/dbraw/zinc/24/60/50/1052246050.db2.gz NQUKNBZGESCIAN-IBGZPJMESA-N 2 1 300.490 4.069 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001168492429 1052407206 /nfs/dbraw/zinc/40/72/06/1052407206.db2.gz RLPPFISNMUMMIE-XLIONFOSSA-N 2 1 318.480 4.097 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237030235 1052434949 /nfs/dbraw/zinc/43/49/49/1052434949.db2.gz HOPGRYRJMGMKBN-NRFANRHFSA-N 2 1 322.496 4.262 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC001222141083 1052449408 /nfs/dbraw/zinc/44/94/08/1052449408.db2.gz DPGIIWDYFCBUIJ-GHTZIAJQSA-N 2 1 314.517 4.064 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222149262 1052450276 /nfs/dbraw/zinc/45/02/76/1052450276.db2.gz WQJJTWJITOHMSX-OAQYLSRUSA-N 2 1 320.436 4.162 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)cc12 ZINC001222148737 1052450672 /nfs/dbraw/zinc/45/06/72/1052450672.db2.gz SDBPVDCNEWCLNN-NRFANRHFSA-N 2 1 320.436 4.162 20 0 DIADMP Cc1csc2sc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)c(C)c12 ZINC001222149487 1052451830 /nfs/dbraw/zinc/45/18/30/1052451830.db2.gz YXOHTMIHCLOXKU-QGZVFWFLSA-N 2 1 320.527 4.155 20 0 DIADMP Fc1cccc(CCC[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222155192 1052453052 /nfs/dbraw/zinc/45/30/52/1052453052.db2.gz XLQNTXBCGCTVIN-HXUWFJFHSA-N 2 1 318.480 4.004 20 0 DIADMP Clc1cccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162115 1052454122 /nfs/dbraw/zinc/45/41/22/1052454122.db2.gz YPCYIJJOJZKFJF-SFHVURJKSA-N 2 1 306.881 4.086 20 0 DIADMP Clc1cccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222162115 1052454126 /nfs/dbraw/zinc/45/41/26/1052454126.db2.gz YPCYIJJOJZKFJF-SFHVURJKSA-N 2 1 306.881 4.086 20 0 DIADMP c1c2ccccc2oc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222160845 1052454227 /nfs/dbraw/zinc/45/42/27/1052454227.db2.gz JDRHKNCVMMZTOU-HXUWFJFHSA-N 2 1 312.457 4.179 20 0 DIADMP Clc1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222160774 1052454254 /nfs/dbraw/zinc/45/42/54/1052454254.db2.gz IQNPBSRLZDUCAW-SFHVURJKSA-N 2 1 306.881 4.086 20 0 DIADMP Clc1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222160774 1052454256 /nfs/dbraw/zinc/45/42/56/1052454256.db2.gz IQNPBSRLZDUCAW-SFHVURJKSA-N 2 1 306.881 4.086 20 0 DIADMP CCc1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)s1 ZINC001222166912 1052454945 /nfs/dbraw/zinc/45/49/45/1052454945.db2.gz FXHMJTBNPUIKKI-GOSISDBHSA-N 2 1 306.519 4.056 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@]12CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222231621 1052464929 /nfs/dbraw/zinc/46/49/29/1052464929.db2.gz OJYMUIRFRWGWPX-LAUBAEHRSA-N 2 1 308.469 4.161 20 0 DIADMP Fc1ccc(-c2ccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]C4)cc2)cc1 ZINC001222243988 1052468120 /nfs/dbraw/zinc/46/81/20/1052468120.db2.gz RRNKHATXVSZHGT-OAQYLSRUSA-N 2 1 324.443 4.211 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]C4)cc2)cc1 ZINC001222243988 1052468121 /nfs/dbraw/zinc/46/81/21/1052468121.db2.gz RRNKHATXVSZHGT-OAQYLSRUSA-N 2 1 324.443 4.211 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222258460 1052470475 /nfs/dbraw/zinc/47/04/75/1052470475.db2.gz ATBAEWFOXMGRRK-QUCCMNQESA-N 2 1 324.553 4.074 20 0 DIADMP c1cc(-c2ccccc2)sc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000316726747 1052471583 /nfs/dbraw/zinc/47/15/83/1052471583.db2.gz GDNLXGUQLANAMO-IRXDYDNUSA-N 2 1 312.482 4.132 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@]3(CCC[NH2+]C3)C2)cc1 ZINC001222272636 1052471668 /nfs/dbraw/zinc/47/16/68/1052471668.db2.gz XVNCEQVFDNDGGF-QFIPXVFZSA-N 2 1 320.480 4.319 20 0 DIADMP CC(C)(C)C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000316903641 1052475518 /nfs/dbraw/zinc/47/55/18/1052475518.db2.gz ZOKBDVPKPMOWCV-FHWLQOOXSA-N 2 1 300.490 4.380 20 0 DIADMP Clc1cccc(C[N@@H+]2CCC[C@]23CCC[NH2+]CC3)c1Cl ZINC001222308670 1052479040 /nfs/dbraw/zinc/47/90/40/1052479040.db2.gz LCLQLTNXOKAYIJ-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1cccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c1Cl ZINC001222308670 1052479042 /nfs/dbraw/zinc/47/90/42/1052479042.db2.gz LCLQLTNXOKAYIJ-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c1 ZINC001222314230 1052479813 /nfs/dbraw/zinc/47/98/13/1052479813.db2.gz DDSSQSBGRCKMSJ-FQEVSTJZSA-N 2 1 300.490 4.092 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@]23CCC[NH2+]CC3)s1 ZINC001222320177 1052482066 /nfs/dbraw/zinc/48/20/66/1052482066.db2.gz CEUCXNNDGFWWKG-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000322368323 1052485246 /nfs/dbraw/zinc/48/52/46/1052485246.db2.gz DBSVDGREGLVYQR-HQSKLWIPSA-N 2 1 306.881 4.396 20 0 DIADMP c1ccc(C(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c2ccccc2)cc1 ZINC001222345195 1052487679 /nfs/dbraw/zinc/48/76/79/1052487679.db2.gz IPXRRZGVIKSCLV-QFIPXVFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc(C(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c2ccccc2)cc1 ZINC001222345195 1052487683 /nfs/dbraw/zinc/48/76/83/1052487683.db2.gz IPXRRZGVIKSCLV-QFIPXVFZSA-N 2 1 320.480 4.037 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000322844538 1052498169 /nfs/dbraw/zinc/49/81/69/1052498169.db2.gz MAQWWISQBMXBBG-HNSVSWJLSA-N 2 1 312.457 4.271 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000322844538 1052498172 /nfs/dbraw/zinc/49/81/72/1052498172.db2.gz MAQWWISQBMXBBG-HNSVSWJLSA-N 2 1 312.457 4.271 20 0 DIADMP Clc1cc(C[NH+]2CCC3(CCC[NH2+]C3)CC2)c(Cl)s1 ZINC001222452815 1052501658 /nfs/dbraw/zinc/50/16/58/1052501658.db2.gz KPQICKLGAVZHGP-UHFFFAOYSA-N 2 1 319.301 4.021 20 0 DIADMP CC(C)=CCC[C@H](C)C[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001222596028 1052515042 /nfs/dbraw/zinc/51/50/42/1052515042.db2.gz OSFDDFLGXVCUNK-AZUAARDMSA-N 2 1 312.501 4.058 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]C[C@@H](C)C(C)(C)C)CC1 ZINC000670267133 1052542878 /nfs/dbraw/zinc/54/28/78/1052542878.db2.gz RTRCPZQOAPEKJH-IAGOWNOFSA-N 2 1 302.506 4.484 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CCC1 ZINC000398045955 1052564101 /nfs/dbraw/zinc/56/41/01/1052564101.db2.gz VSXISAMDUQXTHA-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP c1csc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)c1 ZINC000037318666 1052622017 /nfs/dbraw/zinc/62/20/17/1052622017.db2.gz ITDJXFFQBOZKAH-GOSISDBHSA-N 2 1 304.503 4.196 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](c2cccs2)C2CCCC2)CC1 ZINC000037414133 1052623339 /nfs/dbraw/zinc/62/33/39/1052623339.db2.gz UJQUQVGUZUXECF-SFHVURJKSA-N 2 1 306.519 4.443 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)CC1 ZINC000124127519 1052637423 /nfs/dbraw/zinc/63/74/23/1052637423.db2.gz SBLGCHHZJGKQHI-CYBMUJFWSA-N 2 1 323.550 4.274 20 0 DIADMP c1ccc(C[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000124357288 1052640284 /nfs/dbraw/zinc/64/02/84/1052640284.db2.gz DKAOWVSEUOXQAC-DENIHFKCSA-N 2 1 320.480 4.044 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CC1 ZINC000125187084 1052646074 /nfs/dbraw/zinc/64/60/74/1052646074.db2.gz UFEQBDFXUKHDTK-OXQOHEQNSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000125475397 1052649162 /nfs/dbraw/zinc/64/91/62/1052649162.db2.gz LQMLJRJMVNHHDS-AWEZNQCLSA-N 2 1 305.853 4.318 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000125475397 1052649165 /nfs/dbraw/zinc/64/91/65/1052649165.db2.gz LQMLJRJMVNHHDS-AWEZNQCLSA-N 2 1 305.853 4.318 20 0 DIADMP CC[N@@H+](CCCn1ccnc1C)[C@H](C)c1cc2ccccc2o1 ZINC000127316064 1052692527 /nfs/dbraw/zinc/69/25/27/1052692527.db2.gz VABNKWUUESWMKC-OAHLLOKOSA-N 2 1 311.429 4.411 20 0 DIADMP CC[N@H+](CCCn1cc[nH+]c1C)[C@H](C)c1cc2ccccc2o1 ZINC000127316064 1052692530 /nfs/dbraw/zinc/69/25/30/1052692530.db2.gz VABNKWUUESWMKC-OAHLLOKOSA-N 2 1 311.429 4.411 20 0 DIADMP CC[N@@H+](CCCn1cc[nH+]c1C)[C@H](C)c1cc2ccccc2o1 ZINC000127316064 1052692531 /nfs/dbraw/zinc/69/25/31/1052692531.db2.gz VABNKWUUESWMKC-OAHLLOKOSA-N 2 1 311.429 4.411 20 0 DIADMP CC[C@@H](C[NH2+]Cc1ccccc1-c1ccccc1)[NH+]1CCCC1 ZINC000917394952 1052724062 /nfs/dbraw/zinc/72/40/62/1052724062.db2.gz YCNUYKJVHRIURV-FQEVSTJZSA-N 2 1 308.469 4.318 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000154726349 1052797709 /nfs/dbraw/zinc/79/77/09/1052797709.db2.gz XKGXGTYPOHWWGF-ZDUSSCGKSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556119222 1052804107 /nfs/dbraw/zinc/80/41/07/1052804107.db2.gz SBTACVXIAFGLOT-DGEVVOEJSA-N 2 1 320.480 4.345 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556119222 1052804109 /nfs/dbraw/zinc/80/41/09/1052804109.db2.gz SBTACVXIAFGLOT-DGEVVOEJSA-N 2 1 320.480 4.345 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556119223 1052804271 /nfs/dbraw/zinc/80/42/71/1052804271.db2.gz SBTACVXIAFGLOT-JCXROGDPSA-N 2 1 320.480 4.345 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556119223 1052804275 /nfs/dbraw/zinc/80/42/75/1052804275.db2.gz SBTACVXIAFGLOT-JCXROGDPSA-N 2 1 320.480 4.345 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556119224 1052804782 /nfs/dbraw/zinc/80/47/82/1052804782.db2.gz SBTACVXIAFGLOT-JJJJLYANSA-N 2 1 320.480 4.345 20 0 DIADMP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556119224 1052804786 /nfs/dbraw/zinc/80/47/86/1052804786.db2.gz SBTACVXIAFGLOT-JJJJLYANSA-N 2 1 320.480 4.345 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]CCC[N@H+](C)Cc1ccccc1 ZINC000070089656 1052814596 /nfs/dbraw/zinc/81/45/96/1052814596.db2.gz BMUXWOBBGQWQPC-MRXNPFEDSA-N 2 1 302.487 4.229 20 0 DIADMP Cc1ccsc1[C@@H](C)[NH2+]CCC[N@@H+](C)Cc1ccccc1 ZINC000070089656 1052814598 /nfs/dbraw/zinc/81/45/98/1052814598.db2.gz BMUXWOBBGQWQPC-MRXNPFEDSA-N 2 1 302.487 4.229 20 0 DIADMP c1oc2ccccc2c1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000556198833 1052818783 /nfs/dbraw/zinc/81/87/83/1052818783.db2.gz XVMBQZHPNCOIQJ-UHFFFAOYSA-N 2 1 312.457 4.320 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000556225497 1052823420 /nfs/dbraw/zinc/82/34/20/1052823420.db2.gz VLDFXBCZOFYNPW-CLAROIROSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@]2(C)C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000556225497 1052823422 /nfs/dbraw/zinc/82/34/22/1052823422.db2.gz VLDFXBCZOFYNPW-CLAROIROSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000519435172 1053143571 /nfs/dbraw/zinc/14/35/71/1053143571.db2.gz JGIKZVRYRWPGSY-MYGLTJDJSA-N 2 1 320.480 4.215 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@@H]1c1ccccc1 ZINC000519435172 1053143577 /nfs/dbraw/zinc/14/35/77/1053143577.db2.gz JGIKZVRYRWPGSY-MYGLTJDJSA-N 2 1 320.480 4.215 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000090585314 1053237685 /nfs/dbraw/zinc/23/76/85/1053237685.db2.gz SCZWJOGMKIZNSL-GOEBONIOSA-N 2 1 323.550 4.033 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC001200105896 1053386189 /nfs/dbraw/zinc/38/61/89/1053386189.db2.gz PMCNAEOSIOXWTN-NZSAHSFTSA-N 2 1 306.538 4.445 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(Oc3ccccc3)c2)C1 ZINC001321650534 1053426492 /nfs/dbraw/zinc/42/64/92/1053426492.db2.gz MIDKHRNHHZIWIC-IBGZPJMESA-N 2 1 324.468 4.300 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CCN1C ZINC000093644860 1053430872 /nfs/dbraw/zinc/43/08/72/1053430872.db2.gz GDJLPDJWOBEYKR-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644860 1053430875 /nfs/dbraw/zinc/43/08/75/1053430875.db2.gz GDJLPDJWOBEYKR-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H](N(C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644860 1053430878 /nfs/dbraw/zinc/43/08/78/1053430878.db2.gz GDJLPDJWOBEYKR-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@@H+]1C ZINC000093644860 1053430881 /nfs/dbraw/zinc/43/08/81/1053430881.db2.gz GDJLPDJWOBEYKR-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cc(-c3ccccc3)cs2)CC[N@H+]1C ZINC000093644860 1053430883 /nfs/dbraw/zinc/43/08/83/1053430883.db2.gz GDJLPDJWOBEYKR-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644860 1053430885 /nfs/dbraw/zinc/43/08/85/1053430885.db2.gz GDJLPDJWOBEYKR-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CC[NH+]1C ZINC000093644860 1053430889 /nfs/dbraw/zinc/43/08/89/1053430889.db2.gz GDJLPDJWOBEYKR-YJBOKZPZSA-N 2 1 314.498 4.330 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)C1 ZINC000324548927 1053464876 /nfs/dbraw/zinc/46/48/76/1053464876.db2.gz PJOSCCVPUZYHLL-SFHVURJKSA-N 2 1 310.441 4.040 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(C)(C)C)s2)C1 ZINC001200243471 1053494233 /nfs/dbraw/zinc/49/42/33/1053494233.db2.gz IOWCIBFMLWTPQA-HNNXBMFYSA-N 2 1 308.535 4.256 20 0 DIADMP CC[C@@H](C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001324115834 1053626696 /nfs/dbraw/zinc/62/66/96/1053626696.db2.gz NQNGWZULUXCUFY-VOBGVNJCSA-N 2 1 300.490 4.208 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000414170850 1053672639 /nfs/dbraw/zinc/67/26/39/1053672639.db2.gz CLDANKWFWROPPA-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@H]1c1ccccc1 ZINC000414175716 1053675418 /nfs/dbraw/zinc/67/54/18/1053675418.db2.gz ZKYISRRBMBEQLH-PLWAMTLXSA-N 2 1 324.443 4.107 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@H]1c1ccccc1 ZINC000414175716 1053675421 /nfs/dbraw/zinc/67/54/21/1053675421.db2.gz ZKYISRRBMBEQLH-PLWAMTLXSA-N 2 1 324.443 4.107 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](c2cccs2)C2CCCC2)C1 ZINC001324836070 1053682464 /nfs/dbraw/zinc/68/24/64/1053682464.db2.gz VIWRWXOQUIBGGW-CRAIPNDOSA-N 2 1 306.519 4.301 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ccc(F)c(F)c2)CC1 ZINC000620645855 1053692202 /nfs/dbraw/zinc/69/22/02/1053692202.db2.gz JLLMBKQJVDOONM-HNNXBMFYSA-N 2 1 324.459 4.470 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccs1 ZINC000154476778 1053738552 /nfs/dbraw/zinc/73/85/52/1053738552.db2.gz DEAYZMXQFAVABY-RYRKJORJSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccs1 ZINC000154476778 1053738558 /nfs/dbraw/zinc/73/85/58/1053738558.db2.gz DEAYZMXQFAVABY-RYRKJORJSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2(c3cccs3)CCCCC2)CC[N@H+]1C ZINC000155177915 1053766538 /nfs/dbraw/zinc/76/65/38/1053766538.db2.gz ORXMZOAGVQEWDI-HOTGVXAUSA-N 2 1 306.519 4.022 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000156048947 1053794535 /nfs/dbraw/zinc/79/45/35/1053794535.db2.gz XSOQYMNELBTVCQ-JBYIUTFZSA-N 2 1 322.496 4.137 20 0 DIADMP CS[C@H]1CCC[C@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)C1 ZINC001200672148 1053874555 /nfs/dbraw/zinc/87/45/55/1053874555.db2.gz LWDHNADNGCOPSJ-OALUTQOASA-N 2 1 320.546 4.291 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccccc1-c1ccc(F)cc1 ZINC001231825238 1053878777 /nfs/dbraw/zinc/87/87/77/1053878777.db2.gz RPITUWSSBLEMIB-UHFFFAOYSA-N 2 1 314.448 4.266 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)CC3CC[NH+](C)CC3)c(C)c12 ZINC001231834617 1053887737 /nfs/dbraw/zinc/88/77/37/1053887737.db2.gz RKSYTNRONRIOBL-UHFFFAOYSA-N 2 1 322.543 4.353 20 0 DIADMP CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000158195029 1053893515 /nfs/dbraw/zinc/89/35/15/1053893515.db2.gz IFDGEIBFGBIVMD-CVEARBPZSA-N 2 1 306.519 4.180 20 0 DIADMP CCC[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000158653063 1053913664 /nfs/dbraw/zinc/91/36/64/1053913664.db2.gz MYVMAZZHXTXNSV-ROUUACIJSA-N 2 1 303.494 4.167 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232144912 1053971509 /nfs/dbraw/zinc/97/15/09/1053971509.db2.gz NXIMNXMYDZIPDO-OAHLLOKOSA-N 2 1 312.432 4.007 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232145933 1053972226 /nfs/dbraw/zinc/97/22/26/1053972226.db2.gz FNVBTFDQQCMPTH-HXUWFJFHSA-N 2 1 314.448 4.470 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1 ZINC001232145949 1053972489 /nfs/dbraw/zinc/97/24/89/1053972489.db2.gz FUDZWBFZOAZHEQ-HKUYNNGSSA-N 2 1 304.453 4.042 20 0 DIADMP CCc1ccc(C[N@@H+](C)Cc2cc(F)cc(C[NH+](C)C)c2)cc1 ZINC001232146055 1053972539 /nfs/dbraw/zinc/97/25/39/1053972539.db2.gz HMBIQWVIDBTEJU-UHFFFAOYSA-N 2 1 314.448 4.082 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+](C)[C@H]2CCc3ccccc32)c1 ZINC001232151547 1053973525 /nfs/dbraw/zinc/97/35/25/1053973525.db2.gz OPSKPPDUDQLDNJ-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP CC[C@@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)c(Cl)c1 ZINC000336842747 1053988911 /nfs/dbraw/zinc/98/89/11/1053988911.db2.gz VFOWEQWXKJTLTJ-OAHLLOKOSA-N 2 1 312.244 4.239 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000163486572 1054042891 /nfs/dbraw/zinc/04/28/91/1054042891.db2.gz ZMLRMXRTXJFLTH-HNNXBMFYSA-N 2 1 315.486 4.080 20 0 DIADMP c1cc(C[NH+]2CCC([NH+]3CCCCC3)CC2)c2c(c1)CCCC2 ZINC001232633584 1054091382 /nfs/dbraw/zinc/09/13/82/1054091382.db2.gz CDVUDVIUZIEYHV-UHFFFAOYSA-N 2 1 312.501 4.016 20 0 DIADMP CC1([NH+]2CCCC2)CC[NH+](Cc2cccc3c2CCCC3)CC1 ZINC001232640455 1054092304 /nfs/dbraw/zinc/09/23/04/1054092304.db2.gz MGZCKUBAJRCDEQ-UHFFFAOYSA-N 2 1 312.501 4.016 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)CC(F)(F)F)cc1 ZINC000166699272 1054094360 /nfs/dbraw/zinc/09/43/60/1054094360.db2.gz ONOISEXZZVSVOF-VXGBXAGGSA-N 2 1 311.351 4.172 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCCC(F)(F)F)CC1 ZINC001334099067 1054182293 /nfs/dbraw/zinc/18/22/93/1054182293.db2.gz YKLGLNMBEYITAL-OAHLLOKOSA-N 2 1 320.443 4.305 20 0 DIADMP Cc1cccc(-c2ccc(C[NH+]3CC[C@]4(CC[N@H+](C)C4)C3)cc2)c1 ZINC001233224262 1054206969 /nfs/dbraw/zinc/20/69/69/1054206969.db2.gz AEJGTWUYRBCULR-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CC[C@]4(CC[NH+](C)C4)C3)cc2)c1 ZINC001233224262 1054206976 /nfs/dbraw/zinc/20/69/76/1054206976.db2.gz AEJGTWUYRBCULR-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3CC[C@]4(CC[NH+](C)C4)C3)cc2)c1 ZINC001233224262 1054206981 /nfs/dbraw/zinc/20/69/81/1054206981.db2.gz AEJGTWUYRBCULR-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1cccc(-c2ccc(C[NH+]3CCC([NH+]4CCC4)CC3)cc2)c1 ZINC001233223870 1054207293 /nfs/dbraw/zinc/20/72/93/1054207293.db2.gz LQRMQDGGINMYSA-UHFFFAOYSA-N 2 1 320.480 4.332 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(Cl)c(F)c1 ZINC001356064756 1054272078 /nfs/dbraw/zinc/27/20/78/1054272078.db2.gz ZKGGBFRSGRSEIL-BPZRQAJTSA-N 2 1 322.855 4.288 20 0 DIADMP c1ccc(C(c2ccccc2)[NH+]2CCC([NH+]3CCCC3)CC2)cc1 ZINC000169322301 1054311309 /nfs/dbraw/zinc/31/13/09/1054311309.db2.gz PVVQAHIHFYTBOQ-UHFFFAOYSA-N 2 1 320.480 4.336 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)sc1C ZINC001233685970 1054331459 /nfs/dbraw/zinc/33/14/59/1054331459.db2.gz UKIOTGNKIFPMDA-QGZVFWFLSA-N 2 1 306.519 4.205 20 0 DIADMP CC(C)c1cccc(NC(=[NH2+])NCC[N@@H+](C)C2CCCCC2)c1 ZINC000849058044 1054366853 /nfs/dbraw/zinc/36/68/53/1054366853.db2.gz CUIYHUWDJAFYMI-UHFFFAOYSA-N 2 1 316.493 4.011 20 0 DIADMP CC[C@@H](C)c1ccc(NC(=[NH2+])NCC[N@H+]2CCCC[C@H]2C)cc1 ZINC000849062170 1054368657 /nfs/dbraw/zinc/36/86/57/1054368657.db2.gz JFNAJUGUXKLTBN-HZPDHXFCSA-N 2 1 316.493 4.011 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccccc3s2)C1 ZINC001343272326 1054441559 /nfs/dbraw/zinc/44/15/59/1054441559.db2.gz HLUOVVWWXPLVPG-LSDHHAIUSA-N 2 1 302.487 4.284 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000671294820 1054525000 /nfs/dbraw/zinc/52/50/00/1054525000.db2.gz LQKHKYHIGLIKLS-WDSOQIARSA-N 2 1 316.489 4.143 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623363042 1054570933 /nfs/dbraw/zinc/57/09/33/1054570933.db2.gz VOMUTNRACNFHTQ-HUUCEWRRSA-N 2 1 300.446 4.265 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623363042 1054570951 /nfs/dbraw/zinc/57/09/51/1054570951.db2.gz VOMUTNRACNFHTQ-HUUCEWRRSA-N 2 1 300.446 4.265 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000623400212 1054585839 /nfs/dbraw/zinc/58/58/39/1054585839.db2.gz LXNFMIWHMHTBLE-GOEBONIOSA-N 2 1 306.519 4.322 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1(C)C ZINC000623487193 1054604368 /nfs/dbraw/zinc/60/43/68/1054604368.db2.gz WJXPVNUCCFCTOC-RBUKOAKNSA-N 2 1 316.464 4.224 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530672 1054614405 /nfs/dbraw/zinc/61/44/05/1054614405.db2.gz HXFYMOPNXXKODV-AAEUAGOBSA-N 2 1 312.910 4.241 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)CC1(C)C ZINC000623530672 1054614408 /nfs/dbraw/zinc/61/44/08/1054614408.db2.gz HXFYMOPNXXKODV-AAEUAGOBSA-N 2 1 312.910 4.241 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CC2CCC(F)(F)CC2)cc1 ZINC001348155704 1054616616 /nfs/dbraw/zinc/61/66/16/1054616616.db2.gz ZXWHONXKQHJIGG-UHFFFAOYSA-N 2 1 310.432 4.006 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CCC[C@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001234995312 1054638510 /nfs/dbraw/zinc/63/85/10/1054638510.db2.gz ZOMQBTSJHRIXPZ-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001234995312 1054638515 /nfs/dbraw/zinc/63/85/15/1054638515.db2.gz ZOMQBTSJHRIXPZ-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@]2(CC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001234992140 1054638710 /nfs/dbraw/zinc/63/87/10/1054638710.db2.gz JBHGDWFPDCLKKZ-UTKZUKDTSA-N 2 1 308.469 4.019 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)c(C)c12 ZINC001235003045 1054641583 /nfs/dbraw/zinc/64/15/83/1054641583.db2.gz ZCVMIJPWVWGUBY-QGZVFWFLSA-N 2 1 320.527 4.155 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c1 ZINC001235038676 1054643048 /nfs/dbraw/zinc/64/30/48/1054643048.db2.gz KWHWILMIDXWEEO-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1cc(C)c(Cl)c(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c1 ZINC001235038676 1054643062 /nfs/dbraw/zinc/64/30/62/1054643062.db2.gz KWHWILMIDXWEEO-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)s1 ZINC001235035198 1054643084 /nfs/dbraw/zinc/64/30/84/1054643084.db2.gz CTGRUYCPMHNSIE-GOSISDBHSA-N 2 1 306.519 4.056 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)CC1 ZINC001235030947 1054643603 /nfs/dbraw/zinc/64/36/03/1054643603.db2.gz JFHGXEUQQDECHL-VQTJNVASSA-N 2 1 302.506 4.145 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)CC1 ZINC001235030948 1054643852 /nfs/dbraw/zinc/64/38/52/1054643852.db2.gz JFHGXEUQQDECHL-WOJBJXKFSA-N 2 1 302.506 4.145 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c(C)c1Cl ZINC001235037931 1054644658 /nfs/dbraw/zinc/64/46/58/1054644658.db2.gz JSYAPKOZZWKBJF-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c(C)c1Cl ZINC001235037931 1054644662 /nfs/dbraw/zinc/64/46/62/1054644662.db2.gz JSYAPKOZZWKBJF-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001235040492 1054646358 /nfs/dbraw/zinc/64/63/58/1054646358.db2.gz KZSAIDDECNCIIY-NZSAHSFTSA-N 2 1 318.892 4.052 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235046546 1054647499 /nfs/dbraw/zinc/64/74/99/1054647499.db2.gz RAUASZYWDDWCEQ-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000178183224 1054649957 /nfs/dbraw/zinc/64/99/57/1054649957.db2.gz WWGKIWSQIPCQOY-QGZVFWFLSA-N 2 1 319.452 4.207 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001235091957 1054653701 /nfs/dbraw/zinc/65/37/01/1054653701.db2.gz GDQBPGJBFLXQDS-GOSISDBHSA-N 2 1 314.517 4.064 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC001235091954 1054653781 /nfs/dbraw/zinc/65/37/81/1054653781.db2.gz GBYZGDNDYICDKX-UHFFFAOYSA-N 2 1 320.436 4.162 20 0 DIADMP CC(C)=CCC[C@H](C)CC[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001235086146 1054654975 /nfs/dbraw/zinc/65/49/75/1054654975.db2.gz AFERTYJIZNMXMY-IRXDYDNUSA-N 2 1 314.464 4.080 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC001235094535 1054657269 /nfs/dbraw/zinc/65/72/69/1054657269.db2.gz ZOGMJIJEXJOVCS-UHFFFAOYSA-N 2 1 320.480 4.238 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1ccoc1 ZINC000178782629 1054658995 /nfs/dbraw/zinc/65/89/95/1054658995.db2.gz SVTLUQOGPNTNHY-MRXNPFEDSA-N 2 1 324.424 4.355 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CCC[C@@]23CC[NH2+]C3)CC1 ZINC001235111700 1054660601 /nfs/dbraw/zinc/66/06/01/1054660601.db2.gz SJEYPIAVPXSRFC-UXHICEINSA-N 2 1 302.506 4.287 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235152604 1054666954 /nfs/dbraw/zinc/66/69/54/1054666954.db2.gz HPMNTYSROSACAD-OAQYLSRUSA-N 2 1 308.469 4.194 20 0 DIADMP c1cc2ccc(C[N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)cc2s1 ZINC001235157486 1054666990 /nfs/dbraw/zinc/66/69/90/1054666990.db2.gz JFXHPVDZNXOZRJ-GOSISDBHSA-N 2 1 314.498 4.255 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)ccc1Cl ZINC001235157695 1054667892 /nfs/dbraw/zinc/66/78/92/1054667892.db2.gz KFKYRIDMYZGCOM-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)s1 ZINC001235155613 1054668012 /nfs/dbraw/zinc/66/80/12/1054668012.db2.gz MCAXUIFISKVCMI-SFHVURJKSA-N 2 1 314.498 4.255 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235167295 1054669616 /nfs/dbraw/zinc/66/96/16/1054669616.db2.gz HOEDQRGIVBTTLE-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235167295 1054669621 /nfs/dbraw/zinc/66/96/21/1054669621.db2.gz HOEDQRGIVBTTLE-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP Cc1cccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1Cl ZINC001235159885 1054670156 /nfs/dbraw/zinc/67/01/56/1054670156.db2.gz XVCLHIDJCYBXJP-KRWDZBQOSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c1 ZINC001235185388 1054678682 /nfs/dbraw/zinc/67/86/82/1054678682.db2.gz SMGUMFSNPBYNME-RTWAWAEBSA-N 2 1 320.480 4.012 20 0 DIADMP CSc1cccc(Cl)c1C[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001235189648 1054680979 /nfs/dbraw/zinc/68/09/79/1054680979.db2.gz OZLHWRSRDICSMH-UHFFFAOYSA-N 2 1 324.921 4.170 20 0 DIADMP CSc1cccc(Cl)c1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235189648 1054680987 /nfs/dbraw/zinc/68/09/87/1054680987.db2.gz OZLHWRSRDICSMH-UHFFFAOYSA-N 2 1 324.921 4.170 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1cc(-c2ccsc2)cs1 ZINC001235190243 1054681337 /nfs/dbraw/zinc/68/13/37/1054681337.db2.gz WDKAPSKVQNGSBY-UHFFFAOYSA-N 2 1 308.516 4.250 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1cc(-c2ccsc2)cs1 ZINC001235190243 1054681347 /nfs/dbraw/zinc/68/13/47/1054681347.db2.gz WDKAPSKVQNGSBY-UHFFFAOYSA-N 2 1 308.516 4.250 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235189990 1054682288 /nfs/dbraw/zinc/68/22/88/1054682288.db2.gz RHQPEBZXVAUSOF-UHFFFAOYSA-N 2 1 300.490 4.137 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C(C)(C)c1cccc(Cl)c1 ZINC000179599497 1054690284 /nfs/dbraw/zinc/69/02/84/1054690284.db2.gz QORKSIYUINXQHP-UHFFFAOYSA-N 2 1 305.853 4.150 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccc(F)c(F)c1)C(C)C ZINC000179676555 1054694051 /nfs/dbraw/zinc/69/40/51/1054694051.db2.gz JCSKEDNTIMBWFP-UGSOOPFHSA-N 2 1 321.415 4.093 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)s1 ZINC001235266059 1054695218 /nfs/dbraw/zinc/69/52/18/1054695218.db2.gz XFIJKIOFTAORKY-MAUKXSAKSA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)s1 ZINC001235266059 1054695224 /nfs/dbraw/zinc/69/52/24/1054695224.db2.gz XFIJKIOFTAORKY-MAUKXSAKSA-N 2 1 306.519 4.055 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)CC1 ZINC001235255485 1054695593 /nfs/dbraw/zinc/69/55/93/1054695593.db2.gz NEHSZYQXIWTHGN-ZCNNSNEGSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)CC1 ZINC001235255485 1054695596 /nfs/dbraw/zinc/69/55/96/1054695596.db2.gz NEHSZYQXIWTHGN-ZCNNSNEGSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)(CC[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC001235424046 1054714873 /nfs/dbraw/zinc/71/48/73/1054714873.db2.gz JCFCZYRYLBVUJI-OALUTQOASA-N 2 1 314.517 4.066 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235425377 1054714993 /nfs/dbraw/zinc/71/49/93/1054714993.db2.gz IXWSMVUQTRSKBO-HOTGVXAUSA-N 2 1 314.498 4.113 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)s1 ZINC001235425892 1054715086 /nfs/dbraw/zinc/71/50/86/1054715086.db2.gz JSQQIGIVFPCDIL-CVEARBPZSA-N 2 1 314.498 4.113 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cc2s1 ZINC001235425994 1054715645 /nfs/dbraw/zinc/71/56/45/1054715645.db2.gz KNTKOZSTTZAECF-MSOLQXFVSA-N 2 1 314.498 4.113 20 0 DIADMP c1cc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c2cccccc1-2 ZINC001235430868 1054717490 /nfs/dbraw/zinc/71/74/90/1054717490.db2.gz YINPHJNRZBEILU-RBUKOAKNSA-N 2 1 308.469 4.003 20 0 DIADMP CCCCCCc1csc(C[N@@H+](C)CC2CC[NH2+]CC2)c1 ZINC001235433320 1054717852 /nfs/dbraw/zinc/71/78/52/1054717852.db2.gz SSZBVQRKVGDELX-UHFFFAOYSA-N 2 1 308.535 4.302 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+](C)CC2CC[NH2+]CC2)CC1 ZINC001235433638 1054717965 /nfs/dbraw/zinc/71/79/65/1054717965.db2.gz OGQSGQLDCIUOMT-IBGZPJMESA-N 2 1 304.522 4.391 20 0 DIADMP C[N@H+](Cc1ccc2sc3ccccc3c2c1)CC1CC[NH2+]CC1 ZINC001235433351 1054718127 /nfs/dbraw/zinc/71/81/27/1054718127.db2.gz UIOZGFLTPGAZSP-UHFFFAOYSA-N 2 1 324.493 4.486 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3oc21)CC1CC[NH2+]CC1 ZINC001235434043 1054718870 /nfs/dbraw/zinc/71/88/70/1054718870.db2.gz YSRXIRRFZOXXSG-UHFFFAOYSA-N 2 1 308.425 4.017 20 0 DIADMP Cc1csc2sc(C[N@@H+](C)CC3CC[NH2+]CC3)c(C)c12 ZINC001235434012 1054719595 /nfs/dbraw/zinc/71/95/95/1054719595.db2.gz WUPUFVRJXZBPRD-UHFFFAOYSA-N 2 1 308.516 4.011 20 0 DIADMP C[N@@H+](CCC[NH3+])Cc1cccc(-c2ccc(C(F)(F)F)cc2)c1 ZINC001235435330 1054723604 /nfs/dbraw/zinc/72/36/04/1054723604.db2.gz KALGYTDOYXBDJO-UHFFFAOYSA-N 2 1 322.374 4.153 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@](C)(Cc1ccccc1)c1ccccc1 ZINC001473551265 1054742849 /nfs/dbraw/zinc/74/28/49/1054742849.db2.gz VUDHLCBSPMKESO-VXKWHMMOSA-N 2 1 322.496 4.218 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001235672901 1054768437 /nfs/dbraw/zinc/76/84/37/1054768437.db2.gz JANSVFGFDTXYJP-AWEZNQCLSA-N 2 1 310.466 4.225 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1CC1CC2(C1)CC[NH2+]CC2 ZINC001235680627 1054774849 /nfs/dbraw/zinc/77/48/49/1054774849.db2.gz UZVLZWNPEMEFFF-IBGZPJMESA-N 2 1 316.464 4.133 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1Cc1sc(C2CC[NH2+]CC2)nc1C ZINC001235694776 1054781496 /nfs/dbraw/zinc/78/14/96/1054781496.db2.gz UDVFWASIUBGAQL-MRXNPFEDSA-N 2 1 321.534 4.073 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1cccc(Oc2ccccc2)c1 ZINC001235712812 1054784763 /nfs/dbraw/zinc/78/47/63/1054784763.db2.gz CQFPYDDZIFDFLU-UHFFFAOYSA-N 2 1 324.468 4.300 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@@H+]1CCC[NH2+]C1CCCCC1 ZINC001235719803 1054789487 /nfs/dbraw/zinc/78/94/87/1054789487.db2.gz ZZRKFTDVLASPSA-IBGZPJMESA-N 2 1 304.453 4.275 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1CCC[NH2+]C1CCCCC1 ZINC001235719803 1054789499 /nfs/dbraw/zinc/78/94/99/1054789499.db2.gz ZZRKFTDVLASPSA-IBGZPJMESA-N 2 1 304.453 4.275 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)CCC3CC[NH2+]CC3)cc2)o1 ZINC001235716706 1054790478 /nfs/dbraw/zinc/79/04/78/1054790478.db2.gz HGOJUJREEHUWRU-UHFFFAOYSA-N 2 1 312.457 4.077 20 0 DIADMP Fc1ccccc1[C@H]1CCC[N@@H+]1CCC[NH2+]C1CCCCC1 ZINC001235719804 1054790611 /nfs/dbraw/zinc/79/06/11/1054790611.db2.gz ZZRKFTDVLASPSA-LJQANCHMSA-N 2 1 304.453 4.275 20 0 DIADMP Fc1ccccc1[C@H]1CCC[N@H+]1CCC[NH2+]C1CCCCC1 ZINC001235719804 1054790624 /nfs/dbraw/zinc/79/06/24/1054790624.db2.gz ZZRKFTDVLASPSA-LJQANCHMSA-N 2 1 304.453 4.275 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(C)sc1C ZINC000623866234 1054794497 /nfs/dbraw/zinc/79/44/97/1054794497.db2.gz PHSNVHFKEBFCFP-BQFCYCMXSA-N 2 1 306.519 4.423 20 0 DIADMP CC[N@@H+](Cc1ccccc1-c1ccc(F)cc1)C1CC[NH2+]CC1 ZINC001235759876 1054800505 /nfs/dbraw/zinc/80/05/05/1054800505.db2.gz DDJAUSLQELKLHQ-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP CC[N@@H+](Cc1ccccc1CCc1ccccc1)C1CC[NH2+]CC1 ZINC001235764483 1054801031 /nfs/dbraw/zinc/80/10/31/1054801031.db2.gz GLZQWFLGJWUFEV-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP [NH3+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc2c3ccccc3oc21 ZINC001235775394 1054804458 /nfs/dbraw/zinc/80/44/58/1054804458.db2.gz GPPCJBPJQQKERY-MQVJKMGUSA-N 2 1 306.409 4.040 20 0 DIADMP C[N@H+](Cc1ccc(C[NH3+])cc1)Cc1cccc(Cl)c1Cl ZINC001235791419 1054806172 /nfs/dbraw/zinc/80/61/72/1054806172.db2.gz QUZNJOHHKFSRQM-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP C[N@@H+](Cc1ccc(C[NH3+])cc1)Cc1cccc(Cl)c1Cl ZINC001235791419 1054806177 /nfs/dbraw/zinc/80/61/77/1054806177.db2.gz QUZNJOHHKFSRQM-UHFFFAOYSA-N 2 1 309.240 4.084 20 0 DIADMP c1ccc([C@H]2c3ccccc3CC[N@@H+]2CC[C@H]2CCCC[NH2+]2)cc1 ZINC001235796650 1054806250 /nfs/dbraw/zinc/80/62/50/1054806250.db2.gz UFQYIAAQEZTXAH-IRLDBZIGSA-N 2 1 320.480 4.166 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2Cl)cc1)C[C@@H]1CC[NH2+]C1 ZINC001235843149 1054823472 /nfs/dbraw/zinc/82/34/72/1054823472.db2.gz WLFNYSFLCVBBCE-MRXNPFEDSA-N 2 1 314.860 4.048 20 0 DIADMP [NH3+]CCCC[N@H+]1CCC[C@@H]1C(c1ccccc1)c1ccccc1 ZINC001235867118 1054826515 /nfs/dbraw/zinc/82/65/15/1054826515.db2.gz NVHPQMHCEYTPON-HXUWFJFHSA-N 2 1 308.469 4.022 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891671 1054832968 /nfs/dbraw/zinc/83/29/68/1054832968.db2.gz HIZQEHWDVVBRDJ-TZMCWYRMSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001235891671 1054832975 /nfs/dbraw/zinc/83/29/75/1054832975.db2.gz HIZQEHWDVVBRDJ-TZMCWYRMSA-N 2 1 312.910 4.022 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2C[C@H]3C[NH2+]CC[C@@H]3C2)CC1 ZINC001235929573 1054853215 /nfs/dbraw/zinc/85/32/15/1054853215.db2.gz RODHHFMPAAPKQL-XUVXKRRUSA-N 2 1 302.506 4.001 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3C[C@H]4CC[NH2+]C[C@H]4C3)cc12 ZINC001235940330 1054858687 /nfs/dbraw/zinc/85/86/87/1054858687.db2.gz SJOQTZHQCWGDEL-CVEARBPZSA-N 2 1 322.477 4.096 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1C[C@H]2CC[NH2+]C[C@H]2C1 ZINC001235940901 1054860113 /nfs/dbraw/zinc/86/01/13/1054860113.db2.gz TYPQANPNRWRQGW-ZBFHGGJFSA-N 2 1 322.477 4.096 20 0 DIADMP Clc1ccc([C@H]2CC[N@@H+](CCC[NH2+]C3CCCCC3)C2)cc1 ZINC001235948922 1054864005 /nfs/dbraw/zinc/86/40/05/1054864005.db2.gz XQBZMLWZLUOSRR-KRWDZBQOSA-N 2 1 320.908 4.442 20 0 DIADMP CC(C)[N@H+](CC[NH3+])Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235946935 1054865148 /nfs/dbraw/zinc/86/51/48/1054865148.db2.gz DQFARSALEQSLDQ-UHFFFAOYSA-N 2 1 302.849 4.176 20 0 DIADMP CC(C)[N@@H+](CC[NH3+])Cc1ccccc1-c1ccc(Cl)cc1 ZINC001235946935 1054865155 /nfs/dbraw/zinc/86/51/55/1054865155.db2.gz DQFARSALEQSLDQ-UHFFFAOYSA-N 2 1 302.849 4.176 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C[C@@H]1CCC[NH2+]C1 ZINC001235950407 1054867584 /nfs/dbraw/zinc/86/75/84/1054867584.db2.gz FEHJOGPJDLGFER-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C[C@@H]1CCC[NH2+]C1 ZINC001235950407 1054867595 /nfs/dbraw/zinc/86/75/95/1054867595.db2.gz FEHJOGPJDLGFER-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](Cc3ccc4c(c3)C[NH2+]C4)CC2)cc1 ZINC001235958956 1054869084 /nfs/dbraw/zinc/86/90/84/1054869084.db2.gz CRGLXNLAFPUBAJ-LJQANCHMSA-N 2 1 306.453 4.060 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](Cc3ccc4c(c3)C[NH2+]C4)CC2)cc1 ZINC001235958955 1054870357 /nfs/dbraw/zinc/87/03/57/1054870357.db2.gz CRGLXNLAFPUBAJ-IBGZPJMESA-N 2 1 306.453 4.060 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001235956299 1054870463 /nfs/dbraw/zinc/87/04/63/1054870463.db2.gz CCYBHYKLNMOPBC-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP C[N@H+](Cc1ccc(C2CCCCC2)cc1)C[C@H]1CCC[NH2+]C1 ZINC001235958258 1054870540 /nfs/dbraw/zinc/87/05/40/1054870540.db2.gz CAJIVDNJOONVAU-SFHVURJKSA-N 2 1 300.490 4.166 20 0 DIADMP CCCCCCc1csc(C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)c1 ZINC001235959357 1054870713 /nfs/dbraw/zinc/87/07/13/1054870713.db2.gz OOUVZWYORKKIHH-QGZVFWFLSA-N 2 1 308.535 4.302 20 0 DIADMP COc1ccccc1[C@H](C)[N@H+](C)CCC[NH2+]C1CCCCC1 ZINC001235962238 1054871830 /nfs/dbraw/zinc/87/18/30/1054871830.db2.gz JHCXYBACJTYQGD-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP COc1ccccc1[C@H](C)[N@@H+](C)CCC[NH2+]C1CCCCC1 ZINC001235962238 1054871839 /nfs/dbraw/zinc/87/18/39/1054871839.db2.gz JHCXYBACJTYQGD-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP C[N@@H+](CCCCC[NH3+])Cc1cc(F)ccc1Oc1ccccc1 ZINC001235961542 1054872120 /nfs/dbraw/zinc/87/21/20/1054872120.db2.gz BYXVTJNGXAWOHX-UHFFFAOYSA-N 2 1 316.420 4.179 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)CC1(C)CC[NH2+]CC1 ZINC001235967907 1054876133 /nfs/dbraw/zinc/87/61/33/1054876133.db2.gz BKQKOTSMMZCTOF-UHFFFAOYSA-N 2 1 324.468 4.300 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000624122489 1054883309 /nfs/dbraw/zinc/88/33/09/1054883309.db2.gz SGMUULPPBNPZMO-UZLBHIALSA-N 2 1 316.464 4.083 20 0 DIADMP Cc1ccc2cc([C@H](C)NC[C@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123929 1054885606 /nfs/dbraw/zinc/88/56/06/1054885606.db2.gz TZSRRHSOQXNNAD-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]C[C@H]3CCCC[N@H+](C)C3)oc2c1 ZINC000624123929 1054885620 /nfs/dbraw/zinc/88/56/20/1054885620.db2.gz TZSRRHSOQXNNAD-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]C[C@H]3CCCC[N@@H+](C)C3)oc2c1 ZINC000624123929 1054885630 /nfs/dbraw/zinc/88/56/30/1054885630.db2.gz TZSRRHSOQXNNAD-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+](Cc1ccccc1-c1ccccc1C)[C@@H]1CCC[NH2+]C1 ZINC001236005898 1054892253 /nfs/dbraw/zinc/89/22/53/1054892253.db2.gz GFRPMMVCFXEFIZ-LJQANCHMSA-N 2 1 308.469 4.236 20 0 DIADMP CC[N@@H+](Cc1ccccc1-c1ccccc1C)[C@@H]1CCC[NH2+]C1 ZINC001236005898 1054892264 /nfs/dbraw/zinc/89/22/64/1054892264.db2.gz GFRPMMVCFXEFIZ-LJQANCHMSA-N 2 1 308.469 4.236 20 0 DIADMP CC[N@H+](Cc1ccccc1-c1ccc(F)cc1)[C@H]1CCC[NH2+]C1 ZINC001236007495 1054893457 /nfs/dbraw/zinc/89/34/57/1054893457.db2.gz NNDQEYLADBXCCI-IBGZPJMESA-N 2 1 312.432 4.067 20 0 DIADMP CC[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@H]1CCC[NH2+]C1 ZINC001236007495 1054893467 /nfs/dbraw/zinc/89/34/67/1054893467.db2.gz NNDQEYLADBXCCI-IBGZPJMESA-N 2 1 312.432 4.067 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046365 1054911428 /nfs/dbraw/zinc/91/14/28/1054911428.db2.gz GBBOMCHLAFRART-DZGCQCFKSA-N 2 1 310.466 4.224 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])C[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046365 1054911443 /nfs/dbraw/zinc/91/14/43/1054911443.db2.gz GBBOMCHLAFRART-DZGCQCFKSA-N 2 1 310.466 4.224 20 0 DIADMP C[N@@H+](CCC(c1ccccc1)c1ccccc1)C[C@@H]1CCC[NH2+]C1 ZINC001236093138 1054940330 /nfs/dbraw/zinc/94/03/30/1054940330.db2.gz RBLIZQRLCSIYSJ-LJQANCHMSA-N 2 1 322.496 4.140 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1cccc(C[NH3+])c1 ZINC001236110108 1054954928 /nfs/dbraw/zinc/95/49/28/1054954928.db2.gz YOUBBSPGWZPFRR-SFHVURJKSA-N 2 1 312.482 4.204 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccccc1Oc1ccc(Cl)cc1 ZINC001236140988 1054966980 /nfs/dbraw/zinc/96/69/80/1054966980.db2.gz CBQDJJWOCAGSRT-UHFFFAOYSA-N 2 1 318.848 4.303 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccc2ccc(-c3ccccc3)nc2c1 ZINC001236142254 1054969077 /nfs/dbraw/zinc/96/90/77/1054969077.db2.gz UFXFTSRTFSDWDB-UHFFFAOYSA-N 2 1 319.452 4.073 20 0 DIADMP CCC[N@@H+](Cc1ccccc1Oc1ccccc1)C1CC[NH2+]CC1 ZINC001236181812 1054980585 /nfs/dbraw/zinc/98/05/85/1054980585.db2.gz GVLCKDUWSDEKSW-UHFFFAOYSA-N 2 1 324.468 4.443 20 0 DIADMP CCC[N@@H+](C[C@@H](C)c1cccc2ccccc21)C1CC[NH2+]CC1 ZINC001236181204 1054982177 /nfs/dbraw/zinc/98/21/77/1054982177.db2.gz XEDJVYBMOOFTIY-QGZVFWFLSA-N 2 1 310.485 4.407 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2C)cc1 ZINC000182444150 1054988012 /nfs/dbraw/zinc/98/80/12/1054988012.db2.gz YYCVDRZKTWWGEO-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@@H+]1CCC[NH+]1CCCCC1 ZINC001236195246 1054992795 /nfs/dbraw/zinc/99/27/95/1054992795.db2.gz YXKMCAYWMMMCAF-HXUWFJFHSA-N 2 1 311.473 4.181 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001236196414 1054995542 /nfs/dbraw/zinc/99/55/42/1054995542.db2.gz ZLPULBVHZCKTOY-OAQYLSRUSA-N 2 1 317.436 4.108 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc3c(c2)Cc2ccccc2-3)CC1 ZINC001236212699 1055002208 /nfs/dbraw/zinc/00/22/08/1055002208.db2.gz MGFQTALTKLIKTI-UHFFFAOYSA-N 2 1 320.480 4.220 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)C[C@H](C)c2cccc3ccccc32)CC1 ZINC001236213408 1055002656 /nfs/dbraw/zinc/00/26/56/1055002656.db2.gz SJZQOXIUIZUGFC-IVMQYODDSA-N 2 1 310.485 4.406 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236217600 1055005009 /nfs/dbraw/zinc/00/50/09/1055005009.db2.gz PJXVNXXPOWTYOV-VQTJNVASSA-N 2 1 312.432 4.194 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@H+](C)[C@H]3CCCC[C@@H]3[NH3+])ccc21 ZINC001236219201 1055007917 /nfs/dbraw/zinc/00/79/17/1055007917.db2.gz VQCGSDUNJHUGOA-RXVVDRJESA-N 2 1 321.468 4.033 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@@H+](C)[C@H]3CCCC[C@@H]3[NH3+])ccc21 ZINC001236219201 1055007930 /nfs/dbraw/zinc/00/79/30/1055007930.db2.gz VQCGSDUNJHUGOA-RXVVDRJESA-N 2 1 321.468 4.033 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236218770 1055010347 /nfs/dbraw/zinc/01/03/47/1055010347.db2.gz UBMUKUBMDRLYAO-ROUUACIJSA-N 2 1 308.425 4.288 20 0 DIADMP Cc1c(C[N@H+](C)[C@H]2CC[C@H]([NH3+])CC2)cccc1-c1ccccc1 ZINC001236222572 1055012366 /nfs/dbraw/zinc/01/23/66/1055012366.db2.gz JBSFHMAHASPLCY-MXVIHJGJSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1cc(Cl)c(Cl)c(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236221552 1055012533 /nfs/dbraw/zinc/01/25/33/1055012533.db2.gz CQDRSKARSMWHKD-XYPYZODXSA-N 2 1 321.679 4.349 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)C1(C)CC[NH2+]CC1 ZINC001236221570 1055013073 /nfs/dbraw/zinc/01/30/73/1055013073.db2.gz CRFJXDCWVOIOBQ-UHFFFAOYSA-N 2 1 310.441 4.053 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C1(C)CC[NH2+]CC1 ZINC001236224815 1055013838 /nfs/dbraw/zinc/01/38/38/1055013838.db2.gz XDVTYUGFSDZILA-KRWDZBQOSA-N 2 1 316.533 4.237 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+](C)[C@H]3CC[C@H]([NH3+])CC3)c2)cc1 ZINC001236224854 1055014427 /nfs/dbraw/zinc/01/44/27/1055014427.db2.gz XXKYIYYEDHOEGQ-MEMLXQNLSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223374 1055014889 /nfs/dbraw/zinc/01/48/89/1055014889.db2.gz PJWRKYZTGPOMEM-IYARVYRRSA-N 2 1 310.441 4.181 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)C1(C)CC[NH2+]CC1 ZINC001236227078 1055016233 /nfs/dbraw/zinc/01/62/33/1055016233.db2.gz ZEAHKCOARUXKPB-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+](C)C3(C)CC[NH2+]CC3)c2)cc1 ZINC001236225761 1055017524 /nfs/dbraw/zinc/01/75/24/1055017524.db2.gz FMAWUSYPPUTSIH-UHFFFAOYSA-N 2 1 324.468 4.361 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+](C)C3(C)CC[NH2+]CC3)cc2)c1 ZINC001236225692 1055017632 /nfs/dbraw/zinc/01/76/32/1055017632.db2.gz BWWYJHSKUQXAHY-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP Cc1ccccc1C[N@@H+](Cc1ccccc1)C1CCC([NH3+])CC1 ZINC001236228582 1055018662 /nfs/dbraw/zinc/01/86/62/1055018662.db2.gz WPJMGQXNDXTATP-UHFFFAOYSA-N 2 1 308.469 4.267 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccc(Cl)o2)Cc2ccccc2)CC1 ZINC001236229093 1055020209 /nfs/dbraw/zinc/02/02/09/1055020209.db2.gz ZEJSAPYAFBPDLD-UHFFFAOYSA-N 2 1 318.848 4.205 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)CC1(C)CC[NH2+]CC1 ZINC001236239179 1055025969 /nfs/dbraw/zinc/02/59/69/1055025969.db2.gz FLHRNZPTDBESLV-UHFFFAOYSA-N 2 1 324.468 4.300 20 0 DIADMP C[N@@H+](CC[C@@H]1CCC[NH2+]C1)Cc1cccc(Oc2ccccc2)c1 ZINC001236242190 1055026779 /nfs/dbraw/zinc/02/67/79/1055026779.db2.gz WHWXWBWYIRPEEM-SFHVURJKSA-N 2 1 324.468 4.300 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001236246088 1055028805 /nfs/dbraw/zinc/02/88/05/1055028805.db2.gz XRYSQJQDYLJEER-AWEZNQCLSA-N 2 1 314.860 4.179 20 0 DIADMP c1oc2ccccc2c1C[N@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236300646 1055050433 /nfs/dbraw/zinc/05/04/33/1055050433.db2.gz VNTROBRWQHSDCW-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP c1oc2ccccc2c1C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236300646 1055050445 /nfs/dbraw/zinc/05/04/45/1055050445.db2.gz VNTROBRWQHSDCW-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)c2)cc1 ZINC001236320026 1055054933 /nfs/dbraw/zinc/05/49/33/1055054933.db2.gz AJBJJNXWDIZISJ-SZPZYZBQSA-N 2 1 320.480 4.093 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)cc12 ZINC001236320598 1055055266 /nfs/dbraw/zinc/05/52/66/1055055266.db2.gz RENSXTSTGRVQLD-CALCHBBNSA-N 2 1 320.436 4.017 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000184377675 1055074944 /nfs/dbraw/zinc/07/49/44/1055074944.db2.gz CGWDISPFSQQZTF-KBPBESRZSA-N 2 1 313.470 4.393 20 0 DIADMP CC1(C[N@H+](Cc2ccccc2F)C2CC[NH2+]CC2)CCCCC1 ZINC001236366906 1055076067 /nfs/dbraw/zinc/07/60/67/1055076067.db2.gz IPGBGPPJMDMVIT-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP CC1(C[N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)CCCCC1 ZINC001236366906 1055076080 /nfs/dbraw/zinc/07/60/80/1055076080.db2.gz IPGBGPPJMDMVIT-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)c1ccc2ccccc2n1)[NH+]1CCCCC1 ZINC000184500569 1055077340 /nfs/dbraw/zinc/07/73/40/1055077340.db2.gz CBMBFGZPQKYHMG-IAGOWNOFSA-N 2 1 311.473 4.150 20 0 DIADMP Clc1cccc(CC[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236373481 1055080701 /nfs/dbraw/zinc/08/07/01/1055080701.db2.gz XJRYYWSPJATHBA-QGZVFWFLSA-N 2 1 320.908 4.127 20 0 DIADMP c1cc2cc(C[N@H+](C[C@H]3CCC[NH2+]C3)C3CCCC3)ccc2o1 ZINC001236372805 1055080798 /nfs/dbraw/zinc/08/07/98/1055080798.db2.gz DQFFIHLAJMRIRN-KRWDZBQOSA-N 2 1 312.457 4.177 20 0 DIADMP CCc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236374574 1055081769 /nfs/dbraw/zinc/08/17/69/1055081769.db2.gz FEDLKKRQMQQFFZ-OAHLLOKOSA-N 2 1 306.519 4.055 20 0 DIADMP CC(C)(C)c1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)[nH]1 ZINC001236374377 1055082109 /nfs/dbraw/zinc/08/21/09/1055082109.db2.gz PXWPNIQUTJPGMW-MRXNPFEDSA-N 2 1 317.521 4.056 20 0 DIADMP CCC[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cccnc1 ZINC000184900485 1055082707 /nfs/dbraw/zinc/08/27/07/1055082707.db2.gz FXGNIVURZPTLHE-HXUWFJFHSA-N 2 1 311.473 4.035 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236374638 1055083689 /nfs/dbraw/zinc/08/36/89/1055083689.db2.gz FRMVHLZOXPOVBV-MRXNPFEDSA-N 2 1 317.521 4.056 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cccnc1 ZINC000185034153 1055088107 /nfs/dbraw/zinc/08/81/07/1055088107.db2.gz QANDCBCIVXFVQQ-PKOBYXMFSA-N 2 1 303.494 4.025 20 0 DIADMP CC1(C[N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)CCCCC1 ZINC001236402036 1055094351 /nfs/dbraw/zinc/09/43/51/1055094351.db2.gz UHMBWEPHETVTRL-UHFFFAOYSA-N 2 1 318.480 4.350 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C[C@H]1CC[NH2+]C1 ZINC001236408077 1055099791 /nfs/dbraw/zinc/09/97/91/1055099791.db2.gz KUKGFXXGVVXSEG-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CC[N@H+](Cc1cccc(-c2c(C)cccc2C)c1)C[C@@H]1CC[NH2+]C1 ZINC001236409494 1055100484 /nfs/dbraw/zinc/10/04/84/1055100484.db2.gz BDXUULRLODFLRT-HXUWFJFHSA-N 2 1 322.496 4.402 20 0 DIADMP CC[N@@H+](C[C@@H]1CC[NH2+]C1)C[C@@H]1CC=C(CCC=C(C)C)CC1 ZINC001236409100 1055100678 /nfs/dbraw/zinc/10/06/78/1055100678.db2.gz XDFIWRGPKWZOGS-WOJBJXKFSA-N 2 1 304.522 4.391 20 0 DIADMP CC[N@@H+](C[C@H](C)Cc1ccc(C(C)(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC001236409181 1055100912 /nfs/dbraw/zinc/10/09/12/1055100912.db2.gz YGOFHOVYRFRADS-MJGOQNOKSA-N 2 1 316.533 4.094 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@@H]([NH3+])[C@@H]2C)c1 ZINC001236423008 1055106560 /nfs/dbraw/zinc/10/65/60/1055106560.db2.gz ZDRQBAOSIUMKIL-FXAWDEMLSA-N 2 1 308.469 4.282 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[C@@H]([NH3+])[C@@H]2C)c1 ZINC001236423008 1055106568 /nfs/dbraw/zinc/10/65/68/1055106568.db2.gz ZDRQBAOSIUMKIL-FXAWDEMLSA-N 2 1 308.469 4.282 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421966 1055107896 /nfs/dbraw/zinc/10/78/96/1055107896.db2.gz UZKXOXGQPJVLTK-IFXJQAMLSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421966 1055107902 /nfs/dbraw/zinc/10/79/02/1055107902.db2.gz UZKXOXGQPJVLTK-IFXJQAMLSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421964 1055107978 /nfs/dbraw/zinc/10/79/78/1055107978.db2.gz UZKXOXGQPJVLTK-AUUYWEPGSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236421964 1055107985 /nfs/dbraw/zinc/10/79/85/1055107985.db2.gz UZKXOXGQPJVLTK-AUUYWEPGSA-N 2 1 314.860 4.319 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]CC3)c1 ZINC001236427911 1055110731 /nfs/dbraw/zinc/11/07/31/1055110731.db2.gz BUBVSTFJJVXGEG-QFIPXVFZSA-N 2 1 320.480 4.286 20 0 DIADMP CCCCCC[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450964 1055120534 /nfs/dbraw/zinc/12/05/34/1055120534.db2.gz OFYCIHIWCBXMHD-UHFFFAOYSA-N 2 1 308.897 4.474 20 0 DIADMP CCCCCC[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236450964 1055120545 /nfs/dbraw/zinc/12/05/45/1055120545.db2.gz OFYCIHIWCBXMHD-UHFFFAOYSA-N 2 1 308.897 4.474 20 0 DIADMP CC(C)(C)C[N@@H+](CCCc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236456905 1055124217 /nfs/dbraw/zinc/12/42/17/1055124217.db2.gz HVRHUOGTGKQWBC-UHFFFAOYSA-N 2 1 322.924 4.373 20 0 DIADMP CCCOc1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001236456948 1055125039 /nfs/dbraw/zinc/12/50/39/1055125039.db2.gz IIRLIOOMZPBSJJ-UHFFFAOYSA-N 2 1 318.505 4.076 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1coc2ccccc12)C1CC[NH2+]CC1 ZINC001236458548 1055126732 /nfs/dbraw/zinc/12/67/32/1055126732.db2.gz WOWVKTHFIDPNAW-UHFFFAOYSA-N 2 1 300.446 4.033 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236459635 1055126898 /nfs/dbraw/zinc/12/68/98/1055126898.db2.gz WKTHHJRWEGHPKK-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP CC(C)Oc1ccccc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458745 1055126968 /nfs/dbraw/zinc/12/69/68/1055126968.db2.gz XMWOSDDHAHJOPF-UHFFFAOYSA-N 2 1 318.505 4.074 20 0 DIADMP CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380927935 1055135988 /nfs/dbraw/zinc/13/59/88/1055135988.db2.gz DJDQQLYYGKXKDI-VAMGGRTRSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)C[N@H+](Cc1csc2ccccc12)[C@@H]1CCC[NH2+]C1 ZINC001236477705 1055136871 /nfs/dbraw/zinc/13/68/71/1055136871.db2.gz KTKCWFQCITZRQH-MRXNPFEDSA-N 2 1 302.487 4.111 20 0 DIADMP CC(C)C[N@@H+](Cc1csc2ccccc12)[C@@H]1CCC[NH2+]C1 ZINC001236477705 1055136877 /nfs/dbraw/zinc/13/68/77/1055136877.db2.gz KTKCWFQCITZRQH-MRXNPFEDSA-N 2 1 302.487 4.111 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001236509126 1055152746 /nfs/dbraw/zinc/15/27/46/1055152746.db2.gz GWEJSKBZSGOBOL-OAHLLOKOSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C[C@H]1CC=CCC1)C1CC[NH2+]CC1 ZINC001236518807 1055157985 /nfs/dbraw/zinc/15/79/85/1055157985.db2.gz YHLCRTCLWHUNHR-KRWDZBQOSA-N 2 1 316.464 4.044 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001236518394 1055158243 /nfs/dbraw/zinc/15/82/43/1055158243.db2.gz RXNFCAJNDYUIMI-PLNGDYQASA-N 2 1 318.480 4.435 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000381337299 1055164768 /nfs/dbraw/zinc/16/47/68/1055164768.db2.gz DGYFLEQMENZJEG-MRXNPFEDSA-N 2 1 314.498 4.372 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000381406402 1055166383 /nfs/dbraw/zinc/16/63/83/1055166383.db2.gz WRQGVVLUBYAGQU-AEFFLSMTSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2ccc3c(c2)C[NH2+]CC3)C2CC2)c1C ZINC001236535094 1055166441 /nfs/dbraw/zinc/16/64/41/1055166441.db2.gz RGLUOIMLKFLQJU-UHFFFAOYSA-N 2 1 320.480 4.114 20 0 DIADMP Cc1cccc(C[N@@H+](Cc2ccc3c(c2)C[NH2+]C3)C2CC2)c1C ZINC001236534794 1055167060 /nfs/dbraw/zinc/16/70/60/1055167060.db2.gz OUPKKMXXUWULDG-UHFFFAOYSA-N 2 1 306.453 4.071 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccsc2Cl)CC2CCC2)CC1 ZINC001236540141 1055168712 /nfs/dbraw/zinc/16/87/12/1055168712.db2.gz IKFGHYWDEQOVQL-SHTZXODSSA-N 2 1 312.910 4.274 20 0 DIADMP CSc1ccccc1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236540827 1055169093 /nfs/dbraw/zinc/16/90/93/1055169093.db2.gz KYQNHQJGZYTTHD-IYARVYRRSA-N 2 1 318.530 4.281 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(C(F)F)c2)CC2CCC2)CC1 ZINC001236541585 1055170227 /nfs/dbraw/zinc/17/02/27/1055170227.db2.gz HHGMQKGWRYPLNZ-IYARVYRRSA-N 2 1 322.443 4.496 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236542079 1055171201 /nfs/dbraw/zinc/17/12/01/1055171201.db2.gz SUEMYQCQMQMWJF-MXVIHJGJSA-N 2 1 300.490 4.175 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(C(F)F)cc2)CC2CCC2)CC1 ZINC001236542896 1055173267 /nfs/dbraw/zinc/17/32/67/1055173267.db2.gz WDTJJTKAQCRVIE-IYARVYRRSA-N 2 1 322.443 4.496 20 0 DIADMP COc1ccc(Cl)cc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550195 1055177354 /nfs/dbraw/zinc/17/73/54/1055177354.db2.gz IKLRWECEZRWYKM-QAQDUYKDSA-N 2 1 324.896 4.077 20 0 DIADMP COc1cc(Cl)ccc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550245 1055177435 /nfs/dbraw/zinc/17/74/35/1055177435.db2.gz AYCWKYZCGUARBU-QAQDUYKDSA-N 2 1 324.896 4.077 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(Cl)cc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550063 1055177466 /nfs/dbraw/zinc/17/74/66/1055177466.db2.gz GIQWHKPKBAEHSE-WKILWMFISA-N 2 1 312.860 4.207 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236549820 1055178554 /nfs/dbraw/zinc/17/85/54/1055178554.db2.gz ALUVGAKZZUXDDA-QAQDUYKDSA-N 2 1 324.871 4.269 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccc(F)cc2Cl)CC2CC2)CC1 ZINC001236552500 1055179356 /nfs/dbraw/zinc/17/93/56/1055179356.db2.gz RBCLRJZUJRIGJJ-QAQDUYKDSA-N 2 1 324.871 4.004 20 0 DIADMP CCCOc1ccccc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552800 1055179546 /nfs/dbraw/zinc/17/95/46/1055179546.db2.gz ZUWRHNFABNRQDK-WGSAOQKQSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(F)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552513 1055179738 /nfs/dbraw/zinc/17/97/38/1055179738.db2.gz WQEAQLJJWFEUIU-WKILWMFISA-N 2 1 312.860 4.207 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)c(C3CC3)c2)CC2CC2)CC1 ZINC001236552977 1055179836 /nfs/dbraw/zinc/17/98/36/1055179836.db2.gz VSVKCTAQSZLFAG-IYARVYRRSA-N 2 1 316.464 4.185 20 0 DIADMP CC(C)c1cccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236551322 1055180071 /nfs/dbraw/zinc/18/00/71/1055180071.db2.gz OHZIMWOALGKIQW-MXVIHJGJSA-N 2 1 300.490 4.292 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC(C)(C)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381791631 1055181553 /nfs/dbraw/zinc/18/15/53/1055181553.db2.gz LMDBSEMUXSPTMF-UHOSZYNNSA-N 2 1 300.490 4.065 20 0 DIADMP CC(C)C[N@@H+](Cc1cc2cccc(F)c2[nH]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554112 1055181634 /nfs/dbraw/zinc/18/16/34/1055181634.db2.gz CKQVUUGASKODHS-JCNLHEQBSA-N 2 1 317.452 4.035 20 0 DIADMP COc1cc(C)c(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236553221 1055181924 /nfs/dbraw/zinc/18/19/24/1055181924.db2.gz YIPVIAZRIFADOK-IYARVYRRSA-N 2 1 318.505 4.040 20 0 DIADMP Cc1ccc(Cl)cc1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236553299 1055181978 /nfs/dbraw/zinc/18/19/78/1055181978.db2.gz ZPUTWVDGHNMLKH-IYARVYRRSA-N 2 1 308.897 4.376 20 0 DIADMP CC(C)C[N@@H+](CC1CCC(F)(F)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236553263 1055182063 /nfs/dbraw/zinc/18/20/63/1055182063.db2.gz YNEFKMSHLXXOJH-WKILWMFISA-N 2 1 302.453 4.040 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554086 1055182087 /nfs/dbraw/zinc/18/20/87/1055182087.db2.gz VKPMKTOXIVBKOH-IYARVYRRSA-N 2 1 306.881 4.130 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236553616 1055182168 /nfs/dbraw/zinc/18/21/68/1055182168.db2.gz REZKUNSPCROZBF-WKILWMFISA-N 2 1 306.881 4.130 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554479 1055182178 /nfs/dbraw/zinc/18/21/78/1055182178.db2.gz GWHZOUMDIONEND-WGSAOQKQSA-N 2 1 302.506 4.285 20 0 DIADMP Cc1ccc2cc(C[N@@H+](CC3CC3)[C@H]3CC[C@H]([NH3+])CC3)ccc2n1 ZINC001236554348 1055182233 /nfs/dbraw/zinc/18/22/33/1055182233.db2.gz ZHXNZLNYUHNJNC-MXVIHJGJSA-N 2 1 323.484 4.025 20 0 DIADMP CC/C=C\CCCCC[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554204 1055182338 /nfs/dbraw/zinc/18/23/38/1055182338.db2.gz XDBYFIMWKXMIOZ-LQJWVLPZSA-N 2 1 322.537 4.264 20 0 DIADMP CC1(C[N@@H+](Cc2ccncc2)[C@H]2CC[C@H]([NH3+])CC2)CCCCC1 ZINC001236559841 1055184725 /nfs/dbraw/zinc/18/47/25/1055184725.db2.gz FPXGVNIKYWIPKM-WGSAOQKQSA-N 2 1 315.505 4.124 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cccs2)C2CCCCC2)CC1 ZINC001236566241 1055186090 /nfs/dbraw/zinc/18/60/90/1055186090.db2.gz UKLJFFWKUWGQKI-JCNLHEQBSA-N 2 1 306.519 4.195 20 0 DIADMP CCOc1ccccc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236566206 1055186453 /nfs/dbraw/zinc/18/64/53/1055186453.db2.gz FSQHRXLXVKEXJL-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(F)ccc2F)C2CCCCC2)CC1 ZINC001236565685 1055186652 /nfs/dbraw/zinc/18/66/52/1055186652.db2.gz MQOZGJRKAMRIIL-SAABIXHNSA-N 2 1 322.443 4.369 20 0 DIADMP Cc1ccc(O)cc1C[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236566154 1055186934 /nfs/dbraw/zinc/18/69/34/1055186934.db2.gz RRUIMXCLMXNUOL-UAPYVXQJSA-N 2 1 316.489 4.105 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236567132 1055187647 /nfs/dbraw/zinc/18/76/47/1055187647.db2.gz UDPBXRRYDSCGDM-SOAMZJECSA-N 2 1 304.522 4.493 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1F ZINC001236566553 1055187805 /nfs/dbraw/zinc/18/78/05/1055187805.db2.gz KNMJBECUZRVYSW-JCNLHEQBSA-N 2 1 322.443 4.288 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3c(c2)CCC3)C2CCCC2)CC1 ZINC001236567478 1055187926 /nfs/dbraw/zinc/18/79/26/1055187926.db2.gz WYCCMLZNARJZFJ-XUTJKUGGSA-N 2 1 312.501 4.190 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236567128 1055188261 /nfs/dbraw/zinc/18/82/61/1055188261.db2.gz UDPBXRRYDSCGDM-DMUMMCEESA-N 2 1 304.522 4.493 20 0 DIADMP CC1(C)CC[C@@H]1[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381886824 1055189260 /nfs/dbraw/zinc/18/92/60/1055189260.db2.gz CAUCDGPDRONEDD-OALUTQOASA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccc2c(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)c[nH]c2c1 ZINC001236571298 1055191220 /nfs/dbraw/zinc/19/12/20/1055191220.db2.gz BHFJZDOFYSCDJK-SAABIXHNSA-N 2 1 311.473 4.101 20 0 DIADMP Cc1ccc2cc(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)ccc2n1 ZINC001236572456 1055193140 /nfs/dbraw/zinc/19/31/40/1055193140.db2.gz MLPBQJSWURHUAS-KESTWPANSA-N 2 1 323.484 4.168 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1 ZINC001236572339 1055193270 /nfs/dbraw/zinc/19/32/70/1055193270.db2.gz VAKOJCOKTWYSCE-SAABIXHNSA-N 2 1 304.453 4.149 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236571425 1055193332 /nfs/dbraw/zinc/19/33/32/1055193332.db2.gz CVRFMIOCIVLRDU-RUCARUNLSA-N 2 1 317.521 4.327 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2Cl)C2CCC2)CC1 ZINC001236572507 1055193585 /nfs/dbraw/zinc/19/35/85/1055193585.db2.gz QRHGYFXAMGNIKQ-KOMQPUFPSA-N 2 1 310.844 4.104 20 0 DIADMP Cc1cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1Cl ZINC001236572574 1055193604 /nfs/dbraw/zinc/19/36/04/1055193604.db2.gz ORMQAEXJSMFBFL-JCNLHEQBSA-N 2 1 306.881 4.273 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2cccc(Cl)c2)C2CCC2)CC1 ZINC001236572880 1055195106 /nfs/dbraw/zinc/19/51/06/1055195106.db2.gz WAFXPKGIKGYHPT-UAPYVXQJSA-N 2 1 320.908 4.397 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000381982986 1055195484 /nfs/dbraw/zinc/19/54/84/1055195484.db2.gz NJURHLPIJIILJH-HOJAQTOUSA-N 2 1 300.490 4.067 20 0 DIADMP COc1c(C)cccc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236573956 1055195490 /nfs/dbraw/zinc/19/54/90/1055195490.db2.gz KRNXSDHRSPHEFB-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3occc32)C2CCCC2)CC1 ZINC001236574781 1055196752 /nfs/dbraw/zinc/19/67/52/1055196752.db2.gz SSZGUDVAHKOIDI-SAABIXHNSA-N 2 1 312.457 4.447 20 0 DIADMP Cc1c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc(F)c1F ZINC001236574780 1055197180 /nfs/dbraw/zinc/19/71/80/1055197180.db2.gz SQAZABBILLHYIA-JCNLHEQBSA-N 2 1 322.443 4.288 20 0 DIADMP CC(C)c1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)ccc1Cl ZINC001236602532 1055200294 /nfs/dbraw/zinc/20/02/94/1055200294.db2.gz WWCGUMXPSSZISJ-MRXNPFEDSA-N 2 1 320.908 4.427 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001236606006 1055203699 /nfs/dbraw/zinc/20/36/99/1055203699.db2.gz YKACNNWUDRRVAC-QQUYBBDPSA-N 2 1 306.453 4.028 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236603872 1055204689 /nfs/dbraw/zinc/20/46/89/1055204689.db2.gz CQOUVJRSZIRRFE-LJQANCHMSA-N 2 1 314.860 4.178 20 0 DIADMP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236616896 1055206112 /nfs/dbraw/zinc/20/61/12/1055206112.db2.gz RQZAHGYDZOBLLL-LJQANCHMSA-N 2 1 314.860 4.178 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236616896 1055206119 /nfs/dbraw/zinc/20/61/19/1055206119.db2.gz RQZAHGYDZOBLLL-LJQANCHMSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccs2)Cc2ccccc2)CC1 ZINC001236682603 1055230222 /nfs/dbraw/zinc/23/02/22/1055230222.db2.gz WPEZBYSNRSVAQR-QAQDUYKDSA-N 2 1 300.471 4.020 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CC=CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236715557 1055239628 /nfs/dbraw/zinc/23/96/28/1055239628.db2.gz VGNSPIAIQKKHBR-HMXCVIKNSA-N 2 1 312.501 4.423 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2cccs2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236715659 1055240193 /nfs/dbraw/zinc/24/01/93/1055240193.db2.gz XPYBMJUHVAOLKZ-IYARVYRRSA-N 2 1 314.498 4.329 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236743251 1055248376 /nfs/dbraw/zinc/24/83/76/1055248376.db2.gz VAFHTZXQTSTRHW-LQJWVLPZSA-N 2 1 304.453 4.254 20 0 DIADMP CCC(=O)C(C)(C)C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236754409 1055252405 /nfs/dbraw/zinc/25/24/05/1055252405.db2.gz GFBNGIPHPGADGJ-IYARVYRRSA-N 2 1 322.537 4.144 20 0 DIADMP Cc1nc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cs1 ZINC001236755249 1055252667 /nfs/dbraw/zinc/25/26/67/1055252667.db2.gz MQXLGDQWUWYUDI-SAABIXHNSA-N 2 1 321.534 4.104 20 0 DIADMP Cc1ncsc1C[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236755881 1055252846 /nfs/dbraw/zinc/25/28/46/1055252846.db2.gz RSOMOHXSLJNXDR-QAQDUYKDSA-N 2 1 321.534 4.104 20 0 DIADMP Cc1c[nH]c(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1C ZINC001236759577 1055252871 /nfs/dbraw/zinc/25/28/71/1055252871.db2.gz WDWJWGIPSVWZIN-WGSAOQKQSA-N 2 1 317.521 4.284 20 0 DIADMP COc1cccc(C)c1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236779945 1055253756 /nfs/dbraw/zinc/25/37/56/1055253756.db2.gz MTLIXHNFCRSTLL-QAQDUYKDSA-N 2 1 318.505 4.122 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)ccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781144 1055254073 /nfs/dbraw/zinc/25/40/73/1055254073.db2.gz AMXDIHYDIWRTMB-SAABIXHNSA-N 2 1 306.469 4.395 20 0 DIADMP CC(C)(C)C[N@@H+](CC1CCC(F)(F)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768090 1055254345 /nfs/dbraw/zinc/25/43/45/1055254345.db2.gz MWFCKGRKUKZADD-WKILWMFISA-N 2 1 316.480 4.430 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc(F)c1F ZINC001236779991 1055254574 /nfs/dbraw/zinc/25/45/74/1055254574.db2.gz NSWYGNIOFZTQIR-WKILWMFISA-N 2 1 324.459 4.391 20 0 DIADMP Cc1cccc(F)c1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236778951 1055256405 /nfs/dbraw/zinc/25/64/05/1055256405.db2.gz CSCGMVMCPRGPFM-WKILWMFISA-N 2 1 306.469 4.252 20 0 DIADMP CCC(CC)[N@@H+](CCc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781956 1055258315 /nfs/dbraw/zinc/25/83/15/1055258315.db2.gz CLOFNYSVPUMCOE-UAPYVXQJSA-N 2 1 306.469 4.129 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)ncc1Cl ZINC001236783680 1055258464 /nfs/dbraw/zinc/25/84/64/1055258464.db2.gz XCPQVHOUGPNKLL-KOMQPUFPSA-N 2 1 323.912 4.161 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(O)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781807 1055259236 /nfs/dbraw/zinc/25/92/36/1055259236.db2.gz JIHJCBJLQPFYFP-KOMQPUFPSA-N 2 1 324.896 4.306 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cncc(C2CC2)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783563 1055259295 /nfs/dbraw/zinc/25/92/95/1055259295.db2.gz UOQVMCMQEOKFTE-WGSAOQKQSA-N 2 1 315.505 4.077 20 0 DIADMP CCC(CC)[N@@H+](CCCc1ccc(C)o1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783110 1055259321 /nfs/dbraw/zinc/25/93/21/1055259321.db2.gz PJHYDMVDEFGOPV-SAABIXHNSA-N 2 1 306.494 4.281 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)CC1 ZINC001236821964 1055277525 /nfs/dbraw/zinc/27/75/25/1055277525.db2.gz XBMYIHBQFCXBRD-HAGHYFMRSA-N 2 1 302.506 4.128 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1 ZINC001236829504 1055278378 /nfs/dbraw/zinc/27/83/78/1055278378.db2.gz KVJVRIALXGVKKY-PWRODBHTSA-N 2 1 320.480 4.140 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(/C=C/c4ccccc4)cc3)C[C@H]12 ZINC001236826273 1055278944 /nfs/dbraw/zinc/27/89/44/1055278944.db2.gz BFHYOMCWFPLQDH-YDITYBEASA-N 2 1 318.464 4.026 20 0 DIADMP CCCCCCc1csc(C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1 ZINC001236826993 1055280716 /nfs/dbraw/zinc/28/07/16/1055280716.db2.gz DNPXZOZCUDGQDQ-SZMVWBNQSA-N 2 1 306.519 4.040 20 0 DIADMP CCC[N@@H+](C[C@@H](C)c1cccc2ccccc21)C[C@@H]1CC[NH2+]C1 ZINC001236832304 1055284334 /nfs/dbraw/zinc/28/43/34/1055284334.db2.gz UEKSPROTILDXRL-QZTJIDSGSA-N 2 1 310.485 4.265 20 0 DIADMP c1cc2c(o1)CCC[C@@H]2[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000764879417 1055285791 /nfs/dbraw/zinc/28/57/91/1055285791.db2.gz ILXHANGQKVFAJP-IBGZPJMESA-N 2 1 316.489 4.291 20 0 DIADMP CCC[N@H+](Cc1sc2scc(C)c2c1C)C[C@H]1CC[NH2+]C1 ZINC001236843082 1055289004 /nfs/dbraw/zinc/28/90/04/1055289004.db2.gz KWYQUTVPEICSCS-AWEZNQCLSA-N 2 1 322.543 4.401 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000764966022 1055306950 /nfs/dbraw/zinc/30/69/50/1055306950.db2.gz XOZLYVHCDGNAEL-JKSUJKDBSA-N 2 1 300.556 4.008 20 0 DIADMP C[C@H]1CCCC[N@@H+](Cc2ccc(-n3ccnc3)c(Cl)c2)C1 ZINC001236901865 1055308014 /nfs/dbraw/zinc/30/80/14/1055308014.db2.gz BKRGWYPEXGFGRI-AWEZNQCLSA-N 2 1 303.837 4.148 20 0 DIADMP Clc1cc(-n2ccnc2)ccc1C[N@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001236915063 1055317589 /nfs/dbraw/zinc/31/75/89/1055317589.db2.gz BDBKFMRCALFJSH-LSDHHAIUSA-N 2 1 315.848 4.148 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001237057815 1055354525 /nfs/dbraw/zinc/35/45/25/1055354525.db2.gz NQWQBLBVXWXRTP-GOSISDBHSA-N 2 1 318.848 4.161 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001237059227 1055355230 /nfs/dbraw/zinc/35/52/30/1055355230.db2.gz RVTGXNFEAKDCOY-FQEVSTJZSA-N 2 1 312.432 4.054 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@](C)(C[NH3+])C3)cc2)cc1 ZINC001237058646 1055355915 /nfs/dbraw/zinc/35/59/15/1055355915.db2.gz QREVDBLFNYLPIG-OAQYLSRUSA-N 2 1 308.469 4.223 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001237056863 1055357021 /nfs/dbraw/zinc/35/70/21/1055357021.db2.gz KKZOTZBYAWDDJJ-FQEVSTJZSA-N 2 1 310.441 4.040 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2Oc2ccccc2)C1 ZINC001237056863 1055357031 /nfs/dbraw/zinc/35/70/31/1055357031.db2.gz KKZOTZBYAWDDJJ-FQEVSTJZSA-N 2 1 310.441 4.040 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@@](C)(C[NH3+])C3)c(C)c12 ZINC001237082369 1055363499 /nfs/dbraw/zinc/36/34/99/1055363499.db2.gz PJTYXPXVGPTLMA-INIZCTEOSA-N 2 1 308.516 4.140 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2cccs2)cc1 ZINC001237081543 1055363584 /nfs/dbraw/zinc/36/35/84/1055363584.db2.gz KJCONTBHLIFWAG-ZNXRZULTSA-N 2 1 312.482 4.117 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+](C)CC2CC[NH+](C)CC2)c1Cl ZINC001237334393 1055431105 /nfs/dbraw/zinc/43/11/05/1055431105.db2.gz HGXARZVSCHRKOZ-UHFFFAOYSA-N 2 1 315.288 4.075 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](C)CC2CC[NH+](C)CC2)c1Cl ZINC001237334393 1055431110 /nfs/dbraw/zinc/43/11/10/1055431110.db2.gz HGXARZVSCHRKOZ-UHFFFAOYSA-N 2 1 315.288 4.075 20 0 DIADMP CC1=CC[C@@H](CC[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)C1(C)C ZINC001237358119 1055439616 /nfs/dbraw/zinc/43/96/16/1055439616.db2.gz CBZXFJNOEJZFRU-IBGZPJMESA-N 2 1 324.512 4.463 20 0 DIADMP c1cc(-c2csc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)c2)cs1 ZINC001237410689 1055450139 /nfs/dbraw/zinc/45/01/39/1055450139.db2.gz CTTVDRYXLDHBTA-GUYCJALGSA-N 2 1 318.511 4.051 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)c2)cs1 ZINC001237410689 1055450155 /nfs/dbraw/zinc/45/01/55/1055450155.db2.gz CTTVDRYXLDHBTA-GUYCJALGSA-N 2 1 318.511 4.051 20 0 DIADMP CCC(CC)CNc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC001620840648 1055455801 /nfs/dbraw/zinc/45/58/01/1055455801.db2.gz NTLVLJWKKORNIJ-UHFFFAOYSA-N 2 1 317.521 4.313 20 0 DIADMP Cc1c(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)cccc1-c1ccccc1 ZINC001237582777 1055477766 /nfs/dbraw/zinc/47/77/66/1055477766.db2.gz GNZHXCKLSBUAPS-IFMALSPDSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1c(C[N@@H+](C)CC2CC[NH+](C)CC2)cccc1-c1ccccc1 ZINC001237580329 1055478216 /nfs/dbraw/zinc/47/82/16/1055478216.db2.gz GVBOZIZZJXCYDY-UHFFFAOYSA-N 2 1 322.496 4.436 20 0 DIADMP Cc1c(C[NH+]2CCC([NH+]3CCC3)CC2)cccc1-c1ccccc1 ZINC001237586745 1055480142 /nfs/dbraw/zinc/48/01/42/1055480142.db2.gz FHISMDGWOOSFLM-UHFFFAOYSA-N 2 1 320.480 4.332 20 0 DIADMP CC(C)Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC001620868616 1055496199 /nfs/dbraw/zinc/49/61/99/1055496199.db2.gz JTKTWLIFCVKPJH-OAQYLSRUSA-N 2 1 316.533 4.343 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)CC2 ZINC001620910380 1055533084 /nfs/dbraw/zinc/53/30/84/1055533084.db2.gz PUKBMODOEPKXGT-IEBWSBKVSA-N 2 1 300.490 4.260 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001620913108 1055537138 /nfs/dbraw/zinc/53/71/38/1055537138.db2.gz UMGHPOFFBZRWBY-IEBWSBKVSA-N 2 1 302.506 4.170 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1 ZINC000386957258 1055537495 /nfs/dbraw/zinc/53/74/95/1055537495.db2.gz VEZCBCZWHWRLIE-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001620924806 1055545427 /nfs/dbraw/zinc/54/54/27/1055545427.db2.gz NGGKGPRUHFGFJR-MISYRCLQSA-N 2 1 302.506 4.423 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC001620925059 1055545831 /nfs/dbraw/zinc/54/58/31/1055545831.db2.gz YDNIGYIBKWJVBL-KVPLUYHFSA-N 2 1 302.506 4.279 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC4(CCCC4)C3)cc21 ZINC001237880077 1055546376 /nfs/dbraw/zinc/54/63/76/1055546376.db2.gz FAKCYORLHBXCLW-UHFFFAOYSA-N 2 1 310.485 4.454 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CC[C@H](C(F)(F)F)C3)cc21 ZINC001237885553 1055552590 /nfs/dbraw/zinc/55/25/90/1055552590.db2.gz IIRGSOMVWGOKGG-HNNXBMFYSA-N 2 1 324.390 4.072 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CC[C@H](C(F)(F)F)C3)cc21 ZINC001237885553 1055552594 /nfs/dbraw/zinc/55/25/94/1055552594.db2.gz IIRGSOMVWGOKGG-HNNXBMFYSA-N 2 1 324.390 4.072 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@H+]1CCC[C@H](CCc2ccccc2)C1 ZINC001238117014 1055608489 /nfs/dbraw/zinc/60/84/89/1055608489.db2.gz UDWJRZABALVCKV-LJQANCHMSA-N 2 1 319.452 4.179 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@@H+]1CCC[C@H](CCc2ccccc2)C1 ZINC001238117014 1055608495 /nfs/dbraw/zinc/60/84/95/1055608495.db2.gz UDWJRZABALVCKV-LJQANCHMSA-N 2 1 319.452 4.179 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC001238120616 1055608809 /nfs/dbraw/zinc/60/88/09/1055608809.db2.gz YZUQEZKJTWRPNP-GOSISDBHSA-N 2 1 305.425 4.104 20 0 DIADMP c1[nH+]cn2c1cccc2C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC001238120616 1055608813 /nfs/dbraw/zinc/60/88/13/1055608813.db2.gz YZUQEZKJTWRPNP-GOSISDBHSA-N 2 1 305.425 4.104 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1sccc1Cl ZINC000338544063 1055614653 /nfs/dbraw/zinc/61/46/53/1055614653.db2.gz IZTNSVTYKTZQOT-UHFFFAOYSA-N 2 1 311.882 4.073 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1sccc1Cl ZINC000338544063 1055614663 /nfs/dbraw/zinc/61/46/63/1055614663.db2.gz IZTNSVTYKTZQOT-UHFFFAOYSA-N 2 1 311.882 4.073 20 0 DIADMP CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001168569626 1055652521 /nfs/dbraw/zinc/65/25/21/1055652521.db2.gz HIGKSLWAJZFRHZ-FXAWDEMLSA-N 2 1 300.490 4.435 20 0 DIADMP C[N@H+](Cc1ccc(F)c(-c2ccccc2)c1)C1CC[NH+](C)CC1 ZINC001238561050 1055687470 /nfs/dbraw/zinc/68/74/70/1055687470.db2.gz MILRBRCCWRSJBB-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)C1CC[NH+](C)CC1 ZINC001238561050 1055687474 /nfs/dbraw/zinc/68/74/74/1055687474.db2.gz MILRBRCCWRSJBB-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP CC(C)(C)[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001620966794 1055700453 /nfs/dbraw/zinc/70/04/53/1055700453.db2.gz KMEGOJTYJAZGPQ-WOJBJXKFSA-N 2 1 314.517 4.455 20 0 DIADMP Cc1cc(C)c(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c(C)c1 ZINC000060815032 1055850090 /nfs/dbraw/zinc/85/00/90/1055850090.db2.gz GYNHGXUXDMSKNP-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C2CCC3(CCC3)CC2)c1 ZINC001620778418 1055945903 /nfs/dbraw/zinc/94/59/03/1055945903.db2.gz SELSNFBYYIIKRL-UHFFFAOYSA-N 2 1 300.490 4.341 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(C)cc2Cl)c1 ZINC001620778332 1055947203 /nfs/dbraw/zinc/94/72/03/1055947203.db2.gz NYTARUNGBQSAHV-UHFFFAOYSA-N 2 1 316.876 4.390 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c(C)c1 ZINC001620983911 1055951510 /nfs/dbraw/zinc/95/15/10/1055951510.db2.gz YBZCJEBKCVQGLP-IRLDBZIGSA-N 2 1 322.496 4.047 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC001620786082 1055959419 /nfs/dbraw/zinc/95/94/19/1055959419.db2.gz XKHLUBCWFYIXKX-RLLQIKCJSA-N 2 1 300.490 4.034 20 0 DIADMP CC[C@H](C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1 ZINC001620724084 1055987210 /nfs/dbraw/zinc/98/72/10/1055987210.db2.gz HDXVDFMLPWPCEY-CEXWTWQISA-N 2 1 302.506 4.138 20 0 DIADMP CCc1cccc(C[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC001621030280 1055992794 /nfs/dbraw/zinc/99/27/94/1055992794.db2.gz AITSXASXXYXHEG-AVRDEDQJSA-N 2 1 322.496 4.107 20 0 DIADMP CCc1ccc(NCC(C)(C)C[N@H+](C)Cc2ccccc2)[nH+]c1 ZINC001621045583 1056004570 /nfs/dbraw/zinc/00/45/70/1056004570.db2.gz ZVNVBNFGSHZIGS-UHFFFAOYSA-N 2 1 311.473 4.214 20 0 DIADMP CCc1ccc(NCC(C)(C)C[N@@H+](C)Cc2ccccc2)[nH+]c1 ZINC001621045583 1056004580 /nfs/dbraw/zinc/00/45/80/1056004580.db2.gz ZVNVBNFGSHZIGS-UHFFFAOYSA-N 2 1 311.473 4.214 20 0 DIADMP CC[N@@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860792 1056178917 /nfs/dbraw/zinc/17/89/17/1056178917.db2.gz YHIKTRUXCQLTQA-AQNXPRMDSA-N 2 1 315.505 4.206 20 0 DIADMP CC[N@H+](c1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860792 1056178921 /nfs/dbraw/zinc/17/89/21/1056178921.db2.gz YHIKTRUXCQLTQA-AQNXPRMDSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@H+](C)[C@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860792 1056178927 /nfs/dbraw/zinc/17/89/27/1056178927.db2.gz YHIKTRUXCQLTQA-AQNXPRMDSA-N 2 1 315.505 4.206 20 0 DIADMP CC[NH+](c1ccc(N[C@@H]2CC[N@@H+](C)[C@H]3CCC[C@@H]32)cc1)C(C)C ZINC000796860792 1056178932 /nfs/dbraw/zinc/17/89/32/1056178932.db2.gz YHIKTRUXCQLTQA-AQNXPRMDSA-N 2 1 315.505 4.206 20 0 DIADMP Clc1cccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000010435329 1056289993 /nfs/dbraw/zinc/28/99/93/1056289993.db2.gz ZAQHVBGTOKGFKI-UHFFFAOYSA-N 2 1 314.860 4.094 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474723146 1056343510 /nfs/dbraw/zinc/34/35/10/1056343510.db2.gz DAECDYSIVYPASR-ZUJMUWTESA-N 2 1 308.432 4.064 20 0 DIADMP C[C@H]([NH2+]CC[N@H+](C)C1CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000474728966 1056344103 /nfs/dbraw/zinc/34/41/03/1056344103.db2.gz VHJQWZHLHJSXRR-NFOMZHRRSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H]([NH2+]CC[N@@H+](C)C1CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000474728966 1056344119 /nfs/dbraw/zinc/34/41/19/1056344119.db2.gz VHJQWZHLHJSXRR-NFOMZHRRSA-N 2 1 320.443 4.208 20 0 DIADMP C[NH+](C)Cc1cccc(C2=CCC[N@@H+](Cc3ccccc3)C2)c1F ZINC001240388806 1056471305 /nfs/dbraw/zinc/47/13/05/1056471305.db2.gz MFPJMNKWLNZCOV-UHFFFAOYSA-N 2 1 324.443 4.177 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1ccc(F)c(Cl)c1)C(C)C ZINC001620828196 1056530560 /nfs/dbraw/zinc/53/05/60/1056530560.db2.gz LKAVTVNSOJGLGY-UHFFFAOYSA-N 2 1 300.849 4.078 20 0 DIADMP Cc1cc(C)cc(C2=CC[N@H+](CCC[NH+]3CCCCC3)CC2)c1 ZINC001616396034 1056648703 /nfs/dbraw/zinc/64/87/03/1056648703.db2.gz RALHFJNTIVQWMQ-UHFFFAOYSA-N 2 1 312.501 4.269 20 0 DIADMP Cc1cc(C)cc(C2=CC[N@@H+](CCC[NH+]3CCCCC3)CC2)c1 ZINC001616396034 1056648705 /nfs/dbraw/zinc/64/87/05/1056648705.db2.gz RALHFJNTIVQWMQ-UHFFFAOYSA-N 2 1 312.501 4.269 20 0 DIADMP COCC[N@@H+](C)CCCC1CC[NH+](CC2CCCCCC2)CC1 ZINC001616420336 1056653195 /nfs/dbraw/zinc/65/31/95/1056653195.db2.gz XLYAMQPYZXFPRB-UHFFFAOYSA-N 2 1 324.553 4.027 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@@H]2CCC(C)(C)O2)CC1)CC(C)C ZINC001616561257 1056677335 /nfs/dbraw/zinc/67/73/35/1056677335.db2.gz UFZNDAONPPDWRJ-IBGZPJMESA-N 2 1 324.553 4.024 20 0 DIADMP C[C@@H]1CCC[C@H](CC[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001616879866 1056729935 /nfs/dbraw/zinc/72/99/35/1056729935.db2.gz GZTHYCOLEHZRRZ-QZTJIDSGSA-N 2 1 302.506 4.396 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+]CC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000672605469 1056735127 /nfs/dbraw/zinc/73/51/27/1056735127.db2.gz LUVGVTYDMJPMKT-FFGOWVMKSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC001617104847 1056776656 /nfs/dbraw/zinc/77/66/56/1056776656.db2.gz ZIJJNDJIWZEFTL-IEBWSBKVSA-N 2 1 300.490 4.046 20 0 DIADMP Cc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1C ZINC000065976663 1056818979 /nfs/dbraw/zinc/81/89/79/1056818979.db2.gz MJVNLZLZMOZFMY-UHFFFAOYSA-N 2 1 310.485 4.433 20 0 DIADMP Cc1cccc2c1CC(C)(C)[N@@H+](CCC[NH+]1CCCCC1)C2 ZINC001618084172 1056922628 /nfs/dbraw/zinc/92/26/28/1056922628.db2.gz NUTZHWHGWCQNDB-UHFFFAOYSA-N 2 1 300.490 4.008 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2ccncc2s1 ZINC000657310334 1056928128 /nfs/dbraw/zinc/92/81/28/1056928128.db2.gz BXVTWYQQCAEJKB-OAHLLOKOSA-N 2 1 317.502 4.041 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CCSc2c(Cl)cccc21)C[NH+]1CCCC1 ZINC000360440986 1057023089 /nfs/dbraw/zinc/02/30/89/1057023089.db2.gz DOTBTBTWEHDDNR-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP Cc1ccc(C2=CC[N@@H+](Cc3ccccc3)CC2)c(C[NH+](C)C)c1 ZINC001241507737 1057078477 /nfs/dbraw/zinc/07/84/77/1057078477.db2.gz NZORNXGYTIOIMG-UHFFFAOYSA-N 2 1 320.480 4.346 20 0 DIADMP CC(C)([NH3+])c1ccc(C2=CC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001241507251 1057078838 /nfs/dbraw/zinc/07/88/38/1057078838.db2.gz SWHOJEKBCMNEGA-UHFFFAOYSA-N 2 1 306.453 4.170 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000361964807 1057102615 /nfs/dbraw/zinc/10/26/15/1057102615.db2.gz CKZCFALXBYDORT-XJKCOSOUSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2)C2CCCCC2)CC[N@@H+]1C ZINC000483708611 1057138036 /nfs/dbraw/zinc/13/80/36/1057138036.db2.gz DDYCCZIEQCDPAF-JRGCBEDISA-N 2 1 314.517 4.250 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2)C2CCCCC2)CC[N@H+]1C ZINC000483708611 1057138038 /nfs/dbraw/zinc/13/80/38/1057138038.db2.gz DDYCCZIEQCDPAF-JRGCBEDISA-N 2 1 314.517 4.250 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCc2ccco2)cc1 ZINC000658326971 1057373768 /nfs/dbraw/zinc/37/37/68/1057373768.db2.gz LRBSMKXPHPLARC-HNNXBMFYSA-N 2 1 309.413 4.057 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000675752155 1057407039 /nfs/dbraw/zinc/40/70/39/1057407039.db2.gz LFMTVCUPJWKPDI-AABGKKOBSA-N 2 1 300.490 4.004 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)C(C)(C)C ZINC000675747064 1057408762 /nfs/dbraw/zinc/40/87/62/1057408762.db2.gz DWANLEPPEYSKKM-RTBURBONSA-N 2 1 324.553 4.070 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166463 1057533675 /nfs/dbraw/zinc/53/36/75/1057533675.db2.gz SDGHZGBKDONIHY-OBJOEFQTSA-N 2 1 314.445 4.135 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166463 1057533677 /nfs/dbraw/zinc/53/36/77/1057533677.db2.gz SDGHZGBKDONIHY-OBJOEFQTSA-N 2 1 314.445 4.135 20 0 DIADMP Cc1ccc2ccccc2c1-c1ccc2c(C3C[NH2+]C3)[nH+]cn2c1 ZINC001242982066 1057535242 /nfs/dbraw/zinc/53/52/42/1057535242.db2.gz XGWXDJPTLMKMPR-UHFFFAOYSA-N 2 1 313.404 4.150 20 0 DIADMP CCC[N@H+]1CCCC[C@H]1c1ccc(-c2ccc(C[NH2+]C)cc2)nc1 ZINC001242991766 1057539516 /nfs/dbraw/zinc/53/95/16/1057539516.db2.gz VTUZSIYZPHQBFB-NRFANRHFSA-N 2 1 323.484 4.405 20 0 DIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1scnc1C1CC1 ZINC000487548788 1057574256 /nfs/dbraw/zinc/57/42/56/1057574256.db2.gz DIALZIOPTNMBCI-UHFFFAOYSA-N 2 1 321.534 4.155 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-c2ccncc2)cc1 ZINC000161601260 1057597517 /nfs/dbraw/zinc/59/75/17/1057597517.db2.gz XSHRWYVADUXWBM-ZLGUVYLKSA-N 2 1 321.468 4.026 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CCSc3c(Cl)cccc32)CC1 ZINC000161651362 1057599004 /nfs/dbraw/zinc/59/90/04/1057599004.db2.gz DMKHVFOCCHQESS-INIZCTEOSA-N 2 1 324.921 4.341 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCSc3c(Cl)cccc32)CC1 ZINC000161651239 1057599460 /nfs/dbraw/zinc/59/94/60/1057599460.db2.gz DMKHVFOCCHQESS-MRXNPFEDSA-N 2 1 324.921 4.341 20 0 DIADMP CC[NH+](CC)Cc1ccccc1-c1ccc2c(c1)C[N@H+](C)CC2 ZINC001243340873 1057652750 /nfs/dbraw/zinc/65/27/50/1057652750.db2.gz XCMKILZACMKMSQ-UHFFFAOYSA-N 2 1 308.469 4.183 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)C(C)(C)C ZINC000166795917 1057676469 /nfs/dbraw/zinc/67/64/69/1057676469.db2.gz OOVLEOOBXURJPB-LMMKCTJWSA-N 2 1 300.490 4.299 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)Cc1cccc(Cl)c1 ZINC000166828519 1057677420 /nfs/dbraw/zinc/67/74/20/1057677420.db2.gz ZYPDATVVEKCYFP-ZWKOTPCHSA-N 2 1 320.908 4.125 20 0 DIADMP Clc1cc(C2CC2)ccc1-c1ccc2c(C3C[NH2+]C3)[nH+]cn2c1 ZINC001244273118 1057919960 /nfs/dbraw/zinc/91/99/60/1057919960.db2.gz LLTUMWPWTUCDMD-UHFFFAOYSA-N 2 1 323.827 4.219 20 0 DIADMP C[NH+]1CCC2(CC1)C[N@@H+](CC1CCCCC1)Cc1ccccc12 ZINC001278384363 1057995103 /nfs/dbraw/zinc/99/51/03/1057995103.db2.gz NHZMYVPUUNIYHT-UHFFFAOYSA-N 2 1 312.501 4.046 20 0 DIADMP CC(C)(C)C[N@@H+]1C[C@@H]2CC[NH+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278386919 1058029879 /nfs/dbraw/zinc/02/98/79/1058029879.db2.gz XXWBTEBSXCYOFD-GASCZTMLSA-N 2 1 320.443 4.019 20 0 DIADMP CC(C)(C)C[NH+]1C[C@@H]2CC[N@@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278386919 1058029881 /nfs/dbraw/zinc/02/98/81/1058029881.db2.gz XXWBTEBSXCYOFD-GASCZTMLSA-N 2 1 320.443 4.019 20 0 DIADMP CC(C)(C)C[NH+]1C[C@@H]2CC[N@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278386919 1058029883 /nfs/dbraw/zinc/02/98/83/1058029883.db2.gz XXWBTEBSXCYOFD-GASCZTMLSA-N 2 1 320.443 4.019 20 0 DIADMP C[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc([C@@H]3CCC[NH2+]3)cc2)nc1 ZINC001245349454 1058149505 /nfs/dbraw/zinc/14/95/05/1058149505.db2.gz MNZULLFNIHIBAP-PZJWPPBQSA-N 2 1 321.468 4.330 20 0 DIADMP C[N@H+]1CC[C@H](c2ccc(-c3ccc([C@H]4CCC[NH2+]4)cc3)cc2)C1 ZINC001245355648 1058151088 /nfs/dbraw/zinc/15/10/88/1058151088.db2.gz JPOWGFSYHNKZCH-LEWJYISDSA-N 2 1 306.453 4.197 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[C@H]2c2ccccc2)C1 ZINC001550505171 1058341281 /nfs/dbraw/zinc/34/12/81/1058341281.db2.gz VBFSLLWUHCLDNI-FYQPLNBISA-N 2 1 323.484 4.230 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[C@@H](c3[nH+]ccn3C)C1)CCC2 ZINC001550502740 1058342691 /nfs/dbraw/zinc/34/26/91/1058342691.db2.gz ADGITTOWTZGVCO-ZIFCJYIRSA-N 2 1 309.457 4.032 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[C@@H]2c2ccccc2)C1 ZINC001550505172 1058343132 /nfs/dbraw/zinc/34/31/32/1058343132.db2.gz VBFSLLWUHCLDNI-YSTOQKLRSA-N 2 1 323.484 4.230 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCC23CCCCC3)C1 ZINC001550515574 1058343268 /nfs/dbraw/zinc/34/32/68/1058343268.db2.gz QKMYOFVCCYTRKE-BRWVUGGUSA-N 2 1 301.478 4.149 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H](c3[nH+]ccn3C)C1)CCC2 ZINC001550502738 1058343301 /nfs/dbraw/zinc/34/33/01/1058343301.db2.gz ADGITTOWTZGVCO-YQVWRLOYSA-N 2 1 309.457 4.032 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H]2C)CC[NH2+]1 ZINC001246063189 1058660922 /nfs/dbraw/zinc/66/09/22/1058660922.db2.gz AVEQQSJIVRYDMA-OLQIXAPSSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)cc1 ZINC001246073494 1058662960 /nfs/dbraw/zinc/66/29/60/1058662960.db2.gz ZISXJXQZPKZISZ-UYAOXDASSA-N 2 1 312.432 4.025 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC001246113442 1058683415 /nfs/dbraw/zinc/68/34/15/1058683415.db2.gz AUFNMFHQEXBYHQ-LSCVPOLPSA-N 2 1 301.261 4.173 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)ccc1Cl ZINC001246113495 1058684985 /nfs/dbraw/zinc/68/49/85/1058684985.db2.gz BJMNWQDLIHZRFP-ZZVYKPCYSA-N 2 1 313.272 4.317 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246154845 1058699876 /nfs/dbraw/zinc/69/98/76/1058699876.db2.gz ROCNQUAAUFRUCD-CVEARBPZSA-N 2 1 315.288 4.394 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246154846 1058699923 /nfs/dbraw/zinc/69/99/23/1058699923.db2.gz ROCNQUAAUFRUCD-HOTGVXAUSA-N 2 1 315.288 4.394 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246155205 1058701707 /nfs/dbraw/zinc/70/17/07/1058701707.db2.gz VSZPBEVLAXDWDO-GJZGRUSLSA-N 2 1 315.288 4.250 20 0 DIADMP Fc1c(Cl)cccc1C[NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246165039 1058708530 /nfs/dbraw/zinc/70/85/30/1058708530.db2.gz ZEBBOFZNQSBEHL-AWEZNQCLSA-N 2 1 310.844 4.024 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC001246177623 1058722655 /nfs/dbraw/zinc/72/26/55/1058722655.db2.gz CJGJSAXMAKZCSL-LAMSDQTKSA-N 2 1 324.443 4.230 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C[C@H]1CCCC[NH2+]1 ZINC001246182318 1058726821 /nfs/dbraw/zinc/72/68/21/1058726821.db2.gz ZLEVECZKQQUFCR-WIYYLYMNSA-N 2 1 322.496 4.329 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246190347 1058732868 /nfs/dbraw/zinc/73/28/68/1058732868.db2.gz IFHOBNVLOYUPDC-GOSISDBHSA-N 2 1 322.452 4.243 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246190815 1058733890 /nfs/dbraw/zinc/73/38/90/1058733890.db2.gz JAUOCIOWROSPRD-REPLKXPHSA-N 2 1 322.452 4.242 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246195456 1058737316 /nfs/dbraw/zinc/73/73/16/1058737316.db2.gz OFPLYFVYQQLVBT-IUODEOHRSA-N 2 1 315.288 4.250 20 0 DIADMP CCCC(CCC)[NH2+][C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246196900 1058738502 /nfs/dbraw/zinc/73/85/02/1058738502.db2.gz IKSNOIBQOZRWOS-PKOBYXMFSA-N 2 1 306.469 4.486 20 0 DIADMP CCCC(CCC)[NH2+][C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246196894 1058739342 /nfs/dbraw/zinc/73/93/42/1058739342.db2.gz IKSNOIBQOZRWOS-HKUYNNGSSA-N 2 1 306.469 4.486 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246199390 1058741647 /nfs/dbraw/zinc/74/16/47/1058741647.db2.gz WESHHDGRZJEZDX-BTTYYORXSA-N 2 1 313.272 4.065 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(Cl)c(F)c2)CC[NH2+]1 ZINC001246211726 1058743389 /nfs/dbraw/zinc/74/33/89/1058743389.db2.gz LJJICUHPHKJJOQ-VHDGCEQUSA-N 2 1 312.860 4.441 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+]C[C@@]1(C)CC[NH2+]CC1(F)F ZINC001246221902 1058747001 /nfs/dbraw/zinc/74/70/01/1058747001.db2.gz PEOQSUZWUADONS-ZWKOTPCHSA-N 2 1 324.459 4.012 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]C[C@]2(C)CC[NH2+]CC2(F)F)CC1 ZINC001246220997 1058747313 /nfs/dbraw/zinc/74/73/13/1058747313.db2.gz MMMWWLYNWXTCGB-DQPZFDDXSA-N 2 1 316.480 4.206 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccc(Cl)c(F)c1 ZINC001246215654 1058747764 /nfs/dbraw/zinc/74/77/64/1058747764.db2.gz ZYDBCWRUNKFPFV-FFSVYQOJSA-N 2 1 312.860 4.296 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1ccc(Cl)c(F)c1 ZINC001246215653 1058747938 /nfs/dbraw/zinc/74/79/38/1058747938.db2.gz ZYDBCWRUNKFPFV-AXAPSJFSSA-N 2 1 312.860 4.296 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CCC2=CCCCC2)CC[NH2+]1 ZINC001246231246 1058753955 /nfs/dbraw/zinc/75/39/55/1058753955.db2.gz CZCSCXAALQWEJX-UYAOXDASSA-N 2 1 316.464 4.407 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CCC2=CCCCC2)CC[NH2+]1 ZINC001246231244 1058754235 /nfs/dbraw/zinc/75/42/35/1058754235.db2.gz CZCSCXAALQWEJX-ICSRJNTNSA-N 2 1 316.464 4.407 20 0 DIADMP CCCc1ccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246229819 1058754667 /nfs/dbraw/zinc/75/46/67/1058754667.db2.gz LSOYGQMYXISTMA-RTWAWAEBSA-N 2 1 308.469 4.222 20 0 DIADMP Cc1ccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246237813 1058761741 /nfs/dbraw/zinc/76/17/41/1058761741.db2.gz IINCDEZCLOUXEB-UXHICEINSA-N 2 1 308.469 4.313 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246240297 1058762390 /nfs/dbraw/zinc/76/23/90/1058762390.db2.gz UHMZWXLYDRMCID-JKSUJKDBSA-N 2 1 306.881 4.085 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC001246237904 1058762834 /nfs/dbraw/zinc/76/28/34/1058762834.db2.gz JTOCCTFXORDORW-QHAWAJNXSA-N 2 1 308.469 4.467 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H](C)C2CCCC2)CC[NH2+]1 ZINC001246242932 1058763543 /nfs/dbraw/zinc/76/35/43/1058763543.db2.gz JYHAVBYGLWPVJS-BJZITVGISA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H](C)C2CCCC2)CC[NH2+]1 ZINC001246242935 1058765635 /nfs/dbraw/zinc/76/56/35/1058765635.db2.gz JYHAVBYGLWPVJS-LJHODMEESA-N 2 1 304.453 4.096 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC(C)(C)C1 ZINC001246250516 1058768165 /nfs/dbraw/zinc/76/81/65/1058768165.db2.gz QAGDARUUWLHZSW-OQIJWPOYSA-N 2 1 300.490 4.284 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001246266709 1058778865 /nfs/dbraw/zinc/77/88/65/1058778865.db2.gz QYOLWRVKKXHAFU-LZLXCTOHSA-N 2 1 304.453 4.096 20 0 DIADMP c1oc2ccccc2c1CC[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246261892 1058779971 /nfs/dbraw/zinc/77/99/71/1058779971.db2.gz ONULXGTWKSZJQI-AZUAARDMSA-N 2 1 320.436 4.058 20 0 DIADMP [NH3+]C[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001246263387 1058780259 /nfs/dbraw/zinc/78/02/59/1058780259.db2.gz DHLMIPCUNFUCNG-RTBURBONSA-N 2 1 300.490 4.039 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C(C)C)CC[NH2+]1 ZINC001246271090 1058784240 /nfs/dbraw/zinc/78/42/40/1058784240.db2.gz DVVNQWASDYNUOW-JTDSTZFVSA-N 2 1 306.469 4.423 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccc(F)c(F)c1 ZINC001246282333 1058799598 /nfs/dbraw/zinc/79/95/98/1058799598.db2.gz BKLLQXYYFYMKFC-HIFRSBDPSA-N 2 1 308.416 4.070 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCCC2(C)C)CC[NH2+]1 ZINC001246292584 1058805882 /nfs/dbraw/zinc/80/58/82/1058805882.db2.gz XUORLHYVUOUSDS-BPQIPLTHSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CCCC2(C)C)CC[NH2+]1 ZINC001246292596 1058807075 /nfs/dbraw/zinc/80/70/75/1058807075.db2.gz XUORLHYVUOUSDS-SZMVWBNQSA-N 2 1 304.453 4.096 20 0 DIADMP [NH3+][C@H](C[NH2+]C1CCC2(CCCCC2)CC1)Cc1ccccc1 ZINC001246300604 1058812205 /nfs/dbraw/zinc/81/22/05/1058812205.db2.gz SHEQMOMHKHZWJH-SFHVURJKSA-N 2 1 300.490 4.039 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246305245 1058816616 /nfs/dbraw/zinc/81/66/16/1058816616.db2.gz HKHNBVQWUYCDKB-TXPKVOOTSA-N 2 1 304.453 4.177 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(OC)cc1 ZINC001246316481 1058824675 /nfs/dbraw/zinc/82/46/75/1058824675.db2.gz ZMCDAYBBKHGDNR-NRSPTQNISA-N 2 1 324.468 4.229 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccc(F)cc1F ZINC001246319358 1058829115 /nfs/dbraw/zinc/82/91/15/1058829115.db2.gz WUSJASIICKWGJW-XYPHTWIQSA-N 2 1 310.432 4.172 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CCC[NH2+][C@@H]1C ZINC001246325278 1058834684 /nfs/dbraw/zinc/83/46/84/1058834684.db2.gz ITWFCPKBJQSBDW-HWWQOWPSSA-N 2 1 315.288 4.045 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246328646 1058838470 /nfs/dbraw/zinc/83/84/70/1058838470.db2.gz YBALOINAFCGXKD-KCPJHIHWSA-N 2 1 315.288 4.045 20 0 DIADMP Cc1ccc(C[C@H]([NH2+][C@@H]2CC[C@H](C)NC2)c2ccccc2)cc1 ZINC001246338907 1058848719 /nfs/dbraw/zinc/84/87/19/1058848719.db2.gz NFWYEJSSSIINCJ-WMQCIHAUSA-N 2 1 308.469 4.009 20 0 DIADMP CCCCCC1CCC([NH2+][C@H]2CC[NH2+]C[C@H]2C(F)(F)F)CC1 ZINC001246341261 1058853961 /nfs/dbraw/zinc/85/39/61/1058853961.db2.gz OMNLIRJGTNGXCD-FJBKBRRZSA-N 2 1 320.443 4.256 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)c(F)c2F)C[C@H](CC)[NH2+]1 ZINC001246348309 1058860749 /nfs/dbraw/zinc/86/07/49/1058860749.db2.gz IZMVVQISPGHAIH-XQLPTFJDSA-N 2 1 310.432 4.233 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCCNc4ccccc43)CC[NH2+]2)cc1 ZINC001246358398 1058869230 /nfs/dbraw/zinc/86/92/30/1058869230.db2.gz PBASCIGZQHQVLF-UIFIKXQLSA-N 2 1 321.468 4.016 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([NH2+]C2(c3ccccc3Cl)CCC2)CC[NH2+]1 ZINC001246360843 1058870332 /nfs/dbraw/zinc/87/03/32/1058870332.db2.gz IQKJTZLDAZLSCM-WMLDXEAASA-N 2 1 320.908 4.476 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+]C2(c3ccccc3F)CCC2)CC[NH2+]1 ZINC001246362608 1058871220 /nfs/dbraw/zinc/87/12/20/1058871220.db2.gz BIARBGDQODBXQV-HOTGVXAUSA-N 2 1 304.453 4.105 20 0 DIADMP CCCC(CCC)[NH2+]C1(c2ccccc2Cl)CC[NH2+]CC1 ZINC001246372795 1058877371 /nfs/dbraw/zinc/87/73/71/1058877371.db2.gz FVZHBBFBVCSOED-UHFFFAOYSA-N 2 1 308.897 4.477 20 0 DIADMP CC1(C)CCC([NH2+]C2(c3ccccc3Cl)CC[NH2+]CC2)CC1 ZINC001246374012 1058878096 /nfs/dbraw/zinc/87/80/96/1058878096.db2.gz IYGGMYBMYNZYJU-UHFFFAOYSA-N 2 1 320.908 4.477 20 0 DIADMP Clc1ccccc1C1([NH2+]C2CCC3(CC3)CC2)CC[NH2+]CC1 ZINC001246374760 1058878398 /nfs/dbraw/zinc/87/83/98/1058878398.db2.gz LIVUPCQUDLOTHV-UHFFFAOYSA-N 2 1 318.892 4.231 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246386105 1058892594 /nfs/dbraw/zinc/89/25/94/1058892594.db2.gz DQUFZMXQIDKVQA-SJLPKXTDSA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246391734 1058897969 /nfs/dbraw/zinc/89/79/69/1058897969.db2.gz GTWMTAQBQGMWNO-MNEFBYGVSA-N 2 1 304.453 4.033 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246401012 1058905420 /nfs/dbraw/zinc/90/54/20/1058905420.db2.gz QUBFULLMNXGRMA-VSZNYVQBSA-N 2 1 321.896 4.085 20 0 DIADMP Fc1ccccc1[C@H](CC1CCC1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246408669 1058909880 /nfs/dbraw/zinc/90/98/80/1058909880.db2.gz VSBUOPSCWFAENM-LPHOPBHVSA-N 2 1 316.464 4.321 20 0 DIADMP CCC1([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246417943 1058916607 /nfs/dbraw/zinc/91/66/07/1058916607.db2.gz WXNRBOGFHRQAIL-DLBZAZTESA-N 2 1 322.443 4.427 20 0 DIADMP Cc1cccc(C2([NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)CCC2)c1 ZINC001246415015 1058916868 /nfs/dbraw/zinc/91/68/68/1058916868.db2.gz WZEPSVIKDJIOSY-NHCUHLMSSA-N 2 1 320.480 4.457 20 0 DIADMP Cc1cccc(C2([NH2+][C@H]3CC[NH2+][C@@H](c4ccccc4)C3)CCC2)c1 ZINC001246415007 1058917185 /nfs/dbraw/zinc/91/71/85/1058917185.db2.gz WZEPSVIKDJIOSY-LEWJYISDSA-N 2 1 320.480 4.457 20 0 DIADMP CCCCC[C@H](CC)[NH2+]C1(c2ccccc2F)CC[NH2+]CC1 ZINC001246429320 1058921248 /nfs/dbraw/zinc/92/12/48/1058921248.db2.gz LWIZXCBHDYRKCQ-INIZCTEOSA-N 2 1 306.469 4.353 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC[NH2+]1 ZINC001246445613 1058937895 /nfs/dbraw/zinc/93/78/95/1058937895.db2.gz YBNJRZGYBVZRHQ-GDIGMMSISA-N 2 1 314.860 4.160 20 0 DIADMP C[NH2+]CC[C@H](C)[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001246445756 1058938471 /nfs/dbraw/zinc/93/84/71/1058938471.db2.gz ZFSPMGQUGQAHBX-KBXCAEBGSA-N 2 1 302.849 4.017 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2OCC)CC[NH2+]1 ZINC001246453265 1058940062 /nfs/dbraw/zinc/94/00/62/1058940062.db2.gz BGAIZYMGFKNDQX-YESZJQIVSA-N 2 1 304.478 4.047 20 0 DIADMP Cc1ccc(C2([NH2+][C@H]3CC[C@@H](C)[NH2+]C3)CCC(F)(F)CC2)cc1 ZINC001246454141 1058940120 /nfs/dbraw/zinc/94/01/20/1058940120.db2.gz DBOWZOHIYXHBRG-WBVHZDCISA-N 2 1 322.443 4.130 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246456006 1058941680 /nfs/dbraw/zinc/94/16/80/1058941680.db2.gz JGNVLJDPUFISLF-IRXDYDNUSA-N 2 1 316.489 4.191 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2OC)C2CC2)CC[NH2+]1 ZINC001246469825 1058956590 /nfs/dbraw/zinc/95/65/90/1058956590.db2.gz TUAFXRLBALPBJS-HLIPFELVSA-N 2 1 316.489 4.047 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(F)cc(Cl)c2)CC[NH2+]1 ZINC001246491973 1058966931 /nfs/dbraw/zinc/96/69/31/1058966931.db2.gz UYYPFFPGIDNBGN-CSMYWGQOSA-N 2 1 312.860 4.441 20 0 DIADMP CC[C@H]1CC([NH2+][C@H](C)c2cc(F)cc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246489298 1058967368 /nfs/dbraw/zinc/96/73/68/1058967368.db2.gz MZFXPEOWKAJMGX-RLCCDNCMSA-N 2 1 312.860 4.439 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1C[NH2+]C[C@H](C)C1 ZINC001246489950 1058968080 /nfs/dbraw/zinc/96/80/80/1058968080.db2.gz BZWWDFUTPPNAAB-OPYAIIAOSA-N 2 1 322.496 4.185 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H](C)CSc1ccc(F)cc1 ZINC001246495388 1058970571 /nfs/dbraw/zinc/97/05/71/1058970571.db2.gz KEEUKNIOWRCPRU-AWEZNQCLSA-N 2 1 312.498 4.194 20 0 DIADMP Fc1cccc2c1CCC[C@H]2[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246500169 1058974600 /nfs/dbraw/zinc/97/46/00/1058974600.db2.gz PHRCZRKKBSFXBG-ZLGUVYLKSA-N 2 1 324.443 4.286 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246499557 1058975187 /nfs/dbraw/zinc/97/51/87/1058975187.db2.gz LCHQGLPOFTUGLX-VCBZYWHSSA-N 2 1 322.443 4.243 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246519404 1058984051 /nfs/dbraw/zinc/98/40/51/1058984051.db2.gz NEZNPJSPNDQVLX-QUCCMNQESA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@H+]3CCCC4(CC[NH2+]CC4)C3)C2)cc1 ZINC001246524892 1058985906 /nfs/dbraw/zinc/98/59/06/1058985906.db2.gz UQWBLPMMJZZKPA-WOJBJXKFSA-N 2 1 312.501 4.178 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530819 1058987035 /nfs/dbraw/zinc/98/70/35/1058987035.db2.gz QFDWRTADPPSBKF-WOJBJXKFSA-N 2 1 308.469 4.238 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)c1 ZINC001246542143 1058993837 /nfs/dbraw/zinc/99/38/37/1058993837.db2.gz WOAQUKLZODEFFK-FQEVSTJZSA-N 2 1 312.501 4.444 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246537653 1058994008 /nfs/dbraw/zinc/99/40/08/1058994008.db2.gz XFXLUJQUCGKPQM-RTBURBONSA-N 2 1 318.892 4.206 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(C)c2)CC[NH2+]1 ZINC001246542657 1058994253 /nfs/dbraw/zinc/99/42/53/1058994253.db2.gz WRIFSFWBDJCMJC-HSALFYBXSA-N 2 1 300.490 4.443 20 0 DIADMP C[C@@H]1CC[N@H+](C2CCC(c3ccccc3)CC2)CC[C@@H]1C[NH3+] ZINC001246557033 1058999337 /nfs/dbraw/zinc/99/93/37/1058999337.db2.gz JOCNWTZKFKRWRV-IHJVYAAUSA-N 2 1 300.490 4.020 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC[C@@H]1C[NH3+] ZINC001246555350 1059000648 /nfs/dbraw/zinc/00/06/48/1059000648.db2.gz DTXXRRTVTKHXAH-VBSBHUPXSA-N 2 1 300.490 4.020 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC[C@H]1C[NH3+] ZINC001246555348 1059000685 /nfs/dbraw/zinc/00/06/85/1059000685.db2.gz DTXXRRTVTKHXAH-RSPOEFSDSA-N 2 1 300.490 4.020 20 0 DIADMP C[C@@H]1C[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CCC[C@H]1C[NH3+] ZINC001246561709 1059003366 /nfs/dbraw/zinc/00/33/66/1059003366.db2.gz KFWMZLXNSOOJHZ-RSPOEFSDSA-N 2 1 300.490 4.020 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@](C)(F)CC2)CC[NH2+]1 ZINC001246567499 1059005972 /nfs/dbraw/zinc/00/59/72/1059005972.db2.gz KRVCYQVHVZORAJ-NZSAHSFTSA-N 2 1 322.443 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@](C)(F)CC2)CC[NH2+]1 ZINC001246567499 1059005996 /nfs/dbraw/zinc/00/59/96/1059005996.db2.gz KRVCYQVHVZORAJ-NZSAHSFTSA-N 2 1 322.443 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@](C)(F)CC2)CC[NH2+]1 ZINC001246567470 1059006568 /nfs/dbraw/zinc/00/65/68/1059006568.db2.gz KRVCYQVHVZORAJ-NEWSRXKRSA-N 2 1 322.443 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@](C)(F)CC2)CC[NH2+]1 ZINC001246567470 1059006571 /nfs/dbraw/zinc/00/65/71/1059006571.db2.gz KRVCYQVHVZORAJ-NEWSRXKRSA-N 2 1 322.443 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](C)CC2)CC[NH2+]1 ZINC001246584615 1059008719 /nfs/dbraw/zinc/00/87/19/1059008719.db2.gz BROKJFXWOKESED-FNHZYXHNSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC[C@H](C)CC2)CC[NH2+]1 ZINC001246584615 1059008741 /nfs/dbraw/zinc/00/87/41/1059008741.db2.gz BROKJFXWOKESED-FNHZYXHNSA-N 2 1 304.453 4.049 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001246579528 1059009835 /nfs/dbraw/zinc/00/98/35/1059009835.db2.gz FJGJJKDKZFCRIX-WOJBJXKFSA-N 2 1 302.506 4.095 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001246578563 1059011760 /nfs/dbraw/zinc/01/17/60/1059011760.db2.gz SAAKPNLUYPTVPB-WOJBJXKFSA-N 2 1 302.506 4.239 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC001246584617 1059013286 /nfs/dbraw/zinc/01/32/86/1059013286.db2.gz BROKJFXWOKESED-LJHODMEESA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](C)CC2)CC[NH2+]1 ZINC001246584617 1059013307 /nfs/dbraw/zinc/01/33/07/1059013307.db2.gz BROKJFXWOKESED-LJHODMEESA-N 2 1 304.453 4.049 20 0 DIADMP c1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246595790 1059014408 /nfs/dbraw/zinc/01/44/08/1059014408.db2.gz IOYUJECUDFPTFC-FQEVSTJZSA-N 2 1 312.501 4.496 20 0 DIADMP C[C@H]1C[N@@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596850 1059017148 /nfs/dbraw/zinc/01/71/48/1059017148.db2.gz KKNPDDGZTFHTFF-LRQRDZAKSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1C[N@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596850 1059017167 /nfs/dbraw/zinc/01/71/67/1059017167.db2.gz KKNPDDGZTFHTFF-LRQRDZAKSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1CC([N@@H+](Cc2ccccc2)C2CCCCC2)C[C@@H](C)[NH2+]1 ZINC001246595801 1059017670 /nfs/dbraw/zinc/01/76/70/1059017670.db2.gz IRIOQANTKNMFRZ-IAGOWNOFSA-N 2 1 300.490 4.350 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)CSc1ccc(F)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001246595960 1059018963 /nfs/dbraw/zinc/01/89/63/1059018963.db2.gz UJEIBBKIJOPVRH-DOTOQJQBSA-N 2 1 324.509 4.159 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@@H](c2ccccc2)C1)[C@@H]1CCC[NH2+]CC1 ZINC001246590738 1059019676 /nfs/dbraw/zinc/01/96/76/1059019676.db2.gz HVFDOLAQNVNRJG-AQNXPRMDSA-N 2 1 300.490 4.175 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CC[C@@H](c2ccccc2)C1)[C@H]1CCC[NH2+]CC1 ZINC001246590739 1059019763 /nfs/dbraw/zinc/01/97/63/1059019763.db2.gz HVFDOLAQNVNRJG-HSALFYBXSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@H+](C2CCC(Cc3ccccc3)CC2)C1 ZINC001246595935 1059019841 /nfs/dbraw/zinc/01/98/41/1059019841.db2.gz UHEPUGQJVXALOT-CBNMVNINSA-N 2 1 314.517 4.239 20 0 DIADMP C1C[N@@H+]([C@@H]2CCCC3(CCCCC3)C2)[C@]2(C1)CCC[NH2+]CC2 ZINC001246608050 1059021454 /nfs/dbraw/zinc/02/14/54/1059021454.db2.gz SGMKFENOMNTYLM-QUCCMNQESA-N 2 1 304.522 4.488 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CC[C@@]34CCC[NH2+]C4)CC2)cc1 ZINC001246607165 1059022067 /nfs/dbraw/zinc/02/20/67/1059022067.db2.gz SHQWLRHCNDEFJJ-NKELODKYSA-N 2 1 318.892 4.194 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@@]34CCC[NH2+]C4)CC2)cc1 ZINC001246607165 1059022090 /nfs/dbraw/zinc/02/20/90/1059022090.db2.gz SHQWLRHCNDEFJJ-NKELODKYSA-N 2 1 318.892 4.194 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CCc2cccc(Cl)c2C1)[C@H]1CCC[NH2+]CC1 ZINC001246597939 1059023324 /nfs/dbraw/zinc/02/33/24/1059023324.db2.gz YYHJKUCYZAUMNO-DLBZAZTESA-N 2 1 320.908 4.050 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246602910 1059024244 /nfs/dbraw/zinc/02/42/44/1059024244.db2.gz DTYYJDRUDWCRSO-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP C1C[N@@H+]([C@@H]2CCCC3(CCCCC3)C2)[C@@]2(C1)CCC[NH2+]CC2 ZINC001246608054 1059026729 /nfs/dbraw/zinc/02/67/29/1059026729.db2.gz SGMKFENOMNTYLM-UYAOXDASSA-N 2 1 304.522 4.488 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246613426 1059026772 /nfs/dbraw/zinc/02/67/72/1059026772.db2.gz ZHYPYUACDNTXGB-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001246609086 1059028915 /nfs/dbraw/zinc/02/89/15/1059028915.db2.gz KPDFJDKXQOWRCM-RTWAWAEBSA-N 2 1 314.517 4.254 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001246608142 1059029853 /nfs/dbraw/zinc/02/98/53/1059029853.db2.gz SXYSMLALHYCWNE-MJGOQNOKSA-N 2 1 318.530 4.084 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001246615208 1059032670 /nfs/dbraw/zinc/03/26/70/1059032670.db2.gz QUCJPPDCNUBMSW-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@H+]3CCC[C@@]4(CCCC[NH2+]4)C3)C2)cc1 ZINC001246616246 1059035060 /nfs/dbraw/zinc/03/50/60/1059035060.db2.gz UYLYAORUGYELNB-HKBOAZHASA-N 2 1 312.501 4.321 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001246615207 1059035186 /nfs/dbraw/zinc/03/51/86/1059035186.db2.gz QUCJPPDCNUBMSW-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP C1C[NH2+][C@@]2(C1)CCC[N@@H+]([C@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633780 1059037038 /nfs/dbraw/zinc/03/70/38/1059037038.db2.gz MMCQPAGVDJPMOW-ICSRJNTNSA-N 2 1 304.522 4.488 20 0 DIADMP C1C[NH2+][C@@]2(C1)CCC[N@H+]([C@H]1CCCC3(CCCCC3)C1)CC2 ZINC001246633780 1059037061 /nfs/dbraw/zinc/03/70/61/1059037061.db2.gz MMCQPAGVDJPMOW-ICSRJNTNSA-N 2 1 304.522 4.488 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001246625776 1059037200 /nfs/dbraw/zinc/03/72/00/1059037200.db2.gz UNJZHPVCMJRUAS-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)CC1 ZINC001246626593 1059037889 /nfs/dbraw/zinc/03/78/89/1059037889.db2.gz XTCSHLOOOHZLRT-VTLFHKLASA-N 2 1 324.512 4.031 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CC[C@@]2(CC[NH2+]2)C1 ZINC001246633009 1059038193 /nfs/dbraw/zinc/03/81/93/1059038193.db2.gz BJTUQFYBFOSONN-GCJKJVERSA-N 2 1 320.480 4.035 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@@]2(CC[NH2+]2)C1 ZINC001246633009 1059038214 /nfs/dbraw/zinc/03/82/14/1059038214.db2.gz BJTUQFYBFOSONN-GCJKJVERSA-N 2 1 320.480 4.035 20 0 DIADMP CCCCCC[C@H](CCC)[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001246637013 1059044539 /nfs/dbraw/zinc/04/45/39/1059044539.db2.gz IJSFZTYPITYBKG-IRXDYDNUSA-N 2 1 316.480 4.446 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@@H+]2CCCC[C@@]23CCC[NH2+]C3)cc1 ZINC001246649543 1059053251 /nfs/dbraw/zinc/05/32/51/1059053251.db2.gz CQCDNMBLDLNIJR-HKUYNNGSSA-N 2 1 318.530 4.084 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCCC[C@@]23CCC[NH2+]C3)cc1 ZINC001246649543 1059053274 /nfs/dbraw/zinc/05/32/74/1059053274.db2.gz CQCDNMBLDLNIJR-HKUYNNGSSA-N 2 1 318.530 4.084 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CC[C@H]2C[C@@]2([NH3+])C1 ZINC001246656590 1059055798 /nfs/dbraw/zinc/05/57/98/1059055798.db2.gz NPTYVZAWNLFNEK-RBDMOPTHSA-N 2 1 320.480 4.020 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC001246659289 1059056339 /nfs/dbraw/zinc/05/63/39/1059056339.db2.gz WTXAAUAGUWBFEB-CIWUYKSXSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC001246659289 1059056357 /nfs/dbraw/zinc/05/63/57/1059056357.db2.gz WTXAAUAGUWBFEB-CIWUYKSXSA-N 2 1 316.464 4.049 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246675891 1059056435 /nfs/dbraw/zinc/05/64/35/1059056435.db2.gz BFVVJMSICHZGQR-GUGJDKNPSA-N 2 1 320.480 4.248 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC001246659298 1059059589 /nfs/dbraw/zinc/05/95/89/1059059589.db2.gz WTXAAUAGUWBFEB-QXOCSCLMSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@@H]3CCC[C@@H]3C2)CC[NH2+]1 ZINC001246659298 1059059613 /nfs/dbraw/zinc/05/96/13/1059059613.db2.gz WTXAAUAGUWBFEB-QXOCSCLMSA-N 2 1 316.464 4.049 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@@]23CC[N@H+](C2CCCCCCC2)C3)cc1 ZINC001246675873 1059059980 /nfs/dbraw/zinc/05/99/80/1059059980.db2.gz BCHKFSNTIUSRRE-NHCUHLMSSA-N 2 1 312.501 4.178 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246677193 1059061391 /nfs/dbraw/zinc/06/13/91/1059061391.db2.gz CFQXLDWYFIZGCU-WOJBJXKFSA-N 2 1 300.490 4.034 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246675958 1059061655 /nfs/dbraw/zinc/06/16/55/1059061655.db2.gz BQWODRXYFVZAID-GFOJFJKKSA-N 2 1 314.517 4.280 20 0 DIADMP CC1(C)CCC[C@@H]([N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)C1 ZINC001246682466 1059061807 /nfs/dbraw/zinc/06/18/07/1059061807.db2.gz CXMCQUBTFPVEIF-SBHAEUEKSA-N 2 1 312.501 4.034 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([N@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)C2)cc1 ZINC001246678036 1059061858 /nfs/dbraw/zinc/06/18/58/1059061858.db2.gz LVBBHYJKDGCPQC-ANULTFPQSA-N 2 1 312.501 4.034 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246675965 1059062912 /nfs/dbraw/zinc/06/29/12/1059062912.db2.gz BQWODRXYFVZAID-OYNPSCLESA-N 2 1 314.517 4.280 20 0 DIADMP CC1(C)CCC[C@H]([N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)C1 ZINC001246677298 1059063269 /nfs/dbraw/zinc/06/32/69/1059063269.db2.gz CXMCQUBTFPVEIF-QKNQBKEWSA-N 2 1 312.501 4.034 20 0 DIADMP C[N@@H+](CC1CC[NH2+]CC1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246678382 1059064752 /nfs/dbraw/zinc/06/47/52/1059064752.db2.gz DFBXTNSALVXLNR-UHFFFAOYSA-N 2 1 320.908 4.298 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)C2)cc1 ZINC001246678039 1059065043 /nfs/dbraw/zinc/06/50/43/1059065043.db2.gz LVBBHYJKDGCPQC-NCYKPQTJSA-N 2 1 312.501 4.034 20 0 DIADMP C1CCC2(C1)CCC([N@H+]1CCC[C@@H]([C@H]3CCC[NH2+]C3)C1)CC2 ZINC001246679638 1059066087 /nfs/dbraw/zinc/06/60/87/1059066087.db2.gz XCKQXXBUNWGIEL-ZWKOTPCHSA-N 2 1 304.522 4.201 20 0 DIADMP CCC1CCC([N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001246684868 1059067397 /nfs/dbraw/zinc/06/73/97/1059067397.db2.gz XZNQHUSNGREMNP-CGNZLSCGSA-N 2 1 312.501 4.034 20 0 DIADMP C[N@H+](Cc1cccc(Cl)c1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246769395 1059071490 /nfs/dbraw/zinc/07/14/90/1059071490.db2.gz JROGNRMJSWIAQC-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246769395 1059071512 /nfs/dbraw/zinc/07/15/12/1059071512.db2.gz JROGNRMJSWIAQC-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246774064 1059074974 /nfs/dbraw/zinc/07/49/74/1059074974.db2.gz FVYVSTGZVKECPT-FCHUYYIVSA-N 2 1 322.496 4.262 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246775583 1059075482 /nfs/dbraw/zinc/07/54/82/1059075482.db2.gz IXRVZEILBJHBDC-UYAOXDASSA-N 2 1 310.485 4.438 20 0 DIADMP CCCC1CC[NH+]([C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)CC1 ZINC001246777752 1059077348 /nfs/dbraw/zinc/07/73/48/1059077348.db2.gz UFNOCZFQLAQAOC-AZUAARDMSA-N 2 1 318.480 4.439 20 0 DIADMP CCCC1CC[NH+]([C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CC1 ZINC001246777754 1059078477 /nfs/dbraw/zinc/07/84/77/1059078477.db2.gz UFNOCZFQLAQAOC-QUCCMNQESA-N 2 1 318.480 4.439 20 0 DIADMP C[N@@H+]([C@H]1CCN[C@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783534 1059080132 /nfs/dbraw/zinc/08/01/32/1059080132.db2.gz ONUNQJCSNMQWTP-IXHQKZKNSA-N 2 1 324.512 4.380 20 0 DIADMP C[N@H+]([C@H]1CC[NH2+][C@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783534 1059080156 /nfs/dbraw/zinc/08/01/56/1059080156.db2.gz ONUNQJCSNMQWTP-IXHQKZKNSA-N 2 1 324.512 4.380 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@H](c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783534 1059080174 /nfs/dbraw/zinc/08/01/74/1059080174.db2.gz ONUNQJCSNMQWTP-IXHQKZKNSA-N 2 1 324.512 4.380 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246783921 1059083247 /nfs/dbraw/zinc/08/32/47/1059083247.db2.gz RAVYYLTYRJJZPX-WMZOPIPTSA-N 2 1 304.453 4.049 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)cc1 ZINC001246784136 1059084243 /nfs/dbraw/zinc/08/42/43/1059084243.db2.gz FEHYXBZOVGJUGK-MSOLQXFVSA-N 2 1 318.892 4.399 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(OC)cc2)CC[NH2+]1 ZINC001246788336 1059085175 /nfs/dbraw/zinc/08/51/75/1059085175.db2.gz RDOOVNNCMDODHC-HBFSDRIKSA-N 2 1 316.489 4.143 20 0 DIADMP c1ccc(C[C@@H]2C[C@H]([N@H+]3CCC[C@@H]3c3ccccc3)CC[NH2+]2)cc1 ZINC001246784133 1059087563 /nfs/dbraw/zinc/08/75/63/1059087563.db2.gz FBOGUIHOMKJARI-YPAWHYETSA-N 2 1 320.480 4.187 20 0 DIADMP c1csc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246786608 1059087996 /nfs/dbraw/zinc/08/79/96/1059087996.db2.gz MDLYHASMVKBCFM-HZPDHXFCSA-N 2 1 304.503 4.340 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(OC)cc2)CC[NH2+]1 ZINC001246788317 1059088099 /nfs/dbraw/zinc/08/80/99/1059088099.db2.gz RDOOVNNCMDODHC-GGPKGHCWSA-N 2 1 316.489 4.143 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+]C2(CCCCC2)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783958 1059088162 /nfs/dbraw/zinc/08/81/62/1059088162.db2.gz SEYCFUACIMMLGM-TWJKGYNYSA-N 2 1 316.533 4.342 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788763 1059092808 /nfs/dbraw/zinc/09/28/08/1059092808.db2.gz IZHKNPDLYHUVIF-MJGOQNOKSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788763 1059092831 /nfs/dbraw/zinc/09/28/31/1059092831.db2.gz IZHKNPDLYHUVIF-MJGOQNOKSA-N 2 1 304.453 4.048 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2OC)C[C@H](CC)[NH2+]1 ZINC001246792527 1059094259 /nfs/dbraw/zinc/09/42/59/1059094259.db2.gz QLXBIEUVPPTQFA-VUHPKUFZSA-N 2 1 316.489 4.141 20 0 DIADMP Fc1ccc(F)c([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246792208 1059094721 /nfs/dbraw/zinc/09/47/21/1059094721.db2.gz OMLOESRTDQSSKW-AYOQOUSVSA-N 2 1 320.427 4.024 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)c1 ZINC001246793080 1059095606 /nfs/dbraw/zinc/09/56/06/1059095606.db2.gz CYYNALUVSWLXAX-LJQANCHMSA-N 2 1 316.464 4.275 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2F)CC[NH2+]1 ZINC001246793066 1059096208 /nfs/dbraw/zinc/09/62/08/1059096208.db2.gz ALJGYBQAIHUFFT-WBAXXEDZSA-N 2 1 304.453 4.129 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCC[C@H]2c2cc(F)ccc2F)C[C@@H](CC)[NH2+]1 ZINC001246792146 1059097907 /nfs/dbraw/zinc/09/79/07/1059097907.db2.gz OBVIZPPCRGLPKY-CLCXKQKWSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2cc(F)ccc2F)C[C@@H](CC)[NH2+]1 ZINC001246792146 1059097925 /nfs/dbraw/zinc/09/79/25/1059097925.db2.gz OBVIZPPCRGLPKY-CLCXKQKWSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCSC[C@H]2c2ccccc2)C[C@H](CC)[NH2+]1 ZINC001246806683 1059100952 /nfs/dbraw/zinc/10/09/52/1059100952.db2.gz HREACBCWCHGTCT-RDGPPVDQSA-N 2 1 318.530 4.086 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246801066 1059101187 /nfs/dbraw/zinc/10/11/87/1059101187.db2.gz YLRZPJXTZFRXFA-YYWHXJBOSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246801066 1059101192 /nfs/dbraw/zinc/10/11/92/1059101192.db2.gz YLRZPJXTZFRXFA-YYWHXJBOSA-N 2 1 324.443 4.456 20 0 DIADMP C[C@@H]1CC([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)C[C@@H](C)[NH2+]1 ZINC001246807600 1059102891 /nfs/dbraw/zinc/10/28/91/1059102891.db2.gz SLJQWJOHIJVMRZ-YVHKJVDXSA-N 2 1 320.480 4.163 20 0 DIADMP Clc1ccccc1[C@H]1CC[N@H+]([C@@H]2CCC3(C2)CC[NH2+]CC3)C1 ZINC001246809334 1059105267 /nfs/dbraw/zinc/10/52/67/1059105267.db2.gz IDTAGIXHEBTXOB-JKSUJKDBSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+]([C@@H]2CCC3(C2)CC[NH2+]CC3)C1 ZINC001246809332 1059106385 /nfs/dbraw/zinc/10/63/85/1059106385.db2.gz IDTAGIXHEBTXOB-HZPDHXFCSA-N 2 1 318.892 4.052 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)C[C@H]1CC[NH2+]C1 ZINC001246815629 1059110507 /nfs/dbraw/zinc/11/05/07/1059110507.db2.gz ZSLKTKWIYKDCHU-OALUTQOASA-N 2 1 322.496 4.138 20 0 DIADMP C[N@@H+](CCc1ccccc1Cl)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246823178 1059111641 /nfs/dbraw/zinc/11/16/41/1059111641.db2.gz NAYFTUZMECTOJU-QGZVFWFLSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1ccc2c(c1)CC[N@@H+](C1CCC3(CC[NH2+]CC3)CC1)C2 ZINC001246834115 1059113874 /nfs/dbraw/zinc/11/38/74/1059113874.db2.gz DTPFZSVACPAQQM-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP CCCCCC1CCC([N@@H+](CCCOC)C2CC[NH2+]CC2)CC1 ZINC001246834610 1059115536 /nfs/dbraw/zinc/11/55/36/1059115536.db2.gz FKCPWUGTPYULNQ-UHFFFAOYSA-N 2 1 324.553 4.216 20 0 DIADMP Fc1cccc([C@@H]2CC[N@@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC001246836328 1059115811 /nfs/dbraw/zinc/11/58/11/1059115811.db2.gz XDXJTNGHTTWAOZ-HMXCVIKNSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1cccc([C@@H]2CC[N@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)c1 ZINC001246836328 1059115815 /nfs/dbraw/zinc/11/58/15/1059115815.db2.gz XDXJTNGHTTWAOZ-HMXCVIKNSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1cccc([C@H]2CC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)c1 ZINC001246833540 1059115984 /nfs/dbraw/zinc/11/59/84/1059115984.db2.gz LSCZYJSCTJCRMS-HKUYNNGSSA-N 2 1 316.464 4.070 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CCC[NH2+]CC1 ZINC001246841338 1059117593 /nfs/dbraw/zinc/11/75/93/1059117593.db2.gz BBOQDFJPKDABAH-GOSISDBHSA-N 2 1 310.441 4.053 20 0 DIADMP CC[N@H+](Cc1cccc(OC)c1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838714 1059117773 /nfs/dbraw/zinc/11/77/73/1059117773.db2.gz FEPATKHOFDXSJJ-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1cccc(OC)c1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838714 1059117782 /nfs/dbraw/zinc/11/77/82/1059117782.db2.gz FEPATKHOFDXSJJ-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@H+](Cc1ccc(F)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838434 1059119101 /nfs/dbraw/zinc/11/91/01/1059119101.db2.gz BVVNIHKRNGXUQX-VQTJNVASSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246838434 1059119113 /nfs/dbraw/zinc/11/91/13/1059119113.db2.gz BVVNIHKRNGXUQX-VQTJNVASSA-N 2 1 312.432 4.141 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCc3c(Cl)cccc3C2)C[C@H](CC)[NH2+]1 ZINC001246839374 1059120132 /nfs/dbraw/zinc/12/01/32/1059120132.db2.gz AHGVDXLNXAAAHV-MUJYYYPQSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCc3c(Cl)cccc3C2)C[C@H](CC)[NH2+]1 ZINC001246839374 1059120143 /nfs/dbraw/zinc/12/01/43/1059120143.db2.gz AHGVDXLNXAAAHV-MUJYYYPQSA-N 2 1 306.881 4.007 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2CCC(C(C)C)CC2)CC[NH2+]1 ZINC001246845518 1059122326 /nfs/dbraw/zinc/12/23/26/1059122326.db2.gz KOEZSURQURJVEG-QUCCMNQESA-N 2 1 318.480 4.295 20 0 DIADMP CCc1ccc(C[N@H+](C)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246845207 1059122421 /nfs/dbraw/zinc/12/24/21/1059122421.db2.gz LNGQNXAYUCBGBT-SFTDATJTSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246845207 1059122436 /nfs/dbraw/zinc/12/24/36/1059122436.db2.gz LNGQNXAYUCBGBT-SFTDATJTSA-N 2 1 308.469 4.174 20 0 DIADMP CC[N@H+](Cc1ccccc1F)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246843257 1059124333 /nfs/dbraw/zinc/12/43/33/1059124333.db2.gz BWRRSQAYFXFSNV-KRWDZBQOSA-N 2 1 304.453 4.103 20 0 DIADMP CC[N@@H+](Cc1ccccc1F)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246843257 1059124351 /nfs/dbraw/zinc/12/43/51/1059124351.db2.gz BWRRSQAYFXFSNV-KRWDZBQOSA-N 2 1 304.453 4.103 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246844668 1059125130 /nfs/dbraw/zinc/12/51/30/1059125130.db2.gz KCEDJMSHZRLEAR-AQNXPRMDSA-N 2 1 314.517 4.423 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246850177 1059127757 /nfs/dbraw/zinc/12/77/57/1059127757.db2.gz HNMVXIOUPNKNAQ-SFHVURJKSA-N 2 1 322.452 4.053 20 0 DIADMP C1C[N@H+]([C@H]2CC[NH2+]C3(CCCCC3)C2)C[C@H]1C1CCCCC1 ZINC001246847678 1059128277 /nfs/dbraw/zinc/12/82/77/1059128277.db2.gz KZFSYGSEJUGTSW-OALUTQOASA-N 2 1 304.522 4.344 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2CC[C@@]2([NH3+])C1 ZINC001246849759 1059128960 /nfs/dbraw/zinc/12/89/60/1059128960.db2.gz AYKCAYNDOYBYIO-NQSCKRDGSA-N 2 1 320.480 4.020 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246849906 1059129054 /nfs/dbraw/zinc/12/90/54/1059129054.db2.gz SJJCQLUZCBJSDJ-ZTFGCOKTSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246846478 1059129081 /nfs/dbraw/zinc/12/90/81/1059129081.db2.gz ALPNFBJCVCUJOK-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246848837 1059129621 /nfs/dbraw/zinc/12/96/21/1059129621.db2.gz YFZIQVDQJKBCLX-QZTJIDSGSA-N 2 1 306.881 4.084 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246854506 1059131119 /nfs/dbraw/zinc/13/11/19/1059131119.db2.gz VETXEIAKIQCLKJ-BWTSREIZSA-N 2 1 322.452 4.194 20 0 DIADMP FC1CC2(C1)CCC[N@@H+]([C@@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246853227 1059131655 /nfs/dbraw/zinc/13/16/55/1059131655.db2.gz LCWOKIDHOYTKPG-KAXARAQCSA-N 2 1 316.464 4.084 20 0 DIADMP FC1CC2(C1)CCC[N@H+]([C@@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246853227 1059131674 /nfs/dbraw/zinc/13/16/74/1059131674.db2.gz LCWOKIDHOYTKPG-KAXARAQCSA-N 2 1 316.464 4.084 20 0 DIADMP FC1CC2(C1)CCC[N@@H+]([C@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246853228 1059132502 /nfs/dbraw/zinc/13/25/02/1059132502.db2.gz LCWOKIDHOYTKPG-NUVZVAJJSA-N 2 1 316.464 4.084 20 0 DIADMP FC1CC2(C1)CCC[N@H+]([C@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246853228 1059132514 /nfs/dbraw/zinc/13/25/14/1059132514.db2.gz LCWOKIDHOYTKPG-NUVZVAJJSA-N 2 1 316.464 4.084 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852135 1059134219 /nfs/dbraw/zinc/13/42/19/1059134219.db2.gz MVXCMQBINYJGBB-JQHSSLGASA-N 2 1 320.908 4.296 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH+]2CC3(C2)CCCCC3)CC[NH2+]1 ZINC001246861053 1059135829 /nfs/dbraw/zinc/13/58/29/1059135829.db2.gz PXPKGMZNLGTRSG-IEBWSBKVSA-N 2 1 316.464 4.193 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246860758 1059135900 /nfs/dbraw/zinc/13/59/00/1059135900.db2.gz AVFPPWWSSZDIEM-FDFHNCONSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246860758 1059135907 /nfs/dbraw/zinc/13/59/07/1059135907.db2.gz AVFPPWWSSZDIEM-FDFHNCONSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc(C[N@H+](C2CC2)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246861095 1059136567 /nfs/dbraw/zinc/13/65/67/1059136567.db2.gz QLRCYWJILKPGAF-LEWJYISDSA-N 2 1 306.453 4.144 20 0 DIADMP c1ccc(C[N@@H+](C2CC2)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246861095 1059136586 /nfs/dbraw/zinc/13/65/86/1059136586.db2.gz QLRCYWJILKPGAF-LEWJYISDSA-N 2 1 306.453 4.144 20 0 DIADMP CC1(C)CCC[C@H]([N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)C1 ZINC001246859904 1059137801 /nfs/dbraw/zinc/13/78/01/1059137801.db2.gz LRTOOFSWKDCASG-SFHVURJKSA-N 2 1 312.501 4.092 20 0 DIADMP c1ccc(C[N@H+](C2CC2)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246861097 1059137910 /nfs/dbraw/zinc/13/79/10/1059137910.db2.gz QLRCYWJILKPGAF-RTWAWAEBSA-N 2 1 306.453 4.144 20 0 DIADMP c1ccc(C[N@@H+](C2CC2)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246861097 1059137927 /nfs/dbraw/zinc/13/79/27/1059137927.db2.gz QLRCYWJILKPGAF-RTWAWAEBSA-N 2 1 306.453 4.144 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246860754 1059138148 /nfs/dbraw/zinc/13/81/48/1059138148.db2.gz AVFPPWWSSZDIEM-BHDDXSALSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246860754 1059138168 /nfs/dbraw/zinc/13/81/68/1059138168.db2.gz AVFPPWWSSZDIEM-BHDDXSALSA-N 2 1 320.480 4.359 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246865041 1059138409 /nfs/dbraw/zinc/13/84/09/1059138409.db2.gz XPMPEKSSVKISLW-HKUYNNGSSA-N 2 1 314.517 4.338 20 0 DIADMP CCCC(CCC)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246862066 1059138729 /nfs/dbraw/zinc/13/87/29/1059138729.db2.gz PSBDTYQNEDOWTP-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP CC1(C)C[N@H+](C2CCC3(CCC[NH2+]C3)CC2)Cc2ccccc21 ZINC001246871102 1059141075 /nfs/dbraw/zinc/14/10/75/1059141075.db2.gz NXMCEWFFSWYFAX-UHFFFAOYSA-N 2 1 312.501 4.092 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2Cc3ccccc3C(C)(C)C2)CC[NH2+]1 ZINC001246869013 1059141661 /nfs/dbraw/zinc/14/16/61/1059141661.db2.gz DVLQSJISVYXJEW-QZTJIDSGSA-N 2 1 300.490 4.091 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@H+]2Cc3ccccc3C(C)(C)C2)CC[NH2+]1 ZINC001246869014 1059143403 /nfs/dbraw/zinc/14/34/03/1059143403.db2.gz DVLQSJISVYXJEW-ROUUACIJSA-N 2 1 300.490 4.091 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCc3ccccc3[C@H]2CC)C[C@@H](CC)[NH2+]1 ZINC001246868236 1059143477 /nfs/dbraw/zinc/14/34/77/1059143477.db2.gz RIEDDWLDQZMSCK-MBOZVWFJSA-N 2 1 300.490 4.305 20 0 DIADMP CC[N@H+](Cc1ccc(OC)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246876077 1059145134 /nfs/dbraw/zinc/14/51/34/1059145134.db2.gz AQZOWKLBRXPDNM-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246876077 1059145144 /nfs/dbraw/zinc/14/51/44/1059145144.db2.gz AQZOWKLBRXPDNM-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCc3cccc(Cl)c3C2)C[C@@H](CC)[NH2+]1 ZINC001246876111 1059145243 /nfs/dbraw/zinc/14/52/43/1059145243.db2.gz YQOACUSXYZXVGW-HUUCEWRRSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCc3cccc(Cl)c3C2)C[C@@H](CC)[NH2+]1 ZINC001246876111 1059145253 /nfs/dbraw/zinc/14/52/53/1059145253.db2.gz YQOACUSXYZXVGW-HUUCEWRRSA-N 2 1 306.881 4.007 20 0 DIADMP CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246882783 1059147979 /nfs/dbraw/zinc/14/79/79/1059147979.db2.gz NYNAEHLRBURXCH-SWLSCSKDSA-N 2 1 315.288 4.344 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[NH2+][C@@H](C)C1 ZINC001246882783 1059147991 /nfs/dbraw/zinc/14/79/91/1059147991.db2.gz NYNAEHLRBURXCH-SWLSCSKDSA-N 2 1 315.288 4.344 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884563 1059149081 /nfs/dbraw/zinc/14/90/81/1059149081.db2.gz BLJZKEGRAWTCTQ-RCJHGTSTSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884563 1059149099 /nfs/dbraw/zinc/14/90/99/1059149099.db2.gz BLJZKEGRAWTCTQ-RCJHGTSTSA-N 2 1 322.443 4.411 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c(F)c1 ZINC001246884392 1059150392 /nfs/dbraw/zinc/15/03/92/1059150392.db2.gz AOFJZXVKLXRBCH-SNRMKQJTSA-N 2 1 320.427 4.024 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2C(C)C)CCN1 ZINC001246885261 1059150771 /nfs/dbraw/zinc/15/07/71/1059150771.db2.gz DFXUFUCCJMOMJN-WDSOQIARSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2C(C)C)CC[NH2+]1 ZINC001246885261 1059150780 /nfs/dbraw/zinc/15/07/80/1059150780.db2.gz DFXUFUCCJMOMJN-WDSOQIARSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2C(C)C)CC[NH2+]1 ZINC001246885261 1059150787 /nfs/dbraw/zinc/15/07/87/1059150787.db2.gz DFXUFUCCJMOMJN-WDSOQIARSA-N 2 1 304.453 4.048 20 0 DIADMP C[N@H+]([C@H]1CC[NH2+][C@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892842 1059152154 /nfs/dbraw/zinc/15/21/54/1059152154.db2.gz OJVJPKALBYWRCP-SFTDATJTSA-N 2 1 322.496 4.433 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+][C@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892842 1059152161 /nfs/dbraw/zinc/15/21/61/1059152161.db2.gz OJVJPKALBYWRCP-SFTDATJTSA-N 2 1 322.496 4.433 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246890228 1059153271 /nfs/dbraw/zinc/15/32/71/1059153271.db2.gz SOQXPUGPXDTBJI-RDJZCZTQSA-N 2 1 316.514 4.220 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](CCC)C1CC[NH2+]CC1 ZINC001246892358 1059153474 /nfs/dbraw/zinc/15/34/74/1059153474.db2.gz BOEOIBSWZZITDP-FQEVSTJZSA-N 2 1 302.506 4.252 20 0 DIADMP CC[C@@H]1CC([N@@H+](C)C(C)(C)Cc2ccccc2)C[C@@H](CC)[NH2+]1 ZINC001246892938 1059154152 /nfs/dbraw/zinc/15/41/52/1059154152.db2.gz PKWIMSWOHAIJGO-QZTJIDSGSA-N 2 1 302.506 4.249 20 0 DIADMP CC[C@H]1CC([N@H+]2CCC[C@@H]2c2cccc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246894977 1059158246 /nfs/dbraw/zinc/15/82/46/1059158246.db2.gz CZXHNJUJWBJAJH-JENIJYKNSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2c[nH]c3ccccc32)CC[NH2+]1 ZINC001246899003 1059158869 /nfs/dbraw/zinc/15/88/69/1059158869.db2.gz BUNSYOPGKFYJTI-YSSFQJQWSA-N 2 1 311.473 4.081 20 0 DIADMP C[N@@H+](C1CCC2(CCC[NH2+]C2)CC1)C(C)(C)Cc1ccccc1 ZINC001246895950 1059159153 /nfs/dbraw/zinc/15/91/53/1059159153.db2.gz YYBVOVTWKFEKJP-UHFFFAOYSA-N 2 1 314.517 4.252 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246896716 1059159192 /nfs/dbraw/zinc/15/91/92/1059159192.db2.gz ZSZVJMZWFKDXPQ-RTWAWAEBSA-N 2 1 308.469 4.194 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246900384 1059160136 /nfs/dbraw/zinc/16/01/36/1059160136.db2.gz IFALTAXKBUEWOS-TYCQWZJGSA-N 2 1 323.484 4.227 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)C(C)(C)Cc1ccccc1 ZINC001246895766 1059160187 /nfs/dbraw/zinc/16/01/87/1059160187.db2.gz YANVJHZBEJENOJ-MSOLQXFVSA-N 2 1 302.506 4.106 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](CCC)C1CC[NH2+]CC1 ZINC001246897451 1059160527 /nfs/dbraw/zinc/16/05/27/1059160527.db2.gz KIRJIJWRKLFEAL-LJQANCHMSA-N 2 1 302.506 4.252 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246903955 1059162635 /nfs/dbraw/zinc/16/26/35/1059162635.db2.gz ZXIPXALROWCXFA-ZWVUXNTGSA-N 2 1 323.484 4.227 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@H+]3CCSc4ccccc4C3)CCN2)cc1 ZINC001246904844 1059163590 /nfs/dbraw/zinc/16/35/90/1059163590.db2.gz JHZQJIVWAYOSLK-OALUTQOASA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@@H]2C[C@@H](N3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904844 1059163605 /nfs/dbraw/zinc/16/36/05/1059163605.db2.gz JHZQJIVWAYOSLK-OALUTQOASA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904844 1059163616 /nfs/dbraw/zinc/16/36/16/1059163616.db2.gz JHZQJIVWAYOSLK-OALUTQOASA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904844 1059163626 /nfs/dbraw/zinc/16/36/26/1059163626.db2.gz JHZQJIVWAYOSLK-OALUTQOASA-N 2 1 324.493 4.088 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246903011 1059164138 /nfs/dbraw/zinc/16/41/38/1059164138.db2.gz HIIACMCBBLFICQ-MSOLQXFVSA-N 2 1 306.881 4.084 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246903557 1059164254 /nfs/dbraw/zinc/16/42/54/1059164254.db2.gz ZBFDOGSYNGMNJE-OXJNMPFZSA-N 2 1 323.484 4.227 20 0 DIADMP Fc1cccc(F)c1[C@@H]1CCC[N@H+]1[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246902756 1059164744 /nfs/dbraw/zinc/16/47/44/1059164744.db2.gz UIDIRYKGOATXOK-DKSSEZFCSA-N 2 1 320.427 4.024 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@@H](Cc3ccccc3)C2)cc1C ZINC001246907073 1059167849 /nfs/dbraw/zinc/16/78/49/1059167849.db2.gz HZFSLVHFTWTIAI-FCHUYYIVSA-N 2 1 322.496 4.099 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246907122 1059167969 /nfs/dbraw/zinc/16/79/69/1059167969.db2.gz IKZNBPWAZDITHN-IBGZPJMESA-N 2 1 300.490 4.048 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@H]2CC[NH2+]C3(CCCCC3)C2)cc1C ZINC001246906661 1059168055 /nfs/dbraw/zinc/16/80/55/1059168055.db2.gz FVGDEKFEOZRENB-IBGZPJMESA-N 2 1 300.490 4.190 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905960 1059168580 /nfs/dbraw/zinc/16/85/80/1059168580.db2.gz PCMOJTXDMHVNGQ-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246905960 1059168589 /nfs/dbraw/zinc/16/85/89/1059168589.db2.gz PCMOJTXDMHVNGQ-WMZOPIPTSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246911377 1059170986 /nfs/dbraw/zinc/17/09/86/1059170986.db2.gz PKWJHHCUEFKWGK-BZUAXINKSA-N 2 1 324.534 4.272 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1C[C@@H](C)[NH2+][C@H](C)C1 ZINC001246909063 1059171515 /nfs/dbraw/zinc/17/15/15/1059171515.db2.gz ZDHXOBHPEUSVDD-CHWSQXEVSA-N 2 1 314.395 4.056 20 0 DIADMP CCC[N@H+](CC(C)C)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246910727 1059171703 /nfs/dbraw/zinc/17/17/03/1059171703.db2.gz KTVUSIQEUHVMIK-IEBWSBKVSA-N 2 1 306.469 4.295 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246910727 1059171709 /nfs/dbraw/zinc/17/17/09/1059171709.db2.gz KTVUSIQEUHVMIK-IEBWSBKVSA-N 2 1 306.469 4.295 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246910463 1059171863 /nfs/dbraw/zinc/17/18/63/1059171863.db2.gz UBSONXRETLPHIS-CABCVRRESA-N 2 1 306.881 4.255 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccccc2)C2CCC3(CC3)CC2)CC1 ZINC001246911001 1059172079 /nfs/dbraw/zinc/17/20/79/1059172079.db2.gz OVVAEIQEMMPJDA-UHFFFAOYSA-N 2 1 312.501 4.481 20 0 DIADMP C[C@@H]1CC([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C[C@@H](C)C1 ZINC001246912154 1059174172 /nfs/dbraw/zinc/17/41/72/1059174172.db2.gz DMJDENTWDFHKKT-IRXDYDNUSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+](C)[C@H]1CCCC[C@H]1[NH3+] ZINC001246916480 1059177046 /nfs/dbraw/zinc/17/70/46/1059177046.db2.gz HYXFHMPPGPXWFP-WQVCFCJDSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)[C@H]1CCCC[C@H]1[NH3+] ZINC001246916480 1059177057 /nfs/dbraw/zinc/17/70/57/1059177057.db2.gz HYXFHMPPGPXWFP-WQVCFCJDSA-N 2 1 312.910 4.022 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246917768 1059177895 /nfs/dbraw/zinc/17/78/95/1059177895.db2.gz XIIZDQDIIXZJQN-OAHLLOKOSA-N 2 1 314.395 4.058 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932141 1059181475 /nfs/dbraw/zinc/18/14/75/1059181475.db2.gz FIKCSNOFFDOURJ-DLBZAZTESA-N 2 1 318.480 4.001 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932815 1059181587 /nfs/dbraw/zinc/18/15/87/1059181587.db2.gz HLDWZDGNGHLCNY-SJLPKXTDSA-N 2 1 318.480 4.001 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246937952 1059184258 /nfs/dbraw/zinc/18/42/58/1059184258.db2.gz KLYUVNGMXUGAPN-LNLFQRSKSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246937952 1059184264 /nfs/dbraw/zinc/18/42/64/1059184264.db2.gz KLYUVNGMXUGAPN-LNLFQRSKSA-N 2 1 304.453 4.192 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246934939 1059184375 /nfs/dbraw/zinc/18/43/75/1059184375.db2.gz DCXXALPSLYGNLR-JKSUJKDBSA-N 2 1 312.567 4.151 20 0 DIADMP Fc1cccc(C[N@@H+](C2CC[NH2+]CC2)C2CCC3(CC3)CC2)c1 ZINC001246935262 1059185617 /nfs/dbraw/zinc/18/56/17/1059185617.db2.gz GDIRVQDNWWTTKU-UHFFFAOYSA-N 2 1 316.464 4.103 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@H]([NH3+])[C@@H]1C ZINC001246937970 1059186150 /nfs/dbraw/zinc/18/61/50/1059186150.db2.gz KSCXNKAGXSDCGD-WQGACYEGSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H]([NH3+])[C@@H]1C ZINC001246937970 1059186168 /nfs/dbraw/zinc/18/61/68/1059186168.db2.gz KSCXNKAGXSDCGD-WQGACYEGSA-N 2 1 315.288 4.126 20 0 DIADMP Fc1cccc(C[N@@H+](C2CC[NH2+]CC2)C2CCCCCCC2)c1 ZINC001246943701 1059189424 /nfs/dbraw/zinc/18/94/24/1059189424.db2.gz RYYAMRKWRGURHP-UHFFFAOYSA-N 2 1 318.480 4.493 20 0 DIADMP CCC[C@H](C)CC[C@@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246950259 1059195480 /nfs/dbraw/zinc/19/54/80/1059195480.db2.gz FPFUURZXLRRBNC-ZWKOTPCHSA-N 2 1 317.521 4.241 20 0 DIADMP CCc1ccc(C[C@@H](C)[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001246949822 1059195881 /nfs/dbraw/zinc/19/58/81/1059195881.db2.gz LXPDLSPRTRZLLH-QGZVFWFLSA-N 2 1 316.533 4.280 20 0 DIADMP Cc1cc(F)cc(C[N@@H+]([C@H]2CCC(C)(C)C2)C2CC[NH2+]CC2)c1 ZINC001246952790 1059198398 /nfs/dbraw/zinc/19/83/98/1059198398.db2.gz VVMUSCHNOAPLBE-IBGZPJMESA-N 2 1 318.480 4.267 20 0 DIADMP CC1(C)CC[C@@H]([N@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955935 1059198605 /nfs/dbraw/zinc/19/86/05/1059198605.db2.gz OCIGLISJIDQRNI-QGZVFWFLSA-N 2 1 322.443 4.098 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955935 1059198611 /nfs/dbraw/zinc/19/86/11/1059198611.db2.gz OCIGLISJIDQRNI-QGZVFWFLSA-N 2 1 322.443 4.098 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccc(F)c(F)c2)C2CC[NH2+]CC2)C1 ZINC001246954865 1059199651 /nfs/dbraw/zinc/19/96/51/1059199651.db2.gz JFGZZHGNXPVSJX-MRXNPFEDSA-N 2 1 322.443 4.098 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+]([C@H]1CCC(C)(C)C1)C1CC[NH2+]CC1 ZINC001246961343 1059206735 /nfs/dbraw/zinc/20/67/35/1059206735.db2.gz QWAUUTCBWHYMSC-IBGZPJMESA-N 2 1 318.480 4.267 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CC[NH2+]CC1)C1CCCCCC1 ZINC001246958734 1059207499 /nfs/dbraw/zinc/20/74/99/1059207499.db2.gz GPDKPQTYHYOYCI-UHFFFAOYSA-N 2 1 318.480 4.411 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001246963795 1059208421 /nfs/dbraw/zinc/20/84/21/1059208421.db2.gz ZAKRSCIAYZXKHS-MRXNPFEDSA-N 2 1 306.469 4.267 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246964068 1059208758 /nfs/dbraw/zinc/20/87/58/1059208758.db2.gz KRJRAVZRWSPDCB-WDSOQIARSA-N 2 1 318.505 4.346 20 0 DIADMP Fc1cccc(F)c1C[N@H+](C1CC[NH2+]CC1)C1CCCCCC1 ZINC001246965141 1059209705 /nfs/dbraw/zinc/20/97/05/1059209705.db2.gz NTEVGQKMJSEUNS-UHFFFAOYSA-N 2 1 322.443 4.242 20 0 DIADMP Fc1cccc(F)c1C[N@@H+](C1CC[NH2+]CC1)C1CCCCCC1 ZINC001246965141 1059209718 /nfs/dbraw/zinc/20/97/18/1059209718.db2.gz NTEVGQKMJSEUNS-UHFFFAOYSA-N 2 1 322.443 4.242 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246964708 1059210095 /nfs/dbraw/zinc/21/00/95/1059210095.db2.gz MILVRNKAZHWTAN-CDHQVMDDSA-N 2 1 318.480 4.129 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2CC[NH2+][C@@H](C(C)(C)C)C2)c1C ZINC001246970202 1059210774 /nfs/dbraw/zinc/21/07/74/1059210774.db2.gz XYUWFIRFHYMXGK-WOJBJXKFSA-N 2 1 314.517 4.435 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)C2CCC3(CC[NH2+]C3)CC2)c1C ZINC001246966603 1059211352 /nfs/dbraw/zinc/21/13/52/1059211352.db2.gz KWZRWDGPNFFLHT-UHFFFAOYSA-N 2 1 312.501 4.190 20 0 DIADMP CCCCCC[C@@H](CCCC)[N@H+]1CC[C@H](N2CCC([NH3+])CC2)C1 ZINC001246974910 1059215393 /nfs/dbraw/zinc/21/53/93/1059215393.db2.gz KSADHNCMCMOXIA-UXHICEINSA-N 2 1 323.569 4.013 20 0 DIADMP CCC(CC)[N@@H+]([C@H](C)c1ccccc1)[C@@H]1CSC2(C[NH2+]C2)C1 ZINC001246976157 1059215852 /nfs/dbraw/zinc/21/58/52/1059215852.db2.gz YFVMSCIJYRGKFW-QAPCUYQASA-N 2 1 318.530 4.086 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CC[NH2+][C@H](C)C1 ZINC001246975271 1059217268 /nfs/dbraw/zinc/21/72/68/1059217268.db2.gz BNSDPRXJMGOJIA-HOJAQTOUSA-N 2 1 302.506 4.250 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001246976231 1059218141 /nfs/dbraw/zinc/21/81/41/1059218141.db2.gz VUIHINPCICEDHR-PZJWPPBQSA-N 2 1 314.517 4.108 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@@H+](C2CCC2)C2CC[NH2+]CC2)cc1 ZINC001246974231 1059219234 /nfs/dbraw/zinc/21/92/34/1059219234.db2.gz JPPOEOPVYLHYJQ-INIZCTEOSA-N 2 1 318.530 4.082 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246976362 1059220653 /nfs/dbraw/zinc/22/06/53/1059220653.db2.gz ZQKSVQJSJLSIOK-PKOBYXMFSA-N 2 1 300.490 4.380 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@@H+](C3CCC3)C3CC[NH2+]CC3)C2)cc1 ZINC001246978415 1059223218 /nfs/dbraw/zinc/22/32/18/1059223218.db2.gz UEGPWYCQJORWOW-WIYYLYMNSA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc([C@H]2CCC[C@@H]([N@@H+](C3CCC3)C3CC[NH2+]CC3)C2)cc1 ZINC001246978412 1059223698 /nfs/dbraw/zinc/22/36/98/1059223698.db2.gz UEGPWYCQJORWOW-GHTZIAJQSA-N 2 1 312.501 4.319 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]12 ZINC001246978244 1059223798 /nfs/dbraw/zinc/22/37/98/1059223798.db2.gz VRGQSJYZUWZMBG-KYZWJYDRSA-N 2 1 318.892 4.035 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246998178 1059226378 /nfs/dbraw/zinc/22/63/78/1059226378.db2.gz BALAGPVWKNZMPJ-WCIQWLHISA-N 2 1 318.480 4.142 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984388 1059228627 /nfs/dbraw/zinc/22/86/27/1059228627.db2.gz FKXIYMJDQZDKPI-HOTGVXAUSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984388 1059228646 /nfs/dbraw/zinc/22/86/46/1059228646.db2.gz FKXIYMJDQZDKPI-HOTGVXAUSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984387 1059229596 /nfs/dbraw/zinc/22/95/96/1059229596.db2.gz FKXIYMJDQZDKPI-CVEARBPZSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984387 1059229615 /nfs/dbraw/zinc/22/96/15/1059229615.db2.gz FKXIYMJDQZDKPI-CVEARBPZSA-N 2 1 315.288 4.202 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)cc1 ZINC001246999802 1059230156 /nfs/dbraw/zinc/23/01/56/1059230156.db2.gz BWWKSMBQBKMLAK-GOSISDBHSA-N 2 1 320.480 4.021 20 0 DIADMP Cc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001247001762 1059233393 /nfs/dbraw/zinc/23/33/93/1059233393.db2.gz KZIDPIJCQCPCJL-UHOSZYNNSA-N 2 1 300.490 4.299 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247015288 1059244703 /nfs/dbraw/zinc/24/47/03/1059244703.db2.gz OBIBUYOZVYAWOR-SJLPKXTDSA-N 2 1 300.490 4.296 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC(C)(C)C1 ZINC001247016350 1059246322 /nfs/dbraw/zinc/24/63/22/1059246322.db2.gz UBYNXCGUWQAMRL-WMZOPIPTSA-N 2 1 312.501 4.296 20 0 DIADMP CC[N@H+](CC[C@H]1CCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492935 1059271176 /nfs/dbraw/zinc/27/11/76/1059271176.db2.gz JWOGWFAVMRDFNN-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP CC[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492935 1059271196 /nfs/dbraw/zinc/27/11/96/1059271196.db2.gz JWOGWFAVMRDFNN-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492935 1059271221 /nfs/dbraw/zinc/27/12/21/1059271221.db2.gz JWOGWFAVMRDFNN-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@H+]1C)Cc1ccc(Cl)c(Cl)c1 ZINC001559492935 1059271241 /nfs/dbraw/zinc/27/12/41/1059271241.db2.gz JWOGWFAVMRDFNN-CQSZACIVSA-N 2 1 315.288 4.300 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cs1 ZINC001559509042 1059304124 /nfs/dbraw/zinc/30/41/24/1059304124.db2.gz OAUXZTUCQJIHHX-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cs1 ZINC001559509042 1059304147 /nfs/dbraw/zinc/30/41/47/1059304147.db2.gz OAUXZTUCQJIHHX-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001559524832 1059321143 /nfs/dbraw/zinc/32/11/43/1059321143.db2.gz RNMIFPCLJNKMKG-SJORKVTESA-N 2 1 316.480 4.256 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)C1 ZINC001559545854 1059347497 /nfs/dbraw/zinc/34/74/97/1059347497.db2.gz ICBHBCBBZJJBMR-FUMNGEBKSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)C1 ZINC001559545854 1059347509 /nfs/dbraw/zinc/34/75/09/1059347509.db2.gz ICBHBCBBZJJBMR-FUMNGEBKSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)C1 ZINC001559545854 1059347525 /nfs/dbraw/zinc/34/75/25/1059347525.db2.gz ICBHBCBBZJJBMR-FUMNGEBKSA-N 2 1 306.538 4.399 20 0 DIADMP C[N@H+](CCc1ccc2ccccc2c1)CC[C@H]1CCCC[NH+]1C ZINC001559567566 1059390286 /nfs/dbraw/zinc/39/02/86/1059390286.db2.gz FRVWYACUWGLMHL-OAQYLSRUSA-N 2 1 310.485 4.189 20 0 DIADMP C[NH+](CCc1ccc2ccccc2c1)CC[C@H]1CCCC[N@@H+]1C ZINC001559567566 1059390310 /nfs/dbraw/zinc/39/03/10/1059390310.db2.gz FRVWYACUWGLMHL-OAQYLSRUSA-N 2 1 310.485 4.189 20 0 DIADMP C[NH+](CCc1ccc2ccccc2c1)CC[C@H]1CCCC[N@H+]1C ZINC001559567566 1059390333 /nfs/dbraw/zinc/39/03/33/1059390333.db2.gz FRVWYACUWGLMHL-OAQYLSRUSA-N 2 1 310.485 4.189 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568202 1059396512 /nfs/dbraw/zinc/39/65/12/1059396512.db2.gz RXRCPWMVKVFXCN-MJGOQNOKSA-N 2 1 318.505 4.491 20 0 DIADMP CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568202 1059396530 /nfs/dbraw/zinc/39/65/30/1059396530.db2.gz RXRCPWMVKVFXCN-MJGOQNOKSA-N 2 1 318.505 4.491 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001559568101 1059396966 /nfs/dbraw/zinc/39/69/66/1059396966.db2.gz QGRPBIJGDMKMIL-SFHVURJKSA-N 2 1 318.505 4.028 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001559568101 1059396988 /nfs/dbraw/zinc/39/69/88/1059396988.db2.gz QGRPBIJGDMKMIL-SFHVURJKSA-N 2 1 318.505 4.028 20 0 DIADMP C[C@H](CCSc1ccccc1)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC001559568553 1059398831 /nfs/dbraw/zinc/39/88/31/1059398831.db2.gz ZQECWUJTIONOKJ-QZTJIDSGSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@H](CCSc1ccccc1)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC001559568553 1059398851 /nfs/dbraw/zinc/39/88/51/1059398851.db2.gz ZQECWUJTIONOKJ-QZTJIDSGSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@H](CCSc1ccccc1)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC001559568553 1059398873 /nfs/dbraw/zinc/39/88/73/1059398873.db2.gz ZQECWUJTIONOKJ-QZTJIDSGSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@H]1C[C@H](c2ccccc2F)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573238 1059405484 /nfs/dbraw/zinc/40/54/84/1059405484.db2.gz ADPAISJPGJESIU-QFBILLFUSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@H]1C[C@H](c2ccccc2F)[N@@H+](CCC[NH+]2CCCCC2)C1 ZINC001559573238 1059405489 /nfs/dbraw/zinc/40/54/89/1059405489.db2.gz ADPAISJPGJESIU-QFBILLFUSA-N 2 1 304.453 4.085 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)C[C@H]1C ZINC001559584394 1059419948 /nfs/dbraw/zinc/41/99/48/1059419948.db2.gz KVCHGKHHDCPBGA-VQIMIIECSA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@H]1C ZINC001559584394 1059419955 /nfs/dbraw/zinc/41/99/55/1059419955.db2.gz KVCHGKHHDCPBGA-VQIMIIECSA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@H]1C ZINC001559584394 1059419969 /nfs/dbraw/zinc/41/99/69/1059419969.db2.gz KVCHGKHHDCPBGA-VQIMIIECSA-N 2 1 302.506 4.289 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC001559594118 1059429918 /nfs/dbraw/zinc/42/99/18/1059429918.db2.gz JKNMWNGOGKIIGM-UGKGYDQZSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC001559594118 1059429931 /nfs/dbraw/zinc/42/99/31/1059429931.db2.gz JKNMWNGOGKIIGM-UGKGYDQZSA-N 2 1 322.496 4.318 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC001559594118 1059429936 /nfs/dbraw/zinc/42/99/36/1059429936.db2.gz JKNMWNGOGKIIGM-UGKGYDQZSA-N 2 1 322.496 4.318 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCCC(C)(F)F)CC1 ZINC001559596602 1059432094 /nfs/dbraw/zinc/43/20/94/1059432094.db2.gz WLLXFOYHCSUUSV-MRXNPFEDSA-N 2 1 316.480 4.398 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(OC(C)(C)C)c2)[C@H](C)C1 ZINC001559600774 1059434528 /nfs/dbraw/zinc/43/45/28/1059434528.db2.gz HCHPYRMYCXQWFX-VQIMIIECSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@H](C)C1 ZINC001559600774 1059434547 /nfs/dbraw/zinc/43/45/47/1059434547.db2.gz HCHPYRMYCXQWFX-VQIMIIECSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@H](C)C1 ZINC001559600774 1059434557 /nfs/dbraw/zinc/43/45/57/1059434557.db2.gz HCHPYRMYCXQWFX-VQIMIIECSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(OC(C)(C)C)c2)[C@@H](C)C1 ZINC001559600773 1059435630 /nfs/dbraw/zinc/43/56/30/1059435630.db2.gz HCHPYRMYCXQWFX-QFBILLFUSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@@H](C)C1 ZINC001559600773 1059435636 /nfs/dbraw/zinc/43/56/36/1059435636.db2.gz HCHPYRMYCXQWFX-QFBILLFUSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@@H](C)C1 ZINC001559600773 1059435644 /nfs/dbraw/zinc/43/56/44/1059435644.db2.gz HCHPYRMYCXQWFX-QFBILLFUSA-N 2 1 318.505 4.026 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737193 1059569201 /nfs/dbraw/zinc/56/92/01/1059569201.db2.gz GGUGCAGRLYZEHF-CVEARBPZSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737193 1059569218 /nfs/dbraw/zinc/56/92/18/1059569218.db2.gz GGUGCAGRLYZEHF-CVEARBPZSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737194 1059570231 /nfs/dbraw/zinc/57/02/31/1059570231.db2.gz GGUGCAGRLYZEHF-HOTGVXAUSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737194 1059570249 /nfs/dbraw/zinc/57/02/49/1059570249.db2.gz GGUGCAGRLYZEHF-HOTGVXAUSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737196 1059571578 /nfs/dbraw/zinc/57/15/78/1059571578.db2.gz GGUGCAGRLYZEHF-JKSUJKDBSA-N 2 1 320.908 4.391 20 0 DIADMP Cc1cccc(Cl)c1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737196 1059571598 /nfs/dbraw/zinc/57/15/98/1059571598.db2.gz GGUGCAGRLYZEHF-JKSUJKDBSA-N 2 1 320.908 4.391 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC12CCC(CC1)C2 ZINC001559775105 1059613485 /nfs/dbraw/zinc/61/34/85/1059613485.db2.gz HWTBCUGIQWZCLI-KJJOEJEFSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CCC2=CCCCC2)CC1 ZINC001559792789 1059628192 /nfs/dbraw/zinc/62/81/92/1059628192.db2.gz TZVYNCWLMTXSTB-UHFFFAOYSA-N 2 1 300.446 4.124 20 0 DIADMP CCCCCC[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001559829289 1059660922 /nfs/dbraw/zinc/66/09/22/1059660922.db2.gz PRLIMFXTCXDOEB-FQEVSTJZSA-N 2 1 300.490 4.165 20 0 DIADMP CCCCCC[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001559829289 1059660932 /nfs/dbraw/zinc/66/09/32/1059660932.db2.gz PRLIMFXTCXDOEB-FQEVSTJZSA-N 2 1 300.490 4.165 20 0 DIADMP CCCCCC[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001559829289 1059660947 /nfs/dbraw/zinc/66/09/47/1059660947.db2.gz PRLIMFXTCXDOEB-FQEVSTJZSA-N 2 1 300.490 4.165 20 0 DIADMP CCc1ccc(CC[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC001559853335 1059676409 /nfs/dbraw/zinc/67/64/09/1059676409.db2.gz YBHIGTUOZATRNZ-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP c1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3C3CC3)CC2)cc1 ZINC001559853107 1059676678 /nfs/dbraw/zinc/67/66/78/1059676678.db2.gz OOROHUXRCFFYIA-UHFFFAOYSA-N 2 1 320.480 4.318 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@]1(C)C[NH+](CC1CCCC1)C2 ZINC001560072938 1059888781 /nfs/dbraw/zinc/88/87/81/1059888781.db2.gz WZRCGPWMFWTWOD-SFTDATJTSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC(C)([NH+](C)C)CC1 ZINC001560071318 1059889979 /nfs/dbraw/zinc/88/99/79/1059889979.db2.gz GHHGIYNDVQKFQW-INIZCTEOSA-N 2 1 302.506 4.461 20 0 DIADMP CC(C)C[N@@H+](CCCc1cccc(F)c1)CC1CC[NH+](C)CC1 ZINC001560090833 1059900285 /nfs/dbraw/zinc/90/02/85/1059900285.db2.gz NKTMCKWMJAAKTM-UHFFFAOYSA-N 2 1 320.496 4.058 20 0 DIADMP CC(C)Oc1cccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)c1 ZINC001560100500 1059905264 /nfs/dbraw/zinc/90/52/64/1059905264.db2.gz NEUGXDIAQPKHOL-UHFFFAOYSA-N 2 1 318.505 4.172 20 0 DIADMP C[C@H](c1c(F)cccc1F)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC001560099445 1059907372 /nfs/dbraw/zinc/90/73/72/1059907372.db2.gz LKXNYZXLRUBHCB-OAHLLOKOSA-N 2 1 310.432 4.224 20 0 DIADMP C[C@H](c1c(F)cccc1F)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001560099445 1059907394 /nfs/dbraw/zinc/90/73/94/1059907394.db2.gz LKXNYZXLRUBHCB-OAHLLOKOSA-N 2 1 310.432 4.224 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](CCCc2ccsc2)CC1 ZINC001560106766 1059916671 /nfs/dbraw/zinc/91/66/71/1059916671.db2.gz CYCABRMFGMANEF-UHFFFAOYSA-N 2 1 320.546 4.411 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)C1(Cc2ccccc2)CCCC1 ZINC001560122648 1059927399 /nfs/dbraw/zinc/92/73/99/1059927399.db2.gz CQOTXWFMSVPURJ-UHFFFAOYSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)C1(Cc2ccccc2)CCCC1 ZINC001560122648 1059927420 /nfs/dbraw/zinc/92/74/20/1059927420.db2.gz CQOTXWFMSVPURJ-UHFFFAOYSA-N 2 1 311.473 4.069 20 0 DIADMP CC(C)CCC[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001560266230 1060037373 /nfs/dbraw/zinc/03/73/73/1060037373.db2.gz UGOLQMLFFHKHAH-GOSISDBHSA-N 2 1 302.506 4.444 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)c1 ZINC001560347660 1060133700 /nfs/dbraw/zinc/13/37/00/1060133700.db2.gz UKGJINBIEYBVJM-IRXDYDNUSA-N 2 1 302.506 4.441 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(C(C)C)c2)C1 ZINC001560406502 1060191285 /nfs/dbraw/zinc/19/12/85/1060191285.db2.gz IULDCTQWAAYUTI-IBGZPJMESA-N 2 1 302.506 4.268 20 0 DIADMP CCc1cccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001560418390 1060202241 /nfs/dbraw/zinc/20/22/41/1060202241.db2.gz LLWWTACPDANILN-AVRDEDQJSA-N 2 1 322.496 4.249 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001560435567 1060222719 /nfs/dbraw/zinc/22/27/19/1060222719.db2.gz TYGHDVKKVGCCMR-OALUTQOASA-N 2 1 314.517 4.354 20 0 DIADMP CCSc1ccccc1C[N@@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001249439483 1060253796 /nfs/dbraw/zinc/25/37/96/1060253796.db2.gz SXJLHIRJLIWSQN-UHFFFAOYSA-N 2 1 320.546 4.351 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479711 1060262095 /nfs/dbraw/zinc/26/20/95/1060262095.db2.gz OGWBGZIZGNEDQV-OALUTQOASA-N 2 1 317.521 4.151 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479711 1060262111 /nfs/dbraw/zinc/26/21/11/1060262111.db2.gz OGWBGZIZGNEDQV-OALUTQOASA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479711 1060262122 /nfs/dbraw/zinc/26/21/22/1060262122.db2.gz OGWBGZIZGNEDQV-OALUTQOASA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479711 1060262142 /nfs/dbraw/zinc/26/21/42/1060262142.db2.gz OGWBGZIZGNEDQV-OALUTQOASA-N 2 1 317.521 4.151 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1cc(C)ccc1NC)C1CCCCC1 ZINC001560524770 1060322388 /nfs/dbraw/zinc/32/23/88/1060322388.db2.gz ZTOXPBCSWPHAKZ-UHFFFAOYSA-N 2 1 317.521 4.171 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cc(C)ccc1NC)C1CCCCC1 ZINC001560524770 1060322411 /nfs/dbraw/zinc/32/24/11/1060322411.db2.gz ZTOXPBCSWPHAKZ-UHFFFAOYSA-N 2 1 317.521 4.171 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)s2)C1 ZINC001560534424 1060337792 /nfs/dbraw/zinc/33/77/92/1060337792.db2.gz ZZWJXGYIKIGGGK-MRXNPFEDSA-N 2 1 314.498 4.237 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc2cc(C)c(C)cc2o1 ZINC001560624467 1060435666 /nfs/dbraw/zinc/43/56/66/1060435666.db2.gz PFYXHTJXDUXNMC-INIZCTEOSA-N 2 1 302.462 4.260 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)CC1 ZINC001560648423 1060471548 /nfs/dbraw/zinc/47/15/48/1060471548.db2.gz OYSOBRGVFPBWJI-RJRNSMGGSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001560704053 1060560004 /nfs/dbraw/zinc/56/00/04/1060560004.db2.gz WFPCYNMBBPOMEU-KPACCLEDSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791547 1060652537 /nfs/dbraw/zinc/65/25/37/1060652537.db2.gz LUZJQUISLZIYPM-OXQOHEQNSA-N 2 1 318.480 4.143 20 0 DIADMP CC[N@@H+](C/C=C\c1cc(C)c(C)cc1C)CCC[NH+]1CCCC1 ZINC001560811657 1060671388 /nfs/dbraw/zinc/67/13/88/1060671388.db2.gz SKGYLOVHYMXFFY-NTMALXAHSA-N 2 1 314.517 4.433 20 0 DIADMP CC[N@H+](C/C=C\c1cc(C)c(C)cc1C)CCC[NH+]1CCCC1 ZINC001560811657 1060671395 /nfs/dbraw/zinc/67/13/95/1060671395.db2.gz SKGYLOVHYMXFFY-NTMALXAHSA-N 2 1 314.517 4.433 20 0 DIADMP CCC[N@H+](CCCc1c(F)cccc1Cl)CCC[NH+](C)C ZINC001560812579 1060671518 /nfs/dbraw/zinc/67/15/18/1060671518.db2.gz XAXHMSZTIMFJEF-UHFFFAOYSA-N 2 1 314.876 4.075 20 0 DIADMP C[C@@H]1CC[C@@H]1[NH2+]C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001560820956 1060679264 /nfs/dbraw/zinc/67/92/64/1060679264.db2.gz ZWRAMUBINMOPLK-SLYNCCJLSA-N 2 1 314.517 4.313 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001560861537 1060718656 /nfs/dbraw/zinc/71/86/56/1060718656.db2.gz QHIFZKKEZDNEAL-ZIAGYGMSSA-N 2 1 316.942 4.433 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001560861537 1060718665 /nfs/dbraw/zinc/71/86/65/1060718665.db2.gz QHIFZKKEZDNEAL-ZIAGYGMSSA-N 2 1 316.942 4.433 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560865057 1060725309 /nfs/dbraw/zinc/72/53/09/1060725309.db2.gz PDRFTIOMSLXZIB-ROUUACIJSA-N 2 1 316.533 4.206 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560865057 1060725322 /nfs/dbraw/zinc/72/53/22/1060725322.db2.gz PDRFTIOMSLXZIB-ROUUACIJSA-N 2 1 316.533 4.206 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC001560869580 1060731321 /nfs/dbraw/zinc/73/13/21/1060731321.db2.gz LCMLLZUWCUTYSK-MSOLQXFVSA-N 2 1 304.522 4.453 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC001560869580 1060731334 /nfs/dbraw/zinc/73/13/34/1060731334.db2.gz LCMLLZUWCUTYSK-MSOLQXFVSA-N 2 1 304.522 4.453 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001560870973 1060732029 /nfs/dbraw/zinc/73/20/29/1060732029.db2.gz VATCJBREMJCXQM-RLLQIKCJSA-N 2 1 302.506 4.421 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001560870973 1060732040 /nfs/dbraw/zinc/73/20/40/1060732040.db2.gz VATCJBREMJCXQM-RLLQIKCJSA-N 2 1 302.506 4.421 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)C1CCCC1 ZINC001560901338 1060765072 /nfs/dbraw/zinc/76/50/72/1060765072.db2.gz QCFAJGJXUUITSX-HKBOAZHASA-N 2 1 314.517 4.280 20 0 DIADMP c1[nH+]cn2cc(Nc3ccc([NH+]4CCCCCC4)cc3)ccc12 ZINC001250328885 1060784756 /nfs/dbraw/zinc/78/47/56/1060784756.db2.gz ZPUQATDETSJDST-UHFFFAOYSA-N 2 1 306.413 4.458 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001560950856 1060816227 /nfs/dbraw/zinc/81/62/27/1060816227.db2.gz PTKGSQUZQNKKMA-LEWJYISDSA-N 2 1 314.517 4.028 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C[C@@H]2CCC[C@@H]21 ZINC001462145359 1060966690 /nfs/dbraw/zinc/96/66/90/1060966690.db2.gz FBFADZGBUUWMMX-LWYYNNOASA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1C[C@@H]2CCC[C@@H]21 ZINC001462145359 1060966714 /nfs/dbraw/zinc/96/67/14/1060966714.db2.gz FBFADZGBUUWMMX-LWYYNNOASA-N 2 1 312.501 4.065 20 0 DIADMP CCC[C@@H](C)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203073 1060967567 /nfs/dbraw/zinc/96/75/67/1060967567.db2.gz HMWPDPBYYRPDQZ-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203073 1060967588 /nfs/dbraw/zinc/96/75/88/1060967588.db2.gz HMWPDPBYYRPDQZ-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203073 1060967606 /nfs/dbraw/zinc/96/76/06/1060967606.db2.gz HMWPDPBYYRPDQZ-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203073 1060967627 /nfs/dbraw/zinc/96/76/27/1060967627.db2.gz HMWPDPBYYRPDQZ-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+]1CCC(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)CC1 ZINC001462149558 1060971703 /nfs/dbraw/zinc/97/17/03/1060971703.db2.gz MPYQSUUGUXFVAY-WKCHPHFGSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCC2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001473206215 1060976900 /nfs/dbraw/zinc/97/69/00/1060976900.db2.gz PZPZGRROXXBZOM-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCC2CCC2)CC[N@H+]1Cc1ccccc1 ZINC001473206215 1060976920 /nfs/dbraw/zinc/97/69/20/1060976920.db2.gz PZPZGRROXXBZOM-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206215 1060976942 /nfs/dbraw/zinc/97/69/42/1060976942.db2.gz PZPZGRROXXBZOM-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCC2CCC2)CC[NH+]1Cc1ccccc1 ZINC001473206215 1060976967 /nfs/dbraw/zinc/97/69/67/1060976967.db2.gz PZPZGRROXXBZOM-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC001473220527 1060996034 /nfs/dbraw/zinc/99/60/34/1060996034.db2.gz WTAYHURTRGRBMN-QUCCMNQESA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC001473220527 1060996057 /nfs/dbraw/zinc/99/60/57/1060996057.db2.gz WTAYHURTRGRBMN-QUCCMNQESA-N 2 1 314.517 4.290 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC001473220527 1060996079 /nfs/dbraw/zinc/99/60/79/1060996079.db2.gz WTAYHURTRGRBMN-QUCCMNQESA-N 2 1 314.517 4.290 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001462183231 1061002645 /nfs/dbraw/zinc/00/26/45/1061002645.db2.gz YHRGSJVIEBBWLO-QRKMNUTDSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001462183231 1061002662 /nfs/dbraw/zinc/00/26/62/1061002662.db2.gz YHRGSJVIEBBWLO-QRKMNUTDSA-N 2 1 312.501 4.380 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001462186475 1061008880 /nfs/dbraw/zinc/00/88/80/1061008880.db2.gz AQBHEKYNYJBBEH-BEFAXECRSA-N 2 1 304.453 4.082 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+]C1CCC(c2ccccc2)CC1 ZINC001462222401 1061039119 /nfs/dbraw/zinc/03/91/19/1061039119.db2.gz NNGFVOIQDWZXAW-MHJFOBGBSA-N 2 1 300.490 4.177 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+]C1CCC(c2ccccc2)CC1 ZINC001462222401 1061039124 /nfs/dbraw/zinc/03/91/24/1061039124.db2.gz NNGFVOIQDWZXAW-MHJFOBGBSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287666 1061059436 /nfs/dbraw/zinc/05/94/36/1061059436.db2.gz VQZKTOAHJKCTDP-CWVBCOCOSA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287666 1061059446 /nfs/dbraw/zinc/05/94/46/1061059446.db2.gz VQZKTOAHJKCTDP-CWVBCOCOSA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287666 1061059460 /nfs/dbraw/zinc/05/94/60/1061059460.db2.gz VQZKTOAHJKCTDP-CWVBCOCOSA-N 2 1 318.549 4.398 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001462271646 1061067216 /nfs/dbraw/zinc/06/72/16/1061067216.db2.gz YCJAFAYUZJAVNG-WTGUMLROSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280360 1061074381 /nfs/dbraw/zinc/07/43/81/1061074381.db2.gz ROHZOOIHXXQFOZ-QRTARXTBSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c2ccsc2S1 ZINC001462280360 1061074391 /nfs/dbraw/zinc/07/43/91/1061074391.db2.gz ROHZOOIHXXQFOZ-QRTARXTBSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c2ccsc2S1 ZINC001462280360 1061074405 /nfs/dbraw/zinc/07/44/05/1061074405.db2.gz ROHZOOIHXXQFOZ-QRTARXTBSA-N 2 1 322.543 4.091 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c2ccsc2S1 ZINC001462280360 1061074421 /nfs/dbraw/zinc/07/44/21/1061074421.db2.gz ROHZOOIHXXQFOZ-QRTARXTBSA-N 2 1 322.543 4.091 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462300109 1061087627 /nfs/dbraw/zinc/08/76/27/1061087627.db2.gz OIMSQWDAYHTORF-RLLQIKCJSA-N 2 1 302.506 4.108 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462300109 1061087643 /nfs/dbraw/zinc/08/76/43/1061087643.db2.gz OIMSQWDAYHTORF-RLLQIKCJSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462301052 1061088195 /nfs/dbraw/zinc/08/81/95/1061088195.db2.gz YOUMUNDMYKTCJQ-RLLQIKCJSA-N 2 1 302.506 4.341 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462301052 1061088208 /nfs/dbraw/zinc/08/82/08/1061088208.db2.gz YOUMUNDMYKTCJQ-RLLQIKCJSA-N 2 1 302.506 4.341 20 0 DIADMP CC(C)C[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001473349191 1061104891 /nfs/dbraw/zinc/10/48/91/1061104891.db2.gz RVWSKOXNBPSQBA-LJQANCHMSA-N 2 1 314.517 4.409 20 0 DIADMP CCCc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001473369601 1061115976 /nfs/dbraw/zinc/11/59/76/1061115976.db2.gz HIXTZTWOJJWQAW-PXNSSMCTSA-N 2 1 314.517 4.382 20 0 DIADMP CC[C@@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)[C@H]1C ZINC001473403185 1061139461 /nfs/dbraw/zinc/13/94/61/1061139461.db2.gz SBVHMIWWFKIAJA-FXAWDEMLSA-N 2 1 300.490 4.293 20 0 DIADMP CC[N@@H+](CCC[NH2+]C[C@H]1CCc2ccccc21)C1CCCCC1 ZINC001462408224 1061153755 /nfs/dbraw/zinc/15/37/55/1061153755.db2.gz NRAPVXPOTPQKEM-LJQANCHMSA-N 2 1 314.517 4.351 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001462407366 1061154377 /nfs/dbraw/zinc/15/43/77/1061154377.db2.gz WNRYULFWNYBILY-UXHICEINSA-N 2 1 302.506 4.064 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H]1C[C@H](OC(C)C)C1(C)C)C1CCCCC1 ZINC001462408116 1061154704 /nfs/dbraw/zinc/15/47/04/1061154704.db2.gz MHAXTOCVKUHMMM-OALUTQOASA-N 2 1 324.553 4.213 20 0 DIADMP CCC(C)(C)[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001462430438 1061170100 /nfs/dbraw/zinc/17/01/00/1061170100.db2.gz TVPDLXZQWUAYCK-ZIFCJYIRSA-N 2 1 302.506 4.311 20 0 DIADMP CCCc1ccc(C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC001473490345 1061187276 /nfs/dbraw/zinc/18/72/76/1061187276.db2.gz ZVCVWIFOQRHXSU-UHFFFAOYSA-N 2 1 322.496 4.393 20 0 DIADMP C1=C(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)CCC1 ZINC001473507806 1061201933 /nfs/dbraw/zinc/20/19/33/1061201933.db2.gz LHDSNVFDCVQMDJ-UHFFFAOYSA-N 2 1 310.485 4.085 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462485226 1061202897 /nfs/dbraw/zinc/20/28/97/1061202897.db2.gz HURHGZXNCBLZFQ-FFGOWVMKSA-N 2 1 316.464 4.225 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001462485226 1061202914 /nfs/dbraw/zinc/20/29/14/1061202914.db2.gz HURHGZXNCBLZFQ-FFGOWVMKSA-N 2 1 316.464 4.225 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001462516728 1061226089 /nfs/dbraw/zinc/22/60/89/1061226089.db2.gz FGJNILWGZBJEAW-GHTZIAJQSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001462516728 1061226105 /nfs/dbraw/zinc/22/61/05/1061226105.db2.gz FGJNILWGZBJEAW-GHTZIAJQSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)cc1 ZINC001462520455 1061230582 /nfs/dbraw/zinc/23/05/82/1061230582.db2.gz WCNXAGSAMVCIDP-RXVVDRJESA-N 2 1 314.517 4.485 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)cc1 ZINC001462520455 1061230596 /nfs/dbraw/zinc/23/05/96/1061230596.db2.gz WCNXAGSAMVCIDP-RXVVDRJESA-N 2 1 314.517 4.485 20 0 DIADMP Cc1cc(C)cc(CC[N@@H+](C)CCCC[NH+]2CCCCC2)c1 ZINC001462536020 1061244411 /nfs/dbraw/zinc/24/44/11/1061244411.db2.gz RIUWFGSYZCJYAY-UHFFFAOYSA-N 2 1 302.506 4.044 20 0 DIADMP C[C@@H](CC1CCCCC1)C[NH+]1C[C@@]23C[N@H+](C)C[C@]2(C1)CCCC3 ZINC001462673101 1061330752 /nfs/dbraw/zinc/33/07/52/1061330752.db2.gz SYFXZVFYDUAHBX-SESVDKBCSA-N 2 1 318.549 4.401 20 0 DIADMP C[C@@H](CC1CCCCC1)C[NH+]1C[C@@]23C[N@@H+](C)C[C@]2(C1)CCCC3 ZINC001462673101 1061330772 /nfs/dbraw/zinc/33/07/72/1061330772.db2.gz SYFXZVFYDUAHBX-SESVDKBCSA-N 2 1 318.549 4.401 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@H](C)[C@@H]1CCCCO1)c1ccccc1 ZINC001462674211 1061332020 /nfs/dbraw/zinc/33/20/20/1061332020.db2.gz KIOSOGLYYZUHDJ-HOJAQTOUSA-N 2 1 318.505 4.007 20 0 DIADMP CC[N@@H+](CCc1ccc(C)cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC001473691512 1061348795 /nfs/dbraw/zinc/34/87/95/1061348795.db2.gz WJBXCOYBMOQSMV-UHFFFAOYSA-N 2 1 310.485 4.121 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2Cc2ccc(CF)cc2)CC1 ZINC001473716738 1061367024 /nfs/dbraw/zinc/36/70/24/1061367024.db2.gz KNDDGQDCDAYNQP-HXUWFJFHSA-N 2 1 318.480 4.243 20 0 DIADMP Cc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)c(Cl)c1 ZINC001473749686 1061392218 /nfs/dbraw/zinc/39/22/18/1061392218.db2.gz OVYSOWPWYKAYER-UHFFFAOYSA-N 2 1 308.897 4.346 20 0 DIADMP Cc1ccc(CCC[N@@H+](C)CCCC[NH+]2CCCCC2)cc1 ZINC001473750578 1061392585 /nfs/dbraw/zinc/39/25/85/1061392585.db2.gz WGKXPUIDTQJPDD-UHFFFAOYSA-N 2 1 302.506 4.126 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](CCCc2cccc(F)c2)CC1 ZINC001473778233 1061405708 /nfs/dbraw/zinc/40/57/08/1061405708.db2.gz WDYULCWBNCMNPT-UHFFFAOYSA-N 2 1 318.480 4.099 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CCCCc3ccccc3)CC2)[nH+]c1C ZINC001473802612 1061414626 /nfs/dbraw/zinc/41/46/26/1061414626.db2.gz PNGWZWUYHCZSMM-UHFFFAOYSA-N 2 1 311.473 4.229 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC=C(c2cccc(C)c2C)CC1 ZINC001473872133 1061445213 /nfs/dbraw/zinc/44/52/13/1061445213.db2.gz HKSWZQCFXXONIG-UHFFFAOYSA-N 2 1 323.484 4.378 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC=C(c2cccc(C)c2C)CC1 ZINC001473872133 1061445216 /nfs/dbraw/zinc/44/52/16/1061445216.db2.gz HKSWZQCFXXONIG-UHFFFAOYSA-N 2 1 323.484 4.378 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC1(C)C ZINC001473921466 1061469931 /nfs/dbraw/zinc/46/99/31/1061469931.db2.gz MRCDLQQFXVQKDS-NHCUHLMSSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001473933542 1061479567 /nfs/dbraw/zinc/47/95/67/1061479567.db2.gz KJIVOBWJWCMOOV-IIMDRIAPSA-N 2 1 314.517 4.443 20 0 DIADMP COc1cc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)ccc1Cl ZINC001473937047 1061482538 /nfs/dbraw/zinc/48/25/38/1061482538.db2.gz JYGUXAMTISONOB-HNNXBMFYSA-N 2 1 324.896 4.093 20 0 DIADMP CC[N@H+](CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1)C(C)C ZINC001473974782 1061518626 /nfs/dbraw/zinc/51/86/26/1061518626.db2.gz LKQJCHDKICUDNP-SFHVURJKSA-N 2 1 318.549 4.483 20 0 DIADMP CC[N@@H+](CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1)C(C)C ZINC001473974782 1061518645 /nfs/dbraw/zinc/51/86/45/1061518645.db2.gz LKQJCHDKICUDNP-SFHVURJKSA-N 2 1 318.549 4.483 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@H+]2CC2CCCCC2)C1 ZINC001473980698 1061523785 /nfs/dbraw/zinc/52/37/85/1061523785.db2.gz YQFORXNCYSADNN-GBESFXJTSA-N 2 1 324.578 4.295 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CC[C@@H](C)[C@@H](C)C2)c1 ZINC001474015646 1061557022 /nfs/dbraw/zinc/55/70/22/1061557022.db2.gz DFYFBKICDKPOIN-UWVAXJGDSA-N 2 1 302.506 4.441 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001474027221 1061567200 /nfs/dbraw/zinc/56/72/00/1061567200.db2.gz CQGSXEBVGUBJRP-GJZGRUSLSA-N 2 1 316.420 4.048 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]CC2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC001474072895 1061619388 /nfs/dbraw/zinc/61/93/88/1061619388.db2.gz AHDBFZXXLPKNMT-WIYYLYMNSA-N 2 1 314.517 4.457 20 0 DIADMP Cc1cscc1C[NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC001474133119 1061679939 /nfs/dbraw/zinc/67/99/39/1061679939.db2.gz HITBQQPLOICWHY-UHFFFAOYSA-N 2 1 316.514 4.304 20 0 DIADMP Cc1cscc1C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001474133119 1061679953 /nfs/dbraw/zinc/67/99/53/1061679953.db2.gz HITBQQPLOICWHY-UHFFFAOYSA-N 2 1 316.514 4.304 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+]C/C(C)=C/c1ccc(Cl)cc1 ZINC001474138724 1061685069 /nfs/dbraw/zinc/68/50/69/1061685069.db2.gz HAGHLNKGGWBFIS-XOVFHRFOSA-N 2 1 306.881 4.207 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+]C/C(C)=C/c1ccc(Cl)cc1 ZINC001474138724 1061685080 /nfs/dbraw/zinc/68/50/80/1061685080.db2.gz HAGHLNKGGWBFIS-XOVFHRFOSA-N 2 1 306.881 4.207 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCC[C@H]2c2ccccc2)CC1(C)C ZINC001474159403 1061700896 /nfs/dbraw/zinc/70/08/96/1061700896.db2.gz KDXRIDALGNESRX-QYZOEREBSA-N 2 1 300.490 4.033 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@@H]2CCC[C@H]2c2ccccc2)CC1(C)C ZINC001474159399 1061702096 /nfs/dbraw/zinc/70/20/96/1061702096.db2.gz KDXRIDALGNESRX-FHWLQOOXSA-N 2 1 300.490 4.033 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(Cc3cccc(Cl)c3)CC2)CC1(C)C ZINC001474173956 1061719134 /nfs/dbraw/zinc/71/91/34/1061719134.db2.gz GCGBGINBQIVJCY-QGZVFWFLSA-N 2 1 320.908 4.125 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC001474209901 1061767244 /nfs/dbraw/zinc/76/72/44/1061767244.db2.gz KKEUPYNNDSHQRD-GIVPXCGWSA-N 2 1 314.517 4.424 20 0 DIADMP CC(C)(C)c1ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC001474223279 1061784347 /nfs/dbraw/zinc/78/43/47/1061784347.db2.gz FIRAQSHCSMSWAP-MRXNPFEDSA-N 2 1 320.546 4.257 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCCC2(CC2)C1 ZINC001474280926 1061849183 /nfs/dbraw/zinc/84/91/83/1061849183.db2.gz QIUNANUESNIGIG-LJQANCHMSA-N 2 1 314.517 4.457 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@H]1CCC[NH+](C)C1 ZINC001474334623 1061928536 /nfs/dbraw/zinc/92/85/36/1061928536.db2.gz VTKJTLXEHOLJFV-KRWDZBQOSA-N 2 1 322.452 4.360 20 0 DIADMP C[NH+](Cc1ccc2oc3ccccc3c2c1)C[C@H]1CCC[N@H+](C)C1 ZINC001474334623 1061928554 /nfs/dbraw/zinc/92/85/54/1061928554.db2.gz VTKJTLXEHOLJFV-KRWDZBQOSA-N 2 1 322.452 4.360 20 0 DIADMP C[NH+](Cc1ccc2oc3ccccc3c2c1)C[C@H]1CCC[N@@H+](C)C1 ZINC001474334623 1061928573 /nfs/dbraw/zinc/92/85/73/1061928573.db2.gz VTKJTLXEHOLJFV-KRWDZBQOSA-N 2 1 322.452 4.360 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1 ZINC001474348412 1061957160 /nfs/dbraw/zinc/95/71/60/1061957160.db2.gz HPHQGJFIUZRAEV-FQEVSTJZSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(CC[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1 ZINC001474348412 1061957190 /nfs/dbraw/zinc/95/71/90/1061957190.db2.gz HPHQGJFIUZRAEV-FQEVSTJZSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(CC[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1 ZINC001474348412 1061957207 /nfs/dbraw/zinc/95/72/07/1061957207.db2.gz HPHQGJFIUZRAEV-FQEVSTJZSA-N 2 1 314.517 4.016 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCC[C@H]2c2ccc(C(C)(C)C)cc2)CC1 ZINC001474357717 1061974376 /nfs/dbraw/zinc/97/43/76/1061974376.db2.gz KRCIAJPXXHHNMX-FQEVSTJZSA-N 2 1 314.517 4.463 20 0 DIADMP CC(C)C1(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)CC1 ZINC001474374301 1062012017 /nfs/dbraw/zinc/01/20/17/1062012017.db2.gz NDBQPTSOYYYFKT-SFHVURJKSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CC[N@@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001474380727 1062027028 /nfs/dbraw/zinc/02/70/28/1062027028.db2.gz AALLARJSTYTKJT-WIYYLYMNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)C1 ZINC001474380727 1062027051 /nfs/dbraw/zinc/02/70/51/1062027051.db2.gz AALLARJSTYTKJT-WIYYLYMNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CC[NH+](C[C@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001474380727 1062027075 /nfs/dbraw/zinc/02/70/75/1062027075.db2.gz AALLARJSTYTKJT-WIYYLYMNSA-N 2 1 314.517 4.267 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)C2CCc3ccccc3CC2)CC1 ZINC001254464795 1062122080 /nfs/dbraw/zinc/12/20/80/1062122080.db2.gz LGDKXCDFHSXJNV-UHFFFAOYSA-N 2 1 314.517 4.130 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001254484903 1062128165 /nfs/dbraw/zinc/12/81/65/1062128165.db2.gz CHUMOLWNVUBJJX-YSTOQKLRSA-N 2 1 300.490 4.003 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001254492526 1062135739 /nfs/dbraw/zinc/13/57/39/1062135739.db2.gz VLPCQBJRBBIGGG-CEWLAPEOSA-N 2 1 316.533 4.496 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]CCc2cccc(Oc3ccccc3)c2)CC1 ZINC001254499660 1062142157 /nfs/dbraw/zinc/14/21/57/1062142157.db2.gz MDJKVKUBGHKGQQ-LJQANCHMSA-N 2 1 324.468 4.095 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001254500028 1062143333 /nfs/dbraw/zinc/14/33/33/1062143333.db2.gz SOZIDPFLSIGKMV-IBGZPJMESA-N 2 1 312.432 4.067 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001254498950 1062143854 /nfs/dbraw/zinc/14/38/54/1062143854.db2.gz USEPHCHYSPLXCE-HXUWFJFHSA-N 2 1 314.517 4.206 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001254509968 1062149911 /nfs/dbraw/zinc/14/99/11/1062149911.db2.gz KSVWVYLXWFYKJX-RTBURBONSA-N 2 1 304.453 4.131 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CCC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC001254510122 1062150667 /nfs/dbraw/zinc/15/06/67/1062150667.db2.gz RXPGPUMDVMCHOW-HZPDHXFCSA-N 2 1 314.395 4.230 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001254510815 1062150871 /nfs/dbraw/zinc/15/08/71/1062150871.db2.gz QSYFGXSIXFTKBF-OALUTQOASA-N 2 1 304.453 4.131 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001254509967 1062151451 /nfs/dbraw/zinc/15/14/51/1062151451.db2.gz KSVWVYLXWFYKJX-RBUKOAKNSA-N 2 1 304.453 4.131 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CCC[NH+](C)CC1 ZINC001254529143 1062160250 /nfs/dbraw/zinc/16/02/50/1062160250.db2.gz KILIHRSFDJFWJB-NVXWUHKLSA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@@H]1CCC[N@H+](C)CC1 ZINC001254529143 1062160260 /nfs/dbraw/zinc/16/02/60/1062160260.db2.gz KILIHRSFDJFWJB-NVXWUHKLSA-N 2 1 304.503 4.030 20 0 DIADMP CSc1ccccc1[C@H]1CCC[NH+]1[C@@H]1CCC[N@@H+](C)CC1 ZINC001254529143 1062160268 /nfs/dbraw/zinc/16/02/68/1062160268.db2.gz KILIHRSFDJFWJB-NVXWUHKLSA-N 2 1 304.503 4.030 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CCC[NH+](C)CC1 ZINC001254530448 1062161183 /nfs/dbraw/zinc/16/11/83/1062161183.db2.gz YKGCTHLLACGIAC-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CCC[NH+](C)CC1 ZINC001254530448 1062161202 /nfs/dbraw/zinc/16/12/02/1062161202.db2.gz YKGCTHLLACGIAC-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccccc1Oc1ccccc1)[C@H]1CCC[N@H+](C)CC1 ZINC001254530448 1062161218 /nfs/dbraw/zinc/16/12/18/1062161218.db2.gz YKGCTHLLACGIAC-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccccc1Oc1ccccc1)[C@H]1CCC[N@@H+](C)CC1 ZINC001254530448 1062161231 /nfs/dbraw/zinc/16/12/31/1062161231.db2.gz YKGCTHLLACGIAC-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2C[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001474481099 1062162171 /nfs/dbraw/zinc/16/21/71/1062162171.db2.gz VYEIGDRDFXKSKX-QUCCMNQESA-N 2 1 312.501 4.103 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254530449 1062161999 /nfs/dbraw/zinc/16/19/99/1062161999.db2.gz YKGCTHLLACGIAC-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254530449 1062162018 /nfs/dbraw/zinc/16/20/18/1062162018.db2.gz YKGCTHLLACGIAC-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccccc1Oc1ccccc1)[C@@H]1CCC[N@H+](C)CC1 ZINC001254530449 1062162030 /nfs/dbraw/zinc/16/20/30/1062162030.db2.gz YKGCTHLLACGIAC-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1ccccc1Oc1ccccc1)[C@@H]1CCC[N@@H+](C)CC1 ZINC001254530449 1062162051 /nfs/dbraw/zinc/16/20/51/1062162051.db2.gz YKGCTHLLACGIAC-LJQANCHMSA-N 2 1 324.468 4.395 20 0 DIADMP CCCSC[C@H](C)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001474483869 1062163342 /nfs/dbraw/zinc/16/33/42/1062163342.db2.gz NGOPRGWPIHBGFZ-HKUYNNGSSA-N 2 1 320.546 4.020 20 0 DIADMP CC(C)C[N@@H+](CCC[NH+](C)C)Cc1ccc(Cl)c(Cl)c1 ZINC001474499864 1062179536 /nfs/dbraw/zinc/17/95/36/1062179536.db2.gz MXEPKMNSBMJTEQ-UHFFFAOYSA-N 2 1 317.304 4.403 20 0 DIADMP C[NH+]1CCC([N@@H+](Cc2ccccc2)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001474504662 1062188076 /nfs/dbraw/zinc/18/80/76/1062188076.db2.gz IMCZMRBZQJAYSE-HSALFYBXSA-N 2 1 312.501 4.019 20 0 DIADMP C[NH+]1CCC([N@H+](Cc2ccccc2)C[C@@H]2CC[C@H]3C[C@H]3C2)CC1 ZINC001474504662 1062188083 /nfs/dbraw/zinc/18/80/83/1062188083.db2.gz IMCZMRBZQJAYSE-HSALFYBXSA-N 2 1 312.501 4.019 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001474508543 1062191763 /nfs/dbraw/zinc/19/17/63/1062191763.db2.gz KVOVZIVCALDLTC-VJFUWPCTSA-N 2 1 306.881 4.050 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001474508543 1062191777 /nfs/dbraw/zinc/19/17/77/1062191777.db2.gz KVOVZIVCALDLTC-VJFUWPCTSA-N 2 1 306.881 4.050 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC001474508062 1062192107 /nfs/dbraw/zinc/19/21/07/1062192107.db2.gz HFOBVKDRCFBABM-SLFFLAALSA-N 2 1 300.490 4.177 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC001474508062 1062192116 /nfs/dbraw/zinc/19/21/16/1062192116.db2.gz HFOBVKDRCFBABM-SLFFLAALSA-N 2 1 300.490 4.177 20 0 DIADMP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC001459541074 1062195178 /nfs/dbraw/zinc/19/51/78/1062195178.db2.gz ZIZRYDAPLKYJFZ-FQEVSTJZSA-N 2 1 314.517 4.434 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC001459541074 1062195200 /nfs/dbraw/zinc/19/52/00/1062195200.db2.gz ZIZRYDAPLKYJFZ-FQEVSTJZSA-N 2 1 314.517 4.434 20 0 DIADMP CCC(C)(C)c1ccc(C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1 ZINC001459548144 1062199600 /nfs/dbraw/zinc/19/96/00/1062199600.db2.gz ZYKLVQRNLKPTSQ-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC001459548144 1062199609 /nfs/dbraw/zinc/19/96/09/1062199609.db2.gz ZYKLVQRNLKPTSQ-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001474524340 1062208704 /nfs/dbraw/zinc/20/87/04/1062208704.db2.gz VFSPOEMEYZQMOG-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@H]1CCc2c1cccc2Cl ZINC001459571129 1062215758 /nfs/dbraw/zinc/21/57/58/1062215758.db2.gz FAELUBCFPQIXBO-KDOFPFPSSA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@H]1CCc2c1cccc2Cl ZINC001459571129 1062215778 /nfs/dbraw/zinc/21/57/78/1062215778.db2.gz FAELUBCFPQIXBO-KDOFPFPSSA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@H]1CCc2c1cccc2Cl ZINC001459571129 1062215800 /nfs/dbraw/zinc/21/58/00/1062215800.db2.gz FAELUBCFPQIXBO-KDOFPFPSSA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](C[C@H](C[N@H+](C)Cc1ccccc1)c1ccccc1)C1CCC1 ZINC001459581611 1062225331 /nfs/dbraw/zinc/22/53/31/1062225331.db2.gz UGWGCIPEEPWAMP-NRFANRHFSA-N 2 1 322.496 4.387 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@@H](C[N@H+](C)C1CCC1)c1ccccc1 ZINC001459581611 1062225355 /nfs/dbraw/zinc/22/53/55/1062225355.db2.gz UGWGCIPEEPWAMP-NRFANRHFSA-N 2 1 322.496 4.387 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@@H](C[N@@H+](C)C1CCC1)c1ccccc1 ZINC001459581611 1062225374 /nfs/dbraw/zinc/22/53/74/1062225374.db2.gz UGWGCIPEEPWAMP-NRFANRHFSA-N 2 1 322.496 4.387 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001474558289 1062262135 /nfs/dbraw/zinc/26/21/35/1062262135.db2.gz NRBKAWGRDVGTCJ-SXLOBPIMSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001474558289 1062262151 /nfs/dbraw/zinc/26/21/51/1062262151.db2.gz NRBKAWGRDVGTCJ-SXLOBPIMSA-N 2 1 302.506 4.207 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCSc2ccc(C)c(C)c2)[C@H](C)C1 ZINC001459665688 1062282590 /nfs/dbraw/zinc/28/25/90/1062282590.db2.gz FIZDRKBSOGZZDV-IEBWSBKVSA-N 2 1 320.546 4.058 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCSc2ccc(C)c(C)c2)[C@H](C)C1 ZINC001459665699 1062283498 /nfs/dbraw/zinc/28/34/98/1062283498.db2.gz FIZDRKBSOGZZDV-MJGOQNOKSA-N 2 1 320.546 4.058 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001459668630 1062287816 /nfs/dbraw/zinc/28/78/16/1062287816.db2.gz LVNKDMUUCKRVEI-LPHOPBHVSA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001459668630 1062287834 /nfs/dbraw/zinc/28/78/34/1062287834.db2.gz LVNKDMUUCKRVEI-LPHOPBHVSA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001459668630 1062287849 /nfs/dbraw/zinc/28/78/49/1062287849.db2.gz LVNKDMUUCKRVEI-LPHOPBHVSA-N 2 1 302.506 4.146 20 0 DIADMP F[C@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255135937 1062329031 /nfs/dbraw/zinc/32/90/31/1062329031.db2.gz GJDTXFAFEDUFJQ-VNTMZGSJSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255135937 1062329047 /nfs/dbraw/zinc/32/90/47/1062329047.db2.gz GJDTXFAFEDUFJQ-VNTMZGSJSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255135937 1062329067 /nfs/dbraw/zinc/32/90/67/1062329067.db2.gz GJDTXFAFEDUFJQ-VNTMZGSJSA-N 2 1 316.464 4.006 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2C[C@H]4CCCC[C@@H]4C2)C3)cc1 ZINC001255135348 1062329748 /nfs/dbraw/zinc/32/97/48/1062329748.db2.gz AEULEPCFIPSFTJ-YXIAPDDASA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2C[C@@H]4CCCC[C@H]4C2)C3)cc1 ZINC001255135342 1062330753 /nfs/dbraw/zinc/33/07/53/1062330753.db2.gz AEULEPCFIPSFTJ-RTOMLYRKSA-N 2 1 324.512 4.304 20 0 DIADMP CC[C@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255146057 1062333201 /nfs/dbraw/zinc/33/32/01/1062333201.db2.gz BRKKPKJLIRUSAT-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255146057 1062333225 /nfs/dbraw/zinc/33/32/25/1062333225.db2.gz BRKKPKJLIRUSAT-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146057 1062333237 /nfs/dbraw/zinc/33/32/37/1062333237.db2.gz BRKKPKJLIRUSAT-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474616299 1062333805 /nfs/dbraw/zinc/33/38/05/1062333805.db2.gz NJOQOKDYMWGONP-BTHPGYMESA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142607 1062336367 /nfs/dbraw/zinc/33/63/67/1062336367.db2.gz DVNNKXSKKWWTRD-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142607 1062336386 /nfs/dbraw/zinc/33/63/86/1062336386.db2.gz DVNNKXSKKWWTRD-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142607 1062336412 /nfs/dbraw/zinc/33/64/12/1062336412.db2.gz DVNNKXSKKWWTRD-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@H](C)C1 ZINC001255142607 1062336434 /nfs/dbraw/zinc/33/64/34/1062336434.db2.gz DVNNKXSKKWWTRD-YCXYWVQESA-N 2 1 312.501 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC4(CC4)CC2)C3)cc1 ZINC001255143054 1062338929 /nfs/dbraw/zinc/33/89/29/1062338929.db2.gz VEVLJKMQKPPSHY-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCCC4(CCC4)C2)C3)cc1 ZINC001255151336 1062343064 /nfs/dbraw/zinc/34/30/64/1062343064.db2.gz WXMJOLGLNMNWBW-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCCC4(CCC4)C2)C3)cc1 ZINC001255151336 1062343085 /nfs/dbraw/zinc/34/30/85/1062343085.db2.gz WXMJOLGLNMNWBW-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCCC4(CCC4)C2)C3)cc1 ZINC001255151336 1062343108 /nfs/dbraw/zinc/34/31/08/1062343108.db2.gz WXMJOLGLNMNWBW-AERCQKQUSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+](CC2CC2)C2CC2)C3)cc1 ZINC001255151088 1062343725 /nfs/dbraw/zinc/34/37/25/1062343725.db2.gz SGRAZKYDBOVFGP-AERCQKQUSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+](CC2CC2)C2CC2)C3)cc1 ZINC001255151088 1062343749 /nfs/dbraw/zinc/34/37/49/1062343749.db2.gz SGRAZKYDBOVFGP-AERCQKQUSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001255151088 1062343771 /nfs/dbraw/zinc/34/37/71/1062343771.db2.gz SGRAZKYDBOVFGP-AERCQKQUSA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+](CC2CC2)C2CC2)C3)cc1 ZINC001255151088 1062343792 /nfs/dbraw/zinc/34/37/92/1062343792.db2.gz SGRAZKYDBOVFGP-AERCQKQUSA-N 2 1 310.485 4.056 20 0 DIADMP C1CC(=C2CCC([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)CC2)C1 ZINC001474633583 1062357981 /nfs/dbraw/zinc/35/79/81/1062357981.db2.gz GRRSMWAZQKIPAU-IBGZPJMESA-N 2 1 302.506 4.406 20 0 DIADMP C1CC(=C2CCC([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)CC2)C1 ZINC001474633583 1062358003 /nfs/dbraw/zinc/35/80/03/1062358003.db2.gz GRRSMWAZQKIPAU-IBGZPJMESA-N 2 1 302.506 4.406 20 0 DIADMP CC1(c2ccccc2)CC([NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001474634102 1062358672 /nfs/dbraw/zinc/35/86/72/1062358672.db2.gz OVQUFPVMPKQXDF-JSOIOWGOSA-N 2 1 312.501 4.103 20 0 DIADMP CC1(c2ccccc2)CC([NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001474634102 1062358693 /nfs/dbraw/zinc/35/86/93/1062358693.db2.gz OVQUFPVMPKQXDF-JSOIOWGOSA-N 2 1 312.501 4.103 20 0 DIADMP CCSc1cccc(C[N@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)c1 ZINC001474646018 1062371400 /nfs/dbraw/zinc/37/14/00/1062371400.db2.gz APSIBTSXABVMCY-LPHOPBHVSA-N 2 1 320.546 4.351 20 0 DIADMP CCSc1cccc(C[N@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)c1 ZINC001474646025 1062372989 /nfs/dbraw/zinc/37/29/89/1062372989.db2.gz APSIBTSXABVMCY-VQIMIIECSA-N 2 1 320.546 4.351 20 0 DIADMP CC[C@@]1(C)CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001459769539 1062380732 /nfs/dbraw/zinc/38/07/32/1062380732.db2.gz NMMAYPZGHUNJIO-FQEVSTJZSA-N 2 1 300.490 4.295 20 0 DIADMP CC1(C)CCC([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC1 ZINC001255301045 1062383571 /nfs/dbraw/zinc/38/35/71/1062383571.db2.gz JVGARSWAAZKWNA-UHFFFAOYSA-N 2 1 304.453 4.044 20 0 DIADMP CC(C)(C)[C@]1(C[NH+]2CC(C)(C)C2)CC[N@@H+](Cc2ccccc2)C1 ZINC001474669087 1062399889 /nfs/dbraw/zinc/39/98/89/1062399889.db2.gz WDKBXTILKIVONV-OAQYLSRUSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671691 1062401653 /nfs/dbraw/zinc/40/16/53/1062401653.db2.gz XQMQVXAPCJHVIW-FXAWDEMLSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1)c1ccccc1 ZINC001474671691 1062401667 /nfs/dbraw/zinc/40/16/67/1062401667.db2.gz XQMQVXAPCJHVIW-FXAWDEMLSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001474670577 1062402441 /nfs/dbraw/zinc/40/24/41/1062402441.db2.gz HLUUJHAAYUNQLR-NQIIRXRSSA-N 2 1 314.517 4.394 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001474670577 1062402459 /nfs/dbraw/zinc/40/24/59/1062402459.db2.gz HLUUJHAAYUNQLR-NQIIRXRSSA-N 2 1 314.517 4.394 20 0 DIADMP CC(C)C[N@H+](Cc1cscc1Cl)CC1CC[NH+](C)CC1 ZINC001474678251 1062410557 /nfs/dbraw/zinc/41/05/57/1062410557.db2.gz MVHQEDYQDBQYRW-UHFFFAOYSA-N 2 1 314.926 4.201 20 0 DIADMP FC1(F)CCC([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255376311 1062419665 /nfs/dbraw/zinc/41/96/65/1062419665.db2.gz BBJWPQHFFQPCBM-KRWDZBQOSA-N 2 1 322.443 4.209 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c(C)c1 ZINC001255383418 1062420915 /nfs/dbraw/zinc/42/09/15/1062420915.db2.gz JBTXTCSETUPQHK-QFIPXVFZSA-N 2 1 322.496 4.448 20 0 DIADMP c1ccc(CCC[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255376386 1062422535 /nfs/dbraw/zinc/42/25/35/1062422535.db2.gz IHTPGMHPYOYPIO-JOCHJYFZSA-N 2 1 322.496 4.264 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccc1 ZINC001255384088 1062422730 /nfs/dbraw/zinc/42/27/30/1062422730.db2.gz SVRMWCHNXKXDEU-NQIIRXRSSA-N 2 1 308.469 4.392 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255393255 1062427666 /nfs/dbraw/zinc/42/76/66/1062427666.db2.gz MWAHSUZCQXWWSZ-OAQYLSRUSA-N 2 1 322.496 4.448 20 0 DIADMP CC(C)CC[C@@H](C)[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386206 1062428990 /nfs/dbraw/zinc/42/89/90/1062428990.db2.gz KYSUKBNKCKLCRT-QUCCMNQESA-N 2 1 302.506 4.455 20 0 DIADMP C[N@@H+](C1CCCCC1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255395416 1062429100 /nfs/dbraw/zinc/42/91/00/1062429100.db2.gz ADPSAZDHNIPVDJ-FQEVSTJZSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+](C1CCCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255395416 1062429106 /nfs/dbraw/zinc/42/91/06/1062429106.db2.gz ADPSAZDHNIPVDJ-FQEVSTJZSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+](C1CCCCC1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255395416 1062429111 /nfs/dbraw/zinc/42/91/11/1062429111.db2.gz ADPSAZDHNIPVDJ-FQEVSTJZSA-N 2 1 300.490 4.306 20 0 DIADMP CC(C)CC[C@@H](C)[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386207 1062429143 /nfs/dbraw/zinc/42/91/43/1062429143.db2.gz KYSUKBNKCKLCRT-UYAOXDASSA-N 2 1 302.506 4.455 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@@H]3CC34CCCCC4)CC2)cc1 ZINC001255391968 1062429556 /nfs/dbraw/zinc/42/95/56/1062429556.db2.gz WLSBTHVQYNAQNQ-VQTJNVASSA-N 2 1 312.501 4.354 20 0 DIADMP CC(C)(CC1CC1)[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255393674 1062429890 /nfs/dbraw/zinc/42/98/90/1062429890.db2.gz SXKTWSDTTCKUAO-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3C[C@@H]4CCCC[C@H]4C3)CC2)cc1 ZINC001255399759 1062432029 /nfs/dbraw/zinc/43/20/29/1062432029.db2.gz ZCIHBHQWZUSSFT-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)[C@H]1C ZINC001255401532 1062432072 /nfs/dbraw/zinc/43/20/72/1062432072.db2.gz BASQXRSQLONARE-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@H]1C ZINC001255401532 1062432080 /nfs/dbraw/zinc/43/20/80/1062432080.db2.gz BASQXRSQLONARE-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@H]1C ZINC001255401532 1062432090 /nfs/dbraw/zinc/43/20/90/1062432090.db2.gz BASQXRSQLONARE-WSTZPKSXSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3C[C@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001255399761 1062433966 /nfs/dbraw/zinc/43/39/66/1062433966.db2.gz ZCIHBHQWZUSSFT-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400041 1062434316 /nfs/dbraw/zinc/43/43/16/1062434316.db2.gz DCPSMGCIIXEOBV-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400041 1062434323 /nfs/dbraw/zinc/43/43/23/1062434323.db2.gz DCPSMGCIIXEOBV-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400041 1062434332 /nfs/dbraw/zinc/43/43/32/1062434332.db2.gz DCPSMGCIIXEOBV-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400041 1062434341 /nfs/dbraw/zinc/43/43/41/1062434341.db2.gz DCPSMGCIIXEOBV-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCc4ccccc4C3)CC2)cc1 ZINC001255399500 1062434831 /nfs/dbraw/zinc/43/48/31/1062434831.db2.gz SXISHHXCAMLOLS-QFIPXVFZSA-N 2 1 320.480 4.099 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCc4ccccc4C3)CC2)cc1 ZINC001255399500 1062434837 /nfs/dbraw/zinc/43/48/37/1062434837.db2.gz SXISHHXCAMLOLS-QFIPXVFZSA-N 2 1 320.480 4.099 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCc4ccccc4C3)CC2)cc1 ZINC001255399500 1062434849 /nfs/dbraw/zinc/43/48/49/1062434849.db2.gz SXISHHXCAMLOLS-QFIPXVFZSA-N 2 1 320.480 4.099 20 0 DIADMP C[C@@H]1CC[C@@H](C)C1[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255395795 1062434935 /nfs/dbraw/zinc/43/49/35/1062434935.db2.gz DMAXBFNRNOSQBK-ZHALLVOQSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)[C@H]1C ZINC001255401530 1062435377 /nfs/dbraw/zinc/43/53/77/1062435377.db2.gz BASQXRSQLONARE-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@H]1C ZINC001255401530 1062435390 /nfs/dbraw/zinc/43/53/90/1062435390.db2.gz BASQXRSQLONARE-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@H]1C ZINC001255401530 1062435396 /nfs/dbraw/zinc/43/53/96/1062435396.db2.gz BASQXRSQLONARE-HBFSDRIKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@]1(F)CCCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255398958 1062436057 /nfs/dbraw/zinc/43/60/57/1062436057.db2.gz NJNGCEWDNQDVFJ-WOJBJXKFSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255398958 1062436067 /nfs/dbraw/zinc/43/60/67/1062436067.db2.gz NJNGCEWDNQDVFJ-WOJBJXKFSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@@]1(F)CCCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255398958 1062436079 /nfs/dbraw/zinc/43/60/79/1062436079.db2.gz NJNGCEWDNQDVFJ-WOJBJXKFSA-N 2 1 318.480 4.255 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3C[C@@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001255399760 1062436128 /nfs/dbraw/zinc/43/61/28/1062436128.db2.gz ZCIHBHQWZUSSFT-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3C[C@@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001255399760 1062436142 /nfs/dbraw/zinc/43/61/42/1062436142.db2.gz ZCIHBHQWZUSSFT-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3C[C@@H]4CCCC[C@@H]4C3)CC2)cc1 ZINC001255399760 1062436148 /nfs/dbraw/zinc/43/61/48/1062436148.db2.gz ZCIHBHQWZUSSFT-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP Fc1ccc2c(c1)C[N@H+]([C@H]1CCC[NH+](Cc3ccccc3)CC1)C2 ZINC001255404444 1062439741 /nfs/dbraw/zinc/43/97/41/1062439741.db2.gz JFDXCKGVJGRTDF-NRFANRHFSA-N 2 1 324.443 4.196 20 0 DIADMP Fc1ccc2c(c1)C[N@@H+]([C@H]1CCC[NH+](Cc3ccccc3)CC1)C2 ZINC001255404444 1062439755 /nfs/dbraw/zinc/43/97/55/1062439755.db2.gz JFDXCKGVJGRTDF-NRFANRHFSA-N 2 1 324.443 4.196 20 0 DIADMP Fc1ccc2c(c1)C[NH+]([C@H]1CCC[N@H+](Cc3ccccc3)CC1)C2 ZINC001255404444 1062439766 /nfs/dbraw/zinc/43/97/66/1062439766.db2.gz JFDXCKGVJGRTDF-NRFANRHFSA-N 2 1 324.443 4.196 20 0 DIADMP Fc1ccc2c(c1)C[NH+]([C@H]1CCC[N@@H+](Cc3ccccc3)CC1)C2 ZINC001255404444 1062439781 /nfs/dbraw/zinc/43/97/81/1062439781.db2.gz JFDXCKGVJGRTDF-NRFANRHFSA-N 2 1 324.443 4.196 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255402659 1062440049 /nfs/dbraw/zinc/44/00/49/1062440049.db2.gz LEGNVBHUQAOBOP-QUCCMNQESA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255402659 1062440059 /nfs/dbraw/zinc/44/00/59/1062440059.db2.gz LEGNVBHUQAOBOP-QUCCMNQESA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1CCCCC[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255402659 1062440073 /nfs/dbraw/zinc/44/00/73/1062440073.db2.gz LEGNVBHUQAOBOP-QUCCMNQESA-N 2 1 300.490 4.306 20 0 DIADMP FC(F)[C@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255406124 1062441177 /nfs/dbraw/zinc/44/11/77/1062441177.db2.gz PCSXIUBRWDOTAV-ROUUACIJSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255406124 1062441188 /nfs/dbraw/zinc/44/11/88/1062441188.db2.gz PCSXIUBRWDOTAV-ROUUACIJSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255406124 1062441199 /nfs/dbraw/zinc/44/11/99/1062441199.db2.gz PCSXIUBRWDOTAV-ROUUACIJSA-N 2 1 322.443 4.018 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408381 1062443290 /nfs/dbraw/zinc/44/32/90/1062443290.db2.gz KWFCAWFGQMZBPR-VQTJNVASSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408381 1062443303 /nfs/dbraw/zinc/44/33/03/1062443303.db2.gz KWFCAWFGQMZBPR-VQTJNVASSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[C@H]1CCC[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408381 1062443314 /nfs/dbraw/zinc/44/33/14/1062443314.db2.gz KWFCAWFGQMZBPR-VQTJNVASSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC4(CCC4)C3)CC2)cc1 ZINC001255410260 1062444604 /nfs/dbraw/zinc/44/46/04/1062444604.db2.gz SIZSINHOYKBIGG-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCCC4(CCC4)C3)CC2)cc1 ZINC001255410260 1062444612 /nfs/dbraw/zinc/44/46/12/1062444612.db2.gz SIZSINHOYKBIGG-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCCC4(CCC4)C3)CC2)cc1 ZINC001255410260 1062444619 /nfs/dbraw/zinc/44/46/19/1062444619.db2.gz SIZSINHOYKBIGG-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP CC/C=C\CC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001459892576 1062477515 /nfs/dbraw/zinc/47/75/15/1062477515.db2.gz QEZWVTIJTBJTSX-ARJAWSKDSA-N 2 1 312.501 4.331 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925802 1062499663 /nfs/dbraw/zinc/49/96/63/1062499663.db2.gz SXJPUGXUPJGFBK-NVXWUHKLSA-N 2 1 320.908 4.391 20 0 DIADMP C[C@H]([NH2+]Cc1cc(Cl)ccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001459925692 1062501142 /nfs/dbraw/zinc/50/11/42/1062501142.db2.gz SPIIIRJSUOTVOW-KBPBESRZSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cc(Cl)ccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925692 1062501164 /nfs/dbraw/zinc/50/11/64/1062501164.db2.gz SPIIIRJSUOTVOW-KBPBESRZSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001459925696 1062501412 /nfs/dbraw/zinc/50/14/12/1062501412.db2.gz SPIIIRJSUOTVOW-KGLIPLIRSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925696 1062501427 /nfs/dbraw/zinc/50/14/27/1062501427.db2.gz SPIIIRJSUOTVOW-KGLIPLIRSA-N 2 1 324.871 4.222 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1C ZINC001255671951 1062511901 /nfs/dbraw/zinc/51/19/01/1062511901.db2.gz YDNOAJPFHOYQTA-AQDPXUSMSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1C ZINC001255671951 1062511927 /nfs/dbraw/zinc/51/19/27/1062511927.db2.gz YDNOAJPFHOYQTA-AQDPXUSMSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(C)cc(C)c1 ZINC001255677426 1062511979 /nfs/dbraw/zinc/51/19/79/1062511979.db2.gz TVXDAVBELMIYOJ-NXEWRWPSSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(C)cc(C)c1 ZINC001255677426 1062512005 /nfs/dbraw/zinc/51/20/05/1062512005.db2.gz TVXDAVBELMIYOJ-NXEWRWPSSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@@H]1C ZINC001459985646 1062548671 /nfs/dbraw/zinc/54/86/71/1062548671.db2.gz NSAYRDHHEZNYON-XLIONFOSSA-N 2 1 300.490 4.293 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001255757180 1062578714 /nfs/dbraw/zinc/57/87/14/1062578714.db2.gz WCOWLBCXKWVEOK-XLAORIBOSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001255757180 1062578737 /nfs/dbraw/zinc/57/87/37/1062578737.db2.gz WCOWLBCXKWVEOK-XLAORIBOSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(SC[C@H](C)N2CCC([N@@H+](C)C3CC3)CC2)cc1 ZINC001255771509 1062591426 /nfs/dbraw/zinc/59/14/26/1062591426.db2.gz SMUIAYFUBXBMKL-INIZCTEOSA-N 2 1 318.530 4.034 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH+]2CCC([N@H+](C)C3CC3)CC2)cc1 ZINC001255771509 1062591447 /nfs/dbraw/zinc/59/14/47/1062591447.db2.gz SMUIAYFUBXBMKL-INIZCTEOSA-N 2 1 318.530 4.034 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH+]2CCC([N@@H+](C)C3CC3)CC2)cc1 ZINC001255771509 1062591467 /nfs/dbraw/zinc/59/14/67/1062591467.db2.gz SMUIAYFUBXBMKL-INIZCTEOSA-N 2 1 318.530 4.034 20 0 DIADMP Cc1ccc(C[C@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001255772787 1062595710 /nfs/dbraw/zinc/59/57/10/1062595710.db2.gz KIMRKBCUHGUEJH-SIKLNZKXSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH2+][C@@H](CC[NH+](C)C)c1ccccc1 ZINC001255830702 1062615171 /nfs/dbraw/zinc/61/51/71/1062615171.db2.gz RNWYJYWJDTYFDB-UZLBHIALSA-N 2 1 314.448 4.039 20 0 DIADMP C[C@H](Cc1ccccc1F)[NH2+][C@H](CC[NH+](C)C)c1ccccc1 ZINC001255830701 1062615444 /nfs/dbraw/zinc/61/54/44/1062615444.db2.gz RNWYJYWJDTYFDB-OXQOHEQNSA-N 2 1 314.448 4.039 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001255851466 1062632414 /nfs/dbraw/zinc/63/24/14/1062632414.db2.gz OYLMPLXLZZREKL-MJGOQNOKSA-N 2 1 318.480 4.097 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255861899 1062638522 /nfs/dbraw/zinc/63/85/22/1062638522.db2.gz IQPOMRCRPIYYPE-QSFXBCCZSA-N 2 1 318.480 4.271 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001255878198 1062650209 /nfs/dbraw/zinc/65/02/09/1062650209.db2.gz MTAKZYMMEIQGEI-UXPWSPDFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001255878198 1062650219 /nfs/dbraw/zinc/65/02/19/1062650219.db2.gz MTAKZYMMEIQGEI-UXPWSPDFSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001255878198 1062650236 /nfs/dbraw/zinc/65/02/36/1062650236.db2.gz MTAKZYMMEIQGEI-UXPWSPDFSA-N 2 1 318.480 4.096 20 0 DIADMP CC1([NH2+]C2CCCCCC2)CC[NH+](Cc2ccccc2)CC1 ZINC001255886278 1062654432 /nfs/dbraw/zinc/65/44/32/1062654432.db2.gz ZQVUIJLNAKBXKC-UHFFFAOYSA-N 2 1 300.490 4.354 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CC[NH+](C4CCCCCC4)C[C@H]3C2)cc1 ZINC001255893294 1062659466 /nfs/dbraw/zinc/65/94/66/1062659466.db2.gz HQZYRLMLXCUFDH-VQTJNVASSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@@H+](C4CCCCCC4)C[C@H]3C2)cc1 ZINC001255893294 1062659474 /nfs/dbraw/zinc/65/94/74/1062659474.db2.gz HQZYRLMLXCUFDH-VQTJNVASSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2C[C@@H]3CC[N@H+](C4CCCCCC4)C[C@H]3C2)cc1 ZINC001255893294 1062659482 /nfs/dbraw/zinc/65/94/82/1062659482.db2.gz HQZYRLMLXCUFDH-VQTJNVASSA-N 2 1 312.501 4.163 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001255967838 1062672309 /nfs/dbraw/zinc/67/23/09/1062672309.db2.gz TZMHKIUKGWELTB-DOTOQJQBSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC001255968416 1062672619 /nfs/dbraw/zinc/67/26/19/1062672619.db2.gz YFARUVWHAYVKJN-CQSZACIVSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC001255968416 1062672635 /nfs/dbraw/zinc/67/26/35/1062672635.db2.gz YFARUVWHAYVKJN-CQSZACIVSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001255968331 1062674004 /nfs/dbraw/zinc/67/40/04/1062674004.db2.gz XVIJETAKHCBRIV-RDJZCZTQSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001255968331 1062674009 /nfs/dbraw/zinc/67/40/09/1062674009.db2.gz XVIJETAKHCBRIV-RDJZCZTQSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+](C)Cc1ccccc1C(F)(F)F ZINC001255965130 1062674197 /nfs/dbraw/zinc/67/41/97/1062674197.db2.gz XYQJICUWOVGPAQ-CQSZACIVSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC001255965130 1062674206 /nfs/dbraw/zinc/67/42/06/1062674206.db2.gz XYQJICUWOVGPAQ-CQSZACIVSA-N 2 1 316.411 4.258 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001256073709 1062693985 /nfs/dbraw/zinc/69/39/85/1062693985.db2.gz ALZXYTLEFKZSJQ-UHFFFAOYSA-N 2 1 318.464 4.015 20 0 DIADMP Clc1ccc([C@@H](C[NH2+]C2CC[NH+](C3CC3)CC2)C2CC2)cc1 ZINC001256074352 1062695198 /nfs/dbraw/zinc/69/51/98/1062695198.db2.gz UMEMERQURZEDCN-IBGZPJMESA-N 2 1 318.892 4.050 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2C2CC[NH+](C3CC3)CC2)cc1C ZINC001256081453 1062698053 /nfs/dbraw/zinc/69/80/53/1062698053.db2.gz DYJNFTAWPHQCIG-NRFANRHFSA-N 2 1 312.501 4.457 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2C2CC[NH+](C3CC3)CC2)cc1C ZINC001256081453 1062698059 /nfs/dbraw/zinc/69/80/59/1062698059.db2.gz DYJNFTAWPHQCIG-NRFANRHFSA-N 2 1 312.501 4.457 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)C1 ZINC001256106890 1062705196 /nfs/dbraw/zinc/70/51/96/1062705196.db2.gz LUEKXFJCVWUAQA-HOJAQTOUSA-N 2 1 300.490 4.034 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001256108398 1062707850 /nfs/dbraw/zinc/70/78/50/1062707850.db2.gz AXSQBOFKUXUCPN-HGJUEJDCSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001256108398 1062707864 /nfs/dbraw/zinc/70/78/64/1062707864.db2.gz AXSQBOFKUXUCPN-HGJUEJDCSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001256120022 1062716243 /nfs/dbraw/zinc/71/62/43/1062716243.db2.gz XTIADIQNJJDYRT-VQTJNVASSA-N 2 1 300.490 4.131 20 0 DIADMP CC(C)CC[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001256367695 1062790268 /nfs/dbraw/zinc/79/02/68/1062790268.db2.gz IDLUPNFEKUDTTL-GOSISDBHSA-N 2 1 318.505 4.392 20 0 DIADMP CCOC1CCC([N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001256433072 1062818286 /nfs/dbraw/zinc/81/82/86/1062818286.db2.gz GVVWOWOYPPFOCZ-VHQLZKCGSA-N 2 1 310.526 4.095 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001256523726 1062848520 /nfs/dbraw/zinc/84/85/20/1062848520.db2.gz RSUASWGEEWRONX-RBDMOPTHSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001256523726 1062848537 /nfs/dbraw/zinc/84/85/37/1062848537.db2.gz RSUASWGEEWRONX-RBDMOPTHSA-N 2 1 320.480 4.317 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001256526619 1062850150 /nfs/dbraw/zinc/85/01/50/1062850150.db2.gz NUACHYCTNJQEOX-WMQCIHAUSA-N 2 1 323.484 4.175 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001256526619 1062850170 /nfs/dbraw/zinc/85/01/70/1062850170.db2.gz NUACHYCTNJQEOX-WMQCIHAUSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256536821 1062850875 /nfs/dbraw/zinc/85/08/75/1062850875.db2.gz GDQSXTKQSFTQQY-AZUAARDMSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256536821 1062850894 /nfs/dbraw/zinc/85/08/94/1062850894.db2.gz GDQSXTKQSFTQQY-AZUAARDMSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536821 1062850925 /nfs/dbraw/zinc/85/09/25/1062850925.db2.gz GDQSXTKQSFTQQY-AZUAARDMSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536821 1062850953 /nfs/dbraw/zinc/85/09/53/1062850953.db2.gz GDQSXTKQSFTQQY-AZUAARDMSA-N 2 1 312.501 4.448 20 0 DIADMP CCC[N@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256537812 1062858903 /nfs/dbraw/zinc/85/89/03/1062858903.db2.gz OTVCENOWPGIFTL-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256537812 1062858924 /nfs/dbraw/zinc/85/89/24/1062858924.db2.gz OTVCENOWPGIFTL-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256537812 1062858951 /nfs/dbraw/zinc/85/89/51/1062858951.db2.gz OTVCENOWPGIFTL-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[NH+](CC1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256537812 1062858973 /nfs/dbraw/zinc/85/89/73/1062858973.db2.gz OTVCENOWPGIFTL-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256539865 1062864786 /nfs/dbraw/zinc/86/47/86/1062864786.db2.gz YNNIAIQDAFXWKQ-DYESRHJHSA-N 2 1 306.453 4.055 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256539865 1062864811 /nfs/dbraw/zinc/86/48/11/1062864811.db2.gz YNNIAIQDAFXWKQ-DYESRHJHSA-N 2 1 306.453 4.055 20 0 DIADMP Cc1cccc(C[NH+](C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538661 1062865193 /nfs/dbraw/zinc/86/51/93/1062865193.db2.gz UZQKEQNVACIMAO-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[NH+](C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538661 1062865217 /nfs/dbraw/zinc/86/52/17/1062865217.db2.gz UZQKEQNVACIMAO-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538661 1062865241 /nfs/dbraw/zinc/86/52/41/1062865241.db2.gz UZQKEQNVACIMAO-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@H+](C)[C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538661 1062865264 /nfs/dbraw/zinc/86/52/64/1062865264.db2.gz UZQKEQNVACIMAO-DENIHFKCSA-N 2 1 322.496 4.480 20 0 DIADMP CC(C)[N@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551684 1062868224 /nfs/dbraw/zinc/86/82/24/1062868224.db2.gz UHHXAKYTOLAJHZ-FXAWDEMLSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551684 1062868244 /nfs/dbraw/zinc/86/82/44/1062868244.db2.gz UHHXAKYTOLAJHZ-FXAWDEMLSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551684 1062868261 /nfs/dbraw/zinc/86/82/61/1062868261.db2.gz UHHXAKYTOLAJHZ-FXAWDEMLSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256551684 1062868280 /nfs/dbraw/zinc/86/82/80/1062868280.db2.gz UHHXAKYTOLAJHZ-FXAWDEMLSA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554138 1062873218 /nfs/dbraw/zinc/87/32/18/1062873218.db2.gz NTXSPXCRYBWPAC-SXLOBPIMSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554138 1062873243 /nfs/dbraw/zinc/87/32/43/1062873243.db2.gz NTXSPXCRYBWPAC-SXLOBPIMSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554138 1062873263 /nfs/dbraw/zinc/87/32/63/1062873263.db2.gz NTXSPXCRYBWPAC-SXLOBPIMSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256554138 1062873270 /nfs/dbraw/zinc/87/32/70/1062873270.db2.gz NTXSPXCRYBWPAC-SXLOBPIMSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552390 1062873977 /nfs/dbraw/zinc/87/39/77/1062873977.db2.gz BWRGMXXNPFBFTL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552390 1062874004 /nfs/dbraw/zinc/87/40/04/1062874004.db2.gz BWRGMXXNPFBFTL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552390 1062874028 /nfs/dbraw/zinc/87/40/28/1062874028.db2.gz BWRGMXXNPFBFTL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001256552390 1062874053 /nfs/dbraw/zinc/87/40/53/1062874053.db2.gz BWRGMXXNPFBFTL-GGPKGHCWSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@H]2CC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001256553921 1062876039 /nfs/dbraw/zinc/87/60/39/1062876039.db2.gz MIIJAQDSOCUGLH-BHIYHBOVSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@H]2CC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001256553921 1062876060 /nfs/dbraw/zinc/87/60/60/1062876060.db2.gz MIIJAQDSOCUGLH-BHIYHBOVSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)C[C@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553921 1062876076 /nfs/dbraw/zinc/87/60/76/1062876076.db2.gz MIIJAQDSOCUGLH-BHIYHBOVSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)C[C@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553921 1062876093 /nfs/dbraw/zinc/87/60/93/1062876093.db2.gz MIIJAQDSOCUGLH-BHIYHBOVSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CC3(C2)CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256553993 1062876169 /nfs/dbraw/zinc/87/61/69/1062876169.db2.gz MYZHTRJUKJNYGK-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CC3(C2)CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256553993 1062876189 /nfs/dbraw/zinc/87/61/89/1062876189.db2.gz MYZHTRJUKJNYGK-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2CC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001256553923 1062876945 /nfs/dbraw/zinc/87/69/45/1062876945.db2.gz MIIJAQDSOCUGLH-NZSAHSFTSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2CC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001256553923 1062876967 /nfs/dbraw/zinc/87/69/67/1062876967.db2.gz MIIJAQDSOCUGLH-NZSAHSFTSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)C[C@@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553923 1062876991 /nfs/dbraw/zinc/87/69/91/1062876991.db2.gz MIIJAQDSOCUGLH-NZSAHSFTSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)C[C@@H]2CC2(C)C)CC[NH+]1Cc1ccccc1 ZINC001256553923 1062877012 /nfs/dbraw/zinc/87/70/12/1062877012.db2.gz MIIJAQDSOCUGLH-NZSAHSFTSA-N 2 1 300.490 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC3(C2)CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256553995 1062878217 /nfs/dbraw/zinc/87/82/17/1062878217.db2.gz MYZHTRJUKJNYGK-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC3(C2)CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256553995 1062878239 /nfs/dbraw/zinc/87/82/39/1062878239.db2.gz MYZHTRJUKJNYGK-QUCCMNQESA-N 2 1 312.501 4.306 20 0 DIADMP CC(C)C1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256556118 1062881742 /nfs/dbraw/zinc/88/17/42/1062881742.db2.gz XFBYDWRSJYOQJG-NQIIRXRSSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001256556118 1062881757 /nfs/dbraw/zinc/88/17/57/1062881757.db2.gz XFBYDWRSJYOQJG-NQIIRXRSSA-N 2 1 314.517 4.408 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC001256556306 1062885911 /nfs/dbraw/zinc/88/59/11/1062885911.db2.gz YRIZPTUVYUFXKR-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC001256556306 1062885926 /nfs/dbraw/zinc/88/59/26/1062885926.db2.gz YRIZPTUVYUFXKR-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC001256556306 1062885938 /nfs/dbraw/zinc/88/59/38/1062885938.db2.gz YRIZPTUVYUFXKR-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC001256556306 1062885959 /nfs/dbraw/zinc/88/59/59/1062885959.db2.gz YRIZPTUVYUFXKR-AJYBTWMASA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccccc1F ZINC001256563909 1062889434 /nfs/dbraw/zinc/88/94/34/1062889434.db2.gz JCHDQFCGIHBKHY-SFHVURJKSA-N 2 1 306.469 4.375 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc(F)cc(F)c1 ZINC001256566472 1062890035 /nfs/dbraw/zinc/89/00/35/1062890035.db2.gz KQZHTKGSXHYULX-QGZVFWFLSA-N 2 1 310.432 4.268 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)C1CC[NH+](C(C)(C)C)CC1 ZINC001256576249 1062898288 /nfs/dbraw/zinc/89/82/88/1062898288.db2.gz CIEPYFZCBPWTMH-UHFFFAOYSA-N 2 1 308.897 4.425 20 0 DIADMP Cc1ccc(CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1C ZINC001256597244 1062910041 /nfs/dbraw/zinc/91/00/41/1062910041.db2.gz RIMAKMWCXWNXAX-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP C[C@@H]1CC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001256603583 1062912304 /nfs/dbraw/zinc/91/23/04/1062912304.db2.gz GTSIGTVXTWRSAW-MRXNPFEDSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@@H]1CC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001256603583 1062912332 /nfs/dbraw/zinc/91/23/32/1062912332.db2.gz GTSIGTVXTWRSAW-MRXNPFEDSA-N 2 1 322.443 4.018 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccncc1 ZINC001256601626 1062913175 /nfs/dbraw/zinc/91/31/75/1062913175.db2.gz UDJHVFXMUZLGRD-NRFANRHFSA-N 2 1 323.484 4.177 20 0 DIADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)CC1CC1 ZINC001256602255 1062915577 /nfs/dbraw/zinc/91/55/77/1062915577.db2.gz RNHSYWKTMZFPJW-UHFFFAOYSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CCCc4ccccc4C3)CC2)cc1 ZINC001256611708 1062919851 /nfs/dbraw/zinc/91/98/51/1062919851.db2.gz UIOJLAXLKFUOLF-UHFFFAOYSA-N 2 1 320.480 4.099 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CCCc4ccccc4C3)CC2)cc1 ZINC001256611708 1062919877 /nfs/dbraw/zinc/91/98/77/1062919877.db2.gz UIOJLAXLKFUOLF-UHFFFAOYSA-N 2 1 320.480 4.099 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C(C)(C)C1 ZINC001460711476 1063007913 /nfs/dbraw/zinc/00/79/13/1063007913.db2.gz VLJGPHMAACYINX-QGZVFWFLSA-N 2 1 300.490 4.293 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](C)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256861776 1063019314 /nfs/dbraw/zinc/01/93/14/1063019314.db2.gz BUKXEZHBRSUMGD-FQEVSTJZSA-N 2 1 309.457 4.134 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256855218 1063021407 /nfs/dbraw/zinc/02/14/07/1063021407.db2.gz IOYPIOFLFVDFKZ-UHFFFAOYSA-N 2 1 323.484 4.351 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256895323 1063030870 /nfs/dbraw/zinc/03/08/70/1063030870.db2.gz AVBYZWNXSPMTIV-HKUYNNGSSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256895323 1063030897 /nfs/dbraw/zinc/03/08/97/1063030897.db2.gz AVBYZWNXSPMTIV-HKUYNNGSSA-N 2 1 300.490 4.004 20 0 DIADMP OCCCCCCCCCC[NH2+][C@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256904094 1063033892 /nfs/dbraw/zinc/03/38/92/1063033892.db2.gz HGADMAAJWIPZPY-IBGZPJMESA-N 2 1 324.553 4.096 20 0 DIADMP OCCCCCCCCCC[NH2+][C@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256904094 1063033916 /nfs/dbraw/zinc/03/39/16/1063033916.db2.gz HGADMAAJWIPZPY-IBGZPJMESA-N 2 1 324.553 4.096 20 0 DIADMP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@H+](CCCC1CCC1)C2 ZINC001460749710 1063036432 /nfs/dbraw/zinc/03/64/32/1063036432.db2.gz RKRVTSSPPTYHES-LEWJYISDSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@]12C[NH+](CCCC3CCC3)C[C@H]1C[N@H+](Cc1ccccc1)C2 ZINC001460749710 1063036445 /nfs/dbraw/zinc/03/64/45/1063036445.db2.gz RKRVTSSPPTYHES-LEWJYISDSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@]12C[NH+](CCCC3CCC3)C[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001460749710 1063036471 /nfs/dbraw/zinc/03/64/71/1063036471.db2.gz RKRVTSSPPTYHES-LEWJYISDSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(CCCC[NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC001256908113 1063041547 /nfs/dbraw/zinc/04/15/47/1063041547.db2.gz LFMGTTOQKMSTEG-LJQANCHMSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(CCCC[NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC001256908113 1063041567 /nfs/dbraw/zinc/04/15/67/1063041567.db2.gz LFMGTTOQKMSTEG-LJQANCHMSA-N 2 1 300.490 4.006 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1cccc(OC)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257252717 1063158887 /nfs/dbraw/zinc/15/88/87/1063158887.db2.gz GGZIBLZVKYSPAX-FHWLQOOXSA-N 2 1 318.505 4.346 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257252199 1063159933 /nfs/dbraw/zinc/15/99/33/1063159933.db2.gz ATWZHFFAZXLKGW-BZSNNMDCSA-N 2 1 306.469 4.476 20 0 DIADMP CCC[C@@H](CC)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001257265502 1063170642 /nfs/dbraw/zinc/17/06/42/1063170642.db2.gz FQJRHDQOEHEFFR-HXUWFJFHSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[C@H](CC)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001257265904 1063170667 /nfs/dbraw/zinc/17/06/67/1063170667.db2.gz KWNIDIZNEDXRKY-IBGZPJMESA-N 2 1 300.490 4.088 20 0 DIADMP CCC[C@H](CC)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001257265904 1063170680 /nfs/dbraw/zinc/17/06/80/1063170680.db2.gz KWNIDIZNEDXRKY-IBGZPJMESA-N 2 1 300.490 4.088 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC([NH3+])(c2ccccc2C(F)(F)F)CC1 ZINC001257310972 1063196503 /nfs/dbraw/zinc/19/65/03/1063196503.db2.gz HFKPHQKKVSJAOW-CYBMUJFWSA-N 2 1 314.395 4.144 20 0 DIADMP CCC[C@H](C)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001257321295 1063200580 /nfs/dbraw/zinc/20/05/80/1063200580.db2.gz ZWTXVJVGHBROJY-WMZOPIPTSA-N 2 1 304.478 4.145 20 0 DIADMP CCC[C@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001257321905 1063201513 /nfs/dbraw/zinc/20/15/13/1063201513.db2.gz ZCGIJOLDKJVFLD-SFHVURJKSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[N@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257324573 1063207198 /nfs/dbraw/zinc/20/71/98/1063207198.db2.gz PMXGCSLTMCDJGO-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001257324573 1063207221 /nfs/dbraw/zinc/20/72/21/1063207221.db2.gz PMXGCSLTMCDJGO-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001257324573 1063207243 /nfs/dbraw/zinc/20/72/43/1063207243.db2.gz PMXGCSLTMCDJGO-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]CC(C)(C)c1ccccc1 ZINC001461049530 1063214274 /nfs/dbraw/zinc/21/42/74/1063214274.db2.gz FLPVXKVNQRXTAE-SFHVURJKSA-N 2 1 302.506 4.208 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2ccc3c(c2)CCC3)C1 ZINC001461050606 1063218878 /nfs/dbraw/zinc/21/88/78/1063218878.db2.gz MTZOXNASXOBMMG-HDICACEKSA-N 2 1 314.517 4.023 20 0 DIADMP CC[C@@H](C[NH2+]C[C@H](C1CCCCC1)[NH+](C)C)c1ccccc1 ZINC001461050731 1063219234 /nfs/dbraw/zinc/21/92/34/1063219234.db2.gz MLAJEXVIKOJQJQ-FXAWDEMLSA-N 2 1 302.506 4.280 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+](C2CCCC2)CC1 ZINC001257355173 1063225406 /nfs/dbraw/zinc/22/54/06/1063225406.db2.gz PTYFZUSDWJRJRR-UHFFFAOYSA-N 2 1 306.881 4.179 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](C2CCCC2)CC1 ZINC001257355173 1063225427 /nfs/dbraw/zinc/22/54/27/1063225427.db2.gz PTYFZUSDWJRJRR-UHFFFAOYSA-N 2 1 306.881 4.179 20 0 DIADMP CCc1cccc2cc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)oc21 ZINC001461065293 1063229307 /nfs/dbraw/zinc/22/93/07/1063229307.db2.gz JGDYSLNSWHOOLY-UHFFFAOYSA-N 2 1 314.473 4.348 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257414921 1063262031 /nfs/dbraw/zinc/26/20/31/1063262031.db2.gz TXZNZEIFPLWNIP-GUDVDZBRSA-N 2 1 303.494 4.122 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]CC2CCC(C)(C)CC2)c1 ZINC001461170174 1063307722 /nfs/dbraw/zinc/30/77/22/1063307722.db2.gz JLNMYMKKMNPJEY-UHFFFAOYSA-N 2 1 302.506 4.444 20 0 DIADMP CCC[C@@H](C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC001461170805 1063308312 /nfs/dbraw/zinc/30/83/12/1063308312.db2.gz MVGMKCZSPNHLCU-QUCCMNQESA-N 2 1 302.506 4.280 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257505435 1063314894 /nfs/dbraw/zinc/31/48/94/1063314894.db2.gz VRDQRNUOPRXSRA-BHIYHBOVSA-N 2 1 303.494 4.122 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257506647 1063318816 /nfs/dbraw/zinc/31/88/16/1063318816.db2.gz REIUWBNYDQFXBO-LNLFQRSKSA-N 2 1 303.494 4.122 20 0 DIADMP CCCC[NH+](CCCC)CC[NH2+]C1CCC(OC(C)C)CC1 ZINC001257872236 1063414994 /nfs/dbraw/zinc/41/49/94/1063414994.db2.gz UUNSKLMITZVFCD-UHFFFAOYSA-N 2 1 312.542 4.214 20 0 DIADMP CC[C@@H](C)[N@@H+](CCC[NH+]1CCCCC1)CCc1ccccc1F ZINC001473128290 1063434735 /nfs/dbraw/zinc/43/47/35/1063434735.db2.gz ICSVVHSAQDYALG-GOSISDBHSA-N 2 1 320.496 4.345 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001473145671 1063453059 /nfs/dbraw/zinc/45/30/59/1063453059.db2.gz VWROYBGKJMZKAA-UHFFFAOYSA-N 2 1 314.517 4.267 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)C1CC[NH+](CC(C)C)CC1 ZINC001258012142 1063464038 /nfs/dbraw/zinc/46/40/38/1063464038.db2.gz TULONZRVMIGDRD-UHFFFAOYSA-N 2 1 302.506 4.265 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001258016136 1063466716 /nfs/dbraw/zinc/46/67/16/1063466716.db2.gz BHTTWNZVJSQTOS-HNNXBMFYSA-N 2 1 308.897 4.453 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)C1CC[NH+](CC(C)C)CC1 ZINC001258017349 1063466961 /nfs/dbraw/zinc/46/69/61/1063466961.db2.gz FJRXCVDJXQBFRC-UHFFFAOYSA-N 2 1 308.897 4.282 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC001473169723 1063473458 /nfs/dbraw/zinc/47/34/58/1063473458.db2.gz FJSQAVQCCCCXSU-WAPOTWQKSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC001473169723 1063473466 /nfs/dbraw/zinc/47/34/66/1063473466.db2.gz FJSQAVQCCCCXSU-WAPOTWQKSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H]2CC[C@@H]3C[C@@H]3C2)C1 ZINC001473169723 1063473475 /nfs/dbraw/zinc/47/34/75/1063473475.db2.gz FJSQAVQCCCCXSU-WAPOTWQKSA-N 2 1 304.522 4.009 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC001473178062 1063486586 /nfs/dbraw/zinc/48/65/86/1063486586.db2.gz VNABJVHKVXKWMW-GOSISDBHSA-N 2 1 322.496 4.320 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC001461425895 1063493561 /nfs/dbraw/zinc/49/35/61/1063493561.db2.gz KTVUGFWYHIBWKT-GJZGRUSLSA-N 2 1 321.534 4.009 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC001461425895 1063493572 /nfs/dbraw/zinc/49/35/72/1063493572.db2.gz KTVUGFWYHIBWKT-GJZGRUSLSA-N 2 1 321.534 4.009 20 0 DIADMP C[C@H]([NH2+]C/C=C\c1cccc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001461426263 1063494931 /nfs/dbraw/zinc/49/49/31/1063494931.db2.gz NKEBIPHZMNPXKQ-AZTQUHGTSA-N 2 1 316.464 4.082 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1CC(C)(C)C1 ZINC001461440137 1063507018 /nfs/dbraw/zinc/50/70/18/1063507018.db2.gz ACOAFDHEIPBWHJ-UHFFFAOYSA-N 2 1 302.506 4.170 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCCCc2ccc(F)cc2)CC1(C)C ZINC001461450955 1063513629 /nfs/dbraw/zinc/51/36/29/1063513629.db2.gz TYEYSOQDKDYCIB-GOSISDBHSA-N 2 1 306.469 4.001 20 0 DIADMP CCC[N@H+]([C@H](C)CC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258140968 1063531901 /nfs/dbraw/zinc/53/19/01/1063531901.db2.gz PXRKEGSWGZJJAV-GOSISDBHSA-N 2 1 302.506 4.204 20 0 DIADMP CCC[N@@H+]([C@H](C)CC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258140968 1063531920 /nfs/dbraw/zinc/53/19/20/1063531920.db2.gz PXRKEGSWGZJJAV-GOSISDBHSA-N 2 1 302.506 4.204 20 0 DIADMP CC1(C)CC[C@@H](C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC001258137092 1063532141 /nfs/dbraw/zinc/53/21/41/1063532141.db2.gz AKCNVJSYVCBXJO-LJQANCHMSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H](Cc1ccco1)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258182915 1063548788 /nfs/dbraw/zinc/54/87/88/1063548788.db2.gz ZBTMCGKPCSGBLJ-JFIYKMOQSA-N 2 1 304.478 4.115 20 0 DIADMP CSCC[C@@H](C)[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258211889 1063563427 /nfs/dbraw/zinc/56/34/27/1063563427.db2.gz OBCNLZYMWFHPOS-BHIYHBOVSA-N 2 1 320.546 4.209 20 0 DIADMP CSCC[C@H](C)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258212954 1063564074 /nfs/dbraw/zinc/56/40/74/1063564074.db2.gz WZODDAFYCIXMJL-WBAXXEDZSA-N 2 1 324.509 4.039 20 0 DIADMP CC1(C)CCC[C@H]([N@@H+](Cc2cccnc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258281074 1063584475 /nfs/dbraw/zinc/58/44/75/1063584475.db2.gz BXVWEBYSVKLBBH-FHWLQOOXSA-N 2 1 315.505 4.122 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCCC(C)(C)C1 ZINC001258288598 1063590231 /nfs/dbraw/zinc/59/02/31/1063590231.db2.gz HGRWOUIRXNYXDZ-VQTJNVASSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CCCC(C)(C)C1 ZINC001258288598 1063590248 /nfs/dbraw/zinc/59/02/48/1063590248.db2.gz HGRWOUIRXNYXDZ-VQTJNVASSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CCCC(C)(C)C1 ZINC001258288598 1063590258 /nfs/dbraw/zinc/59/02/58/1063590258.db2.gz HGRWOUIRXNYXDZ-VQTJNVASSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+][C@@H]1CCC[N@@H+](C)CC1 ZINC001258296408 1063593673 /nfs/dbraw/zinc/59/36/73/1063593673.db2.gz WPKHSFKBOXIMQS-HZPDHXFCSA-N 2 1 324.534 4.144 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1C ZINC001461591230 1063599038 /nfs/dbraw/zinc/59/90/38/1063599038.db2.gz YCSXONBIIXLEKJ-YADHBBJMSA-N 2 1 322.496 4.047 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001258315145 1063606715 /nfs/dbraw/zinc/60/67/15/1063606715.db2.gz KANYZYPSOKIUBF-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP CSC(C)(C)C[C@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001258320741 1063607636 /nfs/dbraw/zinc/60/76/36/1063607636.db2.gz WSLSGJSTPWSPBR-INIZCTEOSA-N 2 1 320.546 4.161 20 0 DIADMP CSC(C)(C)C[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001258320742 1063608593 /nfs/dbraw/zinc/60/85/93/1063608593.db2.gz WSLSGJSTPWSPBR-MRXNPFEDSA-N 2 1 320.546 4.161 20 0 DIADMP CC(C)c1ccccc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461664436 1063644357 /nfs/dbraw/zinc/64/43/57/1063644357.db2.gz RACPGZZDJVNPBY-SFHVURJKSA-N 2 1 300.490 4.022 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461666192 1063647332 /nfs/dbraw/zinc/64/73/32/1063647332.db2.gz WPLIPMREORZNOX-KRWDZBQOSA-N 2 1 320.908 4.168 20 0 DIADMP CC(C)(C)C1CCC([NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)CC1 ZINC001461666396 1063647636 /nfs/dbraw/zinc/64/76/36/1063647636.db2.gz XOBREFQDAZVKES-LMDPOFIKSA-N 2 1 306.538 4.303 20 0 DIADMP CCCCC[C@@H](CC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258433532 1063650476 /nfs/dbraw/zinc/65/04/76/1063650476.db2.gz GQQFZRCJNDHVLF-KZNAEPCWSA-N 2 1 310.526 4.096 20 0 DIADMP CCCCC[C@H](CC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258434589 1063652266 /nfs/dbraw/zinc/65/22/66/1063652266.db2.gz NZXJMJRNKINLIM-KRWDZBQOSA-N 2 1 318.505 4.304 20 0 DIADMP C[C@H](CC1CC1)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001258461747 1063666957 /nfs/dbraw/zinc/66/69/57/1063666957.db2.gz FTNPTYPDWIVZCQ-GOSISDBHSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001258471093 1063669669 /nfs/dbraw/zinc/66/96/69/1063669669.db2.gz WGSNSFFNHWUSSJ-HNNXBMFYSA-N 2 1 320.908 4.425 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)cc2)CC1 ZINC001258471093 1063669676 /nfs/dbraw/zinc/66/96/76/1063669676.db2.gz WGSNSFFNHWUSSJ-HNNXBMFYSA-N 2 1 320.908 4.425 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001258598854 1063702645 /nfs/dbraw/zinc/70/26/45/1063702645.db2.gz XYJMCAZTWUCCLR-INIZCTEOSA-N 2 1 306.881 4.169 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001258598855 1063703357 /nfs/dbraw/zinc/70/33/57/1063703357.db2.gz XYJMCAZTWUCCLR-MRXNPFEDSA-N 2 1 306.881 4.169 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258607568 1063709629 /nfs/dbraw/zinc/70/96/29/1063709629.db2.gz LTKWFIIUEHMANJ-HXUWFJFHSA-N 2 1 312.501 4.088 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258607568 1063709642 /nfs/dbraw/zinc/70/96/42/1063709642.db2.gz LTKWFIIUEHMANJ-HXUWFJFHSA-N 2 1 312.501 4.088 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@@H]2C[C@H](C)CC(C)(C)C2)CC1 ZINC001258688298 1063753157 /nfs/dbraw/zinc/75/31/57/1063753157.db2.gz OAKIIQGWVMEUHC-MAUKXSAKSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC(C)(C)C1 ZINC001258693244 1063755596 /nfs/dbraw/zinc/75/55/96/1063755596.db2.gz VPUDQJOMVKNLTP-MAUKXSAKSA-N 2 1 318.480 4.290 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001258701709 1063759532 /nfs/dbraw/zinc/75/95/32/1063759532.db2.gz MPEMDEGCCSUGCQ-PMACEKPBSA-N 2 1 302.506 4.109 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258708012 1063765435 /nfs/dbraw/zinc/76/54/35/1063765435.db2.gz QGIQMIYEVLBPFP-NCYKPQTJSA-N 2 1 314.517 4.393 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258708012 1063765449 /nfs/dbraw/zinc/76/54/49/1063765449.db2.gz QGIQMIYEVLBPFP-NCYKPQTJSA-N 2 1 314.517 4.393 20 0 DIADMP C[N@@H+](CC1CCC2(CCCCC2)CC1)C[C@@H]1CCC[NH+](C)C1 ZINC001461886153 1063774929 /nfs/dbraw/zinc/77/49/29/1063774929.db2.gz CMZHTXMIBFFLMY-LJQANCHMSA-N 2 1 306.538 4.401 20 0 DIADMP C[NH+](CC1CCC2(CCCCC2)CC1)C[C@@H]1CCC[N@H+](C)C1 ZINC001461886153 1063774944 /nfs/dbraw/zinc/77/49/44/1063774944.db2.gz CMZHTXMIBFFLMY-LJQANCHMSA-N 2 1 306.538 4.401 20 0 DIADMP C[NH+](CC1CCC2(CCCCC2)CC1)C[C@@H]1CCC[N@@H+](C)C1 ZINC001461886153 1063774958 /nfs/dbraw/zinc/77/49/58/1063774958.db2.gz CMZHTXMIBFFLMY-LJQANCHMSA-N 2 1 306.538 4.401 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1cccc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258741607 1063790947 /nfs/dbraw/zinc/79/09/47/1063790947.db2.gz MYTDVHHXZXERRL-WBAXXEDZSA-N 2 1 308.897 4.251 20 0 DIADMP CC(C)c1ccc(CC[N@@H+](C)CC[C@H]2CCCC[NH+]2C)cc1 ZINC001461920286 1063799589 /nfs/dbraw/zinc/79/95/89/1063799589.db2.gz JZVZPFFFSIEMFS-HXUWFJFHSA-N 2 1 302.506 4.159 20 0 DIADMP CC(C)c1ccc(CC[NH+](C)CC[C@H]2CCCC[N@@H+]2C)cc1 ZINC001461920286 1063799597 /nfs/dbraw/zinc/79/95/97/1063799597.db2.gz JZVZPFFFSIEMFS-HXUWFJFHSA-N 2 1 302.506 4.159 20 0 DIADMP CC(C)c1ccc(CC[NH+](C)CC[C@H]2CCCC[N@H+]2C)cc1 ZINC001461920286 1063799603 /nfs/dbraw/zinc/79/96/03/1063799603.db2.gz JZVZPFFFSIEMFS-HXUWFJFHSA-N 2 1 302.506 4.159 20 0 DIADMP CCCC[C@@H](CCC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258764697 1063811072 /nfs/dbraw/zinc/81/10/72/1063811072.db2.gz YPFIXPNCDPWTIW-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001258774066 1063815270 /nfs/dbraw/zinc/81/52/70/1063815270.db2.gz ICICUUAUBLVQRP-SFHVURJKSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001258774066 1063815274 /nfs/dbraw/zinc/81/52/74/1063815274.db2.gz ICICUUAUBLVQRP-SFHVURJKSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001258776131 1063815294 /nfs/dbraw/zinc/81/52/94/1063815294.db2.gz UTTFGXZJCMWGNH-GOSISDBHSA-N 2 1 318.530 4.420 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001258776131 1063815298 /nfs/dbraw/zinc/81/52/98/1063815298.db2.gz UTTFGXZJCMWGNH-GOSISDBHSA-N 2 1 318.530 4.420 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCCC[C@@H]2c2cccc(OC)c2)CC1 ZINC001258774616 1063816114 /nfs/dbraw/zinc/81/61/14/1063816114.db2.gz UGCUVAHPIQZJKR-HXUWFJFHSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCCC[C@@H]2c2cccc(OC)c2)CC1 ZINC001258774616 1063816128 /nfs/dbraw/zinc/81/61/28/1063816128.db2.gz UGCUVAHPIQZJKR-HXUWFJFHSA-N 2 1 316.489 4.097 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001258775426 1063816660 /nfs/dbraw/zinc/81/66/60/1063816660.db2.gz OJNWTKMBWKBWTR-OAHLLOKOSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001258775426 1063816671 /nfs/dbraw/zinc/81/66/71/1063816671.db2.gz OJNWTKMBWKBWTR-OAHLLOKOSA-N 2 1 306.881 4.004 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001258771783 1063817123 /nfs/dbraw/zinc/81/71/23/1063817123.db2.gz UROIOSLRACTPIE-UHFFFAOYSA-N 2 1 318.892 4.304 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001258771783 1063817131 /nfs/dbraw/zinc/81/71/31/1063817131.db2.gz UROIOSLRACTPIE-UHFFFAOYSA-N 2 1 318.892 4.304 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H](CCc3ccccc3)C2)CC1 ZINC001258778183 1063819933 /nfs/dbraw/zinc/81/99/33/1063819933.db2.gz YPYFAJNBIIKJKQ-HXUWFJFHSA-N 2 1 314.517 4.206 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258785118 1063821107 /nfs/dbraw/zinc/82/11/07/1063821107.db2.gz DTZVLPROYSFBIM-IAGOWNOFSA-N 2 1 318.505 4.160 20 0 DIADMP CC[C@H](C)C[C@H](CC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258799434 1063833991 /nfs/dbraw/zinc/83/39/91/1063833991.db2.gz FDJYVLDBEBIBDZ-RDJZCZTQSA-N 2 1 303.494 4.163 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814422 1063844674 /nfs/dbraw/zinc/84/46/74/1063844674.db2.gz OUTWLISENFFLHT-KNTRFNDTSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001258814514 1063845168 /nfs/dbraw/zinc/84/51/68/1063845168.db2.gz PMJMWYPENNUMEJ-WMLDXEAASA-N 2 1 306.881 4.169 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001258825520 1063850110 /nfs/dbraw/zinc/85/01/10/1063850110.db2.gz WWHWATZONGHQFL-IEBWSBKVSA-N 2 1 316.489 4.146 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001258848498 1063865455 /nfs/dbraw/zinc/86/54/55/1063865455.db2.gz GDKRWNFRFGUKSE-SFTDATJTSA-N 2 1 314.517 4.348 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001258852169 1063866506 /nfs/dbraw/zinc/86/65/06/1063866506.db2.gz ZNQDIQFLNOGCBT-HKBOAZHASA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258852169 1063866518 /nfs/dbraw/zinc/86/65/18/1063866518.db2.gz ZNQDIQFLNOGCBT-HKBOAZHASA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001258852169 1063866526 /nfs/dbraw/zinc/86/65/26/1063866526.db2.gz ZNQDIQFLNOGCBT-HKBOAZHASA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001258852171 1063867246 /nfs/dbraw/zinc/86/72/46/1063867246.db2.gz ZNQDIQFLNOGCBT-QHAWAJNXSA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258852171 1063867256 /nfs/dbraw/zinc/86/72/56/1063867256.db2.gz ZNQDIQFLNOGCBT-QHAWAJNXSA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001258852171 1063867267 /nfs/dbraw/zinc/86/72/67/1063867267.db2.gz ZNQDIQFLNOGCBT-QHAWAJNXSA-N 2 1 314.517 4.347 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCC[C@@H]1CCF ZINC000556857292 1063900384 /nfs/dbraw/zinc/90/03/84/1063900384.db2.gz RMPRZGTWDQBWAE-APWZRJJASA-N 2 1 306.469 4.145 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)cc2)c1 ZINC001462071549 1063914156 /nfs/dbraw/zinc/91/41/56/1063914156.db2.gz MJNQZRGAJVORMC-UHFFFAOYSA-N 2 1 320.480 4.378 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+]C(c2ccccc2)c2ccccc2)CC1 ZINC000378897026 1063980078 /nfs/dbraw/zinc/98/00/78/1063980078.db2.gz WSZAJSOPZSJFST-UHFFFAOYSA-N 2 1 322.496 4.486 20 0 DIADMP CC(C)C([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000379624631 1063986089 /nfs/dbraw/zinc/98/60/89/1063986089.db2.gz DQIPEKOYAWBRCA-HKUYNNGSSA-N 2 1 302.506 4.310 20 0 DIADMP CC(C)C([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000379624631 1063986100 /nfs/dbraw/zinc/98/61/00/1063986100.db2.gz DQIPEKOYAWBRCA-HKUYNNGSSA-N 2 1 302.506 4.310 20 0 DIADMP CC(C)C(C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)C ZINC000380916461 1063989390 /nfs/dbraw/zinc/98/93/90/1063989390.db2.gz SPYRTZQEBYINGH-IBGZPJMESA-N 2 1 302.506 4.026 20 0 DIADMP CCCC(CCC)[NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381799715 1063992324 /nfs/dbraw/zinc/99/23/24/1063992324.db2.gz RVLUHPQEERTVRK-PKOBYXMFSA-N 2 1 302.506 4.455 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)CC1 ZINC000381776098 1063992873 /nfs/dbraw/zinc/99/28/73/1063992873.db2.gz CYABKXIPQZSVFI-OSAJVMOISA-N 2 1 312.501 4.065 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381819087 1063994404 /nfs/dbraw/zinc/99/44/04/1063994404.db2.gz DZVZOVGHGGCQJG-NSHGMRRFSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381819085 1063994525 /nfs/dbraw/zinc/99/45/25/1063994525.db2.gz DZVZOVGHGGCQJG-NLWGTHIKSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCCC[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC000382066293 1063996955 /nfs/dbraw/zinc/99/69/55/1063996955.db2.gz RBEJXSRDLULOPU-WOJBJXKFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCCC[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000382066293 1063996963 /nfs/dbraw/zinc/99/69/63/1063996963.db2.gz RBEJXSRDLULOPU-WOJBJXKFSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCCC[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000382066293 1063996973 /nfs/dbraw/zinc/99/69/73/1063996973.db2.gz RBEJXSRDLULOPU-WOJBJXKFSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)C[C@H](C)C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000382073449 1063997582 /nfs/dbraw/zinc/99/75/82/1063997582.db2.gz SWSHGJQDTHRKOC-NSHGMRRFSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@]1(C[NH2+]C/C=C\c2ccccc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000383360913 1064002504 /nfs/dbraw/zinc/00/25/04/1064002504.db2.gz SRQZMWMUIOLKCD-NGHDKMLMSA-N 2 1 320.480 4.202 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517334 1064161355 /nfs/dbraw/zinc/16/13/55/1064161355.db2.gz ARXGCIACZBYXNK-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517334 1064161362 /nfs/dbraw/zinc/16/13/62/1064161362.db2.gz ARXGCIACZBYXNK-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390669536 1064166124 /nfs/dbraw/zinc/16/61/24/1064166124.db2.gz NMTVMYNBURENDX-MOPGFXCFSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@@H](CC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390669536 1064166129 /nfs/dbraw/zinc/16/61/29/1064166129.db2.gz NMTVMYNBURENDX-MOPGFXCFSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCCC[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390773881 1064169299 /nfs/dbraw/zinc/16/92/99/1064169299.db2.gz LOZJVFABEGQPSE-QUCCMNQESA-N 2 1 302.506 4.457 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)CC(c2ccccc2)c2ccccc2)CC1 ZINC000392288165 1064226620 /nfs/dbraw/zinc/22/66/20/1064226620.db2.gz NUYYUQFENMZVKO-UHFFFAOYSA-N 2 1 322.496 4.281 20 0 DIADMP C[N@H+]1CC[C@]2(C1)CCC[NH+](CCC13CC4CC(CC(C4)C1)C3)C2 ZINC001279275009 1064339611 /nfs/dbraw/zinc/33/96/11/1064339611.db2.gz AIIHQDLZAZWXHQ-KGMASTOKSA-N 2 1 316.533 4.011 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@H+](CCC13CC4CC(CC(C4)C1)C3)C2 ZINC001279275009 1064339627 /nfs/dbraw/zinc/33/96/27/1064339627.db2.gz AIIHQDLZAZWXHQ-KGMASTOKSA-N 2 1 316.533 4.011 20 0 DIADMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](CCC13CC4CC(CC(C4)C1)C3)C2 ZINC001279275009 1064339644 /nfs/dbraw/zinc/33/96/44/1064339644.db2.gz AIIHQDLZAZWXHQ-KGMASTOKSA-N 2 1 316.533 4.011 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3C[C@@H]4CC[N@@H+](C)CC[C@@H]4C3)cc2)o1 ZINC001279291601 1064342273 /nfs/dbraw/zinc/34/22/73/1064342273.db2.gz AQRRAWXZLKLANG-BGYRXZFFSA-N 2 1 324.468 4.029 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[NH+](C)CC[C@@H]4C3)cc2)o1 ZINC001279291601 1064342278 /nfs/dbraw/zinc/34/22/78/1064342278.db2.gz AQRRAWXZLKLANG-BGYRXZFFSA-N 2 1 324.468 4.029 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3C[C@@H]4CC[NH+](C)CC[C@@H]4C3)cc2)o1 ZINC001279291601 1064342289 /nfs/dbraw/zinc/34/22/89/1064342289.db2.gz AQRRAWXZLKLANG-BGYRXZFFSA-N 2 1 324.468 4.029 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[NH+]1CCC2(CC[N@@H+](C)C2)CC1 ZINC001279494115 1064353701 /nfs/dbraw/zinc/35/37/01/1064353701.db2.gz FDNNWQJDAKIHQL-SFHVURJKSA-N 2 1 324.553 4.026 20 0 DIADMP Cc1cccc(N2CCC[C@]3(CCC[N@@H+](C4CCCC4)C3)C2)[nH+]1 ZINC001279752225 1064365810 /nfs/dbraw/zinc/36/58/10/1064365810.db2.gz KPFAQQNYYOUWHT-FQEVSTJZSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cccc(N2CCC[C@]3(CCC[N@H+](C4CCCC4)C3)C2)[nH+]1 ZINC001279752225 1064365820 /nfs/dbraw/zinc/36/58/20/1064365820.db2.gz KPFAQQNYYOUWHT-FQEVSTJZSA-N 2 1 313.489 4.015 20 0 DIADMP CSc1cc(C)cc(C[N@@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)c1 ZINC001280162534 1064383418 /nfs/dbraw/zinc/38/34/18/1064383418.db2.gz CLOIPXZMKDULQT-LJQANCHMSA-N 2 1 318.530 4.025 20 0 DIADMP CSc1cc(C)cc(C[N@H+]2CCC[C@@]3(CCC[NH+](C)C3)C2)c1 ZINC001280162534 1064383434 /nfs/dbraw/zinc/38/34/34/1064383434.db2.gz CLOIPXZMKDULQT-LJQANCHMSA-N 2 1 318.530 4.025 20 0 DIADMP CSc1cc(C)cc(C[NH+]2CCC[C@@]3(CCC[N@H+](C)C3)C2)c1 ZINC001280162534 1064383440 /nfs/dbraw/zinc/38/34/40/1064383440.db2.gz CLOIPXZMKDULQT-LJQANCHMSA-N 2 1 318.530 4.025 20 0 DIADMP CSc1cc(C)cc(C[NH+]2CCC[C@@]3(CCC[N@@H+](C)C3)C2)c1 ZINC001280162534 1064383449 /nfs/dbraw/zinc/38/34/49/1064383449.db2.gz CLOIPXZMKDULQT-LJQANCHMSA-N 2 1 318.530 4.025 20 0 DIADMP CC(C)Oc1cccc(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000817888767 1064412107 /nfs/dbraw/zinc/41/21/07/1064412107.db2.gz OGIGEHOOVYWFSO-CTNGQTDRSA-N 2 1 324.468 4.057 20 0 DIADMP Fc1cccc(C2([NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)CCC2)c1 ZINC000647802328 1064415561 /nfs/dbraw/zinc/41/55/61/1064415561.db2.gz JCQPTIPZJYUCTM-WOJBJXKFSA-N 2 1 324.443 4.288 20 0 DIADMP CCCCC[N@@H+]1CCCC2=C[C@H]3C[C@H](C[NH+]4CCCC[C@H]34)[C@@H]21 ZINC000653861645 1064723393 /nfs/dbraw/zinc/72/33/93/1064723393.db2.gz AUCIROLPUVZRPC-MTQWCTHYSA-N 2 1 302.506 4.072 20 0 DIADMP CCCCC[N@H+]1CCCC2=C[C@H]3C[C@H](C[NH+]4CCCC[C@H]34)[C@@H]21 ZINC000653861645 1064723408 /nfs/dbraw/zinc/72/34/08/1064723408.db2.gz AUCIROLPUVZRPC-MTQWCTHYSA-N 2 1 302.506 4.072 20 0 DIADMP CCCCC[NH+]1CCCC2=C[C@H]3C[C@H](C[N@@H+]4CCCC[C@H]34)[C@@H]21 ZINC000653861645 1064723423 /nfs/dbraw/zinc/72/34/23/1064723423.db2.gz AUCIROLPUVZRPC-MTQWCTHYSA-N 2 1 302.506 4.072 20 0 DIADMP CCCCC[NH+]1CCCC2=C[C@H]3C[C@H](C[N@H+]4CCCC[C@H]34)[C@@H]21 ZINC000653861645 1064723435 /nfs/dbraw/zinc/72/34/35/1064723435.db2.gz AUCIROLPUVZRPC-MTQWCTHYSA-N 2 1 302.506 4.072 20 0 DIADMP C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001307492529 1065436620 /nfs/dbraw/zinc/43/66/20/1065436620.db2.gz MABDBRIEZHKATH-MSOLQXFVSA-N 2 1 300.490 4.293 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC12CCC(CC1)C2 ZINC001307495144 1065439107 /nfs/dbraw/zinc/43/91/07/1065439107.db2.gz AMVYBZOXQDFVSZ-CKHPTIKVSA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC12CCC(CC1)C2 ZINC001307495144 1065439115 /nfs/dbraw/zinc/43/91/15/1065439115.db2.gz AMVYBZOXQDFVSZ-CKHPTIKVSA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC12CCC(CC1)C2 ZINC001307495144 1065439120 /nfs/dbraw/zinc/43/91/20/1065439120.db2.gz AMVYBZOXQDFVSZ-CKHPTIKVSA-N 2 1 312.501 4.021 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](CC2CCC(c3ccccc3)CC2)C1 ZINC001307514889 1065454082 /nfs/dbraw/zinc/45/40/82/1065454082.db2.gz WWJPJMQMORSDMZ-OBXNSHGQSA-N 2 1 314.517 4.234 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC001307514889 1065454093 /nfs/dbraw/zinc/45/40/93/1065454093.db2.gz WWJPJMQMORSDMZ-OBXNSHGQSA-N 2 1 314.517 4.234 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC001307514889 1065454099 /nfs/dbraw/zinc/45/40/99/1065454099.db2.gz WWJPJMQMORSDMZ-OBXNSHGQSA-N 2 1 314.517 4.234 20 0 DIADMP CC1CC(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC001307523662 1065461332 /nfs/dbraw/zinc/46/13/32/1065461332.db2.gz BCPNKJFTSNWWQY-BOWFFMLLSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC001307523662 1065461336 /nfs/dbraw/zinc/46/13/36/1065461336.db2.gz BCPNKJFTSNWWQY-BOWFFMLLSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC001307523662 1065461341 /nfs/dbraw/zinc/46/13/41/1065461341.db2.gz BCPNKJFTSNWWQY-BOWFFMLLSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC001307523665 1065462332 /nfs/dbraw/zinc/46/23/32/1065462332.db2.gz BCPNKJFTSNWWQY-CGNZLSCGSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC001307523665 1065462335 /nfs/dbraw/zinc/46/23/35/1065462335.db2.gz BCPNKJFTSNWWQY-CGNZLSCGSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC001307523665 1065462342 /nfs/dbraw/zinc/46/23/42/1065462342.db2.gz BCPNKJFTSNWWQY-CGNZLSCGSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@H](C)C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001307523978 1065462379 /nfs/dbraw/zinc/46/23/79/1065462379.db2.gz QYPGHDRIUSVMLT-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001307523978 1065462383 /nfs/dbraw/zinc/46/23/83/1065462383.db2.gz QYPGHDRIUSVMLT-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001307523978 1065462390 /nfs/dbraw/zinc/46/23/90/1065462390.db2.gz QYPGHDRIUSVMLT-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC001307559545 1065482550 /nfs/dbraw/zinc/48/25/50/1065482550.db2.gz NYCVIYSZZUIMJL-SFHVURJKSA-N 2 1 313.489 4.079 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CCC[NH+]1CCCC1 ZINC001307725681 1065588460 /nfs/dbraw/zinc/58/84/60/1065588460.db2.gz RDLIDUUCAJFZEC-CYBMUJFWSA-N 2 1 315.288 4.472 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCC[NH+]1CCCC1 ZINC001307725681 1065588471 /nfs/dbraw/zinc/58/84/71/1065588471.db2.gz RDLIDUUCAJFZEC-CYBMUJFWSA-N 2 1 315.288 4.472 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001307785568 1065619901 /nfs/dbraw/zinc/61/99/01/1065619901.db2.gz NCDAQEXJZCVDFA-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001307785568 1065619903 /nfs/dbraw/zinc/61/99/03/1065619903.db2.gz NCDAQEXJZCVDFA-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001307785568 1065619911 /nfs/dbraw/zinc/61/99/11/1065619911.db2.gz NCDAQEXJZCVDFA-UTKZUKDTSA-N 2 1 308.469 4.319 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1Cc2cccc(C)c2CC1(C)C ZINC001307789907 1065621182 /nfs/dbraw/zinc/62/11/82/1065621182.db2.gz UQCYMVJVKFULBR-UHFFFAOYSA-N 2 1 311.473 4.117 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1Cc2cccc(C)c2CC1(C)C ZINC001307789907 1065621188 /nfs/dbraw/zinc/62/11/88/1065621188.db2.gz UQCYMVJVKFULBR-UHFFFAOYSA-N 2 1 311.473 4.117 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CCCN(c3cc[nH+]cc3)CC2)c(C)c1 ZINC001307875814 1065664467 /nfs/dbraw/zinc/66/44/67/1065664467.db2.gz SOZUHHGPIAZCEA-LJQANCHMSA-N 2 1 323.484 4.280 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)CCCc1c(F)cccc1F ZINC001308037559 1065735860 /nfs/dbraw/zinc/73/58/60/1065735860.db2.gz CXJFOMGQRHTKNA-UHFFFAOYSA-N 2 1 324.459 4.095 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC001308199281 1065805438 /nfs/dbraw/zinc/80/54/38/1065805438.db2.gz JEJVUWRYSYQMEL-UWVAXJGDSA-N 2 1 300.490 4.339 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)C1 ZINC001308198798 1065805483 /nfs/dbraw/zinc/80/54/83/1065805483.db2.gz CMICIKVXHSYGPS-UWVAXJGDSA-N 2 1 300.490 4.197 20 0 DIADMP CCc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001308204268 1065811772 /nfs/dbraw/zinc/81/17/72/1065811772.db2.gz QAPLAPKWPUOKMK-HDICACEKSA-N 2 1 302.506 4.097 20 0 DIADMP CCc1ccccc1C[NH2+]C1CC[NH+](Cc2ccccc2C)CC1 ZINC001308206328 1065814481 /nfs/dbraw/zinc/81/44/81/1065814481.db2.gz UVNQVKQRHGFMGT-UHFFFAOYSA-N 2 1 322.496 4.312 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC(C)(C)C[C@@H]2C)CC1 ZINC001308205694 1065815406 /nfs/dbraw/zinc/81/54/06/1065815406.db2.gz AXEMPJSBDXXSQS-FXAWDEMLSA-N 2 1 314.517 4.374 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+]C[C@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001308208946 1065817199 /nfs/dbraw/zinc/81/71/99/1065817199.db2.gz JLZJUXTXHUHLMA-MJGOQNOKSA-N 2 1 316.533 4.094 20 0 DIADMP C[C@H]1CCC[C@@](C[NH2+]CC(C)(C)c2ccccc2)([NH+](C)C)C1 ZINC001308219101 1065826028 /nfs/dbraw/zinc/82/60/28/1065826028.db2.gz QVNCDYUQUMMBDP-FXAWDEMLSA-N 2 1 302.506 4.064 20 0 DIADMP CCCCOc1ccccc1C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC001308254404 1065859486 /nfs/dbraw/zinc/85/94/86/1065859486.db2.gz NABWOZZYSMURPH-SFHVURJKSA-N 2 1 318.505 4.076 20 0 DIADMP CCCCOc1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC001308254404 1065859494 /nfs/dbraw/zinc/85/94/94/1065859494.db2.gz NABWOZZYSMURPH-SFHVURJKSA-N 2 1 318.505 4.076 20 0 DIADMP C[C@H]([NH2+]C1(C[NH2+][C@H]2CCC[C@@H]2C)CCCC1)c1ccccc1 ZINC001308278585 1065878941 /nfs/dbraw/zinc/87/89/41/1065878941.db2.gz DOCNEVGLKIIFDQ-LNLFQRSKSA-N 2 1 300.490 4.428 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CC(C)(C)C[C@@H]2C)c1 ZINC001308281696 1065880485 /nfs/dbraw/zinc/88/04/85/1065880485.db2.gz VXYISMYHVDTUTC-QFBILLFUSA-N 2 1 302.506 4.441 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CC(C)(C)C[C@@H]2C)c1 ZINC001308281695 1065881214 /nfs/dbraw/zinc/88/12/14/1065881214.db2.gz VXYISMYHVDTUTC-LPHOPBHVSA-N 2 1 302.506 4.441 20 0 DIADMP CC(C)CC[C@H]1CC[C@@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC001308302968 1065898911 /nfs/dbraw/zinc/89/89/11/1065898911.db2.gz BRXQKMGVWRQAPT-AZUAARDMSA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001308333279 1065919163 /nfs/dbraw/zinc/91/91/63/1065919163.db2.gz MHCHKDLYTYHCSU-APWZRJJASA-N 2 1 302.506 4.203 20 0 DIADMP CC(C)CCC[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001308333371 1065919206 /nfs/dbraw/zinc/91/92/06/1065919206.db2.gz LJPQCQBXJLWGRZ-AZUAARDMSA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC001308333282 1065920514 /nfs/dbraw/zinc/92/05/14/1065920514.db2.gz MHCHKDLYTYHCSU-VQIMIIECSA-N 2 1 302.506 4.203 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1(C2CC2)CCC1 ZINC001308343860 1065927563 /nfs/dbraw/zinc/92/75/63/1065927563.db2.gz XRLBXNWOYWCEFX-UHFFFAOYSA-N 2 1 314.517 4.315 20 0 DIADMP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cccc(Cl)c1N ZINC001308378581 1065952687 /nfs/dbraw/zinc/95/26/87/1065952687.db2.gz KPHNVTLBEYQWSL-UHFFFAOYSA-N 2 1 323.912 4.057 20 0 DIADMP C[C@@H]1CCC[C@H]1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382706 1065953979 /nfs/dbraw/zinc/95/39/79/1065953979.db2.gz RCOBNTKCXCMGJW-YZGWKJHDSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1CCC[C@H]1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382706 1065953984 /nfs/dbraw/zinc/95/39/84/1065953984.db2.gz RCOBNTKCXCMGJW-YZGWKJHDSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@H]1CC[C@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001308393366 1065958791 /nfs/dbraw/zinc/95/87/91/1065958791.db2.gz UACDDLLLGRODCC-HKUYNNGSSA-N 2 1 302.506 4.170 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001308393368 1065959536 /nfs/dbraw/zinc/95/95/36/1065959536.db2.gz UACDDLLLGRODCC-MJGOQNOKSA-N 2 1 302.506 4.170 20 0 DIADMP CCSC1(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CC1 ZINC001308473577 1066012075 /nfs/dbraw/zinc/01/20/75/1066012075.db2.gz KOWKZRLBFDMEBE-UHFFFAOYSA-N 2 1 320.546 4.020 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(Sc2ccccc2)cc1)[NH+](C)C ZINC001308478928 1066018200 /nfs/dbraw/zinc/01/82/00/1066018200.db2.gz LRVXKHJQHUROTD-MRXNPFEDSA-N 2 1 314.498 4.268 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCS1 ZINC001308539244 1066056101 /nfs/dbraw/zinc/05/61/01/1066056101.db2.gz CJQKVVMNQGOJAB-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559481 1066070128 /nfs/dbraw/zinc/07/01/28/1066070128.db2.gz CRKOZJIJYCRVND-DUIUGDAFSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559481 1066070140 /nfs/dbraw/zinc/07/01/40/1066070140.db2.gz CRKOZJIJYCRVND-DUIUGDAFSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559481 1066070152 /nfs/dbraw/zinc/07/01/52/1066070152.db2.gz CRKOZJIJYCRVND-DUIUGDAFSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C/C=C/c2c(C)cc(C)cc2C)C1 ZINC001308559481 1066070163 /nfs/dbraw/zinc/07/01/63/1066070163.db2.gz CRKOZJIJYCRVND-DUIUGDAFSA-N 2 1 314.517 4.289 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573274 1066088223 /nfs/dbraw/zinc/08/82/23/1066088223.db2.gz FHOKAPCNFCMDQJ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573274 1066088236 /nfs/dbraw/zinc/08/82/36/1066088236.db2.gz FHOKAPCNFCMDQJ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1Cl ZINC001308573274 1066088246 /nfs/dbraw/zinc/08/82/46/1066088246.db2.gz FHOKAPCNFCMDQJ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1Cl ZINC001308573274 1066088259 /nfs/dbraw/zinc/08/82/59/1066088259.db2.gz FHOKAPCNFCMDQJ-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573276 1066088843 /nfs/dbraw/zinc/08/88/43/1066088843.db2.gz FHOKAPCNFCMDQJ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1Cl ZINC001308573276 1066088847 /nfs/dbraw/zinc/08/88/47/1066088847.db2.gz FHOKAPCNFCMDQJ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1Cl ZINC001308573276 1066088852 /nfs/dbraw/zinc/08/88/52/1066088852.db2.gz FHOKAPCNFCMDQJ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1Cl ZINC001308573276 1066088860 /nfs/dbraw/zinc/08/88/60/1066088860.db2.gz FHOKAPCNFCMDQJ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597409 1066108645 /nfs/dbraw/zinc/10/86/45/1066108645.db2.gz AUGYJHLYXQDQQB-KRWDZBQOSA-N 2 1 312.501 4.215 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597409 1066108650 /nfs/dbraw/zinc/10/86/50/1066108650.db2.gz AUGYJHLYXQDQQB-KRWDZBQOSA-N 2 1 312.501 4.215 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597409 1066108655 /nfs/dbraw/zinc/10/86/55/1066108655.db2.gz AUGYJHLYXQDQQB-KRWDZBQOSA-N 2 1 312.501 4.215 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001308597409 1066108657 /nfs/dbraw/zinc/10/86/57/1066108657.db2.gz AUGYJHLYXQDQQB-KRWDZBQOSA-N 2 1 312.501 4.215 20 0 DIADMP CC[C@@H](C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1)c1ccccc1 ZINC001308612623 1066117504 /nfs/dbraw/zinc/11/75/04/1066117504.db2.gz PORPEBYZXNYEIP-IBGZPJMESA-N 2 1 302.506 4.232 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001308634200 1066128620 /nfs/dbraw/zinc/12/86/20/1066128620.db2.gz GDEAACGREIMYDS-MBPVOVBZSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2CC=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001308633620 1066128947 /nfs/dbraw/zinc/12/89/47/1066128947.db2.gz KNFVWRYWXOSCKJ-SFHLNBCPSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2CC=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001308633620 1066128950 /nfs/dbraw/zinc/12/89/50/1066128950.db2.gz KNFVWRYWXOSCKJ-SFHLNBCPSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)C[C@@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633620 1066128953 /nfs/dbraw/zinc/12/89/53/1066128953.db2.gz KNFVWRYWXOSCKJ-SFHLNBCPSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)C[C@@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633620 1066128957 /nfs/dbraw/zinc/12/89/57/1066128957.db2.gz KNFVWRYWXOSCKJ-SFHLNBCPSA-N 2 1 312.501 4.328 20 0 DIADMP CC(C)(C)[C@@]1(C[NH+]2CCCC2)CC[N@@H+](Cc2ccccc2)C1 ZINC001308648013 1066135014 /nfs/dbraw/zinc/13/50/14/1066135014.db2.gz YBYHSDSYNICTLA-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CCCC23CC[NH+](C)CC3)c(C)c1 ZINC001308689975 1066182620 /nfs/dbraw/zinc/18/26/20/1066182620.db2.gz SEEMGMKCZDVHQK-ALCCZGGFSA-N 2 1 312.501 4.185 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001308721522 1066199071 /nfs/dbraw/zinc/19/90/71/1066199071.db2.gz CNGHBYNENJHQAV-NQIIRXRSSA-N 2 1 314.517 4.485 20 0 DIADMP C[C@@]1(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]23)CC[N@@H+](Cc2ccccc2)C1 ZINC001308729009 1066205252 /nfs/dbraw/zinc/20/52/52/1066205252.db2.gz VIOSBGWZLGZARF-BURNTYAHSA-N 2 1 312.501 4.067 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccs3)cc2)C1 ZINC001308741856 1066216158 /nfs/dbraw/zinc/21/61/58/1066216158.db2.gz WIPZVQYGGIWFJB-KRWDZBQOSA-N 2 1 314.498 4.235 20 0 DIADMP CCCc1ccc(C[N@@H+](C)CCCc2[nH+]ccn2CCC)s1 ZINC001308744374 1066218433 /nfs/dbraw/zinc/21/84/33/1066218433.db2.gz UUYWUFQEHHRHAV-UHFFFAOYSA-N 2 1 319.518 4.372 20 0 DIADMP CCCc1ccc(C[N@H+](C)CCCc2[nH+]ccn2CCC)s1 ZINC001308744374 1066218443 /nfs/dbraw/zinc/21/84/43/1066218443.db2.gz UUYWUFQEHHRHAV-UHFFFAOYSA-N 2 1 319.518 4.372 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CCC[C@H](CC)C1 ZINC001308743503 1066219635 /nfs/dbraw/zinc/21/96/35/1066219635.db2.gz IUGJKJHMDYDPBV-ROUUACIJSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CCC[C@H](CC)C1 ZINC001308743503 1066219647 /nfs/dbraw/zinc/21/96/47/1066219647.db2.gz IUGJKJHMDYDPBV-ROUUACIJSA-N 2 1 305.510 4.374 20 0 DIADMP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308772732 1066246582 /nfs/dbraw/zinc/24/65/82/1066246582.db2.gz WIHQRASXJFHRSS-WLRLJWMZSA-N 2 1 314.517 4.313 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001308797450 1066272806 /nfs/dbraw/zinc/27/28/06/1066272806.db2.gz FLYWRGPDZSNAIU-ZIAGYGMSSA-N 2 1 316.942 4.433 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001308797450 1066272810 /nfs/dbraw/zinc/27/28/10/1066272810.db2.gz FLYWRGPDZSNAIU-ZIAGYGMSSA-N 2 1 316.942 4.433 20 0 DIADMP Cc1ccc([C@H]2CCC[C@@H]2[NH2+]CCC[N@H+](C)CC(C)C)cc1 ZINC001308847612 1066323862 /nfs/dbraw/zinc/32/38/62/1066323862.db2.gz LLMOYEBKMVXULX-UXHICEINSA-N 2 1 302.506 4.199 20 0 DIADMP CC[C@@H](CC1CCCCC1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308882896 1066361670 /nfs/dbraw/zinc/36/16/70/1066361670.db2.gz BYPGSOJFPFLPPS-UXHICEINSA-N 2 1 306.538 4.447 20 0 DIADMP C[C@H](C[N@@H+]1CCCC[C@H]1[C@@H](C)C[NH+](C)C)c1cc(F)cc(F)c1 ZINC001308882874 1066363240 /nfs/dbraw/zinc/36/32/40/1066363240.db2.gz SGRJSRMUBUEBSD-VCBZYWHSSA-N 2 1 324.459 4.121 20 0 DIADMP CCSc1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC001308917004 1066393598 /nfs/dbraw/zinc/39/35/98/1066393598.db2.gz FVFNJUBHIPOMPR-UHFFFAOYSA-N 2 1 306.519 4.151 20 0 DIADMP CC(C)O[C@H](C[N@H+]1CCC(C)(C)[NH2+]C(C)(C)C1)c1ccccc1 ZINC001308985196 1066433277 /nfs/dbraw/zinc/43/32/77/1066433277.db2.gz XLVZKITUFXSFJH-GOSISDBHSA-N 2 1 318.505 4.005 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccs1 ZINC000019914604 182164330 /nfs/dbraw/zinc/16/43/30/182164330.db2.gz NGVLADSJUZQCPC-HNNXBMFYSA-N 2 1 300.471 4.063 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cn1 ZINC000274801376 130263511 /nfs/dbraw/zinc/26/35/11/130263511.db2.gz VINKCKYUBLUOJB-KKUMJFAQSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(Cl)cn1 ZINC000274801376 130263512 /nfs/dbraw/zinc/26/35/12/130263512.db2.gz VINKCKYUBLUOJB-KKUMJFAQSA-N 2 1 321.896 4.039 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000274927693 130274539 /nfs/dbraw/zinc/27/45/39/130274539.db2.gz QDXRQFYLVCTKKQ-UIFIKXQLSA-N 2 1 323.484 4.033 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000274927698 130275494 /nfs/dbraw/zinc/27/54/94/130275494.db2.gz QDXRQFYLVCTKKQ-YYWHXJBOSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cc(Cl)ccc1Cl ZINC000275553031 130336492 /nfs/dbraw/zinc/33/64/92/130336492.db2.gz NLQPYXUGZHLXTN-RYUDHWBXSA-N 2 1 324.255 4.103 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000275648512 130353618 /nfs/dbraw/zinc/35/36/18/130353618.db2.gz UFMZYAAAFYGALF-VXGBXAGGSA-N 2 1 324.255 4.103 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000179834854 331546962 /nfs/dbraw/zinc/54/69/62/331546962.db2.gz LSHDCGOKGZTVAB-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000530914631 331635207 /nfs/dbraw/zinc/63/52/07/331635207.db2.gz CLBXGQWWIRAXLM-DLBZAZTESA-N 2 1 316.420 4.048 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1nccc2ccccc21 ZINC000564439940 331817703 /nfs/dbraw/zinc/81/77/03/331817703.db2.gz XBXHUUBVFVBXJD-MRXNPFEDSA-N 2 1 311.473 4.007 20 0 DIADMP C[C@H](CC[NH2+][C@H](C)c1nccc2ccccc21)[NH+]1CCCCC1 ZINC000558506365 331914370 /nfs/dbraw/zinc/91/43/70/331914370.db2.gz ZIGYWOYIHJNAAG-IAGOWNOFSA-N 2 1 311.473 4.150 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+]Cc1ccc(-c2ccccc2F)s1 ZINC000518271578 332004006 /nfs/dbraw/zinc/00/40/06/332004006.db2.gz AXJFPPSKWHTTFG-UHFFFAOYSA-N 2 1 320.477 4.374 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1ccc(-c2ccccc2F)s1 ZINC000518271578 332004008 /nfs/dbraw/zinc/00/40/08/332004008.db2.gz AXJFPPSKWHTTFG-UHFFFAOYSA-N 2 1 320.477 4.374 20 0 DIADMP CCc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C(C)C)cc1 ZINC000409446959 332031024 /nfs/dbraw/zinc/03/10/24/332031024.db2.gz BOHCXXARYGKBFP-NXEWRWPSSA-N 2 1 300.490 4.161 20 0 DIADMP CCc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C(C)C)cc1 ZINC000409446960 332031259 /nfs/dbraw/zinc/03/12/59/332031259.db2.gz BOHCXXARYGKBFP-RAFMOHDBSA-N 2 1 300.490 4.161 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)c2ccccc2F)CC1 ZINC000520044085 332032175 /nfs/dbraw/zinc/03/21/75/332032175.db2.gz OGBVZAVIIURGHZ-INIZCTEOSA-N 2 1 306.469 4.331 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000131770061 332033536 /nfs/dbraw/zinc/03/35/36/332033536.db2.gz QMNZLLDTLIIWNG-BPIHKTFHSA-N 2 1 316.489 4.140 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000131770061 332033538 /nfs/dbraw/zinc/03/35/38/332033538.db2.gz QMNZLLDTLIIWNG-BPIHKTFHSA-N 2 1 316.489 4.140 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCCC2CCOCC2)CC1 ZINC000410324183 332110916 /nfs/dbraw/zinc/11/09/16/332110916.db2.gz AYTUSUMMCIJWSD-UHFFFAOYSA-N 2 1 324.553 4.027 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc2ccc(C)cc2o1 ZINC000426052733 335096323 /nfs/dbraw/zinc/09/63/23/335096323.db2.gz ZGJQCPLFKZOVGU-OAHLLOKOSA-N 2 1 311.429 4.377 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000536476873 332250878 /nfs/dbraw/zinc/25/08/78/332250878.db2.gz WFIUDOJWXYGFNZ-VQTJNVASSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000536476873 332250879 /nfs/dbraw/zinc/25/08/79/332250879.db2.gz WFIUDOJWXYGFNZ-VQTJNVASSA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCc2ccc(Cl)cc21 ZINC000536491148 332252498 /nfs/dbraw/zinc/25/24/98/332252498.db2.gz IQCISJQNBLUKPX-GOSISDBHSA-N 2 1 317.864 4.292 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc3ccccc3c2)C1 ZINC000531101724 332262481 /nfs/dbraw/zinc/26/24/81/332262481.db2.gz YBSPUYFUNAOTMC-IBGZPJMESA-N 2 1 308.469 4.004 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2)C1 ZINC000531101724 332262483 /nfs/dbraw/zinc/26/24/83/332262483.db2.gz YBSPUYFUNAOTMC-IBGZPJMESA-N 2 1 308.469 4.004 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2)C1 ZINC000531101724 332262485 /nfs/dbraw/zinc/26/24/85/332262485.db2.gz YBSPUYFUNAOTMC-IBGZPJMESA-N 2 1 308.469 4.004 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767179 332280352 /nfs/dbraw/zinc/28/03/52/332280352.db2.gz OXHYSULDDAYULZ-QLFBSQMISA-N 2 1 300.421 4.112 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(F)c2ccccc21 ZINC000559767179 332280353 /nfs/dbraw/zinc/28/03/53/332280353.db2.gz OXHYSULDDAYULZ-QLFBSQMISA-N 2 1 300.421 4.112 20 0 DIADMP CC[N@@H+](CCCCn1ccnc1C)Cc1ccc(Cl)s1 ZINC000125427983 332282309 /nfs/dbraw/zinc/28/23/09/332282309.db2.gz ZSRLLRAPRNSFAS-UHFFFAOYSA-N 2 1 311.882 4.209 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)Cc1ccc(Cl)s1 ZINC000125427983 332282310 /nfs/dbraw/zinc/28/23/10/332282310.db2.gz ZSRLLRAPRNSFAS-UHFFFAOYSA-N 2 1 311.882 4.209 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2(C)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000559794462 332282524 /nfs/dbraw/zinc/28/25/24/332282524.db2.gz XLSCFJUSXULQAR-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2(C)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000559794462 332282526 /nfs/dbraw/zinc/28/25/26/332282526.db2.gz XLSCFJUSXULQAR-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794462 332282527 /nfs/dbraw/zinc/28/25/27/332282527.db2.gz XLSCFJUSXULQAR-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794462 332282529 /nfs/dbraw/zinc/28/25/29/332282529.db2.gz XLSCFJUSXULQAR-PKOBYXMFSA-N 2 1 300.490 4.162 20 0 DIADMP CCSCCC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000559918408 332293042 /nfs/dbraw/zinc/29/30/42/332293042.db2.gz GHYYMAUZYWCBAL-UHFFFAOYSA-N 2 1 320.546 4.162 20 0 DIADMP COC1CC[NH+](C2(C[NH2+][C@H](C)CCC(C)(C)C)CCCC2)CC1 ZINC000560246241 332322922 /nfs/dbraw/zinc/32/29/22/332322922.db2.gz OWJVFKNDKLEDGH-QGZVFWFLSA-N 2 1 324.553 4.214 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000560581280 332364242 /nfs/dbraw/zinc/36/42/42/332364242.db2.gz HETBLGDHZAPHFW-LBDPXKHJSA-N 2 1 320.443 4.208 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000560581280 332364244 /nfs/dbraw/zinc/36/42/44/332364244.db2.gz HETBLGDHZAPHFW-LBDPXKHJSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccc(C)cc1)C1CCC1 ZINC000427703500 332493011 /nfs/dbraw/zinc/49/30/11/332493011.db2.gz FRUXLQDSENELRJ-OXJNMPFZSA-N 2 1 311.473 4.267 20 0 DIADMP CC(C)c1ccc(C[C@@H]2CC[NH+](CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC000460986005 333177966 /nfs/dbraw/zinc/17/79/66/333177966.db2.gz YZOBISKPSQUIGN-FPOVZHCZSA-N 2 1 314.517 4.159 20 0 DIADMP c1cn2c(cccc2C[N@H+]2C[C@@H](c3ccccc3)[C@H]3CCC[C@@H]32)n1 ZINC000582089596 333208778 /nfs/dbraw/zinc/20/87/78/333208778.db2.gz MYLDSCWEMCKJSK-AABGKKOBSA-N 2 1 317.436 4.102 20 0 DIADMP Cc1ccnc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000514085405 333249459 /nfs/dbraw/zinc/24/94/59/333249459.db2.gz VLKHGQLVURSOOR-GOSISDBHSA-N 2 1 323.484 4.227 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000500645288 333251717 /nfs/dbraw/zinc/25/17/17/333251717.db2.gz CLWFLRPPHCXRJA-CEXWTWQISA-N 2 1 317.521 4.271 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497520785 333258417 /nfs/dbraw/zinc/25/84/17/333258417.db2.gz FHXCCQASPNPCSB-INIZCTEOSA-N 2 1 306.453 4.078 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]C2c3ccccc3-c3ccccc32)C1 ZINC000497520785 333258419 /nfs/dbraw/zinc/25/84/19/333258419.db2.gz FHXCCQASPNPCSB-INIZCTEOSA-N 2 1 306.453 4.078 20 0 DIADMP C[C@H]([NH2+]C1CC(C(C)(C)C)C1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000582112646 333272475 /nfs/dbraw/zinc/27/24/75/333272475.db2.gz OJXWSTIUGLVPMD-YUKKFIBKSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSc2ccccc21 ZINC000019993198 333295900 /nfs/dbraw/zinc/29/59/00/333295900.db2.gz FNUPIFJQSVZZOV-DOTOQJQBSA-N 2 1 304.503 4.078 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCSc2ccccc21 ZINC000019993198 333295902 /nfs/dbraw/zinc/29/59/02/333295902.db2.gz FNUPIFJQSVZZOV-DOTOQJQBSA-N 2 1 304.503 4.078 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000497829235 333297404 /nfs/dbraw/zinc/29/74/04/333297404.db2.gz RBONCHHGSWMTFL-BEFAXECRSA-N 2 1 314.473 4.451 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390565372 333300780 /nfs/dbraw/zinc/30/07/80/333300780.db2.gz BJECZBSKAIWAJF-NZSAHSFTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390565372 333300781 /nfs/dbraw/zinc/30/07/81/333300781.db2.gz BJECZBSKAIWAJF-NZSAHSFTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCCC1 ZINC000390583517 333303836 /nfs/dbraw/zinc/30/38/36/333303836.db2.gz FAXWEVJZQJFGLR-ZNDGOPKYSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594286 333305187 /nfs/dbraw/zinc/30/51/87/333305187.db2.gz GYHBWWKNHHTOSM-QRQLOZEOSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594286 333305188 /nfs/dbraw/zinc/30/51/88/333305188.db2.gz GYHBWWKNHHTOSM-QRQLOZEOSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H](CC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390685943 333314945 /nfs/dbraw/zinc/31/49/45/333314945.db2.gz XXIVDAPZEZFRSY-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H](CC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390685943 333314947 /nfs/dbraw/zinc/31/49/47/333314947.db2.gz XXIVDAPZEZFRSY-LPHOPBHVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]CCC1CCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390801613 333394417 /nfs/dbraw/zinc/39/44/17/333394417.db2.gz PMCRZYSUKQPQLW-FXAWDEMLSA-N 2 1 300.490 4.067 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+]C3CC[NH+](C4CC4)CC3)ccc2c1 ZINC000122856856 333463029 /nfs/dbraw/zinc/46/30/29/333463029.db2.gz MGDBQMNVROZFPU-HNNXBMFYSA-N 2 1 324.468 4.126 20 0 DIADMP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccsc2)c2ccc(Cl)cc2)C1 ZINC000563424250 333603160 /nfs/dbraw/zinc/60/31/60/333603160.db2.gz KDSZUGNUHBWEAG-BRWVUGGUSA-N 2 1 320.889 4.350 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000392003960 335149950 /nfs/dbraw/zinc/14/99/50/335149950.db2.gz RGMMSTLUDPSMOY-MYGYKHERSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000414658079 334059798 /nfs/dbraw/zinc/05/97/98/334059798.db2.gz IXTPBTAIPYJHPO-NVXWUHKLSA-N 2 1 312.482 4.007 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000280344873 334116658 /nfs/dbraw/zinc/11/66/58/334116658.db2.gz RVIMYVIOJUWDTJ-PXNSSMCTSA-N 2 1 315.505 4.025 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000415082616 334272130 /nfs/dbraw/zinc/27/21/30/334272130.db2.gz DFDUIRHMFDEKIB-SDDRHHMPSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@@H](C)c1ccc(Cl)cc1 ZINC000295116594 334218899 /nfs/dbraw/zinc/21/88/99/334218899.db2.gz WVUIAPUABFIGIA-NCEHJCIBSA-N 2 1 306.881 4.047 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@H+](C(C)C)C1 ZINC000582149470 334273658 /nfs/dbraw/zinc/27/36/58/334273658.db2.gz NAVVYHVBBJFKSU-PMACEKPBSA-N 2 1 302.506 4.108 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)Cc1ccccc1 ZINC000415087425 334275729 /nfs/dbraw/zinc/27/57/29/334275729.db2.gz UHWVPOVJGORSMC-NHCUHLMSSA-N 2 1 322.496 4.338 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccsc2)CC1 ZINC000514091970 334263896 /nfs/dbraw/zinc/26/38/96/334263896.db2.gz AICISFCRJVHOLH-UHFFFAOYSA-N 2 1 314.498 4.092 20 0 DIADMP C[C@@H](N[C@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(Cl)ccc1Cl ZINC000187644186 334266463 /nfs/dbraw/zinc/26/64/63/334266463.db2.gz DWXIGQZEYMVZCM-WZRBSPASSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC000187644170 334266537 /nfs/dbraw/zinc/26/65/37/334266537.db2.gz DWXIGQZEYMVZCM-DMDPSCGWSA-N 2 1 301.261 4.127 20 0 DIADMP Cc1cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1-c1ccccc1 ZINC000187749960 334271631 /nfs/dbraw/zinc/27/16/31/334271631.db2.gz WFRCRUOLXXZLDS-NHCUHLMSSA-N 2 1 320.480 4.378 20 0 DIADMP Clc1cccc([C@H]([NH2+]C[C@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000415094088 334280568 /nfs/dbraw/zinc/28/05/68/334280568.db2.gz WNKRBHOCIJVBBC-HNAYVOBHSA-N 2 1 314.860 4.019 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H]3CCSc4ccccc43)CC[NH2+]2)cc1 ZINC000415098531 334281225 /nfs/dbraw/zinc/28/12/25/334281225.db2.gz FMLWEEQLIFEJKQ-UHOSZYNNSA-N 2 1 324.493 4.306 20 0 DIADMP Cc1ccccc1C1(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC000415098512 334281353 /nfs/dbraw/zinc/28/13/53/334281353.db2.gz FJXOKUXBPQZIIU-FPOVZHCZSA-N 2 1 320.480 4.110 20 0 DIADMP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415113198 334282147 /nfs/dbraw/zinc/28/21/47/334282147.db2.gz BOSVDSFMXWEKSV-ZSYWTGECSA-N 2 1 300.490 4.284 20 0 DIADMP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415113195 334282179 /nfs/dbraw/zinc/28/21/79/334282179.db2.gz BOSVDSFMXWEKSV-YRXWBPOGSA-N 2 1 300.490 4.284 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCC1 ZINC000531962011 334312653 /nfs/dbraw/zinc/31/26/53/334312653.db2.gz GNWDZAOZKUBCTA-RVKKMQEKSA-N 2 1 320.908 4.080 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CCc3ccccc32)CC1 ZINC000531967588 334326353 /nfs/dbraw/zinc/32/63/53/334326353.db2.gz GTLUSFQTDBFSRC-JTSKRJEESA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000534757356 334336883 /nfs/dbraw/zinc/33/68/83/334336883.db2.gz XWQLSJYKFZPFMY-PXNSSMCTSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000534757356 334336885 /nfs/dbraw/zinc/33/68/85/334336885.db2.gz XWQLSJYKFZPFMY-PXNSSMCTSA-N 2 1 311.473 4.179 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000534757356 334336886 /nfs/dbraw/zinc/33/68/86/334336886.db2.gz XWQLSJYKFZPFMY-PXNSSMCTSA-N 2 1 311.473 4.179 20 0 DIADMP CCCOc1cccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000535082880 334366662 /nfs/dbraw/zinc/36/66/62/334366662.db2.gz PNHORNKLWXERGW-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP Cc1ccc([C@@H]([NH2+]CCCCn2cc[nH+]c2C)C2CCCC2)o1 ZINC000342780514 334570517 /nfs/dbraw/zinc/57/05/17/334570517.db2.gz KXHASOFSRDTVSZ-IBGZPJMESA-N 2 1 315.461 4.394 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000188068910 334635834 /nfs/dbraw/zinc/63/58/34/334635834.db2.gz WRKOASFQBXPENY-WOJBJXKFSA-N 2 1 311.473 4.072 20 0 DIADMP C[NH+](Cc1ccoc1)Cc1cccc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000343644382 335184484 /nfs/dbraw/zinc/18/44/84/335184484.db2.gz HTXOLCNBIDHDSG-UHFFFAOYSA-N 2 1 324.424 4.137 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)C1CCC(C(F)(F)F)CC1 ZINC000344125602 335219690 /nfs/dbraw/zinc/21/96/90/335219690.db2.gz IJOFAQYWVLGMHU-UHFFFAOYSA-N 2 1 317.399 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)C1CCC(C(F)(F)F)CC1 ZINC000344125602 335219692 /nfs/dbraw/zinc/21/96/92/335219692.db2.gz IJOFAQYWVLGMHU-UHFFFAOYSA-N 2 1 317.399 4.025 20 0 DIADMP C[C@@H](CC1CC1)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000344743088 335272785 /nfs/dbraw/zinc/27/27/85/335272785.db2.gz KBISAQJAQUYPRM-INIZCTEOSA-N 2 1 312.457 4.190 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000346305342 335398173 /nfs/dbraw/zinc/39/81/73/335398173.db2.gz HRHAUTRMEUNRJM-CYBMUJFWSA-N 2 1 303.837 4.071 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000346305342 335398175 /nfs/dbraw/zinc/39/81/75/335398175.db2.gz HRHAUTRMEUNRJM-CYBMUJFWSA-N 2 1 303.837 4.071 20 0 DIADMP C[C@@H](c1cccs1)[N@@H+](CCn1ccnc1)Cc1ccccc1 ZINC000346305537 335398405 /nfs/dbraw/zinc/39/84/05/335398405.db2.gz INVLIQKLLGQXGJ-INIZCTEOSA-N 2 1 311.454 4.208 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000346312110 335398863 /nfs/dbraw/zinc/39/88/63/335398863.db2.gz OJBOIJSBRVISOS-NSHDSACASA-N 2 1 312.244 4.191 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000346312110 335398864 /nfs/dbraw/zinc/39/88/64/335398864.db2.gz OJBOIJSBRVISOS-NSHDSACASA-N 2 1 312.244 4.191 20 0 DIADMP CC(C)Cc1ccc([C@@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC000347758347 335527298 /nfs/dbraw/zinc/52/72/98/335527298.db2.gz QFKZCXIFCYQJHV-FQEVSTJZSA-N 2 1 313.489 4.148 20 0 DIADMP CCSCC[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348068174 335545879 /nfs/dbraw/zinc/54/58/79/335545879.db2.gz DTEUZMPEIZFLPP-GJZGRUSLSA-N 2 1 317.502 4.363 20 0 DIADMP CCSCC[C@@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348068177 335545995 /nfs/dbraw/zinc/54/59/95/335545995.db2.gz DTEUZMPEIZFLPP-HUUCEWRRSA-N 2 1 317.502 4.363 20 0 DIADMP Cc1sccc1C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000351568544 336045491 /nfs/dbraw/zinc/04/54/91/336045491.db2.gz ODUFLHFVTMFHMJ-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1sccc1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000351568544 336045492 /nfs/dbraw/zinc/04/54/92/336045492.db2.gz ODUFLHFVTMFHMJ-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1sccc1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000351568544 336045494 /nfs/dbraw/zinc/04/54/94/336045494.db2.gz ODUFLHFVTMFHMJ-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1sccc1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000351568544 336045496 /nfs/dbraw/zinc/04/54/96/336045496.db2.gz ODUFLHFVTMFHMJ-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2CCCC(F)(F)C2)CC1 ZINC000352357474 336214022 /nfs/dbraw/zinc/21/40/22/336214022.db2.gz NTABHQPAMLMORN-HNNXBMFYSA-N 2 1 324.415 4.059 20 0 DIADMP C[C@H](C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1 ZINC000526123802 336219221 /nfs/dbraw/zinc/21/92/21/336219221.db2.gz MMSBWEFYTBRQNX-DLBZAZTESA-N 2 1 306.469 4.031 20 0 DIADMP C[C@H](C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1 ZINC000526123803 336219238 /nfs/dbraw/zinc/21/92/38/336219238.db2.gz MMSBWEFYTBRQNX-IAGOWNOFSA-N 2 1 306.469 4.031 20 0 DIADMP CCC1(CC)CCC([NH2+]Cc2ncc(C[NH+](C)C)s2)CC1 ZINC000352714479 336231945 /nfs/dbraw/zinc/23/19/45/336231945.db2.gz WRCUHQSCPUHPBK-UHFFFAOYSA-N 2 1 309.523 4.043 20 0 DIADMP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000532393497 336245261 /nfs/dbraw/zinc/24/52/61/336245261.db2.gz JXQDATFSTRFGSN-WBVHZDCISA-N 2 1 321.534 4.011 20 0 DIADMP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1cnc(C2CC2)s1 ZINC000532393495 336245298 /nfs/dbraw/zinc/24/52/98/336245298.db2.gz JXQDATFSTRFGSN-NVXWUHKLSA-N 2 1 321.534 4.011 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cc2ccccc2o1 ZINC000580359885 336259585 /nfs/dbraw/zinc/25/95/85/336259585.db2.gz BQTRJIGMVPKOMF-GMBSWORKSA-N 2 1 300.446 4.202 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc2ccccc2o1 ZINC000580359885 336259586 /nfs/dbraw/zinc/25/95/86/336259586.db2.gz BQTRJIGMVPKOMF-GMBSWORKSA-N 2 1 300.446 4.202 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000532737700 336268861 /nfs/dbraw/zinc/26/88/61/336268861.db2.gz MOOLAICBTKJHNQ-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000532737700 336268862 /nfs/dbraw/zinc/26/88/62/336268862.db2.gz MOOLAICBTKJHNQ-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000532737700 336268863 /nfs/dbraw/zinc/26/88/63/336268863.db2.gz MOOLAICBTKJHNQ-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000532737700 336268864 /nfs/dbraw/zinc/26/88/64/336268864.db2.gz MOOLAICBTKJHNQ-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000532737700 336268865 /nfs/dbraw/zinc/26/88/65/336268865.db2.gz MOOLAICBTKJHNQ-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000532737700 336268866 /nfs/dbraw/zinc/26/88/66/336268866.db2.gz MOOLAICBTKJHNQ-ALKREAHSSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000532737703 336268880 /nfs/dbraw/zinc/26/88/80/336268880.db2.gz MOOLAICBTKJHNQ-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000532737703 336268881 /nfs/dbraw/zinc/26/88/81/336268881.db2.gz MOOLAICBTKJHNQ-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000532737703 336268882 /nfs/dbraw/zinc/26/88/82/336268882.db2.gz MOOLAICBTKJHNQ-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000532737703 336268883 /nfs/dbraw/zinc/26/88/83/336268883.db2.gz MOOLAICBTKJHNQ-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000532737703 336268884 /nfs/dbraw/zinc/26/88/84/336268884.db2.gz MOOLAICBTKJHNQ-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000532737703 336268885 /nfs/dbraw/zinc/26/88/85/336268885.db2.gz MOOLAICBTKJHNQ-SIXWZSSISA-N 2 1 318.892 4.350 20 0 DIADMP COc1ccc2cc([C@H](C)N[C@H]3CC[N@H+]4CCCC[C@@H]34)ccc2c1 ZINC000324893320 336271401 /nfs/dbraw/zinc/27/14/01/336271401.db2.gz ONFKKYGKAMROCU-JHVJFLLYSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@H]3CCN4CCCC[C@@H]34)ccc2c1 ZINC000324893320 336271402 /nfs/dbraw/zinc/27/14/02/336271402.db2.gz ONFKKYGKAMROCU-JHVJFLLYSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCCC[C@@H]34)ccc2c1 ZINC000324893320 336271403 /nfs/dbraw/zinc/27/14/03/336271403.db2.gz ONFKKYGKAMROCU-JHVJFLLYSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@H]3CC[N@H+]4CCCC[C@@H]34)ccc2c1 ZINC000324893320 336271404 /nfs/dbraw/zinc/27/14/04/336271404.db2.gz ONFKKYGKAMROCU-JHVJFLLYSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)N[C@@H]3CC[N@H+]4CCCC[C@@H]34)ccc2c1 ZINC000324893322 336271511 /nfs/dbraw/zinc/27/15/11/336271511.db2.gz ONFKKYGKAMROCU-RVHYNSKXSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CCN4CCCC[C@@H]34)ccc2c1 ZINC000324893322 336271512 /nfs/dbraw/zinc/27/15/12/336271512.db2.gz ONFKKYGKAMROCU-RVHYNSKXSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCCC[C@@H]34)ccc2c1 ZINC000324893322 336271513 /nfs/dbraw/zinc/27/15/13/336271513.db2.gz ONFKKYGKAMROCU-RVHYNSKXSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCCC[C@@H]34)ccc2c1 ZINC000324893322 336271514 /nfs/dbraw/zinc/27/15/14/336271514.db2.gz ONFKKYGKAMROCU-RVHYNSKXSA-N 2 1 324.468 4.126 20 0 DIADMP FC(F)c1ccc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000526983699 336278107 /nfs/dbraw/zinc/27/81/07/336278107.db2.gz SYPXIMMJQDQKHZ-UHFFFAOYSA-N 2 1 322.443 4.368 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000417994411 336287105 /nfs/dbraw/zinc/28/71/05/336287105.db2.gz YVNKARUWPISPKG-KRQVXIAISA-N 2 1 312.501 4.033 20 0 DIADMP CC(C)[NH+]1CCC(N(C)c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000301070226 336288434 /nfs/dbraw/zinc/28/84/34/336288434.db2.gz KEWGFJPXDWWURD-UHFFFAOYSA-N 2 1 317.864 4.197 20 0 DIADMP Cc1cc(NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)nc(C)n1 ZINC000301129282 336291340 /nfs/dbraw/zinc/29/13/40/336291340.db2.gz ZBMWGHHCXFHLAV-MRXNPFEDSA-N 2 1 324.472 4.080 20 0 DIADMP Cc1cc(NCc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)nc(C)[nH+]1 ZINC000301129282 336291341 /nfs/dbraw/zinc/29/13/41/336291341.db2.gz ZBMWGHHCXFHLAV-MRXNPFEDSA-N 2 1 324.472 4.080 20 0 DIADMP Cc1cc(NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)nc(C)[nH+]1 ZINC000301129282 336291342 /nfs/dbraw/zinc/29/13/42/336291342.db2.gz ZBMWGHHCXFHLAV-MRXNPFEDSA-N 2 1 324.472 4.080 20 0 DIADMP Clc1c[nH+]ccc1NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000301497650 336310414 /nfs/dbraw/zinc/31/04/14/336310414.db2.gz CYGQEXNMDZISSC-CYBMUJFWSA-N 2 1 321.877 4.121 20 0 DIADMP Clc1c[nH+]ccc1NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301497650 336310415 /nfs/dbraw/zinc/31/04/15/336310415.db2.gz CYGQEXNMDZISSC-CYBMUJFWSA-N 2 1 321.877 4.121 20 0 DIADMP Clc1c[nH+]ccc1NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000301580283 336316267 /nfs/dbraw/zinc/31/62/67/336316267.db2.gz NHOYFTMLSLKYOT-UHFFFAOYSA-N 2 1 315.848 4.333 20 0 DIADMP CCC[N@@H+]1CC[C@H](CNc2cc[nH+]c3ccc(Cl)cc23)C1 ZINC000301973792 336340740 /nfs/dbraw/zinc/34/07/40/336340740.db2.gz AYNYFCSJPPANHS-CYBMUJFWSA-N 2 1 303.837 4.032 20 0 DIADMP CCC[N@H+]1CC[C@H](CNc2cc[nH+]c3ccc(Cl)cc23)C1 ZINC000301973792 336340741 /nfs/dbraw/zinc/34/07/41/336340741.db2.gz AYNYFCSJPPANHS-CYBMUJFWSA-N 2 1 303.837 4.032 20 0 DIADMP CC[N@H+](C)Cc1cccc(CNc2cc[nH+]c3ccsc32)c1 ZINC000302002219 336342451 /nfs/dbraw/zinc/34/24/51/336342451.db2.gz XEGSOUZWCPCFCO-UHFFFAOYSA-N 2 1 311.454 4.360 20 0 DIADMP CC[N@@H+](C)Cc1cccc(CNc2cc[nH+]c3ccsc32)c1 ZINC000302002219 336342452 /nfs/dbraw/zinc/34/24/52/336342452.db2.gz XEGSOUZWCPCFCO-UHFFFAOYSA-N 2 1 311.454 4.360 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1cccc(C)c1 ZINC000353533217 336423081 /nfs/dbraw/zinc/42/30/81/336423081.db2.gz XUCXBRJFQKFHGS-FQEVSTJZSA-N 2 1 323.484 4.408 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H]1CCSc2ccccc21)C(C)C ZINC000361806852 336773824 /nfs/dbraw/zinc/77/38/24/336773824.db2.gz OTTSJESCPBBEON-QGZVFWFLSA-N 2 1 306.519 4.322 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000122725308 337022850 /nfs/dbraw/zinc/02/28/50/337022850.db2.gz NNNCWOPIYSBDLZ-DOTOQJQBSA-N 2 1 301.434 4.038 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000122725308 337022851 /nfs/dbraw/zinc/02/28/51/337022851.db2.gz NNNCWOPIYSBDLZ-DOTOQJQBSA-N 2 1 301.434 4.038 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000122725555 337022917 /nfs/dbraw/zinc/02/29/17/337022917.db2.gz NNNCWOPIYSBDLZ-NVXWUHKLSA-N 2 1 301.434 4.038 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000122725555 337022918 /nfs/dbraw/zinc/02/29/18/337022918.db2.gz NNNCWOPIYSBDLZ-NVXWUHKLSA-N 2 1 301.434 4.038 20 0 DIADMP c1ccc2c(c1)[nH]c1c2CCC[C@@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000377566801 337055463 /nfs/dbraw/zinc/05/54/63/337055463.db2.gz XNGXAWYLAJPYFL-PMTKGXAQSA-N 2 1 323.484 4.152 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cncc(C)c2)cc1 ZINC000184384571 337198117 /nfs/dbraw/zinc/19/81/17/337198117.db2.gz BGXDEQHZKYDVPZ-HZPDHXFCSA-N 2 1 320.440 4.296 20 0 DIADMP CC[NH2+]CCC[NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F ZINC000582958550 337218619 /nfs/dbraw/zinc/21/86/19/337218619.db2.gz AAWIFRLRIBPSRJ-ZDUSSCGKSA-N 2 1 322.399 4.091 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CCCC34CCCC4)CC2)cc1 ZINC000392774112 337280539 /nfs/dbraw/zinc/28/05/39/337280539.db2.gz UGGGDWDRVFNOOY-HXUWFJFHSA-N 2 1 312.501 4.354 20 0 DIADMP Cc1c[nH+]ccc1NCc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000192622052 337305870 /nfs/dbraw/zinc/30/58/70/337305870.db2.gz XHAZYSFQPJQPBA-UHFFFAOYSA-N 2 1 321.424 4.227 20 0 DIADMP C[NH+](Cc1ccc(C2CCCC2)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000583776100 337332199 /nfs/dbraw/zinc/33/21/99/337332199.db2.gz QFKVEMYENQZROS-WCRBZPEASA-N 2 1 312.501 4.401 20 0 DIADMP C[NH+](Cc1ccc(C2CCCC2)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000583776100 337332200 /nfs/dbraw/zinc/33/22/00/337332200.db2.gz QFKVEMYENQZROS-WCRBZPEASA-N 2 1 312.501 4.401 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(F)c2Cl)CC1 ZINC000583800459 337334770 /nfs/dbraw/zinc/33/47/70/337334770.db2.gz ZNEAXHVSZNIBAY-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000035047371 337393775 /nfs/dbraw/zinc/39/37/75/337393775.db2.gz LBEHPPUIWXWADE-INIZCTEOSA-N 2 1 324.921 4.341 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@@H]2CCC[NH2+]CC2)c2ccccc2)cc1 ZINC000422766886 337685689 /nfs/dbraw/zinc/68/56/89/337685689.db2.gz QIZLLZIUWQJMTH-RTBURBONSA-N 2 1 314.860 4.161 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000422770345 337685807 /nfs/dbraw/zinc/68/58/07/337685807.db2.gz WFASQVIHRIAXGV-SRVKXCTJSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc(Cl)ccc1Cl ZINC000422783221 337686324 /nfs/dbraw/zinc/68/63/24/337686324.db2.gz NTYHZQOQGHOVCY-SDDRHHMPSA-N 2 1 301.261 4.032 20 0 DIADMP CC(C)c1ccc([C@@H]([NH2+][C@H](C)C2C[NH2+]C2)c2cccs2)cc1 ZINC000422788742 337686332 /nfs/dbraw/zinc/68/63/32/337686332.db2.gz RINUPLNYWBDUIC-AUUYWEPGSA-N 2 1 314.498 4.158 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1 ZINC000422829674 337688211 /nfs/dbraw/zinc/68/82/11/337688211.db2.gz HPUXFPFHRXKDGL-WOJBJXKFSA-N 2 1 308.469 4.047 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc2cc(Cl)ccc2o1 ZINC000422914719 337691159 /nfs/dbraw/zinc/69/11/59/337691159.db2.gz VRAXRNZQHAJUCN-FMVWZJFZSA-N 2 1 304.821 4.020 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]Cc3cccc4ccccc43)CC[NH2+]2)cc1 ZINC000422918639 337691363 /nfs/dbraw/zinc/69/13/63/337691363.db2.gz HXFZGTWJIBMBEB-UNMCSNQZSA-N 2 1 316.448 4.423 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]Cc3cccc4ccccc43)CC[NH2+]2)cc1 ZINC000422918637 337691488 /nfs/dbraw/zinc/69/14/88/337691488.db2.gz HXFZGTWJIBMBEB-IRLDBZIGSA-N 2 1 316.448 4.423 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C)c1c[nH+]ccc1N ZINC000422924293 337691748 /nfs/dbraw/zinc/69/17/48/337691748.db2.gz UDNMBDQTCHEZMV-NNDWQROWSA-N 2 1 315.848 4.195 20 0 DIADMP C[C@H]([NH2+]C1CCC(C)(c2ccccc2)CC1)c1c[nH+]ccc1N ZINC000422990279 337693787 /nfs/dbraw/zinc/69/37/87/337693787.db2.gz NCQLBTSVSBJQHD-FVWXCPNNSA-N 2 1 309.457 4.045 20 0 DIADMP COCCCC[C@H]([NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1 ZINC000423085320 337698727 /nfs/dbraw/zinc/69/87/27/337698727.db2.gz KCXQWZWQMAHOHM-PCCBWWKXSA-N 2 1 324.468 4.279 20 0 DIADMP Clc1sc(Cl)c2c1CCC[C@@H]2[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000423202679 337703771 /nfs/dbraw/zinc/70/37/71/337703771.db2.gz BMILVQLECJMCOG-ONGXEEELSA-N 2 1 319.301 4.022 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(Cl)c(Cl)c1Cl ZINC000423210048 337704259 /nfs/dbraw/zinc/70/42/59/337704259.db2.gz JMNGMNXDDHJJGF-ZJUUUORDSA-N 2 1 321.679 4.297 20 0 DIADMP C[C@@H]([NH2+][C@H](C[NH3+])C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC000423261122 337707925 /nfs/dbraw/zinc/70/79/25/337707925.db2.gz JBYJXNHVNIJLBP-FKFRUQKQSA-N 2 1 320.443 4.241 20 0 DIADMP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc2cc(Cl)ccc2o1 ZINC000423339577 337712950 /nfs/dbraw/zinc/71/29/50/337712950.db2.gz LIYJIVNMGLGZIA-SJKOYZFVSA-N 2 1 306.837 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H](C[NH3+])C1CCCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423501055 337723412 /nfs/dbraw/zinc/72/34/12/337723412.db2.gz KWONXVWQGFZTFN-DEQVHRJGSA-N 2 1 312.910 4.001 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423505922 337723655 /nfs/dbraw/zinc/72/36/55/337723655.db2.gz IEHWUPIQBMMSLR-GDBMZVCRSA-N 2 1 317.502 4.397 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)o1 ZINC000119363910 337858575 /nfs/dbraw/zinc/85/85/75/337858575.db2.gz WSZFUNVUMLIHOY-HNNXBMFYSA-N 2 1 304.478 4.344 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2ccccc2o1 ZINC000119855642 337866616 /nfs/dbraw/zinc/86/66/16/337866616.db2.gz RIBHECWLHAOJMJ-AWEZNQCLSA-N 2 1 300.446 4.346 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@@H]2CCC[C@H]21 ZINC000426312707 338026357 /nfs/dbraw/zinc/02/63/57/338026357.db2.gz KFXAGATVGZTMNN-PMOUVXMZSA-N 2 1 324.921 4.241 20 0 DIADMP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000428994312 338068187 /nfs/dbraw/zinc/06/81/87/338068187.db2.gz BJQXRVDHKWXREZ-JXFKEZNVSA-N 2 1 300.490 4.073 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429539682 338083425 /nfs/dbraw/zinc/08/34/25/338083425.db2.gz RNZNNKPAHUNRFW-CZUORRHYSA-N 2 1 314.395 4.183 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@H+](C2c3ccccc3-c3ccccc32)CC1 ZINC000429540511 338083438 /nfs/dbraw/zinc/08/34/38/338083438.db2.gz SVZNPPONBJQGKY-INIZCTEOSA-N 2 1 306.453 4.173 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429539678 338083510 /nfs/dbraw/zinc/08/35/10/338083510.db2.gz RNZNNKPAHUNRFW-CJNGLKHVSA-N 2 1 314.395 4.183 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CCCSCC(C)C)CC1 ZINC000429723590 338088492 /nfs/dbraw/zinc/08/84/92/338088492.db2.gz UZBFNGSMYZHNMP-UHFFFAOYSA-N 2 1 322.518 4.013 20 0 DIADMP C[C@H](CCSc1ccccc1)[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000431602032 338134466 /nfs/dbraw/zinc/13/44/66/338134466.db2.gz DUGZULAPOCUNCZ-QGZVFWFLSA-N 2 1 318.530 4.118 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431606570 338134555 /nfs/dbraw/zinc/13/45/55/338134555.db2.gz FNMNEBOERJVBRP-ROUUACIJSA-N 2 1 320.546 4.221 20 0 DIADMP C[C@@H](CCSc1ccccc1)[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000431624833 338134938 /nfs/dbraw/zinc/13/49/38/338134938.db2.gz XLBLPOWUWVJPFS-JKSUJKDBSA-N 2 1 315.486 4.160 20 0 DIADMP CC(C)CCOc1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000432792135 338168063 /nfs/dbraw/zinc/16/80/63/338168063.db2.gz IYMFZZGLRFDNCL-IBGZPJMESA-N 2 1 318.505 4.028 20 0 DIADMP CC(C)CCOc1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000432792135 338168064 /nfs/dbraw/zinc/16/80/64/338168064.db2.gz IYMFZZGLRFDNCL-IBGZPJMESA-N 2 1 318.505 4.028 20 0 DIADMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311846 338191271 /nfs/dbraw/zinc/19/12/71/338191271.db2.gz OCDSLEBEVDIWOW-SJLPKXTDSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311846 338191272 /nfs/dbraw/zinc/19/12/72/338191272.db2.gz OCDSLEBEVDIWOW-SJLPKXTDSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311846 338191273 /nfs/dbraw/zinc/19/12/73/338191273.db2.gz OCDSLEBEVDIWOW-SJLPKXTDSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@@H]1CC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433311846 338191274 /nfs/dbraw/zinc/19/12/74/338191274.db2.gz OCDSLEBEVDIWOW-SJLPKXTDSA-N 2 1 306.881 4.004 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434672945 338223060 /nfs/dbraw/zinc/22/30/60/338223060.db2.gz OLEGNPWSCRKHLA-QGZVFWFLSA-N 2 1 323.484 4.468 20 0 DIADMP CCc1ccccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434687796 338223530 /nfs/dbraw/zinc/22/35/30/338223530.db2.gz GBFWRNCFSQXIBS-UHFFFAOYSA-N 2 1 323.484 4.161 20 0 DIADMP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000434752289 338224760 /nfs/dbraw/zinc/22/47/60/338224760.db2.gz AUEPRKMYTAFBCA-FXAWDEMLSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000436267958 338264442 /nfs/dbraw/zinc/26/44/42/338264442.db2.gz FPWAGXNMGDPCCP-HLAWJBBLSA-N 2 1 314.517 4.424 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC(C)(C)CCc3ccccc32)CC[N@@H+]1C ZINC000436295831 338266944 /nfs/dbraw/zinc/26/69/44/338266944.db2.gz SGWWGTVKYKSTDU-SUMDDJOVSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC(C)(C)CCc3ccccc32)CC[N@H+]1C ZINC000436295831 338266945 /nfs/dbraw/zinc/26/69/45/338266945.db2.gz SGWWGTVKYKSTDU-SUMDDJOVSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)CCCCCOc2ccccc2)CC1 ZINC000437596201 338315732 /nfs/dbraw/zinc/31/57/32/338315732.db2.gz VRAKCBJXGPFCAE-UHFFFAOYSA-N 2 1 318.505 4.040 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437786843 338321554 /nfs/dbraw/zinc/32/15/54/338321554.db2.gz PEUBGAXNEKAISO-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000437786843 338321555 /nfs/dbraw/zinc/32/15/55/338321555.db2.gz PEUBGAXNEKAISO-HIFRSBDPSA-N 2 1 324.871 4.222 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000438844986 338353542 /nfs/dbraw/zinc/35/35/42/338353542.db2.gz XJWYMZLSVXVBEU-HSALFYBXSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000438844986 338353543 /nfs/dbraw/zinc/35/35/43/338353543.db2.gz XJWYMZLSVXVBEU-HSALFYBXSA-N 2 1 323.484 4.070 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CCN1C ZINC000438847056 338353681 /nfs/dbraw/zinc/35/36/81/338353681.db2.gz CZMRMZQWNWYFQL-GHTZIAJQSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000438847056 338353682 /nfs/dbraw/zinc/35/36/82/338353682.db2.gz CZMRMZQWNWYFQL-GHTZIAJQSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000438847056 338353683 /nfs/dbraw/zinc/35/36/83/338353683.db2.gz CZMRMZQWNWYFQL-GHTZIAJQSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847056 338353684 /nfs/dbraw/zinc/35/36/84/338353684.db2.gz CZMRMZQWNWYFQL-GHTZIAJQSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847056 338353685 /nfs/dbraw/zinc/35/36/85/338353685.db2.gz CZMRMZQWNWYFQL-GHTZIAJQSA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CCN1C ZINC000438847060 338353729 /nfs/dbraw/zinc/35/37/29/338353729.db2.gz CZMRMZQWNWYFQL-RXVVDRJESA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000438847060 338353730 /nfs/dbraw/zinc/35/37/30/338353730.db2.gz CZMRMZQWNWYFQL-RXVVDRJESA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC(c2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000438847060 338353731 /nfs/dbraw/zinc/35/37/31/338353731.db2.gz CZMRMZQWNWYFQL-RXVVDRJESA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847060 338353732 /nfs/dbraw/zinc/35/37/32/338353732.db2.gz CZMRMZQWNWYFQL-RXVVDRJESA-N 2 1 322.496 4.233 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CC(c2ccccc2)c2ccccc2)CC[NH+]1C ZINC000438847060 338353733 /nfs/dbraw/zinc/35/37/33/338353733.db2.gz CZMRMZQWNWYFQL-RXVVDRJESA-N 2 1 322.496 4.233 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC000439311641 338366841 /nfs/dbraw/zinc/36/68/41/338366841.db2.gz CDBGFMFYWIEMSF-UYAOXDASSA-N 2 1 300.490 4.131 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]Cc2c[nH+]ccc2N(C)C)c2ccccc21 ZINC000447979012 338573527 /nfs/dbraw/zinc/57/35/27/338573527.db2.gz UFCAAPBUUHNLGD-RTBURBONSA-N 2 1 309.457 4.122 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CC[C@H](C)c2ccsc21 ZINC000453109762 338794882 /nfs/dbraw/zinc/79/48/82/338794882.db2.gz AQOAIPBBNYSARS-XJKSGUPXSA-N 2 1 303.475 4.261 20 0 DIADMP CCC(C)(C)OCC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000453405601 338839319 /nfs/dbraw/zinc/83/93/19/338839319.db2.gz JKDWKXCQWKBLDM-OAHLLOKOSA-N 2 1 315.461 4.037 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1cccc(Cl)c1)C1CCCC1 ZINC000459380269 339025825 /nfs/dbraw/zinc/02/58/25/339025825.db2.gz AZUQAUNSPXDNQG-GOSISDBHSA-N 2 1 317.864 4.137 20 0 DIADMP c1ccc(CC2(C[NH2+]C3CC[NH+](C4CC4)CC3)CCCC2)cc1 ZINC000459471035 339031214 /nfs/dbraw/zinc/03/12/14/339031214.db2.gz FMIVXHNOIFGQJZ-UHFFFAOYSA-N 2 1 312.501 4.006 20 0 DIADMP C[C@@H]1CCC[N@H+](CCCCNc2cc[nH+]c3ccsc32)C1 ZINC000462786927 339088658 /nfs/dbraw/zinc/08/86/58/339088658.db2.gz FKQRRTCCPSJREF-CQSZACIVSA-N 2 1 303.475 4.220 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCCNc2cc[nH+]c3ccsc32)C1 ZINC000462786927 339088659 /nfs/dbraw/zinc/08/86/59/339088659.db2.gz FKQRRTCCPSJREF-CQSZACIVSA-N 2 1 303.475 4.220 20 0 DIADMP FCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000462821690 339092089 /nfs/dbraw/zinc/09/20/89/339092089.db2.gz MKXPYFUNEXLZTO-SLFFLAALSA-N 2 1 318.480 4.017 20 0 DIADMP FCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000462821692 339092150 /nfs/dbraw/zinc/09/21/50/339092150.db2.gz MKXPYFUNEXLZTO-VAMGGRTRSA-N 2 1 318.480 4.017 20 0 DIADMP Cc1cc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462888224 339096290 /nfs/dbraw/zinc/09/62/90/339096290.db2.gz DWUNWBAOGAYJQS-ZFWWWQNUSA-N 2 1 317.864 4.400 20 0 DIADMP Cc1cc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462888223 339096388 /nfs/dbraw/zinc/09/63/88/339096388.db2.gz DWUNWBAOGAYJQS-UKRRQHHQSA-N 2 1 317.864 4.400 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463117788 339106399 /nfs/dbraw/zinc/10/63/99/339106399.db2.gz VBIAJRSOUXEDHD-DENIHFKCSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1cccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000463117788 339106400 /nfs/dbraw/zinc/10/64/00/339106400.db2.gz VBIAJRSOUXEDHD-DENIHFKCSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463132677 339106802 /nfs/dbraw/zinc/10/68/02/339106802.db2.gz BLTLCEWQNVTXQP-UGKGYDQZSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463132677 339106803 /nfs/dbraw/zinc/10/68/03/339106803.db2.gz BLTLCEWQNVTXQP-UGKGYDQZSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463138265 339106891 /nfs/dbraw/zinc/10/68/91/339106891.db2.gz CJULGSASRRCINL-OXQOHEQNSA-N 2 1 318.480 4.001 20 0 DIADMP CC[C@H]1CCC[C@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463206954 339109420 /nfs/dbraw/zinc/10/94/20/339109420.db2.gz RIJWAKHAXHOXLW-FXAWDEMLSA-N 2 1 318.480 4.001 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207749 339109459 /nfs/dbraw/zinc/10/94/59/339109459.db2.gz UHDJJAQYKFYJSQ-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463207749 339109460 /nfs/dbraw/zinc/10/94/60/339109460.db2.gz UHDJJAQYKFYJSQ-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463249084 339112060 /nfs/dbraw/zinc/11/20/60/339112060.db2.gz YDURHIZOBWIRLA-BWPNAZKDSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463249084 339112061 /nfs/dbraw/zinc/11/20/61/339112061.db2.gz YDURHIZOBWIRLA-BWPNAZKDSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CCC3(CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463248916 339112077 /nfs/dbraw/zinc/11/20/77/339112077.db2.gz CAYMBKDDXBIHKK-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CCC3(CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463248916 339112078 /nfs/dbraw/zinc/11/20/78/339112078.db2.gz CAYMBKDDXBIHKK-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463278914 339112910 /nfs/dbraw/zinc/11/29/10/339112910.db2.gz DYSAXAFWPKBTTO-MJGOQNOKSA-N 2 1 320.546 4.162 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463278914 339112911 /nfs/dbraw/zinc/11/29/11/339112911.db2.gz DYSAXAFWPKBTTO-MJGOQNOKSA-N 2 1 320.546 4.162 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCc2ccc3ccccc3c2)C1 ZINC000464778407 339153027 /nfs/dbraw/zinc/15/30/27/339153027.db2.gz OBAJVKBRPPBHQM-LJQANCHMSA-N 2 1 310.485 4.046 20 0 DIADMP C[C@@H](C[N@@H+]1CCC[C@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460535 339205821 /nfs/dbraw/zinc/20/58/21/339205821.db2.gz CNMYILILXFYXQM-FXQLRMTLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@H](C)C1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466460535 339205822 /nfs/dbraw/zinc/20/58/22/339205822.db2.gz CNMYILILXFYXQM-FXQLRMTLSA-N 2 1 320.443 4.065 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)CC1 ZINC000467350754 339233297 /nfs/dbraw/zinc/23/32/97/339233297.db2.gz UCYRLZYCXUGUKE-IBGZPJMESA-N 2 1 318.892 4.423 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000467435421 339238478 /nfs/dbraw/zinc/23/84/78/339238478.db2.gz YDQUSKDSGOWTNY-CCSZMFHSSA-N 2 1 324.871 4.043 20 0 DIADMP C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1cccc2nccn21 ZINC000467550617 339242095 /nfs/dbraw/zinc/24/20/95/339242095.db2.gz LXARIXHXCHMAQJ-SJLPKXTDSA-N 2 1 305.425 4.102 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)C[C@H]1C ZINC000468392715 339261435 /nfs/dbraw/zinc/26/14/35/339261435.db2.gz PCFJQQPEDMVEFJ-LMPOIIKSSA-N 2 1 320.443 4.160 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CC2CCC(C(F)(F)F)CC2)C[C@H]1C ZINC000468392715 339261436 /nfs/dbraw/zinc/26/14/36/339261436.db2.gz PCFJQQPEDMVEFJ-LMPOIIKSSA-N 2 1 320.443 4.160 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CC2CCC(C(F)(F)F)CC2)C[C@H]1C ZINC000468392715 339261437 /nfs/dbraw/zinc/26/14/37/339261437.db2.gz PCFJQQPEDMVEFJ-LMPOIIKSSA-N 2 1 320.443 4.160 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)CC1CCC(C(F)(F)F)CC1 ZINC000468404242 339262144 /nfs/dbraw/zinc/26/21/44/339262144.db2.gz BVFCDHXBNGENBW-GPANFISMSA-N 2 1 320.443 4.161 20 0 DIADMP COC1CC[NH+](C2(C[NH2+][C@H](C)CCCC(C)C)CCCC2)CC1 ZINC000468554672 339266203 /nfs/dbraw/zinc/26/62/03/339266203.db2.gz NYDCPXSIAUDVGH-GOSISDBHSA-N 2 1 324.553 4.214 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CC2(c3cccs3)CCCCC2)[C@@H](C)C1 ZINC000468766149 339270249 /nfs/dbraw/zinc/27/02/49/339270249.db2.gz AOBFMGWHGBKSIS-DLBZAZTESA-N 2 1 320.546 4.270 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)CC[NH+](C)C ZINC000468791442 339270956 /nfs/dbraw/zinc/27/09/56/339270956.db2.gz BKUALRMNIYHLOV-KBPBESRZSA-N 2 1 317.502 4.109 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000468791525 339270966 /nfs/dbraw/zinc/27/09/66/339270966.db2.gz BKUALRMNIYHLOV-ZIAGYGMSSA-N 2 1 317.502 4.109 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCC2)[C@H](C)C1 ZINC000468987908 339276825 /nfs/dbraw/zinc/27/68/25/339276825.db2.gz NOORDSFKQZLZJL-QAPCUYQASA-N 2 1 320.908 4.082 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCc2ccc3ccccc3c2)C1 ZINC000471047569 339335723 /nfs/dbraw/zinc/33/57/23/339335723.db2.gz KHKJFQYBMWTNTI-IBGZPJMESA-N 2 1 310.485 4.046 20 0 DIADMP Fc1cccc(Cl)c1CCC[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000472579321 339374108 /nfs/dbraw/zinc/37/41/08/339374108.db2.gz HXJJBPGYXSFESP-ZDUSSCGKSA-N 2 1 321.827 4.014 20 0 DIADMP Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CC[C@H]2CCCC[NH+]2C)C1 ZINC000472579389 339374113 /nfs/dbraw/zinc/37/41/13/339374113.db2.gz OIJOUPHNOFVDCW-GUDVDZBRSA-N 2 1 300.490 4.047 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)C1CCC(F)(F)CC1 ZINC000474029956 339397787 /nfs/dbraw/zinc/39/77/87/339397787.db2.gz GRDJHMIQEXYLDF-GJZGRUSLSA-N 2 1 302.453 4.055 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474468235 339415706 /nfs/dbraw/zinc/41/57/06/339415706.db2.gz DXDWRGURAVQETR-KFWWJZLASA-N 2 1 319.880 4.263 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000474468233 339415727 /nfs/dbraw/zinc/41/57/27/339415727.db2.gz DXDWRGURAVQETR-ILXRZTDVSA-N 2 1 319.880 4.263 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+](C)C)c1ccc2ccccc2c1OC(F)F ZINC000479871039 339551797 /nfs/dbraw/zinc/55/17/97/339551797.db2.gz FKDGWBHLWWBQNC-CYBMUJFWSA-N 2 1 322.399 4.044 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cc(C)cc(C)c3)CC2)[nH+]c1 ZINC000484174870 339682566 /nfs/dbraw/zinc/68/25/66/339682566.db2.gz KRXDRAGNRXCHIK-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP CCC(CC)(C[NH2+]C[C@@H]1CCSC1)[NH2+][C@H](C)c1ccccc1 ZINC000487288271 339749387 /nfs/dbraw/zinc/74/93/87/339749387.db2.gz MOAGYHZHRBEJIB-SJORKVTESA-N 2 1 320.546 4.239 20 0 DIADMP C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000489105975 339801931 /nfs/dbraw/zinc/80/19/31/339801931.db2.gz MTLMJUREUFENEJ-KRWDZBQOSA-N 2 1 312.501 4.187 20 0 DIADMP C[C@H](c1ccc2c(c1)CCC2)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000489105978 339801936 /nfs/dbraw/zinc/80/19/36/339801936.db2.gz MTLMJUREUFENEJ-QGZVFWFLSA-N 2 1 312.501 4.187 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](C/C=C\c3ccccc3)C2)CC1 ZINC000498842539 340024214 /nfs/dbraw/zinc/02/42/14/340024214.db2.gz FTNCTLHNGYUNIA-CTTRRDQISA-N 2 1 312.501 4.144 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](C/C=C\c3ccccc3)C2)CC1 ZINC000498842539 340024215 /nfs/dbraw/zinc/02/42/15/340024215.db2.gz FTNCTLHNGYUNIA-CTTRRDQISA-N 2 1 312.501 4.144 20 0 DIADMP CC(C)[C@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccc(F)cn1 ZINC000498931986 340026354 /nfs/dbraw/zinc/02/63/54/340026354.db2.gz WBQLERGYZKWYFW-SFHVURJKSA-N 2 1 309.473 4.016 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000499145276 340031096 /nfs/dbraw/zinc/03/10/96/340031096.db2.gz FTHQXXXGXIATFP-KOUNCHBCSA-N 2 1 320.480 4.280 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000499148320 340031162 /nfs/dbraw/zinc/03/11/62/340031162.db2.gz RWPRTOJFRPWYRY-HNNXBMFYSA-N 2 1 321.896 4.216 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000499148320 340031163 /nfs/dbraw/zinc/03/11/63/340031163.db2.gz RWPRTOJFRPWYRY-HNNXBMFYSA-N 2 1 321.896 4.216 20 0 DIADMP Cc1cccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000499151294 340031256 /nfs/dbraw/zinc/03/12/56/340031256.db2.gz XXFSRJFCWIDSEQ-KOUNCHBCSA-N 2 1 320.480 4.280 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2CCCCCC2)C3)cc1 ZINC000499160178 340031364 /nfs/dbraw/zinc/03/13/64/340031364.db2.gz IAUFSOKWKGPPDD-MZADTFQBSA-N 2 1 312.501 4.494 20 0 DIADMP CC(C)C1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000499238163 340033114 /nfs/dbraw/zinc/03/31/14/340033114.db2.gz RPFQLWBNQBPCQK-OWZKRDHZSA-N 2 1 312.501 4.208 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499247576 340033151 /nfs/dbraw/zinc/03/31/51/340033151.db2.gz VWRLHOJUUKMUIQ-SSSFQFABSA-N 2 1 312.501 4.350 20 0 DIADMP C(C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006801 340072133 /nfs/dbraw/zinc/07/21/33/340072133.db2.gz KJFCWGUFLUQDGC-LPHOPBHVSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006801 340072134 /nfs/dbraw/zinc/07/21/34/340072134.db2.gz KJFCWGUFLUQDGC-LPHOPBHVSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006801 340072135 /nfs/dbraw/zinc/07/21/35/340072135.db2.gz KJFCWGUFLUQDGC-LPHOPBHVSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006801 340072136 /nfs/dbraw/zinc/07/21/36/340072136.db2.gz KJFCWGUFLUQDGC-LPHOPBHVSA-N 2 1 322.562 4.001 20 0 DIADMP C[C@H]([NH2+]CCSC1CCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000501064298 340073378 /nfs/dbraw/zinc/07/33/78/340073378.db2.gz PXASMRXUMFUONP-IRXDYDNUSA-N 2 1 324.578 4.295 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501083060 340074041 /nfs/dbraw/zinc/07/40/41/340074041.db2.gz SOBOEJDVIFOPFW-UHFFFAOYSA-N 2 1 323.484 4.047 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)[NH+](C)C ZINC000501470767 340081787 /nfs/dbraw/zinc/08/17/87/340081787.db2.gz YZTHASIQVYYYMG-HOJAQTOUSA-N 2 1 317.521 4.064 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@@H]1CCC12CCC2 ZINC000502462130 340104613 /nfs/dbraw/zinc/10/46/13/340104613.db2.gz LQTGPRVHQVAOMR-BWPNAZKDSA-N 2 1 312.501 4.065 20 0 DIADMP COc1cc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)ccc1F ZINC000504900204 340155276 /nfs/dbraw/zinc/15/52/76/340155276.db2.gz SZUJBAPARIJTGV-JKSUJKDBSA-N 2 1 322.468 4.140 20 0 DIADMP CCc1oc2ccccc2c1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000506458380 340194846 /nfs/dbraw/zinc/19/48/46/340194846.db2.gz CGIGXTXOCONQJO-UHFFFAOYSA-N 2 1 312.457 4.055 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCc2ccccc2)C1 ZINC000506483801 340195563 /nfs/dbraw/zinc/19/55/63/340195563.db2.gz XGJKWADDLIMYEA-TZIWHRDSSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC000506483801 340195564 /nfs/dbraw/zinc/19/55/64/340195564.db2.gz XGJKWADDLIMYEA-TZIWHRDSSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000506483801 340195565 /nfs/dbraw/zinc/19/55/65/340195565.db2.gz XGJKWADDLIMYEA-TZIWHRDSSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCc2ccccc2)C1 ZINC000506483799 340195582 /nfs/dbraw/zinc/19/55/82/340195582.db2.gz XGJKWADDLIMYEA-FPOVZHCZSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC000506483799 340195583 /nfs/dbraw/zinc/19/55/83/340195583.db2.gz XGJKWADDLIMYEA-FPOVZHCZSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000506483799 340195584 /nfs/dbraw/zinc/19/55/84/340195584.db2.gz XGJKWADDLIMYEA-FPOVZHCZSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483714 340195669 /nfs/dbraw/zinc/19/56/69/340195669.db2.gz WCTMRTKOWCJLLI-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483714 340195670 /nfs/dbraw/zinc/19/56/70/340195670.db2.gz WCTMRTKOWCJLLI-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506483714 340195671 /nfs/dbraw/zinc/19/56/71/340195671.db2.gz WCTMRTKOWCJLLI-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506483714 340195672 /nfs/dbraw/zinc/19/56/72/340195672.db2.gz WCTMRTKOWCJLLI-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP CCCCCOc1ccc(C[N@H+](C)C2CC[NH+](CC)CC2)cc1 ZINC000506674260 340199254 /nfs/dbraw/zinc/19/92/54/340199254.db2.gz KEJFPXDQHYOASP-UHFFFAOYSA-N 2 1 318.505 4.172 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)C2CC[NH+](CC)CC2)cc1 ZINC000506674260 340199255 /nfs/dbraw/zinc/19/92/55/340199255.db2.gz KEJFPXDQHYOASP-UHFFFAOYSA-N 2 1 318.505 4.172 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000506862369 340202959 /nfs/dbraw/zinc/20/29/59/340202959.db2.gz PPLXTMISXUMSHD-RTWAWAEBSA-N 2 1 314.517 4.234 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2csc3ccccc23)CC1 ZINC000507356972 340217921 /nfs/dbraw/zinc/21/79/21/340217921.db2.gz GLYPZHQOPORKNI-UHFFFAOYSA-N 2 1 302.487 4.206 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000507533098 340224718 /nfs/dbraw/zinc/22/47/18/340224718.db2.gz SVFXFAUKGYTLOE-RBUKOAKNSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1cccc(CC[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000508711782 340251287 /nfs/dbraw/zinc/25/12/87/340251287.db2.gz PEJUFHLPHGOLLH-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000510122126 340289545 /nfs/dbraw/zinc/28/95/45/340289545.db2.gz SOXNWNCXDNINDC-LJQANCHMSA-N 2 1 322.496 4.140 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000302988949 340292569 /nfs/dbraw/zinc/29/25/69/340292569.db2.gz FNFGXFQHOUTYMJ-OALUTQOASA-N 2 1 300.490 4.192 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2c(C)oc3ccccc32)CC1 ZINC000510467066 340300124 /nfs/dbraw/zinc/30/01/24/340300124.db2.gz GEAWTMHEPRTVEO-UHFFFAOYSA-N 2 1 300.446 4.047 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(OCC(C)C)cc2)CC1 ZINC000510466767 340300322 /nfs/dbraw/zinc/30/03/22/340300322.db2.gz AODVDWMFLRAZEM-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(OCC(C)C)cc2)CC1 ZINC000510466767 340300323 /nfs/dbraw/zinc/30/03/23/340300323.db2.gz AODVDWMFLRAZEM-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP Fc1ccc2c(c1)[C@H]([N@H+]1CCC[C@H]([NH+]3CCCC3)CC1)CCC2 ZINC000510582485 340303392 /nfs/dbraw/zinc/30/33/92/340303392.db2.gz DXRZWSWARLROOY-AZUAARDMSA-N 2 1 316.464 4.153 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000510737011 340308725 /nfs/dbraw/zinc/30/87/25/340308725.db2.gz QYIFPUXPBQJAHX-PMACEKPBSA-N 2 1 300.490 4.195 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CCC2)[C@@H]1c1cccs1 ZINC000510739048 340308956 /nfs/dbraw/zinc/30/89/56/340308956.db2.gz SIYNZJBQNNKGIU-YWTNHNAXSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CCC2)[C@@H]1c1cccs1 ZINC000510739048 340308957 /nfs/dbraw/zinc/30/89/57/340308957.db2.gz SIYNZJBQNNKGIU-YWTNHNAXSA-N 2 1 318.530 4.299 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000511007872 340318043 /nfs/dbraw/zinc/31/80/43/340318043.db2.gz BFPGIWBDBOGUKP-VRXWPRPYSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111620 340321060 /nfs/dbraw/zinc/32/10/60/340321060.db2.gz QGESKGYXPUCQGE-SFHVURJKSA-N 2 1 320.546 4.351 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111620 340321061 /nfs/dbraw/zinc/32/10/61/340321061.db2.gz QGESKGYXPUCQGE-SFHVURJKSA-N 2 1 320.546 4.351 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111620 340321062 /nfs/dbraw/zinc/32/10/62/340321062.db2.gz QGESKGYXPUCQGE-SFHVURJKSA-N 2 1 320.546 4.351 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511111620 340321063 /nfs/dbraw/zinc/32/10/63/340321063.db2.gz QGESKGYXPUCQGE-SFHVURJKSA-N 2 1 320.546 4.351 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(C)C)cc2)C[C@@H]1C ZINC000511148508 340322429 /nfs/dbraw/zinc/32/24/29/340322429.db2.gz YYBKRDBGUFJTQA-WMZOPIPTSA-N 2 1 320.546 4.492 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC000511162696 340323024 /nfs/dbraw/zinc/32/30/24/340323024.db2.gz SFGRUQBKILBDQW-HKUYNNGSSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC000511162696 340323025 /nfs/dbraw/zinc/32/30/25/340323025.db2.gz SFGRUQBKILBDQW-HKUYNNGSSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC000511162696 340323026 /nfs/dbraw/zinc/32/30/26/340323026.db2.gz SFGRUQBKILBDQW-HKUYNNGSSA-N 2 1 318.530 4.103 20 0 DIADMP Cc1ccccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303517669 340329674 /nfs/dbraw/zinc/32/96/74/340329674.db2.gz CHIUWIDINQHZHU-RTBURBONSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303517669 340329675 /nfs/dbraw/zinc/32/96/75/340329675.db2.gz CHIUWIDINQHZHU-RTBURBONSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303517669 340329676 /nfs/dbraw/zinc/32/96/76/340329676.db2.gz CHIUWIDINQHZHU-RTBURBONSA-N 2 1 300.490 4.081 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc2occc2c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000511912618 340342738 /nfs/dbraw/zinc/34/27/38/340342738.db2.gz QQDAWKQUWGXIEJ-CRAIPNDOSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC000512135621 340349537 /nfs/dbraw/zinc/34/95/37/340349537.db2.gz MOCCFILBHLVLFH-IOBAAEILSA-N 2 1 322.443 4.222 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2occc2c1 ZINC000512145767 340349790 /nfs/dbraw/zinc/34/97/90/340349790.db2.gz NKHKWRDREIXLQR-MRXNPFEDSA-N 2 1 300.446 4.177 20 0 DIADMP CC(C)Oc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000512829619 340379683 /nfs/dbraw/zinc/37/96/83/340379683.db2.gz UPJKQYBDPHKGFK-SFHVURJKSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc2ccccc2n1 ZINC000178396068 340449224 /nfs/dbraw/zinc/44/92/24/340449224.db2.gz AICARQVYSFEVJS-KRWDZBQOSA-N 2 1 311.473 4.007 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1c2ccccc2-c2ccccc21 ZINC000183791005 340489205 /nfs/dbraw/zinc/48/92/05/340489205.db2.gz DSANITKCVPKWMD-HNNXBMFYSA-N 2 1 317.436 4.187 20 0 DIADMP CC1(C)CCC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000236741850 340664549 /nfs/dbraw/zinc/66/45/49/340664549.db2.gz JURSNQLWAQQZKG-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)CCCC[C@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000236907128 340666275 /nfs/dbraw/zinc/66/62/75/340666275.db2.gz RRXBRZYPMHQANN-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccccc1C[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237554580 340672132 /nfs/dbraw/zinc/67/21/32/340672132.db2.gz WZNHLERIISTUMI-LJQANCHMSA-N 2 1 322.496 4.180 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C ZINC000037211045 340773644 /nfs/dbraw/zinc/77/36/44/340773644.db2.gz HTRAAKACVIEMMS-ZDUSSCGKSA-N 2 1 311.539 4.132 20 0 DIADMP CC(C)CC(CC(C)C)[NH2+]CC1([NH+]2CCCCC2)CCOCC1 ZINC000537975416 340794765 /nfs/dbraw/zinc/79/47/65/340794765.db2.gz OFCDJROZDBWOJA-UHFFFAOYSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1oc2ccccc2c1C)C(C)C ZINC000539260137 340878892 /nfs/dbraw/zinc/87/88/92/340878892.db2.gz MJTKKPWHMVZJHF-GOSISDBHSA-N 2 1 311.429 4.233 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC000539508967 340888460 /nfs/dbraw/zinc/88/84/60/340888460.db2.gz DXEOLHFTVCTYEK-IAGOWNOFSA-N 2 1 313.489 4.174 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](CC(C)C)c1cccs1 ZINC000540167827 340919915 /nfs/dbraw/zinc/91/99/15/340919915.db2.gz XJXZXEFFBHSEFF-ZBFHGGJFSA-N 2 1 305.491 4.266 20 0 DIADMP Cc1cccc(CCC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000542529542 341012339 /nfs/dbraw/zinc/01/23/39/341012339.db2.gz IYVRVQVQTRJONI-QUCCMNQESA-N 2 1 314.517 4.170 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(-c2ccccc2)s1 ZINC000542667741 341016369 /nfs/dbraw/zinc/01/63/69/341016369.db2.gz XESOCLHZNBOIIM-CQSZACIVSA-N 2 1 311.454 4.271 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(-c2ccccc2)s1 ZINC000543626603 341051674 /nfs/dbraw/zinc/05/16/74/341051674.db2.gz FSCMXIWSQAQRIB-HNNXBMFYSA-N 2 1 312.482 4.328 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707158 341054427 /nfs/dbraw/zinc/05/44/27/341054427.db2.gz BYJZGAHKVIXKLK-KXBFYZLASA-N 2 1 314.473 4.451 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)C1 ZINC000543707158 341054428 /nfs/dbraw/zinc/05/44/28/341054428.db2.gz BYJZGAHKVIXKLK-KXBFYZLASA-N 2 1 314.473 4.451 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)c(F)c1 ZINC000543775011 341058079 /nfs/dbraw/zinc/05/80/79/341058079.db2.gz HDKVZBVIEDTXNL-HNAYVOBHSA-N 2 1 324.459 4.372 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142033 341071900 /nfs/dbraw/zinc/07/19/00/341071900.db2.gz IHFWTZMFVHBZJZ-IEBWSBKVSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)[C@H]([N@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142033 341071901 /nfs/dbraw/zinc/07/19/01/341071901.db2.gz IHFWTZMFVHBZJZ-IEBWSBKVSA-N 2 1 318.892 4.278 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578316 341086913 /nfs/dbraw/zinc/08/69/13/341086913.db2.gz ZNYLXUROAACWQL-HOTGVXAUSA-N 2 1 314.498 4.408 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)s1 ZINC000544578316 341086914 /nfs/dbraw/zinc/08/69/14/341086914.db2.gz ZNYLXUROAACWQL-HOTGVXAUSA-N 2 1 314.498 4.408 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH+]1CCC(C)(c2ccccc2)CC1 ZINC000131806280 341112052 /nfs/dbraw/zinc/11/20/52/341112052.db2.gz OXABQMHDYMDLSU-UHFFFAOYSA-N 2 1 311.473 4.025 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H](CCCc2ccccc2)c2ccccc2)CC1 ZINC000237170446 341208443 /nfs/dbraw/zinc/20/84/43/341208443.db2.gz AZRURNCRIHPHCN-QFIPXVFZSA-N 2 1 322.496 4.434 20 0 DIADMP CC(C)SCC[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138971 341287014 /nfs/dbraw/zinc/28/70/14/341287014.db2.gz OSYYAMVUGHJIJO-PKOBYXMFSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138971 341287015 /nfs/dbraw/zinc/28/70/15/341287015.db2.gz OSYYAMVUGHJIJO-PKOBYXMFSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138971 341287016 /nfs/dbraw/zinc/28/70/16/341287016.db2.gz OSYYAMVUGHJIJO-PKOBYXMFSA-N 2 1 320.546 4.113 20 0 DIADMP CC(C)SCC[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000549138971 341287017 /nfs/dbraw/zinc/28/70/17/341287017.db2.gz OSYYAMVUGHJIJO-PKOBYXMFSA-N 2 1 320.546 4.113 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000245455505 341295070 /nfs/dbraw/zinc/29/50/70/341295070.db2.gz IESXJZHEBZRHFF-CVEARBPZSA-N 2 1 306.519 4.180 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+]Cc2sc3c(cccc3Cl)c2C)C1 ZINC000549710701 341301121 /nfs/dbraw/zinc/30/11/21/341301121.db2.gz ASAPCYGNSCCLER-CYBMUJFWSA-N 2 1 322.905 4.295 20 0 DIADMP CN1CCC[C@]2(CC[N@H+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840367 341304729 /nfs/dbraw/zinc/30/47/29/341304729.db2.gz WKPJIMBZWCVGAU-QFIPXVFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[N@@H+]1CCC[C@]2(CC[NH+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840367 341304730 /nfs/dbraw/zinc/30/47/30/341304730.db2.gz WKPJIMBZWCVGAU-QFIPXVFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[N@H+]1CCC[C@]2(CC[NH+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840367 341304731 /nfs/dbraw/zinc/30/47/31/341304731.db2.gz WKPJIMBZWCVGAU-QFIPXVFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@@H+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840367 341304732 /nfs/dbraw/zinc/30/47/32/341304732.db2.gz WKPJIMBZWCVGAU-QFIPXVFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@H+](C3c4ccccc4-c4ccccc43)C2)C1 ZINC000549840367 341304733 /nfs/dbraw/zinc/30/47/33/341304733.db2.gz WKPJIMBZWCVGAU-QFIPXVFZSA-N 2 1 318.464 4.174 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550610060 341319539 /nfs/dbraw/zinc/31/95/39/341319539.db2.gz LTPBXTXVLNNCFM-HHXXYDBFSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550610060 341319540 /nfs/dbraw/zinc/31/95/40/341319540.db2.gz LTPBXTXVLNNCFM-HHXXYDBFSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(F)c2ccccc21 ZINC000550623168 341319783 /nfs/dbraw/zinc/31/97/83/341319783.db2.gz SYLOWDLCJAOCPX-PNHOKKKMSA-N 2 1 312.432 4.256 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(F)c2ccccc21 ZINC000550623168 341319784 /nfs/dbraw/zinc/31/97/84/341319784.db2.gz SYLOWDLCJAOCPX-PNHOKKKMSA-N 2 1 312.432 4.256 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000550621992 341319804 /nfs/dbraw/zinc/31/98/04/341319804.db2.gz HWESMMOHZCXGDE-LCLWPZTBSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000550621992 341319805 /nfs/dbraw/zinc/31/98/05/341319805.db2.gz HWESMMOHZCXGDE-LCLWPZTBSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000550621478 341319854 /nfs/dbraw/zinc/31/98/54/341319854.db2.gz CBPNBLDFCUWAIS-RTWAWAEBSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c(C)c1 ZINC000550621478 341319855 /nfs/dbraw/zinc/31/98/55/341319855.db2.gz CBPNBLDFCUWAIS-RTWAWAEBSA-N 2 1 308.469 4.229 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccc(F)c2ccccc21 ZINC000550623167 341319868 /nfs/dbraw/zinc/31/98/68/341319868.db2.gz SYLOWDLCJAOCPX-KPOBHBOGSA-N 2 1 312.432 4.256 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(F)c2ccccc21 ZINC000550623167 341319869 /nfs/dbraw/zinc/31/98/69/341319869.db2.gz SYLOWDLCJAOCPX-KPOBHBOGSA-N 2 1 312.432 4.256 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CCC(C)(C)CC2)C[C@H]1c1ccccc1 ZINC000550665712 341320921 /nfs/dbraw/zinc/32/09/21/341320921.db2.gz NDRMKNJQZXMERW-MOPGFXCFSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CCC(C)(C)CC2)C[C@H]1c1ccccc1 ZINC000550665712 341320922 /nfs/dbraw/zinc/32/09/22/341320922.db2.gz NDRMKNJQZXMERW-MOPGFXCFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H]1CCC[C@@H]1[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551309932 341338209 /nfs/dbraw/zinc/33/82/09/341338209.db2.gz ZPCLHQQWQWAOKW-ACAXCVFMSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)CC[NH+](C)C)cc1Cl ZINC000551529470 341344013 /nfs/dbraw/zinc/34/40/13/341344013.db2.gz CAZFSWPWIBUKEL-KBPBESRZSA-N 2 1 312.885 4.118 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@H]2CC=CCC2)[C@H]1c1cccs1 ZINC000246488963 341350627 /nfs/dbraw/zinc/35/06/27/341350627.db2.gz AOIGORQUFUMFEQ-JZXOWHBKSA-N 2 1 304.503 4.077 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@H]2CC=CCC2)[C@H]1c1cccs1 ZINC000246488963 341350628 /nfs/dbraw/zinc/35/06/28/341350628.db2.gz AOIGORQUFUMFEQ-JZXOWHBKSA-N 2 1 304.503 4.077 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000246500116 341350943 /nfs/dbraw/zinc/35/09/43/341350943.db2.gz SNCNOLURGMAZDJ-FRULXJFHSA-N 2 1 306.881 4.109 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000246500116 341350944 /nfs/dbraw/zinc/35/09/44/341350944.db2.gz SNCNOLURGMAZDJ-FRULXJFHSA-N 2 1 306.881 4.109 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC000551833024 341353297 /nfs/dbraw/zinc/35/32/97/341353297.db2.gz FXRVMJWAEKMSBZ-NRSPTQNISA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccco1 ZINC000246816782 341357278 /nfs/dbraw/zinc/35/72/78/341357278.db2.gz AXSFWADWUHJDNE-DLBZAZTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccco1 ZINC000246816782 341357279 /nfs/dbraw/zinc/35/72/79/341357279.db2.gz AXSFWADWUHJDNE-DLBZAZTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccco1 ZINC000246847414 341357842 /nfs/dbraw/zinc/35/78/42/341357842.db2.gz CKHFNKNBCVPSDI-DLBZAZTESA-N 2 1 312.457 4.362 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccccc2C(F)(F)F)C1 ZINC000246939363 341358951 /nfs/dbraw/zinc/35/89/51/341358951.db2.gz HNPPXMXSJAXEJX-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccccc1 ZINC000247347145 341363840 /nfs/dbraw/zinc/36/38/40/341363840.db2.gz AREWONJBHYDDJX-KVSKMBFKSA-N 2 1 314.498 4.482 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccccc1 ZINC000247347145 341363841 /nfs/dbraw/zinc/36/38/41/341363841.db2.gz AREWONJBHYDDJX-KVSKMBFKSA-N 2 1 314.498 4.482 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3ccccc3s2)C[C@@H]1C ZINC000552071414 341367483 /nfs/dbraw/zinc/36/74/83/341367483.db2.gz CWLKLCHGZIYRRO-GOEBONIOSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3ccccc3s2)C[C@@H]1C ZINC000552071414 341367484 /nfs/dbraw/zinc/36/74/84/341367484.db2.gz CWLKLCHGZIYRRO-GOEBONIOSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3ccccc3s2)C[C@@H]1C ZINC000552071414 341367485 /nfs/dbraw/zinc/36/74/85/341367485.db2.gz CWLKLCHGZIYRRO-GOEBONIOSA-N 2 1 302.487 4.206 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248404345 341376664 /nfs/dbraw/zinc/37/66/64/341376664.db2.gz QBMKSMAFRZWAQU-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248404345 341376665 /nfs/dbraw/zinc/37/66/65/341376665.db2.gz QBMKSMAFRZWAQU-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248407186 341376830 /nfs/dbraw/zinc/37/68/30/341376830.db2.gz UBSIFFWWGNISKC-UXLLHSPISA-N 2 1 304.453 4.129 20 0 DIADMP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cnn1C(C)C ZINC000248688234 341384328 /nfs/dbraw/zinc/38/43/28/341384328.db2.gz IDALMEHOLUUFND-IAGOWNOFSA-N 2 1 320.525 4.078 20 0 DIADMP CC(C)CC[C@H]([NH2+]CC1([NH+]2CCCC2)CCOCC1)C(C)(C)C ZINC000554734305 341462565 /nfs/dbraw/zinc/46/25/65/341462565.db2.gz JCHXCDIKTWULCV-SFHVURJKSA-N 2 1 324.553 4.072 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)c2ccccc21 ZINC000556047836 341492806 /nfs/dbraw/zinc/49/28/06/341492806.db2.gz DPHGRLSLGHVFLJ-AWEZNQCLSA-N 2 1 312.432 4.256 20 0 DIADMP CC(C)Oc1cccc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000261951337 341510266 /nfs/dbraw/zinc/51/02/66/341510266.db2.gz WHWGXFWATDWVAV-VHKYSDTDSA-N 2 1 310.441 4.269 20 0 DIADMP CC(C)CCn1cccc1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000176992581 341909914 /nfs/dbraw/zinc/90/99/14/341909914.db2.gz BIQODNSGETZDPP-UHFFFAOYSA-N 2 1 317.521 4.031 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000158651232 525461917 /nfs/dbraw/zinc/46/19/17/525461917.db2.gz UVNXEZRGCKAXRX-ROUUACIJSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000158651232 525461926 /nfs/dbraw/zinc/46/19/26/525461926.db2.gz UVNXEZRGCKAXRX-ROUUACIJSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CC[C@H]2C2CCC2)cc1 ZINC000337985651 527382848 /nfs/dbraw/zinc/38/28/48/527382848.db2.gz AOLOVCXNLQWILD-GKCIPKSASA-N 2 1 309.457 4.410 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1c2ccccc2-c2ccccc21 ZINC000182680852 527403657 /nfs/dbraw/zinc/40/36/57/527403657.db2.gz MAJHLYNKHHCOLT-UHFFFAOYSA-N 2 1 317.436 4.331 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000366002909 527423074 /nfs/dbraw/zinc/42/30/74/527423074.db2.gz VZYGNCISUOHGPR-KWCYVHTRSA-N 2 1 323.893 4.078 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(Cl)cc1Cl ZINC000643545964 1035589645 /nfs/dbraw/zinc/58/96/45/1035589645.db2.gz GKIFLEYXWAVZQW-AAEUAGOBSA-N 2 1 313.272 4.319 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1Cl ZINC000643545698 1035589732 /nfs/dbraw/zinc/58/97/32/1035589732.db2.gz AXORGBXRELBFEW-AAEUAGOBSA-N 2 1 313.272 4.319 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546344 1035592166 /nfs/dbraw/zinc/59/21/66/1035592166.db2.gz NDRYSYQDFRYBQG-OCCSQVGLSA-N 2 1 321.534 4.074 20 0 DIADMP Clc1cccc2c1SCC[C@H]2[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546090 1035592825 /nfs/dbraw/zinc/59/28/25/1035592825.db2.gz IEVSKVOFMYFOPB-SWLSCSKDSA-N 2 1 322.905 4.141 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547264 1035600640 /nfs/dbraw/zinc/60/06/40/1035600640.db2.gz BXLWENKQQFTEMA-VQTJNVASSA-N 2 1 324.443 4.179 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](F)C2)cc1 ZINC000579832790 1035779597 /nfs/dbraw/zinc/77/95/97/1035779597.db2.gz UGUGNPRLJSSFGS-JQFCIGGWSA-N 2 1 301.409 4.112 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)[C@@H](C)c1cccc(OC)c1 ZINC000179408922 1035872353 /nfs/dbraw/zinc/87/23/53/1035872353.db2.gz CQKXTNCGZZETQH-INIZCTEOSA-N 2 1 315.461 4.063 20 0 DIADMP CC[N@@H+](CCCCn1cc[nH+]c1C)[C@@H](C)c1cccc(OC)c1 ZINC000179408922 1035872380 /nfs/dbraw/zinc/87/23/80/1035872380.db2.gz CQKXTNCGZZETQH-INIZCTEOSA-N 2 1 315.461 4.063 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](C2CC2)C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000705360869 1035881064 /nfs/dbraw/zinc/88/10/64/1035881064.db2.gz CERRPBNVWILJMS-CZAAIQMYSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](C2CC2)C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000705360869 1035881089 /nfs/dbraw/zinc/88/10/89/1035881089.db2.gz CERRPBNVWILJMS-CZAAIQMYSA-N 2 1 312.501 4.208 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)o1 ZINC000154880682 1036050842 /nfs/dbraw/zinc/05/08/42/1036050842.db2.gz IPJYKTZHZZVINF-MRXNPFEDSA-N 2 1 300.446 4.279 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001209453168 1036195805 /nfs/dbraw/zinc/19/58/05/1036195805.db2.gz ZLHHACKPBSQIPP-GOSISDBHSA-N 2 1 318.530 4.421 20 0 DIADMP CC1CCC([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000236827822 1036316034 /nfs/dbraw/zinc/31/60/34/1036316034.db2.gz PYTIVAUSCJGMMD-AQFXKWCLSA-N 2 1 306.519 4.128 20 0 DIADMP CC1CCC([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000236827822 1036316046 /nfs/dbraw/zinc/31/60/46/1036316046.db2.gz PYTIVAUSCJGMMD-AQFXKWCLSA-N 2 1 306.519 4.128 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001648802471 1036375149 /nfs/dbraw/zinc/37/51/49/1036375149.db2.gz JYUJPCVAWVJCLJ-UWVAXJGDSA-N 2 1 302.506 4.441 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1 ZINC001648802469 1036375517 /nfs/dbraw/zinc/37/55/17/1036375517.db2.gz JYUJPCVAWVJCLJ-HLIPFELVSA-N 2 1 302.506 4.441 20 0 DIADMP C[C@@H](C[NH2+]C[C@@H](C1CC1)[NH+](C)C)Cc1ccc(C(C)(C)C)cc1 ZINC001648837414 1036617747 /nfs/dbraw/zinc/61/77/47/1036617747.db2.gz QEQJRXSJIRZXOG-UZLBHIALSA-N 2 1 316.533 4.093 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)CCCc1c[nH+]cn1C ZINC000579974562 1036662742 /nfs/dbraw/zinc/66/27/42/1036662742.db2.gz MGRPNXKJDVPCHH-LSDHHAIUSA-N 2 1 319.880 4.130 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000579974562 1036662752 /nfs/dbraw/zinc/66/27/52/1036662752.db2.gz MGRPNXKJDVPCHH-LSDHHAIUSA-N 2 1 319.880 4.130 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3c(O)cccc32)c1 ZINC000340472722 1036692813 /nfs/dbraw/zinc/69/28/13/1036692813.db2.gz AGVJGOAXPROCBI-FQEVSTJZSA-N 2 1 324.468 4.011 20 0 DIADMP CCc1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001167321734 1036702594 /nfs/dbraw/zinc/70/25/94/1036702594.db2.gz JGQXSDLFUZCNBQ-LJQANCHMSA-N 2 1 314.517 4.337 20 0 DIADMP C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[NH2+]1 ZINC001210499514 1036747117 /nfs/dbraw/zinc/74/71/17/1036747117.db2.gz UUTLIHQBJNSBJZ-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC[NH2+]1 ZINC001210499514 1036747132 /nfs/dbraw/zinc/74/71/32/1036747132.db2.gz UUTLIHQBJNSBJZ-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Cl)s2)C1 ZINC000539046275 1036767649 /nfs/dbraw/zinc/76/76/49/1036767649.db2.gz IYXSJHQKBMFLQW-ZIAGYGMSSA-N 2 1 314.926 4.420 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCCCCC1 ZINC000398020333 1037083891 /nfs/dbraw/zinc/08/38/91/1037083891.db2.gz JVUXGEFLWVMDQP-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]C1CCCCCC1 ZINC000398020333 1037083910 /nfs/dbraw/zinc/08/39/10/1037083910.db2.gz JVUXGEFLWVMDQP-FXAWDEMLSA-N 2 1 300.490 4.209 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398036293 1037104470 /nfs/dbraw/zinc/10/44/70/1037104470.db2.gz QANMETJHPMOMAP-YZGWKJHDSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@H](CC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398036293 1037104475 /nfs/dbraw/zinc/10/44/75/1037104475.db2.gz QANMETJHPMOMAP-YZGWKJHDSA-N 2 1 302.506 4.455 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398039731 1037108239 /nfs/dbraw/zinc/10/82/39/1037108239.db2.gz RHVJBVBOFDXTKA-RZMNMVRNSA-N 2 1 300.490 4.065 20 0 DIADMP CC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398039731 1037108248 /nfs/dbraw/zinc/10/82/48/1037108248.db2.gz RHVJBVBOFDXTKA-RZMNMVRNSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]Cc1cccc(-c2ccccc2)c1 ZINC000077329757 1037238205 /nfs/dbraw/zinc/23/82/05/1037238205.db2.gz IEOKHNXRIPSEIL-UHFFFAOYSA-N 2 1 305.425 4.038 20 0 DIADMP Cc1cc(C)c([C@H](C)[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(C)c1 ZINC001167429871 1037248782 /nfs/dbraw/zinc/24/87/82/1037248782.db2.gz NRANUTTZTWQVCV-PMACEKPBSA-N 2 1 314.517 4.481 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000580744472 1037281458 /nfs/dbraw/zinc/28/14/58/1037281458.db2.gz VDUCYPWTNDEVLO-ZUJMUWTESA-N 2 1 308.432 4.062 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000580744472 1037281471 /nfs/dbraw/zinc/28/14/71/1037281471.db2.gz VDUCYPWTNDEVLO-ZUJMUWTESA-N 2 1 308.432 4.062 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C[C@@H](C)C1 ZINC000398193533 1037278104 /nfs/dbraw/zinc/27/81/04/1037278104.db2.gz NKYXQLXPRCBQML-ARXXEPJESA-N 2 1 314.517 4.311 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C[C@@H](C)C1 ZINC000398193533 1037278119 /nfs/dbraw/zinc/27/81/19/1037278119.db2.gz NKYXQLXPRCBQML-ARXXEPJESA-N 2 1 314.517 4.311 20 0 DIADMP CCC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398228699 1037296111 /nfs/dbraw/zinc/29/61/11/1037296111.db2.gz YZBIVOYNUVDDRI-CZOVOBHWSA-N 2 1 314.517 4.455 20 0 DIADMP CCC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000398228699 1037296125 /nfs/dbraw/zinc/29/61/25/1037296125.db2.gz YZBIVOYNUVDDRI-CZOVOBHWSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000398227130 1037296962 /nfs/dbraw/zinc/29/69/62/1037296962.db2.gz YIEOCDFQGJHQAK-MTFRMWQMSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000398227130 1037296975 /nfs/dbraw/zinc/29/69/75/1037296975.db2.gz YIEOCDFQGJHQAK-MTFRMWQMSA-N 2 1 314.517 4.311 20 0 DIADMP Cc1ccc(N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)n1 ZINC000580979292 1037394584 /nfs/dbraw/zinc/39/45/84/1037394584.db2.gz PADJRARPRAFMIY-QFBILLFUSA-N 2 1 309.457 4.021 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C(C)(C)c1ccc(Cl)cc1 ZINC000128204022 1037435724 /nfs/dbraw/zinc/43/57/24/1037435724.db2.gz ZRPGTXYNYMJWQI-UHFFFAOYSA-N 2 1 305.853 4.150 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCCc1c[nH+]cn1C ZINC000581259098 1037502859 /nfs/dbraw/zinc/50/28/59/1037502859.db2.gz XVZALTDCBSPHMU-WOJBJXKFSA-N 2 1 311.473 4.011 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1CCCc1c[nH+]cn1C ZINC000581259098 1037502874 /nfs/dbraw/zinc/50/28/74/1037502874.db2.gz XVZALTDCBSPHMU-WOJBJXKFSA-N 2 1 311.473 4.011 20 0 DIADMP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCCc1c[nH+]cn1C ZINC000581259095 1037503167 /nfs/dbraw/zinc/50/31/67/1037503167.db2.gz XVZALTDCBSPHMU-PMACEKPBSA-N 2 1 311.473 4.011 20 0 DIADMP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCCc1c[nH+]cn1C ZINC000581259095 1037503173 /nfs/dbraw/zinc/50/31/73/1037503173.db2.gz XVZALTDCBSPHMU-PMACEKPBSA-N 2 1 311.473 4.011 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cnc3ccsc3c2)CC1 ZINC000126524576 1038102873 /nfs/dbraw/zinc/10/28/73/1038102873.db2.gz FECCIRTUXMLZHD-AWEZNQCLSA-N 2 1 317.502 4.211 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000535685700 1038314704 /nfs/dbraw/zinc/31/47/04/1038314704.db2.gz LOPXWTBMDPXZRF-KBXCAEBGSA-N 2 1 306.881 4.039 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226938 1038379568 /nfs/dbraw/zinc/37/95/68/1038379568.db2.gz DUROSBDESLFWQZ-DOTOQJQBSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226938 1038379583 /nfs/dbraw/zinc/37/95/83/1038379583.db2.gz DUROSBDESLFWQZ-DOTOQJQBSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H](C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001167499256 1038452149 /nfs/dbraw/zinc/45/21/49/1038452149.db2.gz FGPYBRPJZIKENK-NRSPTQNISA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@@H](C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001167499256 1038452152 /nfs/dbraw/zinc/45/21/52/1038452152.db2.gz FGPYBRPJZIKENK-NRSPTQNISA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@@H](C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001167499256 1038452155 /nfs/dbraw/zinc/45/21/55/1038452155.db2.gz FGPYBRPJZIKENK-NRSPTQNISA-N 2 1 314.517 4.267 20 0 DIADMP Cc1ccc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1C ZINC001167499395 1038454556 /nfs/dbraw/zinc/45/45/56/1038454556.db2.gz HWJJOOSBHXQDFA-JOCHJYFZSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1C ZINC001167499395 1038454561 /nfs/dbraw/zinc/45/45/61/1038454561.db2.gz HWJJOOSBHXQDFA-JOCHJYFZSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC001167499395 1038454568 /nfs/dbraw/zinc/45/45/68/1038454568.db2.gz HWJJOOSBHXQDFA-JOCHJYFZSA-N 2 1 322.496 4.257 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102100 1038514018 /nfs/dbraw/zinc/51/40/18/1038514018.db2.gz CJDJYUZVCZAQCO-TZMCWYRMSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102100 1038514027 /nfs/dbraw/zinc/51/40/27/1038514027.db2.gz CJDJYUZVCZAQCO-TZMCWYRMSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102100 1038514031 /nfs/dbraw/zinc/51/40/31/1038514031.db2.gz CJDJYUZVCZAQCO-TZMCWYRMSA-N 2 1 314.395 4.068 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102100 1038514036 /nfs/dbraw/zinc/51/40/36/1038514036.db2.gz CJDJYUZVCZAQCO-TZMCWYRMSA-N 2 1 314.395 4.068 20 0 DIADMP c1ccc2cc(CC[N@H+]3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000606447887 1038603715 /nfs/dbraw/zinc/60/37/15/1038603715.db2.gz LMOQVXZRHQIJIP-QFIPXVFZSA-N 2 1 322.496 4.333 20 0 DIADMP C(CC[N@H+]1CCC[C@H]2CCC[C@H]21)C[NH+]1CCC[C@@H]2CCC[C@@H]21 ZINC000582339675 1038635252 /nfs/dbraw/zinc/63/52/52/1038635252.db2.gz CPGLNEKTBGXKEJ-FGYAAKKASA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@@H+]1CCC[C@@H]2CCC[C@@H]21)C[NH+]1CCC[C@H]2CCC[C@H]21 ZINC000582339675 1038635258 /nfs/dbraw/zinc/63/52/58/1038635258.db2.gz CPGLNEKTBGXKEJ-FGYAAKKASA-N 2 1 304.522 4.296 20 0 DIADMP C(CC[N@H+]1CCC[C@@H]2CCC[C@@H]21)C[NH+]1CCC[C@H]2CCC[C@H]21 ZINC000582339675 1038635260 /nfs/dbraw/zinc/63/52/60/1038635260.db2.gz CPGLNEKTBGXKEJ-FGYAAKKASA-N 2 1 304.522 4.296 20 0 DIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1CCC1 ZINC000684836050 1038642456 /nfs/dbraw/zinc/64/24/56/1038642456.db2.gz OZBHOCWLMCIQNS-DZIBYMRMSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1[nH+]c2c(n1Cc1ccc(C[NH+]3CCCCC3)cc1)CCCC2 ZINC000582370926 1038642607 /nfs/dbraw/zinc/64/26/07/1038642607.db2.gz FJACTXQAUQDURP-UHFFFAOYSA-N 2 1 323.484 4.105 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@@H+]1C ZINC001167586157 1038713173 /nfs/dbraw/zinc/71/31/73/1038713173.db2.gz IERYACCZFPZEQU-KDOFPFPSSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cc(Cl)cc3ccccc32)CC[N@H+]1C ZINC001167586157 1038713176 /nfs/dbraw/zinc/71/31/76/1038713176.db2.gz IERYACCZFPZEQU-KDOFPFPSSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586157 1038713183 /nfs/dbraw/zinc/71/31/83/1038713183.db2.gz IERYACCZFPZEQU-KDOFPFPSSA-N 2 1 316.876 4.408 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc3ccccc32)CC[NH+]1C ZINC001167586157 1038713186 /nfs/dbraw/zinc/71/31/86/1038713186.db2.gz IERYACCZFPZEQU-KDOFPFPSSA-N 2 1 316.876 4.408 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@H]1CCN(C)[C@@H](C)C1 ZINC001167586615 1038714977 /nfs/dbraw/zinc/71/49/77/1038714977.db2.gz OXROSFRCHDDGRJ-LPHOPBHVSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1 ZINC001167586615 1038714985 /nfs/dbraw/zinc/71/49/85/1038714985.db2.gz OXROSFRCHDDGRJ-LPHOPBHVSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1 ZINC001167586615 1038714994 /nfs/dbraw/zinc/71/49/94/1038714994.db2.gz OXROSFRCHDDGRJ-LPHOPBHVSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC001167586615 1038715003 /nfs/dbraw/zinc/71/50/03/1038715003.db2.gz OXROSFRCHDDGRJ-LPHOPBHVSA-N 2 1 310.485 4.317 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+](C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC001167586615 1038715012 /nfs/dbraw/zinc/71/50/12/1038715012.db2.gz OXROSFRCHDDGRJ-LPHOPBHVSA-N 2 1 310.485 4.317 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000684953143 1038737236 /nfs/dbraw/zinc/73/72/36/1038737236.db2.gz AFNPXDFGSFLNBS-FQEVSTJZSA-N 2 1 323.484 4.089 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599368 1038758892 /nfs/dbraw/zinc/75/88/92/1038758892.db2.gz TUWONCPJIJEIQG-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599368 1038758897 /nfs/dbraw/zinc/75/88/97/1038758897.db2.gz TUWONCPJIJEIQG-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599368 1038758900 /nfs/dbraw/zinc/75/89/00/1038758900.db2.gz TUWONCPJIJEIQG-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599368 1038758908 /nfs/dbraw/zinc/75/89/08/1038758908.db2.gz TUWONCPJIJEIQG-KRWDZBQOSA-N 2 1 322.443 4.194 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000608061140 1038761066 /nfs/dbraw/zinc/76/10/66/1038761066.db2.gz ABCQFCGHOYBLCI-FXAWDEMLSA-N 2 1 308.469 4.234 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)s2)cc1 ZINC000608061660 1038761835 /nfs/dbraw/zinc/76/18/35/1038761835.db2.gz XVPKYYUSVBKGEJ-RDJZCZTQSA-N 2 1 314.498 4.296 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+](C)[C@@H](C)C3)s2)cc1 ZINC000608061660 1038761838 /nfs/dbraw/zinc/76/18/38/1038761838.db2.gz XVPKYYUSVBKGEJ-RDJZCZTQSA-N 2 1 314.498 4.296 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@@H+]1C ZINC000608061364 1038761928 /nfs/dbraw/zinc/76/19/28/1038761928.db2.gz RBELWGJWPYUHRT-KBPBESRZSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3F)s2)CC[N@H+]1C ZINC000608061364 1038761937 /nfs/dbraw/zinc/76/19/37/1038761937.db2.gz RBELWGJWPYUHRT-KBPBESRZSA-N 2 1 318.461 4.127 20 0 DIADMP C[N@H+](Cc1ccccc1)[C@@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000608092658 1038773456 /nfs/dbraw/zinc/77/34/56/1038773456.db2.gz BWLZVVFVQHQHKI-MRXNPFEDSA-N 2 1 323.465 4.007 20 0 DIADMP C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000608092658 1038773463 /nfs/dbraw/zinc/77/34/63/1038773463.db2.gz BWLZVVFVQHQHKI-MRXNPFEDSA-N 2 1 323.465 4.007 20 0 DIADMP CC(C[NH+]1CCC[C@@H]2CCC[C@@H]21)C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000608564658 1038885049 /nfs/dbraw/zinc/88/50/49/1038885049.db2.gz YMUIVAWWYWCZAR-MUGJNUQGSA-N 2 1 304.522 4.152 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1CCCc1ccccc1 ZINC000342860557 1038926549 /nfs/dbraw/zinc/92/65/49/1038926549.db2.gz PEWNQIFWVHIQBZ-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1CCCc1ccccc1 ZINC000342860557 1038926565 /nfs/dbraw/zinc/92/65/65/1038926565.db2.gz PEWNQIFWVHIQBZ-HXUWFJFHSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000342865925 1038933879 /nfs/dbraw/zinc/93/38/79/1038933879.db2.gz XUIROTRKWVGVQJ-SFHVURJKSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000342865925 1038933883 /nfs/dbraw/zinc/93/38/83/1038933883.db2.gz XUIROTRKWVGVQJ-SFHVURJKSA-N 2 1 319.399 4.087 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@]2(C)CC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000657670692 1038981456 /nfs/dbraw/zinc/98/14/56/1038981456.db2.gz NMJTZOOURUQGJZ-KBAYOESNSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@]2(C)CC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000657670692 1038981471 /nfs/dbraw/zinc/98/14/71/1038981471.db2.gz NMJTZOOURUQGJZ-KBAYOESNSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2cccs2)cc1F ZINC000153699815 1039095054 /nfs/dbraw/zinc/09/50/54/1039095054.db2.gz PMJWQWGNNCGRTH-GFCCVEGCSA-N 2 1 315.417 4.232 20 0 DIADMP CC(C)CCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000539817973 1039347316 /nfs/dbraw/zinc/34/73/16/1039347316.db2.gz OLUHNRMDYSBLOY-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000539817973 1039347337 /nfs/dbraw/zinc/34/73/37/1039347337.db2.gz OLUHNRMDYSBLOY-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000539817973 1039347348 /nfs/dbraw/zinc/34/73/48/1039347348.db2.gz OLUHNRMDYSBLOY-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC(C)CCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000539817973 1039347368 /nfs/dbraw/zinc/34/73/68/1039347368.db2.gz OLUHNRMDYSBLOY-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2csc3ccccc23)C[C@@H]1C ZINC000539818118 1039348604 /nfs/dbraw/zinc/34/86/04/1039348604.db2.gz QPQFOZQPUIGGIP-GOEBONIOSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2csc3ccccc23)C[C@@H]1C ZINC000539818118 1039348617 /nfs/dbraw/zinc/34/86/17/1039348617.db2.gz QPQFOZQPUIGGIP-GOEBONIOSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2csc3ccccc23)C[C@@H]1C ZINC000539818118 1039348631 /nfs/dbraw/zinc/34/86/31/1039348631.db2.gz QPQFOZQPUIGGIP-GOEBONIOSA-N 2 1 302.487 4.206 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1)c1ccsc1 ZINC000669850659 1039382746 /nfs/dbraw/zinc/38/27/46/1039382746.db2.gz DLOGJSDTBVSRME-RLFYNMQTSA-N 2 1 306.519 4.442 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1)c1ccsc1 ZINC000669850658 1039384216 /nfs/dbraw/zinc/38/42/16/1039384216.db2.gz DLOGJSDTBVSRME-MPGHIAIKSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000539896598 1039384408 /nfs/dbraw/zinc/38/44/08/1039384408.db2.gz MDRGCOGBOAACOL-OXJNMPFZSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000539896598 1039384424 /nfs/dbraw/zinc/38/44/24/1039384424.db2.gz MDRGCOGBOAACOL-OXJNMPFZSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1oc2ccccc2c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000539896598 1039384432 /nfs/dbraw/zinc/38/44/32/1039384432.db2.gz MDRGCOGBOAACOL-OXJNMPFZSA-N 2 1 324.468 4.190 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@H](C)C(F)(F)F)CC1)CC1CC1 ZINC000540049627 1039407262 /nfs/dbraw/zinc/40/72/62/1039407262.db2.gz HJTSUATXUQKOEK-AWEZNQCLSA-N 2 1 320.443 4.019 20 0 DIADMP Cc1cnc([C@H](C)[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000540052837 1039410335 /nfs/dbraw/zinc/41/03/35/1039410335.db2.gz KQKFQJRPQQTPCF-RDJZCZTQSA-N 2 1 319.493 4.021 20 0 DIADMP Cc1cnc([C@H](C)[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000540052837 1039410344 /nfs/dbraw/zinc/41/03/44/1039410344.db2.gz KQKFQJRPQQTPCF-RDJZCZTQSA-N 2 1 319.493 4.021 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540150598 1039432006 /nfs/dbraw/zinc/43/20/06/1039432006.db2.gz GOTBCNYDGGPHJQ-SJORKVTESA-N 2 1 320.546 4.427 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540150593 1039432274 /nfs/dbraw/zinc/43/22/74/1039432274.db2.gz GOTBCNYDGGPHJQ-DLBZAZTESA-N 2 1 320.546 4.427 20 0 DIADMP C[C@H]1C[C@H]1[C@H]([NH2+][C@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C)c1ccc(Cl)cc1 ZINC000540189086 1039442094 /nfs/dbraw/zinc/44/20/94/1039442094.db2.gz WUNXEYHDASXHFD-ZRYOEQAYSA-N 2 1 320.908 4.355 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000540261593 1039463287 /nfs/dbraw/zinc/46/32/87/1039463287.db2.gz JHORQZNOTKANCE-RDTXWAMCSA-N 2 1 306.881 4.111 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 ZINC000540302072 1039470195 /nfs/dbraw/zinc/47/01/95/1039470195.db2.gz ORQHNXITOZOUTE-MRXNPFEDSA-N 2 1 324.255 4.239 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccccc1C(F)(F)F ZINC000540459086 1039496916 /nfs/dbraw/zinc/49/69/16/1039496916.db2.gz IHINQZWNOGDMPO-UONOGXRCSA-N 2 1 314.395 4.230 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccccc1C(F)(F)F ZINC000540459083 1039496955 /nfs/dbraw/zinc/49/69/55/1039496955.db2.gz IHINQZWNOGDMPO-KBPBESRZSA-N 2 1 314.395 4.230 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000540591700 1039520353 /nfs/dbraw/zinc/52/03/53/1039520353.db2.gz NKLJVEFBCTWQEW-MAUKXSAKSA-N 2 1 306.469 4.234 20 0 DIADMP C[C@H](CC[NH2+][C@@H]1CCSc2c(F)cccc21)[NH+]1CCCCC1 ZINC000346872540 1039578393 /nfs/dbraw/zinc/57/83/93/1039578393.db2.gz NJLRNIHTVCPBPT-RHSMWYFYSA-N 2 1 322.493 4.217 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000584060193 1039584120 /nfs/dbraw/zinc/58/41/20/1039584120.db2.gz PICHGEWJPWVZGB-RZUBCFFCSA-N 2 1 320.480 4.142 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCc3ccccc32)C[C@@H]1c1ccccc1 ZINC000584060193 1039584133 /nfs/dbraw/zinc/58/41/33/1039584133.db2.gz PICHGEWJPWVZGB-RZUBCFFCSA-N 2 1 320.480 4.142 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cc2ccncc2s1 ZINC000657824563 1039585473 /nfs/dbraw/zinc/58/54/73/1039585473.db2.gz URSKURNDMYDZGN-CABCVRRESA-N 2 1 317.502 4.211 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCC(C)(F)F)C1 ZINC000929644414 1039594717 /nfs/dbraw/zinc/59/47/17/1039594717.db2.gz REQUCWMMUYRENV-JKSUJKDBSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCC(C)(F)F)C1 ZINC000929644414 1039594732 /nfs/dbraw/zinc/59/47/32/1039594732.db2.gz REQUCWMMUYRENV-JKSUJKDBSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCC(C)(F)F)C1 ZINC000929644414 1039594741 /nfs/dbraw/zinc/59/47/41/1039594741.db2.gz REQUCWMMUYRENV-JKSUJKDBSA-N 2 1 302.453 4.008 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc2cnccc2o1 ZINC000657838853 1039680094 /nfs/dbraw/zinc/68/00/94/1039680094.db2.gz ZNIFVBZEHJQVPE-HZPDHXFCSA-N 2 1 315.461 4.133 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc2cnccc2o1 ZINC000657838852 1039681295 /nfs/dbraw/zinc/68/12/95/1039681295.db2.gz ZNIFVBZEHJQVPE-HOTGVXAUSA-N 2 1 315.461 4.133 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)C(C)(C)C(F)F)CC1 ZINC000657840235 1039686408 /nfs/dbraw/zinc/68/64/08/1039686408.db2.gz NXKWSVAUFNQQEX-OAHLLOKOSA-N 2 1 324.459 4.229 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](C)C2CCCCCC2)[C@H](C)C1 ZINC000541544990 1039697534 /nfs/dbraw/zinc/69/75/34/1039697534.db2.gz CBDZIXUJVKWPTD-GGPKGHCWSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000541660433 1039726381 /nfs/dbraw/zinc/72/63/81/1039726381.db2.gz DMNBSZFIKDQISE-HZPDHXFCSA-N 2 1 300.446 4.266 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CC[C@H]1CCCC[N@H+]1C ZINC000541660433 1039726402 /nfs/dbraw/zinc/72/64/02/1039726402.db2.gz DMNBSZFIKDQISE-HZPDHXFCSA-N 2 1 300.446 4.266 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000657859186 1039774216 /nfs/dbraw/zinc/77/42/16/1039774216.db2.gz QLHCECJGAUUQCV-WBVHZDCISA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C(C)(C)C(F)F ZINC000657859184 1039774913 /nfs/dbraw/zinc/77/49/13/1039774913.db2.gz QLHCECJGAUUQCV-RDJZCZTQSA-N 2 1 324.459 4.168 20 0 DIADMP c1cc(CCC[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cs1 ZINC000542100579 1039789543 /nfs/dbraw/zinc/78/95/43/1039789543.db2.gz DYFRNPZUIUIRCC-LJQANCHMSA-N 2 1 320.546 4.269 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cccnc1 ZINC000091286475 1039839956 /nfs/dbraw/zinc/83/99/56/1039839956.db2.gz YMWABMUXAKFMLQ-PKOBYXMFSA-N 2 1 303.494 4.023 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccccc1Cl)C(C)C ZINC000091288164 1039844160 /nfs/dbraw/zinc/84/41/60/1039844160.db2.gz ZAGRSRXBNFKFRH-KRWDZBQOSA-N 2 1 305.853 4.222 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000166615184 1039878333 /nfs/dbraw/zinc/87/83/33/1039878333.db2.gz SWUJFTAQDRYTBI-DAYGRLMNSA-N 2 1 306.881 4.254 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1Cl ZINC000166615184 1039878357 /nfs/dbraw/zinc/87/83/57/1039878357.db2.gz SWUJFTAQDRYTBI-DAYGRLMNSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470308 1040066488 /nfs/dbraw/zinc/06/64/88/1040066488.db2.gz FHTZFTRFZVEQIU-BEFAXECRSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470308 1040066500 /nfs/dbraw/zinc/06/65/00/1040066500.db2.gz FHTZFTRFZVEQIU-BEFAXECRSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470308 1040066512 /nfs/dbraw/zinc/06/65/12/1040066512.db2.gz FHTZFTRFZVEQIU-BEFAXECRSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470308 1040066528 /nfs/dbraw/zinc/06/65/28/1040066528.db2.gz FHTZFTRFZVEQIU-BEFAXECRSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470312 1040068122 /nfs/dbraw/zinc/06/81/22/1040068122.db2.gz FHTZFTRFZVEQIU-KXBFYZLASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470312 1040068144 /nfs/dbraw/zinc/06/81/44/1040068144.db2.gz FHTZFTRFZVEQIU-KXBFYZLASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470312 1040068164 /nfs/dbraw/zinc/06/81/64/1040068164.db2.gz FHTZFTRFZVEQIU-KXBFYZLASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000685470312 1040068179 /nfs/dbraw/zinc/06/81/79/1040068179.db2.gz FHTZFTRFZVEQIU-KXBFYZLASA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000309704555 1040089087 /nfs/dbraw/zinc/08/90/87/1040089087.db2.gz HJSNZNVLWBTRDJ-BQFCYCMXSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC000309689071 1040089193 /nfs/dbraw/zinc/08/91/93/1040089193.db2.gz CITBNXRSTJCGNY-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000309719923 1040089729 /nfs/dbraw/zinc/08/97/29/1040089729.db2.gz LWYAPIZADXLWQI-CTNGQTDRSA-N 2 1 308.469 4.249 20 0 DIADMP CCC1(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC000309693137 1040090337 /nfs/dbraw/zinc/09/03/37/1040090337.db2.gz CGBOUEGVDDNKSQ-IEBWSBKVSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1CC(C)(C)C[C@@H]1C ZINC000708575039 1040092428 /nfs/dbraw/zinc/09/24/28/1040092428.db2.gz PQGJXKHVYYYMTN-HNJRGHQBSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309751678 1040094806 /nfs/dbraw/zinc/09/48/06/1040094806.db2.gz ZRHOUEDQSMSNED-BQFCYCMXSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309885437 1040099412 /nfs/dbraw/zinc/09/94/12/1040099412.db2.gz YVJCVHWPTQXCSY-MISYRCLQSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C3CC(c4ccccc4)C3)C2)cc1 ZINC000310088697 1040105714 /nfs/dbraw/zinc/10/57/14/1040105714.db2.gz PNOJKJPJCJHAMZ-KPQWGBOZSA-N 2 1 320.480 4.044 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2ccccc21)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310197482 1040112080 /nfs/dbraw/zinc/11/20/80/1040112080.db2.gz ASZVBOGXECCEQN-XJABCFGWSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000310380612 1040118680 /nfs/dbraw/zinc/11/86/80/1040118680.db2.gz BIQDBZNNMXOERK-SFGWALBWSA-N 2 1 320.480 4.347 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@H]1CC[C@@H](C)[C@H](C)C1 ZINC000708582330 1040131679 /nfs/dbraw/zinc/13/16/79/1040131679.db2.gz UGABDNRKWUASAI-VLFNSIGCSA-N 2 1 314.517 4.169 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](C)c2cc3ccccc3s2)CC1 ZINC000223361178 1040240698 /nfs/dbraw/zinc/24/06/98/1040240698.db2.gz AUVCLQUWGNRZJN-CQSZACIVSA-N 2 1 302.487 4.426 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C[C@@H](c2ccccc2)C1 ZINC000323308525 1040521453 /nfs/dbraw/zinc/52/14/53/1040521453.db2.gz FBCADAHGPGBHRP-HNJRGHQBSA-N 2 1 312.501 4.033 20 0 DIADMP CC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000236713392 1040654782 /nfs/dbraw/zinc/65/47/82/1040654782.db2.gz QLZCVMKXEBSJPH-BKDYDCAMSA-N 2 1 312.501 4.350 20 0 DIADMP Clc1c[nH+]ccc1NC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000309694016 1040720154 /nfs/dbraw/zinc/72/01/54/1040720154.db2.gz DPRHJWKRZUESIL-MRXNPFEDSA-N 2 1 315.848 4.059 20 0 DIADMP Clc1c[nH+]ccc1NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309694016 1040720169 /nfs/dbraw/zinc/72/01/69/1040720169.db2.gz DPRHJWKRZUESIL-MRXNPFEDSA-N 2 1 315.848 4.059 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309729514 1040723741 /nfs/dbraw/zinc/72/37/41/1040723741.db2.gz ONSYXNKVUHAMOK-XUVXKRRUSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309729515 1040724450 /nfs/dbraw/zinc/72/44/50/1040724450.db2.gz ONSYXNKVUHAMOK-ZCNNSNEGSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000309729512 1040725314 /nfs/dbraw/zinc/72/53/14/1040725314.db2.gz ONSYXNKVUHAMOK-AQNXPRMDSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309811298 1040732429 /nfs/dbraw/zinc/73/24/29/1040732429.db2.gz WMQPYNWRFWXRLX-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)[C@H]1C[C@@H]1C ZINC000414067279 1040813367 /nfs/dbraw/zinc/81/33/67/1040813367.db2.gz AGTXMJBMLXQJKA-JSJNYSNDSA-N 2 1 300.490 4.236 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@H]1C ZINC000414131124 1040903596 /nfs/dbraw/zinc/90/35/96/1040903596.db2.gz XLEJQDDQNFESNO-OCABDXPQSA-N 2 1 306.519 4.155 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@H]1C ZINC000414131124 1040903605 /nfs/dbraw/zinc/90/36/05/1040903605.db2.gz XLEJQDDQNFESNO-OCABDXPQSA-N 2 1 306.519 4.155 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(SC)cc2)CC1 ZINC000613491173 1041003371 /nfs/dbraw/zinc/00/33/71/1041003371.db2.gz IUZCJGDEPWGPHJ-UHFFFAOYSA-N 2 1 320.546 4.352 20 0 DIADMP Cc1nccn1CCCC[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000125519144 1041111493 /nfs/dbraw/zinc/11/14/93/1041111493.db2.gz ZUZFANFVFUIAPG-UHFFFAOYSA-N 2 1 315.436 4.023 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000125519144 1041111498 /nfs/dbraw/zinc/11/14/98/1041111498.db2.gz ZUZFANFVFUIAPG-UHFFFAOYSA-N 2 1 315.436 4.023 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000125519144 1041111505 /nfs/dbraw/zinc/11/15/05/1041111505.db2.gz ZUZFANFVFUIAPG-UHFFFAOYSA-N 2 1 315.436 4.023 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccsc2)CC1 ZINC000539820225 1041120162 /nfs/dbraw/zinc/12/01/62/1041120162.db2.gz HOKHHNZMDPGQDO-INIZCTEOSA-N 2 1 306.519 4.225 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cccc(Cl)c2F)cc1 ZINC000809739096 1041241325 /nfs/dbraw/zinc/24/13/25/1041241325.db2.gz XHYXODKMBOEYMJ-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(Cl)c2F)cc1 ZINC000809739096 1041241335 /nfs/dbraw/zinc/24/13/35/1041241335.db2.gz XHYXODKMBOEYMJ-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc[nH+]cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000301567216 1041244089 /nfs/dbraw/zinc/24/40/89/1041244089.db2.gz WQOTXYWSLCYTAK-GDBMZVCRSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@@H]1C[C@H](Nc2cc[nH+]cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301567216 1041244109 /nfs/dbraw/zinc/24/41/09/1041244109.db2.gz WQOTXYWSLCYTAK-GDBMZVCRSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@@H]1C[C@H](Nc2nc3ccccc3[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000301900372 1041256088 /nfs/dbraw/zinc/25/60/88/1041256088.db2.gz YZTWYLBVJXQJNG-NVXWUHKLSA-N 2 1 320.440 4.028 20 0 DIADMP CCCCCC[C@H](CC)[NH+]1CCC([NH3+])(c2cccnc2)CC1 ZINC001170589766 1041274615 /nfs/dbraw/zinc/27/46/15/1041274615.db2.gz ANAHBXAPZDFVKG-SFHVURJKSA-N 2 1 303.494 4.080 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001170592571 1041288341 /nfs/dbraw/zinc/28/83/41/1041288341.db2.gz FHWPMRZIMXROQB-UNMCSNQZSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001170592571 1041288349 /nfs/dbraw/zinc/28/83/49/1041288349.db2.gz FHWPMRZIMXROQB-UNMCSNQZSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001170592571 1041288356 /nfs/dbraw/zinc/28/83/56/1041288356.db2.gz FHWPMRZIMXROQB-UNMCSNQZSA-N 2 1 320.480 4.118 20 0 DIADMP CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC001170594665 1041297566 /nfs/dbraw/zinc/29/75/66/1041297566.db2.gz WCJIAXWCTDWZKQ-XLIONFOSSA-N 2 1 300.490 4.289 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1 ZINC001170594665 1041297577 /nfs/dbraw/zinc/29/75/77/1041297577.db2.gz WCJIAXWCTDWZKQ-XLIONFOSSA-N 2 1 300.490 4.289 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC001170594665 1041297589 /nfs/dbraw/zinc/29/75/89/1041297589.db2.gz WCJIAXWCTDWZKQ-XLIONFOSSA-N 2 1 300.490 4.289 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309689187 1041399877 /nfs/dbraw/zinc/39/98/77/1041399877.db2.gz CJOHQDDVUDPQNF-HSALFYBXSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc(Cl)ccc1Cl ZINC000136296932 1041554381 /nfs/dbraw/zinc/55/43/81/1041554381.db2.gz PSZYVVZHNOBOQV-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc(Cl)ccc1Cl ZINC000136296932 1041554384 /nfs/dbraw/zinc/55/43/84/1041554384.db2.gz PSZYVVZHNOBOQV-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP C[NH+]1CCC(CC[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001207479927 1041613890 /nfs/dbraw/zinc/61/38/90/1041613890.db2.gz PMLQNVNLRFMKOP-UHFFFAOYSA-N 2 1 318.892 4.161 20 0 DIADMP Cc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)o1 ZINC000813789754 1041730974 /nfs/dbraw/zinc/73/09/74/1041730974.db2.gz CKSSQMBBUGQEJQ-IHWFROFDSA-N 2 1 324.468 4.263 20 0 DIADMP Cc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)o1 ZINC000813789754 1041730984 /nfs/dbraw/zinc/73/09/84/1041730984.db2.gz CKSSQMBBUGQEJQ-IHWFROFDSA-N 2 1 324.468 4.263 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813789786 1041732394 /nfs/dbraw/zinc/73/23/94/1041732394.db2.gz CURLXBVPKIBIMM-ZMWHVPEISA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC000709355259 1041734259 /nfs/dbraw/zinc/73/42/59/1041734259.db2.gz QTASZMHBGPDHIY-PWSUYJOCSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCC1 ZINC000813881668 1041742610 /nfs/dbraw/zinc/74/26/10/1041742610.db2.gz SBNZSDMTCJWEDP-ZNDGOPKYSA-N 2 1 312.501 4.350 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)C[C@@H]21 ZINC001170716131 1041745984 /nfs/dbraw/zinc/74/59/84/1041745984.db2.gz PEUAZEMPLIQCQN-ULBFJEEJSA-N 2 1 324.512 4.206 20 0 DIADMP CC(C)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000814173094 1041778754 /nfs/dbraw/zinc/77/87/54/1041778754.db2.gz IHBNQBRMKFGHAH-IHWFROFDSA-N 2 1 300.490 4.208 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([N@@H+](Cc3ccccc3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170739186 1041808787 /nfs/dbraw/zinc/80/87/87/1041808787.db2.gz QKPVLGDVRCKJBM-CCQCEHTISA-N 2 1 312.501 4.193 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(-c2ccccc2)cn1 ZINC000651829466 1041926669 /nfs/dbraw/zinc/92/66/69/1041926669.db2.gz DCBAROCFJDRERH-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(-c2ccccc2)cn1 ZINC000651827814 1041926950 /nfs/dbraw/zinc/92/69/50/1041926950.db2.gz OCGVRGMZWBAEHT-KRWDZBQOSA-N 2 1 323.484 4.274 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1 ZINC000815576139 1041965665 /nfs/dbraw/zinc/96/56/65/1041965665.db2.gz KMYSBKZJRWMOFD-INIZCTEOSA-N 2 1 314.448 4.437 20 0 DIADMP CC[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000537940629 1041994664 /nfs/dbraw/zinc/99/46/64/1041994664.db2.gz RAAIDAVFKVOBMW-HQRMLTQVSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1F)CC1CC1 ZINC000661794942 1041996166 /nfs/dbraw/zinc/99/61/66/1041996166.db2.gz XXZNFGFAIUXUET-UHFFFAOYSA-N 2 1 315.436 4.023 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1F)CC1CC1 ZINC000661794942 1041996176 /nfs/dbraw/zinc/99/61/76/1041996176.db2.gz XXZNFGFAIUXUET-UHFFFAOYSA-N 2 1 315.436 4.023 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000248879425 1042068068 /nfs/dbraw/zinc/06/80/68/1042068068.db2.gz KIYRADFZZIVLDR-PXNSSMCTSA-N 2 1 315.505 4.035 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccccc1SC(C)(C)C ZINC000817970673 1042134879 /nfs/dbraw/zinc/13/48/79/1042134879.db2.gz BULFUBAPUJSKLO-KFWWJZLASA-N 2 1 306.519 4.368 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170918061 1042164716 /nfs/dbraw/zinc/16/47/16/1042164716.db2.gz SRHLVLFZVLGPEW-DOTOQJQBSA-N 2 1 320.908 4.038 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472210 1042183206 /nfs/dbraw/zinc/18/32/06/1042183206.db2.gz ZSQVJPKNOWOHQV-SJLPKXTDSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472210 1042183210 /nfs/dbraw/zinc/18/32/10/1042183210.db2.gz ZSQVJPKNOWOHQV-SJLPKXTDSA-N 2 1 323.484 4.007 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCc2ccccc2Cl)CC1 ZINC000303273585 1042200002 /nfs/dbraw/zinc/20/00/02/1042200002.db2.gz RXARXTRDJRBGSN-UHFFFAOYSA-N 2 1 322.924 4.326 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC001167824167 1042210166 /nfs/dbraw/zinc/21/01/66/1042210166.db2.gz CAYUANQAYIAKCD-LPHOPBHVSA-N 2 1 306.469 4.473 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001167825934 1042216072 /nfs/dbraw/zinc/21/60/72/1042216072.db2.gz LTDQSRBLXGWODO-UYAOXDASSA-N 2 1 302.506 4.062 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000643521338 1042220244 /nfs/dbraw/zinc/22/02/44/1042220244.db2.gz ADWPXAYODWZPTC-DOMZBBRYSA-N 2 1 301.261 4.176 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001167833574 1042235858 /nfs/dbraw/zinc/23/58/58/1042235858.db2.gz CRXVFBBWQYDTPX-WMZOPIPTSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@H](C)c1ccccc1OC ZINC001167836751 1042248371 /nfs/dbraw/zinc/24/83/71/1042248371.db2.gz GQXZVSPHKKTYFR-IAGOWNOFSA-N 2 1 306.494 4.199 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001167837863 1042250219 /nfs/dbraw/zinc/25/02/19/1042250219.db2.gz NDLGMNGDGLRUHM-SJLPKXTDSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)C(C)(C)Cc1ccccc1 ZINC001167841011 1042253845 /nfs/dbraw/zinc/25/38/45/1042253845.db2.gz JJKWMSMOUDXJNB-SFHVURJKSA-N 2 1 304.522 4.450 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1Cl ZINC000279050885 1042265044 /nfs/dbraw/zinc/26/50/44/1042265044.db2.gz YAEAWSBXOBXEPQ-VXGBXAGGSA-N 2 1 324.255 4.103 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)c1 ZINC000324629216 1042270115 /nfs/dbraw/zinc/27/01/15/1042270115.db2.gz UDYBFRRTXDLYPY-SIKLNZKXSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)c2ccccc2)c1 ZINC000324629216 1042270123 /nfs/dbraw/zinc/27/01/23/1042270123.db2.gz UDYBFRRTXDLYPY-SIKLNZKXSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1ccc(C)c([C@@H]([NH2+]C[C@H]2CCC[N@@H+](C)C2)c2ccccc2)c1 ZINC000324629215 1042270432 /nfs/dbraw/zinc/27/04/32/1042270432.db2.gz UDYBFRRTXDLYPY-KNQAVFIVSA-N 2 1 322.496 4.324 20 0 DIADMP Cc1ccc(C)c([C@@H]([NH2+]C[C@H]2CCC[N@H+](C)C2)c2ccccc2)c1 ZINC000324629215 1042270435 /nfs/dbraw/zinc/27/04/35/1042270435.db2.gz UDYBFRRTXDLYPY-KNQAVFIVSA-N 2 1 322.496 4.324 20 0 DIADMP CC(C)(C)[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)cc1 ZINC000320134643 1042310181 /nfs/dbraw/zinc/31/01/81/1042310181.db2.gz JWHSKBXNVMJTJG-GOSISDBHSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H](C[NH2+][C@H]1CCSc2ccc(Cl)cc21)C[NH+]1CCCC1 ZINC000062078759 1042314587 /nfs/dbraw/zinc/31/45/87/1042314587.db2.gz IMCFVPRNFWDTLL-BBRMVZONSA-N 2 1 324.921 4.198 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(C(F)F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000279715292 1042334169 /nfs/dbraw/zinc/33/41/69/1042334169.db2.gz LQWGRIVASVRMEV-WMLDXEAASA-N 2 1 322.443 4.367 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](CNCc2ccc(-c3ccccc3)o2)C1 ZINC000236608947 1042369899 /nfs/dbraw/zinc/36/98/99/1042369899.db2.gz LFVAPVBGKPHWSH-KRWDZBQOSA-N 2 1 312.457 4.157 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC000236608947 1042369903 /nfs/dbraw/zinc/36/99/03/1042369903.db2.gz LFVAPVBGKPHWSH-KRWDZBQOSA-N 2 1 312.457 4.157 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)o2)C1 ZINC000236608947 1042369909 /nfs/dbraw/zinc/36/99/09/1042369909.db2.gz LFVAPVBGKPHWSH-KRWDZBQOSA-N 2 1 312.457 4.157 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482861 1042374437 /nfs/dbraw/zinc/37/44/37/1042374437.db2.gz RGOHZNOUUMCSGV-FIKGOQFSSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(-c2ccccc2)cc1 ZINC000391482861 1042374442 /nfs/dbraw/zinc/37/44/42/1042374442.db2.gz RGOHZNOUUMCSGV-FIKGOQFSSA-N 2 1 308.469 4.487 20 0 DIADMP CC(C)[N@@H+]1CC[C@@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000040624106 1042389290 /nfs/dbraw/zinc/38/92/90/1042389290.db2.gz HNQATEVKNQQTQB-ZDUSSCGKSA-N 2 1 303.837 4.030 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000040624106 1042389295 /nfs/dbraw/zinc/38/92/95/1042389295.db2.gz HNQATEVKNQQTQB-ZDUSSCGKSA-N 2 1 303.837 4.030 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2CCC(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000647252556 1042405880 /nfs/dbraw/zinc/40/58/80/1042405880.db2.gz JWCKPVHJFPTVEH-OYGLOCFBSA-N 2 1 318.480 4.157 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2CCC(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC000647252556 1042405883 /nfs/dbraw/zinc/40/58/83/1042405883.db2.gz JWCKPVHJFPTVEH-OYGLOCFBSA-N 2 1 318.480 4.157 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@@H]34)c2)cc1 ZINC000614328413 1042467112 /nfs/dbraw/zinc/46/71/12/1042467112.db2.gz BUMTXLOOSOZDRT-SFTDATJTSA-N 2 1 306.453 4.070 20 0 DIADMP c1ccc(-c2cccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@@H]34)c2)cc1 ZINC000614328413 1042467115 /nfs/dbraw/zinc/46/71/15/1042467115.db2.gz BUMTXLOOSOZDRT-SFTDATJTSA-N 2 1 306.453 4.070 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000513493471 1042547293 /nfs/dbraw/zinc/54/72/93/1042547293.db2.gz BAORHFPSKALTLP-JYBIWHBTSA-N 2 1 300.490 4.065 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2)s1)CC1CC[NH+](C)CC1 ZINC000513717775 1042597655 /nfs/dbraw/zinc/59/76/55/1042597655.db2.gz RTLLHJZMUSIGBU-UHFFFAOYSA-N 2 1 314.498 4.189 20 0 DIADMP c1c2ccccc2[nH]c1[C@@H]1CCCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420307648 1042599303 /nfs/dbraw/zinc/59/93/03/1042599303.db2.gz RPVSTQCPBKQUCE-JXFKEZNVSA-N 2 1 311.473 4.085 20 0 DIADMP C[C@@H](c1cccs1)[N@@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000420321344 1042599338 /nfs/dbraw/zinc/59/93/38/1042599338.db2.gz RHUHSWNKLBAGSI-IRXDYDNUSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H](c1cccs1)[N@@H+](CC[C@H]1CC[NH2+]C1)Cc1ccccc1 ZINC000420321343 1042599372 /nfs/dbraw/zinc/59/93/72/1042599372.db2.gz RHUHSWNKLBAGSI-IAGOWNOFSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccncc1Cl ZINC000421819842 1042653271 /nfs/dbraw/zinc/65/32/71/1042653271.db2.gz JHQDORFJDLKERZ-CABCVRRESA-N 2 1 309.885 4.040 20 0 DIADMP Cc1[nH]c2ccc(C[NH2+][C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2c1C ZINC000422724033 1042689196 /nfs/dbraw/zinc/68/91/96/1042689196.db2.gz UDWWRDKMEFFDBI-UYAOXDASSA-N 2 1 305.425 4.019 20 0 DIADMP c1ccc([C@H]2CCC[C@@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000422714633 1042689276 /nfs/dbraw/zinc/68/92/76/1042689276.db2.gz RGHYHOIBAWXKFW-CZYKHXBRSA-N 2 1 320.480 4.406 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422836189 1042690814 /nfs/dbraw/zinc/69/08/14/1042690814.db2.gz JMIOUYMYZLHCOA-PYSHFNSBSA-N 2 1 310.416 4.184 20 0 DIADMP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000422922480 1042692365 /nfs/dbraw/zinc/69/23/65/1042692365.db2.gz SWHWFVCCRLJYQU-JQWIXIFHSA-N 2 1 321.827 4.053 20 0 DIADMP C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C)c1c[nH+]ccc1N ZINC000422924295 1042693259 /nfs/dbraw/zinc/69/32/59/1042693259.db2.gz UDNMBDQTCHEZMV-SJECXTJVSA-N 2 1 315.848 4.195 20 0 DIADMP C[C@H](Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1c[nH+]ccc1N ZINC000422921342 1042693917 /nfs/dbraw/zinc/69/39/17/1042693917.db2.gz NXKOSMIMALOXBH-CVEARBPZSA-N 2 1 324.472 4.042 20 0 DIADMP C[C@@H](Nc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1c[nH+]ccc1N ZINC000422921344 1042693962 /nfs/dbraw/zinc/69/39/62/1042693962.db2.gz NXKOSMIMALOXBH-HZPDHXFCSA-N 2 1 324.472 4.042 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(OC3CCCC3)cc2)c2ccccc21 ZINC000422950831 1042694447 /nfs/dbraw/zinc/69/44/47/1042694447.db2.gz ZDEONOYLPRDVSV-SFTDATJTSA-N 2 1 322.452 4.242 20 0 DIADMP Cc1ccc([C@@H]([NH2+]CCC[NH2+]Cc2cccnc2)C2CCC2)cc1 ZINC000423185155 1042698710 /nfs/dbraw/zinc/69/87/10/1042698710.db2.gz JJICTRGUWYATBU-NRFANRHFSA-N 2 1 323.484 4.001 20 0 DIADMP C[C@@H]([NH2+]CC[NH3+])c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000423196378 1042700312 /nfs/dbraw/zinc/70/03/12/1042700312.db2.gz ZTPFHERTMOOZNG-SNVBAGLBSA-N 2 1 314.376 4.043 20 0 DIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H](C)[C@@H](C)[NH3+] ZINC000423451016 1042712225 /nfs/dbraw/zinc/71/22/25/1042712225.db2.gz UIGLCWZQNYGACI-VWYCJHECSA-N 2 1 323.893 4.158 20 0 DIADMP C[C@@H]([NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1)[C@H](C)[NH3+] ZINC000423479467 1042714630 /nfs/dbraw/zinc/71/46/30/1042714630.db2.gz VIDOPGWYFDHJOK-OZVIIMIRSA-N 2 1 308.878 4.011 20 0 DIADMP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2c(F)cc(C)cc2F)c1 ZINC000424153182 1042727861 /nfs/dbraw/zinc/72/78/61/1042727861.db2.gz JRFZQQQOLJVKGB-UHFFFAOYSA-N 2 1 318.411 4.015 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2c(F)cc(C)cc2F)c1 ZINC000424153182 1042727864 /nfs/dbraw/zinc/72/78/64/1042727864.db2.gz JRFZQQQOLJVKGB-UHFFFAOYSA-N 2 1 318.411 4.015 20 0 DIADMP COc1ccc([C@H](C)NC[C@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319165 1042733442 /nfs/dbraw/zinc/73/34/42/1042733442.db2.gz RTXRWHGJTZLCSA-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c(Cl)c1 ZINC000424319165 1042733449 /nfs/dbraw/zinc/73/34/49/1042733449.db2.gz RTXRWHGJTZLCSA-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319165 1042733452 /nfs/dbraw/zinc/73/34/52/1042733452.db2.gz RTXRWHGJTZLCSA-LSDHHAIUSA-N 2 1 324.896 4.120 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3CCCC[C@H]3[NH3+])cs2)cs1 ZINC000424371763 1042738638 /nfs/dbraw/zinc/73/86/38/1042738638.db2.gz GNONNHTUPGJLBH-ZLKJLUDKSA-N 2 1 321.515 4.101 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](C(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000514083313 1042770341 /nfs/dbraw/zinc/77/03/41/1042770341.db2.gz MJPPXWVSVSCFMG-NHCUHLMSSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](C(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000514083313 1042770345 /nfs/dbraw/zinc/77/03/45/1042770345.db2.gz MJPPXWVSVSCFMG-NHCUHLMSSA-N 2 1 320.480 4.192 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](C(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000514083313 1042770350 /nfs/dbraw/zinc/77/03/50/1042770350.db2.gz MJPPXWVSVSCFMG-NHCUHLMSSA-N 2 1 320.480 4.192 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CC[C@]2(C1)CCC[NH+](CCOCC)C2 ZINC001280151317 1042828143 /nfs/dbraw/zinc/82/81/43/1042828143.db2.gz HVZABZYEPVLKMS-VQTJNVASSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC[C@]2(C1)CCC[N@H+](CCOCC)C2 ZINC001280151317 1042828149 /nfs/dbraw/zinc/82/81/49/1042828149.db2.gz HVZABZYEPVLKMS-VQTJNVASSA-N 2 1 324.553 4.027 20 0 DIADMP CC(C)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167961745 1042848522 /nfs/dbraw/zinc/84/85/22/1042848522.db2.gz PCADMWDXPSUEIJ-SEJPIABJSA-N 2 1 312.501 4.305 20 0 DIADMP C[C@]1(C[NH2+][C@H]2C[C@@H]3CCCC[C@@H]32)CC[N@@H+](Cc2ccccc2)C1 ZINC000712458641 1042851832 /nfs/dbraw/zinc/85/18/32/1042851832.db2.gz VUTASKLGHOINHS-XSDIEEQYSA-N 2 1 312.501 4.067 20 0 DIADMP FC(F)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167962174 1042865527 /nfs/dbraw/zinc/86/55/27/1042865527.db2.gz UZBZSEAPLTUJHT-AYHJJNSGSA-N 2 1 320.427 4.119 20 0 DIADMP C[C@H](C[NH2+][C@H]1CCCSc2ccc(Cl)cc21)C[NH+](C)C ZINC000425926355 1042875678 /nfs/dbraw/zinc/87/56/78/1042875678.db2.gz RYMAFPWZDSUWQT-DOMZBBRYSA-N 2 1 312.910 4.054 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934356 1042876536 /nfs/dbraw/zinc/87/65/36/1042876536.db2.gz BJQRKFQFQIOWSG-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934356 1042876541 /nfs/dbraw/zinc/87/65/41/1042876541.db2.gz BJQRKFQFQIOWSG-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]C3CC[NH+](CC4CC4)CC3)oc2c1 ZINC000425932091 1042876682 /nfs/dbraw/zinc/87/66/82/1042876682.db2.gz UACHJCVZNNAIJP-HNNXBMFYSA-N 2 1 312.457 4.266 20 0 DIADMP CC(C)Oc1ccccc1C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000517537545 1042884005 /nfs/dbraw/zinc/88/40/05/1042884005.db2.gz ZXWBKNUEKIKUTH-SFHVURJKSA-N 2 1 318.505 4.218 20 0 DIADMP Cc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)cc1C ZINC000518762328 1042919996 /nfs/dbraw/zinc/91/99/96/1042919996.db2.gz QEHQHKOUHIKOLR-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP C[NH+](CC[C@H]1CCC[N@H+]1C)C1c2ccccc2-c2ccccc21 ZINC001167966877 1042952329 /nfs/dbraw/zinc/95/23/29/1042952329.db2.gz BHCYCZORWYAPQC-MRXNPFEDSA-N 2 1 306.453 4.173 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167975235 1042968874 /nfs/dbraw/zinc/96/88/74/1042968874.db2.gz MUTAQWZLCLRKBK-KOVLHOQQSA-N 2 1 312.501 4.305 20 0 DIADMP CC(C)C([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C(C)C ZINC000643379022 1042980238 /nfs/dbraw/zinc/98/02/38/1042980238.db2.gz PBJBIDARLACSGO-UHFFFAOYSA-N 2 1 320.496 4.103 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441355897 1043038734 /nfs/dbraw/zinc/03/87/34/1043038734.db2.gz LFLCEFYSHRHSNW-DZGCQCFKSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441355897 1043038739 /nfs/dbraw/zinc/03/87/39/1043038739.db2.gz LFLCEFYSHRHSNW-DZGCQCFKSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC000441355897 1043038744 /nfs/dbraw/zinc/03/87/44/1043038744.db2.gz LFLCEFYSHRHSNW-DZGCQCFKSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC000441355897 1043038748 /nfs/dbraw/zinc/03/87/48/1043038748.db2.gz LFLCEFYSHRHSNW-DZGCQCFKSA-N 2 1 312.860 4.346 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441395975 1043042604 /nfs/dbraw/zinc/04/26/04/1043042604.db2.gz BDDSLEJOGCMTNN-UIFIKXQLSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441395975 1043042608 /nfs/dbraw/zinc/04/26/08/1043042608.db2.gz BDDSLEJOGCMTNN-UIFIKXQLSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441395975 1043042613 /nfs/dbraw/zinc/04/26/13/1043042613.db2.gz BDDSLEJOGCMTNN-UIFIKXQLSA-N 2 1 310.485 4.013 20 0 DIADMP c1ccc2c(c1)CCC[C@@H]2[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441395975 1043042618 /nfs/dbraw/zinc/04/26/18/1043042618.db2.gz BDDSLEJOGCMTNN-UIFIKXQLSA-N 2 1 310.485 4.013 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441393803 1043043020 /nfs/dbraw/zinc/04/30/20/1043043020.db2.gz IAZCJCNFQGTFDD-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441393803 1043043027 /nfs/dbraw/zinc/04/30/27/1043043027.db2.gz IAZCJCNFQGTFDD-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441393803 1043043034 /nfs/dbraw/zinc/04/30/34/1043043034.db2.gz IAZCJCNFQGTFDD-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441393803 1043043039 /nfs/dbraw/zinc/04/30/39/1043043039.db2.gz IAZCJCNFQGTFDD-IDHHARJASA-N 2 1 318.892 4.350 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441411724 1043045214 /nfs/dbraw/zinc/04/52/14/1043045214.db2.gz HDWVUWASFNCXOC-DBVUQKKJSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000441411724 1043045220 /nfs/dbraw/zinc/04/52/20/1043045220.db2.gz HDWVUWASFNCXOC-DBVUQKKJSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000441411724 1043045228 /nfs/dbraw/zinc/04/52/28/1043045228.db2.gz HDWVUWASFNCXOC-DBVUQKKJSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441411724 1043045234 /nfs/dbraw/zinc/04/52/34/1043045234.db2.gz HDWVUWASFNCXOC-DBVUQKKJSA-N 2 1 316.464 4.226 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625243 1043051546 /nfs/dbraw/zinc/05/15/46/1043051546.db2.gz CFXKMYBLAGPAOW-ICSRJNTNSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625243 1043051559 /nfs/dbraw/zinc/05/15/59/1043051559.db2.gz CFXKMYBLAGPAOW-ICSRJNTNSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625243 1043051572 /nfs/dbraw/zinc/05/15/72/1043051572.db2.gz CFXKMYBLAGPAOW-ICSRJNTNSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000112625243 1043051581 /nfs/dbraw/zinc/05/15/81/1043051581.db2.gz CFXKMYBLAGPAOW-ICSRJNTNSA-N 2 1 300.490 4.081 20 0 DIADMP c1ccc([C@@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)C2)cc1 ZINC001167991989 1043052460 /nfs/dbraw/zinc/05/24/60/1043052460.db2.gz GDCSHMLHMVXWST-IZCSPVGOSA-N 2 1 324.512 4.271 20 0 DIADMP c1ccc([C@@H]2CCC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167991989 1043052475 /nfs/dbraw/zinc/05/24/75/1043052475.db2.gz GDCSHMLHMVXWST-IZCSPVGOSA-N 2 1 324.512 4.271 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)cc1 ZINC001167991989 1043052483 /nfs/dbraw/zinc/05/24/83/1043052483.db2.gz GDCSHMLHMVXWST-IZCSPVGOSA-N 2 1 324.512 4.271 20 0 DIADMP c1ccc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995732 1043078302 /nfs/dbraw/zinc/07/83/02/1043078302.db2.gz PCQOSKQGAWDNHR-JKWVGCSGSA-N 2 1 310.485 4.229 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)nc1 ZINC000183191709 1043157321 /nfs/dbraw/zinc/15/73/21/1043157321.db2.gz LXZDGVNISDUFGM-OFQRWUPVSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(Cl)nc1 ZINC000183191709 1043157325 /nfs/dbraw/zinc/15/73/25/1043157325.db2.gz LXZDGVNISDUFGM-OFQRWUPVSA-N 2 1 321.896 4.039 20 0 DIADMP FC(F)c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000183949564 1043174287 /nfs/dbraw/zinc/17/42/87/1043174287.db2.gz ZAHDAZAIHCOPLA-KRWDZBQOSA-N 2 1 308.416 4.075 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000183949564 1043174294 /nfs/dbraw/zinc/17/42/94/1043174294.db2.gz ZAHDAZAIHCOPLA-KRWDZBQOSA-N 2 1 308.416 4.075 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1cc2c(ccnc2Cl)o1 ZINC000866281541 1043174342 /nfs/dbraw/zinc/17/43/42/1043174342.db2.gz JDSHKYSPIYNSSR-RWMBFGLXSA-N 2 1 321.852 4.005 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183999753 1043176197 /nfs/dbraw/zinc/17/61/97/1043176197.db2.gz FTMWBLRKQZVZFY-YOEHRIQHSA-N 2 1 322.443 4.367 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183999771 1043177418 /nfs/dbraw/zinc/17/74/18/1043177418.db2.gz FTMWBLRKQZVZFY-PBHICJAKSA-N 2 1 322.443 4.367 20 0 DIADMP CCC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1cccnc1 ZINC000185352219 1043200753 /nfs/dbraw/zinc/20/07/53/1043200753.db2.gz XRFHQTMWDHJMIN-HXUWFJFHSA-N 2 1 311.473 4.164 20 0 DIADMP Cc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1C ZINC001168004787 1043237101 /nfs/dbraw/zinc/23/71/01/1043237101.db2.gz ZEYWQLHNNKHHQD-WCRBZPEASA-N 2 1 312.501 4.141 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]CC3([NH3+])CCCC3)cs2)cs1 ZINC000665249199 1043315137 /nfs/dbraw/zinc/31/51/37/1043315137.db2.gz KZDBNSNDPMDYSN-LLVKDONJSA-N 2 1 321.515 4.102 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC001168011374 1043323963 /nfs/dbraw/zinc/32/39/63/1043323963.db2.gz ONECIQCXPJNEQU-SFNKJDCFSA-N 2 1 302.506 4.452 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+]CCCn3cc[nH+]c3C)ccc2c1 ZINC000268883186 1043341016 /nfs/dbraw/zinc/34/10/16/1043341016.db2.gz SBDRWUUPJQZOLL-HNNXBMFYSA-N 2 1 323.440 4.094 20 0 DIADMP C[C@H]([NH2+]C1CCN(C2CCC2)CC1)c1ccc(F)c(Cl)c1 ZINC000269023739 1043351044 /nfs/dbraw/zinc/35/10/44/1043351044.db2.gz QCTVNEUIENGNIG-LBPRGKRZSA-N 2 1 310.844 4.147 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(F)c(Cl)c1 ZINC000269023739 1043351058 /nfs/dbraw/zinc/35/10/58/1043351058.db2.gz QCTVNEUIENGNIG-LBPRGKRZSA-N 2 1 310.844 4.147 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)C[NH2+]C2CCC(C(F)F)CC2)C1 ZINC000442709798 1043408327 /nfs/dbraw/zinc/40/83/27/1043408327.db2.gz ASCLVQACKFGHQH-PJPHBNEVSA-N 2 1 316.480 4.156 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2S1 ZINC000872025953 1043424640 /nfs/dbraw/zinc/42/46/40/1043424640.db2.gz WEIQMXLUHISIKP-INMHGKMJSA-N 2 1 316.514 4.219 20 0 DIADMP FC1(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000558255402 1043473309 /nfs/dbraw/zinc/47/33/09/1043473309.db2.gz DPSLEVZWMRJEDN-LDLYASANSA-N 2 1 316.464 4.054 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC000925832434 1043479642 /nfs/dbraw/zinc/47/96/42/1043479642.db2.gz VTPLYGSFDMEIKO-DBVUQKKJSA-N 2 1 324.468 4.148 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCCc2c(Cl)cccc21 ZINC000349463212 1043507163 /nfs/dbraw/zinc/50/71/63/1043507163.db2.gz SLZYUCDZGRQZFI-UGSOOPFHSA-N 2 1 317.864 4.148 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584750 1043510826 /nfs/dbraw/zinc/51/08/26/1043510826.db2.gz ZQMNICQGTHREBL-YLJYHZDGSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584750 1043510839 /nfs/dbraw/zinc/51/08/39/1043510839.db2.gz ZQMNICQGTHREBL-YLJYHZDGSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1 ZINC000777584750 1043510852 /nfs/dbraw/zinc/51/08/52/1043510852.db2.gz ZQMNICQGTHREBL-YLJYHZDGSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777584750 1043510865 /nfs/dbraw/zinc/51/08/65/1043510865.db2.gz ZQMNICQGTHREBL-YLJYHZDGSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584749 1043510962 /nfs/dbraw/zinc/51/09/62/1043510962.db2.gz ZQMNICQGTHREBL-XLIONFOSSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584749 1043510976 /nfs/dbraw/zinc/51/09/76/1043510976.db2.gz ZQMNICQGTHREBL-XLIONFOSSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1 ZINC000777584749 1043510986 /nfs/dbraw/zinc/51/09/86/1043510986.db2.gz ZQMNICQGTHREBL-XLIONFOSSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777584749 1043510996 /nfs/dbraw/zinc/51/09/96/1043510996.db2.gz ZQMNICQGTHREBL-XLIONFOSSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584748 1043511302 /nfs/dbraw/zinc/51/13/02/1043511302.db2.gz ZQMNICQGTHREBL-PXNSSMCTSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc(CF)cc2)C1 ZINC000777584748 1043511314 /nfs/dbraw/zinc/51/13/14/1043511314.db2.gz ZQMNICQGTHREBL-PXNSSMCTSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc(CF)cc2)C1 ZINC000777584748 1043511331 /nfs/dbraw/zinc/51/13/31/1043511331.db2.gz ZQMNICQGTHREBL-PXNSSMCTSA-N 2 1 318.480 4.243 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777584748 1043511342 /nfs/dbraw/zinc/51/13/42/1043511342.db2.gz ZQMNICQGTHREBL-PXNSSMCTSA-N 2 1 318.480 4.243 20 0 DIADMP CSc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000558486163 1043519554 /nfs/dbraw/zinc/51/95/54/1043519554.db2.gz RVNKSZNZXMSBJC-KGLIPLIRSA-N 2 1 324.559 4.213 20 0 DIADMP Cc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)c2ccccc2[nH+]1 ZINC000522107265 1043540473 /nfs/dbraw/zinc/54/04/73/1043540473.db2.gz WVTPMIMOYFRKCZ-UHFFFAOYSA-N 2 1 311.473 4.100 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2csc(Cl)c2)CC1 ZINC000191233624 1043552809 /nfs/dbraw/zinc/55/28/09/1043552809.db2.gz JYGFJPFNDVWEPD-GFCCVEGCSA-N 2 1 300.899 4.317 20 0 DIADMP CCCCc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000314643672 1043557367 /nfs/dbraw/zinc/55/73/67/1043557367.db2.gz FNVCZVAXXRLBLW-AEFFLSMTSA-N 2 1 300.490 4.164 20 0 DIADMP CCCCc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000314643676 1043558247 /nfs/dbraw/zinc/55/82/47/1043558247.db2.gz FNVCZVAXXRLBLW-SJLPKXTDSA-N 2 1 300.490 4.164 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000474061181 1043562635 /nfs/dbraw/zinc/56/26/35/1043562635.db2.gz WAUVOELZJNJHEQ-YZGWKJHDSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CCC12CCCC2 ZINC000474061181 1043562639 /nfs/dbraw/zinc/56/26/39/1043562639.db2.gz WAUVOELZJNJHEQ-YZGWKJHDSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CCC23CCCC3)CC1 ZINC000474065611 1043565519 /nfs/dbraw/zinc/56/55/19/1043565519.db2.gz KDLLNUGSLOOBHL-HXUWFJFHSA-N 2 1 312.501 4.272 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)C2CCC(F)(F)CC2)C1 ZINC000474066008 1043565968 /nfs/dbraw/zinc/56/59/68/1043565968.db2.gz NOKCZPUGFYOLCS-HOTGVXAUSA-N 2 1 316.480 4.158 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926574759 1043601375 /nfs/dbraw/zinc/60/13/75/1043601375.db2.gz YFLBRURADFTTGO-NWDGAFQWSA-N 2 1 320.424 4.149 20 0 DIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccoc1 ZINC000353457019 1043608079 /nfs/dbraw/zinc/60/80/79/1043608079.db2.gz YBJCQWQMEKBAQC-IBGZPJMESA-N 2 1 304.478 4.221 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC23CCCC3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168022534 1043610566 /nfs/dbraw/zinc/61/05/66/1043610566.db2.gz ABHLHHMFBCODSD-PIKOESSRSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC23CCCC3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168022532 1043610990 /nfs/dbraw/zinc/61/09/90/1043610990.db2.gz ABHLHHMFBCODSD-HNJRGHQBSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H](Nc1cc(C2CC2)cc[nH+]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000353563538 1043617468 /nfs/dbraw/zinc/61/74/68/1043617468.db2.gz TWFWWEBCVANKDL-OXQOHEQNSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@@H](Nc1cc(C2CC2)cc[nH+]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000353563538 1043617476 /nfs/dbraw/zinc/61/74/76/1043617476.db2.gz TWFWWEBCVANKDL-OXQOHEQNSA-N 2 1 321.468 4.282 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C)CCc1ccccc1 ZINC000191471346 1043643596 /nfs/dbraw/zinc/64/35/96/1043643596.db2.gz RMMYPHHUJPMDCU-GOSISDBHSA-N 2 1 313.489 4.179 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)CCc1ccccc1 ZINC000191471346 1043643603 /nfs/dbraw/zinc/64/36/03/1043643603.db2.gz RMMYPHHUJPMDCU-GOSISDBHSA-N 2 1 313.489 4.179 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)CCc1ccccc1 ZINC000191471346 1043643609 /nfs/dbraw/zinc/64/36/09/1043643609.db2.gz RMMYPHHUJPMDCU-GOSISDBHSA-N 2 1 313.489 4.179 20 0 DIADMP c1cc2cc(C[NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)ccc2o1 ZINC000665237596 1043643948 /nfs/dbraw/zinc/64/39/48/1043643948.db2.gz FHJJVZNXOGOGEW-OALUTQOASA-N 2 1 306.409 4.016 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1ccccc1Cl ZINC000191482830 1043647254 /nfs/dbraw/zinc/64/72/54/1043647254.db2.gz CIDBAHBQIXBEOU-UHFFFAOYSA-N 2 1 319.880 4.054 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1ccccc1Cl ZINC000191482830 1043647258 /nfs/dbraw/zinc/64/72/58/1043647258.db2.gz CIDBAHBQIXBEOU-UHFFFAOYSA-N 2 1 319.880 4.054 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCS[C@@H](C)C2)cc1 ZINC000927032941 1043670770 /nfs/dbraw/zinc/67/07/70/1043670770.db2.gz QVVVGRBXTDRFPO-GRDNDAEWSA-N 2 1 315.486 4.115 20 0 DIADMP CC(C)C[C@@H](C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1)c1ccccc1 ZINC000474157395 1043673117 /nfs/dbraw/zinc/67/31/17/1043673117.db2.gz XGBKUUHIGTWSRF-MOPGFXCFSA-N 2 1 311.473 4.419 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cncs2)cc1 ZINC000166674830 1043673697 /nfs/dbraw/zinc/67/36/97/1043673697.db2.gz VKUNVYUBGDJGDG-QWHCGFSZSA-N 2 1 312.442 4.049 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@@H]1CCN(C)[C@H](C)C1)c1ccccc1 ZINC000474284509 1043721093 /nfs/dbraw/zinc/72/10/93/1043721093.db2.gz RLMVJOBHLZGMOV-MISYRCLQSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1)c1ccccc1 ZINC000474284509 1043721105 /nfs/dbraw/zinc/72/11/05/1043721105.db2.gz RLMVJOBHLZGMOV-MISYRCLQSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1)c1ccccc1 ZINC000474284509 1043721117 /nfs/dbraw/zinc/72/11/17/1043721117.db2.gz RLMVJOBHLZGMOV-MISYRCLQSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1 ZINC000474284509 1043721128 /nfs/dbraw/zinc/72/11/28/1043721128.db2.gz RLMVJOBHLZGMOV-MISYRCLQSA-N 2 1 302.506 4.231 20 0 DIADMP CC(C)C[C@H](C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccccc1 ZINC000474284509 1043721138 /nfs/dbraw/zinc/72/11/38/1043721138.db2.gz RLMVJOBHLZGMOV-MISYRCLQSA-N 2 1 302.506 4.231 20 0 DIADMP CC[C@H](C)[C@H](C)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000777692463 1043756165 /nfs/dbraw/zinc/75/61/65/1043756165.db2.gz BZOTWRHXBACIJD-IRXDYDNUSA-N 2 1 317.521 4.311 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2c(cccc2C(C)C)C1 ZINC000355371646 1043763338 /nfs/dbraw/zinc/76/33/38/1043763338.db2.gz DJIRCOLZTJJEHX-UHFFFAOYSA-N 2 1 311.473 4.153 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2c(cccc2C(C)C)C1 ZINC000355371646 1043763353 /nfs/dbraw/zinc/76/33/53/1043763353.db2.gz DJIRCOLZTJJEHX-UHFFFAOYSA-N 2 1 311.473 4.153 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1 ZINC000474463249 1043789746 /nfs/dbraw/zinc/78/97/46/1043789746.db2.gz BQOMRKMTHZXINW-HUUCEWRRSA-N 2 1 319.518 4.108 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474462509 1043789927 /nfs/dbraw/zinc/78/99/27/1043789927.db2.gz SPGQQWLAVLUERT-ZOBORPQBSA-N 2 1 314.926 4.213 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474464203 1043792428 /nfs/dbraw/zinc/79/24/28/1043792428.db2.gz LYPKVBNACQFSQQ-MELADBBJSA-N 2 1 314.926 4.213 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C[C@H](CC(C)C)c1ccccc1 ZINC000474469952 1043793433 /nfs/dbraw/zinc/79/34/33/1043793433.db2.gz INRGJZNNLGGFJA-XLIONFOSSA-N 2 1 313.489 4.247 20 0 DIADMP CC(C)C[C@H](C[NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000474482292 1043797261 /nfs/dbraw/zinc/79/72/61/1043797261.db2.gz KHFUBGCSWTXFBZ-GOSISDBHSA-N 2 1 300.490 4.033 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(SC)s1 ZINC000356311693 1043834427 /nfs/dbraw/zinc/83/44/27/1043834427.db2.gz BQCFBUMKTTXITM-UHFFFAOYSA-N 2 1 323.531 4.141 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(SC)s1 ZINC000356311693 1043834450 /nfs/dbraw/zinc/83/44/50/1043834450.db2.gz BQCFBUMKTTXITM-UHFFFAOYSA-N 2 1 323.531 4.141 20 0 DIADMP C[C@H]1CC([N@@H+]2CCCC2(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039205 1043852318 /nfs/dbraw/zinc/85/23/18/1043852318.db2.gz CGPMSNDJGHEFCT-IRXDYDNUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@H]1CC([N@H+]2CCCC2(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039205 1043852339 /nfs/dbraw/zinc/85/23/39/1043852339.db2.gz CGPMSNDJGHEFCT-IRXDYDNUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@H]1CC([NH+]2CCC(F)(F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039243 1043854182 /nfs/dbraw/zinc/85/41/82/1043854182.db2.gz CMFSTBDKGOGBHR-HOTGVXAUSA-N 2 1 322.443 4.159 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H](C)c2ccc(Cl)cc2)C1 ZINC000474626392 1043858244 /nfs/dbraw/zinc/85/82/44/1043858244.db2.gz FBUGONHNCLPROP-OWCLPIDISA-N 2 1 308.897 4.154 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H](C)c2ccc(Cl)cc2)C1 ZINC000474626391 1043859320 /nfs/dbraw/zinc/85/93/20/1043859320.db2.gz FBUGONHNCLPROP-HRCADAONSA-N 2 1 308.897 4.154 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2nccc3ccccc32)C1 ZINC000289704573 1043866810 /nfs/dbraw/zinc/86/68/10/1043866810.db2.gz KNZYLGBXLZJQJN-SJORKVTESA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2nccc3ccccc32)C1 ZINC000289704573 1043866831 /nfs/dbraw/zinc/86/68/31/1043866831.db2.gz KNZYLGBXLZJQJN-SJORKVTESA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2nccc3ccccc32)C1 ZINC000289704564 1043867185 /nfs/dbraw/zinc/86/71/85/1043867185.db2.gz KNZYLGBXLZJQJN-IRXDYDNUSA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2nccc3ccccc32)C1 ZINC000289704564 1043867199 /nfs/dbraw/zinc/86/71/99/1043867199.db2.gz KNZYLGBXLZJQJN-IRXDYDNUSA-N 2 1 311.473 4.006 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039908 1043870027 /nfs/dbraw/zinc/87/00/27/1043870027.db2.gz IMNSKBUXEYRCHP-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](F)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039908 1043870045 /nfs/dbraw/zinc/87/00/45/1043870045.db2.gz IMNSKBUXEYRCHP-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039908 1043870064 /nfs/dbraw/zinc/87/00/64/1043870064.db2.gz IMNSKBUXEYRCHP-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@H](F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039908 1043870081 /nfs/dbraw/zinc/87/00/81/1043870081.db2.gz IMNSKBUXEYRCHP-HNJRGHQBSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC[C@H](F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039910 1043870479 /nfs/dbraw/zinc/87/04/79/1043870479.db2.gz IMNSKBUXEYRCHP-LMMKCTJWSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@H](F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039910 1043870493 /nfs/dbraw/zinc/87/04/93/1043870493.db2.gz IMNSKBUXEYRCHP-LMMKCTJWSA-N 2 1 318.480 4.252 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2)o1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000289765753 1043875643 /nfs/dbraw/zinc/87/56/43/1043875643.db2.gz RCTSTKMEPSLKDK-JWTNVVGKSA-N 2 1 310.441 4.004 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)o1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000289765753 1043875661 /nfs/dbraw/zinc/87/56/61/1043875661.db2.gz RCTSTKMEPSLKDK-JWTNVVGKSA-N 2 1 310.441 4.004 20 0 DIADMP C[NH+](Cc1ccc(-c2ccccc2)o1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000289765753 1043875683 /nfs/dbraw/zinc/87/56/83/1043875683.db2.gz RCTSTKMEPSLKDK-JWTNVVGKSA-N 2 1 310.441 4.004 20 0 DIADMP C[NH+](Cc1ccc(-c2ccccc2)o1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000289765753 1043875697 /nfs/dbraw/zinc/87/56/97/1043875697.db2.gz RCTSTKMEPSLKDK-JWTNVVGKSA-N 2 1 310.441 4.004 20 0 DIADMP CC[C@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H](C)C2CCSCC2)C1 ZINC000474711664 1043895681 /nfs/dbraw/zinc/89/56/81/1043895681.db2.gz RUOBYHQGAVVHKZ-HOTGVXAUSA-N 2 1 312.567 4.008 20 0 DIADMP CC[C@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H](C)C2CCSCC2)C1 ZINC000474711664 1043895704 /nfs/dbraw/zinc/89/57/04/1043895704.db2.gz RUOBYHQGAVVHKZ-HOTGVXAUSA-N 2 1 312.567 4.008 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)C1CCCCC1 ZINC000474729813 1043903208 /nfs/dbraw/zinc/90/32/08/1043903208.db2.gz GUDGEZOTJRTLRC-ICSRJNTNSA-N 2 1 314.517 4.109 20 0 DIADMP CC(C)C[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCOC(C)C)CC2)C1 ZINC000474794543 1043919284 /nfs/dbraw/zinc/91/92/84/1043919284.db2.gz JYPIFNPIEVIXHH-UYAOXDASSA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)Sc1cccc(Cl)c1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000474883085 1043969483 /nfs/dbraw/zinc/96/94/83/1043969483.db2.gz UQARACUFMGFVCX-UHFFFAOYSA-N 2 1 324.921 4.192 20 0 DIADMP CC[C@H]1CC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000562042137 1044053750 /nfs/dbraw/zinc/05/37/50/1044053750.db2.gz USORTGXMNKERRN-JXFKEZNVSA-N 2 1 312.457 4.190 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCc2sccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000358474852 1044075574 /nfs/dbraw/zinc/07/55/74/1044075574.db2.gz VEXZQPGMAWWADP-MPGHIAIKSA-N 2 1 318.530 4.368 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC3(CC3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168048310 1044078813 /nfs/dbraw/zinc/07/88/13/1044078813.db2.gz VHRPZACOQBZOSW-OPVJXMOQSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC3(CC3)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168048310 1044078825 /nfs/dbraw/zinc/07/88/25/1044078825.db2.gz VHRPZACOQBZOSW-OPVJXMOQSA-N 2 1 312.501 4.304 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2cscc2C(F)(F)F)CC1 ZINC000562198269 1044083491 /nfs/dbraw/zinc/08/34/91/1044083491.db2.gz DMLKVTRSBGVDOZ-UHFFFAOYSA-N 2 1 320.424 4.121 20 0 DIADMP CC[C@@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccccc1OC ZINC000346865868 1044162417 /nfs/dbraw/zinc/16/24/17/1044162417.db2.gz ONLCXHLBUBAZSP-SJLPKXTDSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H](CC[NH2+][C@H]1CCSc2ccccc21)[NH+]1CCCCC1 ZINC000346869183 1044165277 /nfs/dbraw/zinc/16/52/77/1044165277.db2.gz TXATZRSFSFQVSY-RDJZCZTQSA-N 2 1 304.503 4.078 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](C)C(F)(F)F)cc1 ZINC000359541907 1044177145 /nfs/dbraw/zinc/17/71/45/1044177145.db2.gz SFNOEHKDINQLGV-RYUDHWBXSA-N 2 1 311.351 4.030 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@H+](C)C(C)C)c1ccccc1OC(F)F ZINC000359631591 1044183428 /nfs/dbraw/zinc/18/34/28/1044183428.db2.gz IMNQROZXRNFYER-OAHLLOKOSA-N 2 1 314.420 4.059 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccccc1OC(F)F ZINC000359631591 1044183433 /nfs/dbraw/zinc/18/34/33/1044183433.db2.gz IMNQROZXRNFYER-OAHLLOKOSA-N 2 1 314.420 4.059 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCSc3ccccc32)C1 ZINC000359935482 1044217655 /nfs/dbraw/zinc/21/76/55/1044217655.db2.gz POUJYMVNKSIPJP-WMZOPIPTSA-N 2 1 318.530 4.325 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCOc2ccccc21 ZINC000359949740 1044218975 /nfs/dbraw/zinc/21/89/75/1044218975.db2.gz LMCYDCRDXUNHSX-PKOBYXMFSA-N 2 1 316.489 4.145 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444187478 1044234440 /nfs/dbraw/zinc/23/44/40/1044234440.db2.gz APFWMLUOKGPRFX-APWZRJJASA-N 2 1 304.453 4.085 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444187478 1044234449 /nfs/dbraw/zinc/23/44/49/1044234449.db2.gz APFWMLUOKGPRFX-APWZRJJASA-N 2 1 304.453 4.085 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444208231 1044237753 /nfs/dbraw/zinc/23/77/53/1044237753.db2.gz CMBNIGREEZJWQS-CVEARBPZSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444208231 1044237765 /nfs/dbraw/zinc/23/77/65/1044237765.db2.gz CMBNIGREEZJWQS-CVEARBPZSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCCOC(C)(C)C)C1 ZINC000475066722 1044258343 /nfs/dbraw/zinc/25/83/43/1044258343.db2.gz LKPKBHXFEWCMTN-RTBURBONSA-N 2 1 324.553 4.168 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCCOC(C)(C)C)C1 ZINC000475066722 1044258358 /nfs/dbraw/zinc/25/83/58/1044258358.db2.gz LKPKBHXFEWCMTN-RTBURBONSA-N 2 1 324.553 4.168 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC(C)(C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053338 1044261046 /nfs/dbraw/zinc/26/10/46/1044261046.db2.gz NVJZFQDAHHKPCI-IAGOWNOFSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC(C)(C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053338 1044261062 /nfs/dbraw/zinc/26/10/62/1044261062.db2.gz NVJZFQDAHHKPCI-IAGOWNOFSA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168054717 1044263754 /nfs/dbraw/zinc/26/37/54/1044263754.db2.gz TUPWDHORMGWSNK-PIKOESSRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[N@@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054717 1044263770 /nfs/dbraw/zinc/26/37/70/1044263770.db2.gz TUPWDHORMGWSNK-PIKOESSRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054717 1044263780 /nfs/dbraw/zinc/26/37/80/1044263780.db2.gz TUPWDHORMGWSNK-PIKOESSRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054717 1044263792 /nfs/dbraw/zinc/26/37/92/1044263792.db2.gz TUPWDHORMGWSNK-PIKOESSRSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168054717 1044263808 /nfs/dbraw/zinc/26/38/08/1044263808.db2.gz TUPWDHORMGWSNK-PIKOESSRSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCC3)CC2)c2ccsc2S1 ZINC000360494202 1044276067 /nfs/dbraw/zinc/27/60/67/1044276067.db2.gz DBDFNSPTAZFGPO-MLGOLLRUSA-N 2 1 322.543 4.280 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000563570861 1044282882 /nfs/dbraw/zinc/28/28/82/1044282882.db2.gz JUQIIEYZFYKPIY-AYOQOUSVSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]1C[N@@H+](C2C[C@@H](C)N(Cc3ccccc3)[C@H](C)C2)C2(CC2)C1 ZINC001168056848 1044288657 /nfs/dbraw/zinc/28/86/57/1044288657.db2.gz JEBNIVQYUFXMQX-RCCFBDPRSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[N@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C2(CC2)C1 ZINC001168056848 1044288675 /nfs/dbraw/zinc/28/86/75/1044288675.db2.gz JEBNIVQYUFXMQX-RCCFBDPRSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1C[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C2(CC2)C1 ZINC001168056848 1044288691 /nfs/dbraw/zinc/28/86/91/1044288691.db2.gz JEBNIVQYUFXMQX-RCCFBDPRSA-N 2 1 312.501 4.302 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+][C@@H](C)CC[NH+](C)C)cs2)cs1 ZINC000360862954 1044319462 /nfs/dbraw/zinc/31/94/62/1044319462.db2.gz YBURXOICJNUSFY-NWDGAFQWSA-N 2 1 323.531 4.171 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCSc2ccc(Cl)cc21 ZINC000360948254 1044334943 /nfs/dbraw/zinc/33/49/43/1044334943.db2.gz QHMLRVUXKLSYSG-HNNXBMFYSA-N 2 1 321.877 4.062 20 0 DIADMP C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475288297 1044346060 /nfs/dbraw/zinc/34/60/60/1044346060.db2.gz RNIPDZZDENWVSM-IRFCIJBXSA-N 2 1 322.496 4.290 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475297524 1044348629 /nfs/dbraw/zinc/34/86/29/1044348629.db2.gz XNABGCAMNZMLHT-PZNLSKEWSA-N 2 1 320.480 4.202 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000361078473 1044358845 /nfs/dbraw/zinc/35/88/45/1044358845.db2.gz HWIDIJQRQIBAPM-VQIMIIECSA-N 2 1 316.489 4.014 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(F)c2ccccc21 ZINC000294374939 1044412104 /nfs/dbraw/zinc/41/21/04/1044412104.db2.gz RDFGNOUHQOXXLA-CABCVRRESA-N 2 1 323.415 4.089 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000565269234 1044423581 /nfs/dbraw/zinc/42/35/81/1044423581.db2.gz AFGBFEPFORVYOP-ICXUMSERSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000361730589 1044437004 /nfs/dbraw/zinc/43/70/04/1044437004.db2.gz YSNIULSPDLMOMD-HXUWFJFHSA-N 2 1 322.456 4.290 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000361730589 1044437012 /nfs/dbraw/zinc/43/70/12/1044437012.db2.gz YSNIULSPDLMOMD-HXUWFJFHSA-N 2 1 322.456 4.290 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@@H]2CCSc3c(F)cccc32)CC1 ZINC000336850263 1044439035 /nfs/dbraw/zinc/43/90/35/1044439035.db2.gz QGQZVAAMGIAALJ-QGZVFWFLSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000565563625 1044443613 /nfs/dbraw/zinc/44/36/13/1044443613.db2.gz SRLDNCOYXKUSMF-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000565563625 1044443622 /nfs/dbraw/zinc/44/36/22/1044443622.db2.gz SRLDNCOYXKUSMF-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563625 1044443630 /nfs/dbraw/zinc/44/36/30/1044443630.db2.gz SRLDNCOYXKUSMF-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563625 1044443635 /nfs/dbraw/zinc/44/36/35/1044443635.db2.gz SRLDNCOYXKUSMF-UZLBHIALSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)C1(c2ccccc2)CCCC1 ZINC000248558171 1044445515 /nfs/dbraw/zinc/44/55/15/1044445515.db2.gz LQTBSINKSLNCAQ-IHPCNDPISA-N 2 1 312.501 4.103 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000361973930 1044466118 /nfs/dbraw/zinc/46/61/18/1044466118.db2.gz ZOTMTXKJWDBXEG-SQWLQELKSA-N 2 1 324.921 4.339 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+](C)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000566429076 1044491360 /nfs/dbraw/zinc/49/13/60/1044491360.db2.gz PGVHTOUSPNESNS-UXHICEINSA-N 2 1 311.473 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+](C)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000566429076 1044491363 /nfs/dbraw/zinc/49/13/63/1044491363.db2.gz PGVHTOUSPNESNS-UXHICEINSA-N 2 1 311.473 4.011 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@H](C)c2ccc(Cl)cc2)C1 ZINC000566587743 1044500847 /nfs/dbraw/zinc/50/08/47/1044500847.db2.gz FNJBFTCLAIOGEW-JYJNAYRXSA-N 2 1 308.897 4.152 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CC3CCC3)C[C@H]21 ZINC001202721622 1044512936 /nfs/dbraw/zinc/51/29/36/1044512936.db2.gz GDTXDUZHHMZCID-QXAKKESOSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](CC3CCC3)C[C@H]21 ZINC001202721622 1044512952 /nfs/dbraw/zinc/51/29/52/1044512952.db2.gz GDTXDUZHHMZCID-QXAKKESOSA-N 2 1 318.530 4.081 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CC3CCC3)C[C@H]21 ZINC001202721619 1044513264 /nfs/dbraw/zinc/51/32/64/1044513264.db2.gz GDTXDUZHHMZCID-BHIYHBOVSA-N 2 1 318.530 4.081 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](CC3CCC3)C[C@H]21 ZINC001202721619 1044513280 /nfs/dbraw/zinc/51/32/80/1044513280.db2.gz GDTXDUZHHMZCID-BHIYHBOVSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000567026872 1044537393 /nfs/dbraw/zinc/53/73/93/1044537393.db2.gz XEVAEGWFNUIDAR-GCJKJVERSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000567026872 1044537409 /nfs/dbraw/zinc/53/74/09/1044537409.db2.gz XEVAEGWFNUIDAR-GCJKJVERSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)c1 ZINC000567026872 1044537424 /nfs/dbraw/zinc/53/74/24/1044537424.db2.gz XEVAEGWFNUIDAR-GCJKJVERSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)c1 ZINC000567026872 1044537433 /nfs/dbraw/zinc/53/74/33/1044537433.db2.gz XEVAEGWFNUIDAR-GCJKJVERSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C)SC2)cc1 ZINC000655720924 1044538731 /nfs/dbraw/zinc/53/87/31/1044538731.db2.gz JEUTUTFGJJCSJD-KEYYUXOJSA-N 2 1 315.486 4.115 20 0 DIADMP Clc1ccc([C@@H]2CC[N@@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000444624591 1044579675 /nfs/dbraw/zinc/57/96/75/1044579675.db2.gz FJFDJFIUOBIPLG-QGZVFWFLSA-N 2 1 306.881 4.005 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CCN1C ZINC000444649485 1044581609 /nfs/dbraw/zinc/58/16/09/1044581609.db2.gz KCORXSVDDSNPAR-KXBFYZLASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649485 1044581656 /nfs/dbraw/zinc/58/16/56/1044581656.db2.gz KCORXSVDDSNPAR-KXBFYZLASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649485 1044581671 /nfs/dbraw/zinc/58/16/71/1044581671.db2.gz KCORXSVDDSNPAR-KXBFYZLASA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000296133930 1044591980 /nfs/dbraw/zinc/59/19/80/1044591980.db2.gz URDJZPBYIMMWNW-WBVHZDCISA-N 2 1 310.432 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCCC(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000296133930 1044591995 /nfs/dbraw/zinc/59/19/95/1044591995.db2.gz URDJZPBYIMMWNW-WBVHZDCISA-N 2 1 310.432 4.065 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000568236873 1044611798 /nfs/dbraw/zinc/61/17/98/1044611798.db2.gz XIGWJQYVTHFFTJ-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP CCC1CC([NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000568569558 1044636870 /nfs/dbraw/zinc/63/68/70/1044636870.db2.gz BROJLRPDGTUULB-SKINQDTJSA-N 2 1 300.490 4.067 20 0 DIADMP C[N@H+]1CC[C@H](NC2(c3ccccc3F)CC2)C[C@@H]1c1ccccc1 ZINC000569013753 1044667117 /nfs/dbraw/zinc/66/71/17/1044667117.db2.gz NHPJRUREBHJMNG-FXAWDEMLSA-N 2 1 324.443 4.240 20 0 DIADMP CN1CC[C@H]([NH2+]C2(c3ccccc3F)CC2)C[C@@H]1c1ccccc1 ZINC000569013753 1044667123 /nfs/dbraw/zinc/66/71/23/1044667123.db2.gz NHPJRUREBHJMNG-FXAWDEMLSA-N 2 1 324.443 4.240 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)[nH+]c1C ZINC000886662670 1044676395 /nfs/dbraw/zinc/67/63/95/1044676395.db2.gz JKFGYQNUHZQNOM-UHFFFAOYSA-N 2 1 319.399 4.344 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000569290981 1044692596 /nfs/dbraw/zinc/69/25/96/1044692596.db2.gz OPXLNYYBFZXXGU-MJGOQNOKSA-N 2 1 309.457 4.021 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000569748350 1044710062 /nfs/dbraw/zinc/71/00/62/1044710062.db2.gz OVVUCCBHDKYHKA-QCFAMHMHSA-N 2 1 314.517 4.280 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCC[C@H](F)C2)CC1 ZINC000570043122 1044728368 /nfs/dbraw/zinc/72/83/68/1044728368.db2.gz HWILGDARRXUWAD-LHQJTOJGSA-N 2 1 318.480 4.300 20 0 DIADMP CN(CC[C@H]1CCCC[N@H+]1C)Cc1cscc1C(F)(F)F ZINC000356132743 1044742009 /nfs/dbraw/zinc/74/20/09/1044742009.db2.gz WEKWFQLUOSLMCD-CYBMUJFWSA-N 2 1 320.424 4.073 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CC(C)=C[C@H](C)C1 ZINC000570371581 1044753844 /nfs/dbraw/zinc/75/38/44/1044753844.db2.gz SGEOIQCBFMGKSL-FUHWJXTLSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CC(C)=C[C@H](C)C1 ZINC000570371581 1044753860 /nfs/dbraw/zinc/75/38/60/1044753860.db2.gz SGEOIQCBFMGKSL-FUHWJXTLSA-N 2 1 303.494 4.150 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000367997490 1044759989 /nfs/dbraw/zinc/75/99/89/1044759989.db2.gz LXIFBYMCRPTSBS-YRNRMSPPSA-N 2 1 323.484 4.070 20 0 DIADMP CC(C)C[C@@H](C)[N@@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000445576010 1044764457 /nfs/dbraw/zinc/76/44/57/1044764457.db2.gz UWPMCLUSMKSYGP-QGZVFWFLSA-N 2 1 303.494 4.055 20 0 DIADMP CC1=C[C@H](C)C[C@H](C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000570764247 1044781537 /nfs/dbraw/zinc/78/15/37/1044781537.db2.gz FUUOQKUUVOMZCO-DSLXNQLJSA-N 2 1 304.522 4.221 20 0 DIADMP CC1=C[C@H](C)C[C@H](C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC000570764248 1044781941 /nfs/dbraw/zinc/78/19/41/1044781941.db2.gz FUUOQKUUVOMZCO-NQYYFHDYSA-N 2 1 304.522 4.221 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@H]1c1ccccc1 ZINC000571424823 1044810668 /nfs/dbraw/zinc/81/06/68/1044810668.db2.gz UAXWVWWMEZCDIQ-VXKWHMMOSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@H]1c1ccccc1 ZINC000571424823 1044810689 /nfs/dbraw/zinc/81/06/89/1044810689.db2.gz UAXWVWWMEZCDIQ-VXKWHMMOSA-N 2 1 320.480 4.489 20 0 DIADMP Cc1nccn1CCCC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000371337304 1044868291 /nfs/dbraw/zinc/86/82/91/1044868291.db2.gz WMKKOYOSWDMDPY-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000371337304 1044868323 /nfs/dbraw/zinc/86/83/23/1044868323.db2.gz WMKKOYOSWDMDPY-QGZVFWFLSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1nccn1CCCC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000371337303 1044869094 /nfs/dbraw/zinc/86/90/94/1044869094.db2.gz WMKKOYOSWDMDPY-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000371337303 1044869137 /nfs/dbraw/zinc/86/91/37/1044869137.db2.gz WMKKOYOSWDMDPY-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000524758104 1044917217 /nfs/dbraw/zinc/91/72/17/1044917217.db2.gz PRTRXUQGDIQGON-QAPCUYQASA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000524758104 1044917233 /nfs/dbraw/zinc/91/72/33/1044917233.db2.gz PRTRXUQGDIQGON-QAPCUYQASA-N 2 1 306.881 4.209 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2C[C@H](C)c3ccccc32)c1 ZINC000574073716 1044938933 /nfs/dbraw/zinc/93/89/33/1044938933.db2.gz BWGISOSMDKJWNN-HRAATJIYSA-N 2 1 308.469 4.476 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000574178588 1044942558 /nfs/dbraw/zinc/94/25/58/1044942558.db2.gz LBNHFCZYFRONRK-NHCUHLMSSA-N 2 1 320.480 4.143 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC2(c3ccccc3)CC2)C[C@@H]1c1ccccc1 ZINC000574178588 1044942567 /nfs/dbraw/zinc/94/25/67/1044942567.db2.gz LBNHFCZYFRONRK-NHCUHLMSSA-N 2 1 320.480 4.143 20 0 DIADMP C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411425163 1045005081 /nfs/dbraw/zinc/00/50/81/1045005081.db2.gz QJOZZYAZPRCRRD-SFHVURJKSA-N 2 1 323.484 4.261 20 0 DIADMP C[C@@H](c1ccncc1)[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411411918 1045006597 /nfs/dbraw/zinc/00/65/97/1045006597.db2.gz BIXUCVYMDCNMIP-SFHVURJKSA-N 2 1 323.484 4.261 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1 ZINC000576353290 1045053253 /nfs/dbraw/zinc/05/32/53/1045053253.db2.gz CGYMIXLXWNCRFZ-YJBOKZPZSA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1)c1cccc(Cl)c1 ZINC000576353289 1045053750 /nfs/dbraw/zinc/05/37/50/1045053750.db2.gz CGYMIXLXWNCRFZ-QAPCUYQASA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623379472 1045064096 /nfs/dbraw/zinc/06/40/96/1045064096.db2.gz RWSKLCQGSZSPCP-SJLPKXTDSA-N 2 1 302.506 4.205 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@@H](C)C[C@H](c2ccccc2)C1)c1c[nH+]ccc1N ZINC000576576078 1045066094 /nfs/dbraw/zinc/06/60/94/1045066094.db2.gz GQWKZPTYWDWXMD-MVJTYMMSSA-N 2 1 309.457 4.117 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(F)c1 ZINC000446942703 1045074214 /nfs/dbraw/zinc/07/42/14/1045074214.db2.gz UCRVPCZWPLPBJE-QFBILLFUSA-N 2 1 306.469 4.234 20 0 DIADMP C[C@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@@H+]1CCCC[C@H]1C ZINC000576864233 1045084948 /nfs/dbraw/zinc/08/49/48/1045084948.db2.gz RSEKIOPNLQRDCW-GYPAPIRSSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H](C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[N@H+]1CCCC[C@H]1C ZINC000576864233 1045084960 /nfs/dbraw/zinc/08/49/60/1045084960.db2.gz RSEKIOPNLQRDCW-GYPAPIRSSA-N 2 1 322.443 4.063 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)o1 ZINC000447595680 1045156498 /nfs/dbraw/zinc/15/64/98/1045156498.db2.gz AJXKXEKNAUCQHM-ZOBUZTSGSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)o1 ZINC000447595680 1045156501 /nfs/dbraw/zinc/15/65/01/1045156501.db2.gz AJXKXEKNAUCQHM-ZOBUZTSGSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)o1 ZINC000447595677 1045157329 /nfs/dbraw/zinc/15/73/29/1045157329.db2.gz AJXKXEKNAUCQHM-YQQAZPJKSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)o1 ZINC000447595677 1045157340 /nfs/dbraw/zinc/15/73/40/1045157340.db2.gz AJXKXEKNAUCQHM-YQQAZPJKSA-N 2 1 304.478 4.200 20 0 DIADMP C[C@H](CC[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000447726449 1045167509 /nfs/dbraw/zinc/16/75/09/1045167509.db2.gz FUXOEBRQHQBPMG-UYAOXDASSA-N 2 1 300.490 4.131 20 0 DIADMP C[C@@H](CC[NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccc1 ZINC000447823507 1045178474 /nfs/dbraw/zinc/17/84/74/1045178474.db2.gz WTGKTDGPINEEPV-OALUTQOASA-N 2 1 302.506 4.282 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000924684341 1045189409 /nfs/dbraw/zinc/18/94/09/1045189409.db2.gz DYMITFNFAMNGLV-YLJYHZDGSA-N 2 1 315.505 4.167 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000527100334 1045194308 /nfs/dbraw/zinc/19/43/08/1045194308.db2.gz QCFWVODFTXJRKP-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2CC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000527100334 1045194314 /nfs/dbraw/zinc/19/43/14/1045194314.db2.gz QCFWVODFTXJRKP-APWZRJJASA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(C[NH+](C)C)c1 ZINC000924722838 1045194697 /nfs/dbraw/zinc/19/46/97/1045194697.db2.gz WCIMSOFWIUSSQG-KBPBESRZSA-N 2 1 318.411 4.438 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Cl)c2)C[C@H]1C ZINC000527116509 1045198475 /nfs/dbraw/zinc/19/84/75/1045198475.db2.gz VGCQZROEWFMCPI-RKVPGOIHSA-N 2 1 308.897 4.248 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CC3(CCC3)C2)[C@@H]1c1cccs1 ZINC000448060846 1045203452 /nfs/dbraw/zinc/20/34/52/1045203452.db2.gz OYMSLZYCCOHXCX-WMLDXEAASA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CC3(CCC3)C2)[C@@H]1c1cccs1 ZINC000448060846 1045203462 /nfs/dbraw/zinc/20/34/62/1045203462.db2.gz OYMSLZYCCOHXCX-WMLDXEAASA-N 2 1 304.503 4.053 20 0 DIADMP CCC[C@@H]([NH2+]C1CC[NH+](CCC(C)C)CC1)c1ccccn1 ZINC000924945722 1045213293 /nfs/dbraw/zinc/21/32/93/1045213293.db2.gz HMDSXHLANKPDLI-LJQANCHMSA-N 2 1 303.494 4.023 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN(C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366421 1045219224 /nfs/dbraw/zinc/21/92/24/1045219224.db2.gz UYMHKFKQAZGLGH-JKSUJKDBSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366421 1045219237 /nfs/dbraw/zinc/21/92/37/1045219237.db2.gz UYMHKFKQAZGLGH-JKSUJKDBSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366421 1045219248 /nfs/dbraw/zinc/21/92/48/1045219248.db2.gz UYMHKFKQAZGLGH-JKSUJKDBSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366421 1045219259 /nfs/dbraw/zinc/21/92/59/1045219259.db2.gz UYMHKFKQAZGLGH-JKSUJKDBSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366421 1045219267 /nfs/dbraw/zinc/21/92/67/1045219267.db2.gz UYMHKFKQAZGLGH-JKSUJKDBSA-N 2 1 308.897 4.107 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1c(C)oc2ccccc21 ZINC000925133213 1045229917 /nfs/dbraw/zinc/22/99/17/1045229917.db2.gz KQJISTGDAYFLBV-AWEZNQCLSA-N 2 1 311.429 4.377 20 0 DIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)ccn1 ZINC000527638546 1045242842 /nfs/dbraw/zinc/24/28/42/1045242842.db2.gz KSKZDKMUWWTOAJ-GOSISDBHSA-N 2 1 323.484 4.054 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668274 1045246804 /nfs/dbraw/zinc/24/68/04/1045246804.db2.gz VHYSXUUHCQMTDR-GAKDAEHKSA-N 2 1 318.530 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)[C@@H]1C[C@H]1C1CC1 ZINC000527668274 1045246815 /nfs/dbraw/zinc/24/68/15/1045246815.db2.gz VHYSXUUHCQMTDR-GAKDAEHKSA-N 2 1 318.530 4.155 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CC12CC2 ZINC000527897804 1045275080 /nfs/dbraw/zinc/27/50/80/1045275080.db2.gz HZQJQVGKDDWYAQ-WDSOQIARSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@@H]1CC12CC2 ZINC000527897804 1045275086 /nfs/dbraw/zinc/27/50/86/1045275086.db2.gz HZQJQVGKDDWYAQ-WDSOQIARSA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@@H](C)c1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000527905702 1045279844 /nfs/dbraw/zinc/27/98/44/1045279844.db2.gz RBHMBCIONDQXQM-VLEKXVRISA-N 2 1 300.490 4.476 20 0 DIADMP CC[C@@H](C)c1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000527905700 1045279881 /nfs/dbraw/zinc/27/98/81/1045279881.db2.gz RBHMBCIONDQXQM-SVVLGYAFSA-N 2 1 300.490 4.476 20 0 DIADMP CSCC1CCC([NH2+]CCCC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000449081612 1045344977 /nfs/dbraw/zinc/34/49/77/1045344977.db2.gz GRJQCINLLVXEMF-AOCRQIFASA-N 2 1 312.567 4.152 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106936 1045347395 /nfs/dbraw/zinc/34/73/95/1045347395.db2.gz NTTMFBFPDYHIQG-YJBOKZPZSA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106936 1045347400 /nfs/dbraw/zinc/34/74/00/1045347400.db2.gz NTTMFBFPDYHIQG-YJBOKZPZSA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106934 1045347418 /nfs/dbraw/zinc/34/74/18/1045347418.db2.gz NTTMFBFPDYHIQG-MAUKXSAKSA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106934 1045347422 /nfs/dbraw/zinc/34/74/22/1045347422.db2.gz NTTMFBFPDYHIQG-MAUKXSAKSA-N 2 1 306.519 4.128 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC000449090194 1045347569 /nfs/dbraw/zinc/34/75/69/1045347569.db2.gz MKTSXCHGMVCCBV-BEFAXECRSA-N 2 1 318.892 4.207 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)Cc2coc3ccccc23)C1 ZINC000449129633 1045350353 /nfs/dbraw/zinc/35/03/53/1045350353.db2.gz DABVCRFRUPCUBS-SJORKVTESA-N 2 1 314.473 4.074 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)cs1 ZINC000449149658 1045352643 /nfs/dbraw/zinc/35/26/43/1045352643.db2.gz OGJVRTLHQBPGFT-INIZCTEOSA-N 2 1 314.498 4.372 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CCC3)[C@H]1c1cccs1 ZINC000449155575 1045353587 /nfs/dbraw/zinc/35/35/87/1045353587.db2.gz BHYSKLTXTHCMMD-NJAFHUGGSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCC23CCC3)[C@H]1c1cccs1 ZINC000449155575 1045353589 /nfs/dbraw/zinc/35/35/89/1045353589.db2.gz BHYSKLTXTHCMMD-NJAFHUGGSA-N 2 1 318.530 4.443 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000449175090 1045354177 /nfs/dbraw/zinc/35/41/77/1045354177.db2.gz QGBZZODTQZNLPC-IEBWSBKVSA-N 2 1 308.469 4.234 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)C1CCC1 ZINC000449160151 1045355284 /nfs/dbraw/zinc/35/52/84/1045355284.db2.gz LBMOZNPYKMKMHI-XYJFISCASA-N 2 1 306.519 4.299 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)C1CCC1 ZINC000449160151 1045355290 /nfs/dbraw/zinc/35/52/90/1045355290.db2.gz LBMOZNPYKMKMHI-XYJFISCASA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC000449178235 1045356117 /nfs/dbraw/zinc/35/61/17/1045356117.db2.gz XGOXVQXNVOWKCN-AETAKHFUSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC000449178235 1045356120 /nfs/dbraw/zinc/35/61/20/1045356120.db2.gz XGOXVQXNVOWKCN-AETAKHFUSA-N 2 1 306.881 4.048 20 0 DIADMP CSCC1CCC([NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)CC1 ZINC000449231301 1045365639 /nfs/dbraw/zinc/36/56/39/1045365639.db2.gz DCUZWTHDMBVVOX-ZLZJIPBDSA-N 2 1 324.578 4.151 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C(C)(F)F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000697127638 1045393710 /nfs/dbraw/zinc/39/37/10/1045393710.db2.gz IVMQKHTVTFTVLF-RDJZCZTQSA-N 2 1 324.459 4.168 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C2CC2)cc1Cl ZINC000449448139 1045394931 /nfs/dbraw/zinc/39/49/31/1045394931.db2.gz FGSXHNZPXNQZEB-RLFYNMQTSA-N 2 1 322.855 4.147 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449730661 1045431056 /nfs/dbraw/zinc/43/10/56/1045431056.db2.gz FXCVSICUDUJXBJ-CRAIPNDOSA-N 2 1 306.881 4.050 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000237498139 1045457422 /nfs/dbraw/zinc/45/74/22/1045457422.db2.gz APGIKBFAGHUQOG-YMIFCHIISA-N 2 1 300.490 4.334 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)C1CC(F)(F)C1 ZINC000529550894 1045496232 /nfs/dbraw/zinc/49/62/32/1045496232.db2.gz QOGYNTSMMLGVGD-GJZGRUSLSA-N 2 1 322.443 4.235 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CC2CC(F)(F)C2)CC1 ZINC000450493299 1045512686 /nfs/dbraw/zinc/51/26/86/1045512686.db2.gz BEPBHBXMHZXWQS-OAHLLOKOSA-N 2 1 314.464 4.008 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(F)cc1 ZINC001120260789 1045537421 /nfs/dbraw/zinc/53/74/21/1045537421.db2.gz XOEBEEPHCNSIRZ-DQXYTYHJSA-N 2 1 302.437 4.024 20 0 DIADMP CC1CCC([NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000381023716 1045557412 /nfs/dbraw/zinc/55/74/12/1045557412.db2.gz XEGVYVMEBJVTGD-LYBXBRPPSA-N 2 1 300.490 4.067 20 0 DIADMP Clc1ccc(/C=C/C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334955 1045645561 /nfs/dbraw/zinc/64/55/61/1045645561.db2.gz KIHZZHZWIWSGDY-MEDHRJKHSA-N 2 1 318.892 4.304 20 0 DIADMP Clc1ccc(/C=C/C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000530334955 1045645565 /nfs/dbraw/zinc/64/55/65/1045645565.db2.gz KIHZZHZWIWSGDY-MEDHRJKHSA-N 2 1 318.892 4.304 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)C/C=C\c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335383 1045646869 /nfs/dbraw/zinc/64/68/69/1045646869.db2.gz NIFRGSYWKGIIIF-YMTSHVIYSA-N 2 1 306.881 4.158 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C/C=C\c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335383 1045646875 /nfs/dbraw/zinc/64/68/75/1045646875.db2.gz NIFRGSYWKGIIIF-YMTSHVIYSA-N 2 1 306.881 4.158 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C/C=C\c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335383 1045646882 /nfs/dbraw/zinc/64/68/82/1045646882.db2.gz NIFRGSYWKGIIIF-YMTSHVIYSA-N 2 1 306.881 4.158 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C/C=C\c2ccc(Cl)cc2)C[C@@H]1C ZINC000530335383 1045646886 /nfs/dbraw/zinc/64/68/86/1045646886.db2.gz NIFRGSYWKGIIIF-YMTSHVIYSA-N 2 1 306.881 4.158 20 0 DIADMP CC[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000392262311 1045648924 /nfs/dbraw/zinc/64/89/24/1045648924.db2.gz RRVAIZJZCXTHEP-INIZCTEOSA-N 2 1 313.272 4.296 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+][C@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629548933 1045678678 /nfs/dbraw/zinc/67/86/78/1045678678.db2.gz OPBCKYGYQKRKOI-QYZOEREBSA-N 2 1 312.844 4.452 20 0 DIADMP CC[C@H](c1ccc(F)cc1F)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000530863914 1045741848 /nfs/dbraw/zinc/74/18/48/1045741848.db2.gz RGJFFMUMLPKHDG-DNVCBOLYSA-N 2 1 322.443 4.080 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2csc(C)c2C)CC1 ZINC000630072867 1045742872 /nfs/dbraw/zinc/74/28/72/1045742872.db2.gz LNKGAHJTMUMKFC-UHFFFAOYSA-N 2 1 306.519 4.205 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cccc3c2CCC3)CC1 ZINC000630072570 1045743855 /nfs/dbraw/zinc/74/38/55/1045743855.db2.gz GFLHPVXAIQQXJD-UHFFFAOYSA-N 2 1 312.501 4.016 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000531715396 1045903626 /nfs/dbraw/zinc/90/36/26/1045903626.db2.gz XOCJEKAUBHZRLJ-KBXCAEBGSA-N 2 1 306.881 4.039 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000531715403 1045903898 /nfs/dbraw/zinc/90/38/98/1045903898.db2.gz XOCJEKAUBHZRLJ-RDTXWAMCSA-N 2 1 306.881 4.039 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)s1 ZINC000631706566 1045906781 /nfs/dbraw/zinc/90/67/81/1045906781.db2.gz IDXJOJNYYSBTKT-ZQIUZPCESA-N 2 1 321.534 4.145 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000531717189 1045909787 /nfs/dbraw/zinc/90/97/87/1045909787.db2.gz GKIDFYJSVBSLHE-MAUKXSAKSA-N 2 1 308.897 4.359 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc2ncccc12 ZINC001137630637 1045909955 /nfs/dbraw/zinc/90/99/55/1045909955.db2.gz HXZKDBJAGZOUCT-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc2ncccc12 ZINC001137630637 1045909962 /nfs/dbraw/zinc/90/99/62/1045909962.db2.gz HXZKDBJAGZOUCT-RBUKOAKNSA-N 2 1 323.484 4.074 20 0 DIADMP Clc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCC2)cc1 ZINC000453072730 1045918519 /nfs/dbraw/zinc/91/85/19/1045918519.db2.gz FWNKZZTVEDDAOK-LIRRHRJNSA-N 2 1 318.892 4.255 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(Cl)cc2F)CC1 ZINC001137660405 1045926176 /nfs/dbraw/zinc/92/61/76/1045926176.db2.gz IQKMDAOYGXHFFT-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)[C@@H]1c1cccs1 ZINC000453124162 1045945786 /nfs/dbraw/zinc/94/57/86/1045945786.db2.gz NRFGSAXLZTZTST-NZSAHSFTSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)[C@@H]1c1cccs1 ZINC000453124162 1045945800 /nfs/dbraw/zinc/94/58/00/1045945800.db2.gz NRFGSAXLZTZTST-NZSAHSFTSA-N 2 1 318.530 4.299 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1ccncc1 ZINC000453126541 1045947040 /nfs/dbraw/zinc/94/70/40/1045947040.db2.gz QKUXFPHXUJZPNF-UWJYYQICSA-N 2 1 323.484 4.348 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)[C@H]1c1cccs1 ZINC000453124161 1045947207 /nfs/dbraw/zinc/94/72/07/1045947207.db2.gz NRFGSAXLZTZTST-NEWSRXKRSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](C2CC2)C2CCC2)[C@H]1c1cccs1 ZINC000453124161 1045947211 /nfs/dbraw/zinc/94/72/11/1045947211.db2.gz NRFGSAXLZTZTST-NEWSRXKRSA-N 2 1 318.530 4.299 20 0 DIADMP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192918348 1045954830 /nfs/dbraw/zinc/95/48/30/1045954830.db2.gz YLHQAVCBAGJTHQ-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000453174675 1045957715 /nfs/dbraw/zinc/95/77/15/1045957715.db2.gz JOIKFGZADIIGND-SFHVURJKSA-N 2 1 304.865 4.033 20 0 DIADMP COc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1C ZINC000902406873 1045992910 /nfs/dbraw/zinc/99/29/10/1045992910.db2.gz VTPLYGSFDMEIKO-UXPWSPDFSA-N 2 1 324.468 4.148 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2sccc21 ZINC000453225058 1045993062 /nfs/dbraw/zinc/99/30/62/1045993062.db2.gz SJHLAWXWERQMBF-VXTDNTOSSA-N 2 1 304.503 4.293 20 0 DIADMP C[C@@H](C[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1)C(C)(C)C ZINC000802647356 1046023616 /nfs/dbraw/zinc/02/36/16/1046023616.db2.gz KGLQZMIXCIQECQ-INIZCTEOSA-N 2 1 317.521 4.311 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1Cl ZINC001206598417 1046031967 /nfs/dbraw/zinc/03/19/67/1046031967.db2.gz JJZRWPVKXWGDLW-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1c(F)ccc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1Cl ZINC001206598417 1046031980 /nfs/dbraw/zinc/03/19/80/1046031980.db2.gz JJZRWPVKXWGDLW-HNNXBMFYSA-N 2 1 312.860 4.140 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cc(Cl)ccc1OC ZINC000453335750 1046041284 /nfs/dbraw/zinc/04/12/84/1046041284.db2.gz DRELOQAUQDAVCY-UCMJJCQDSA-N 2 1 322.880 4.015 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(Cl)ccc1OC ZINC000453335750 1046041295 /nfs/dbraw/zinc/04/12/95/1046041295.db2.gz DRELOQAUQDAVCY-UCMJJCQDSA-N 2 1 322.880 4.015 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1Cl ZINC000453341985 1046046300 /nfs/dbraw/zinc/04/63/00/1046046300.db2.gz HWFJTYBHGYXFGG-MUSFGAPCSA-N 2 1 306.881 4.252 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1Cl ZINC000453341985 1046046312 /nfs/dbraw/zinc/04/63/12/1046046312.db2.gz HWFJTYBHGYXFGG-MUSFGAPCSA-N 2 1 306.881 4.252 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cccc(-c2ccccc2)c1 ZINC000237586745 1046049673 /nfs/dbraw/zinc/04/96/73/1046049673.db2.gz CSURXRDAIQRDMJ-QGZVFWFLSA-N 2 1 319.452 4.284 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1C[C@H](c2ccccc2)C1(C)C)C1CC1 ZINC000453403393 1046077391 /nfs/dbraw/zinc/07/73/91/1046077391.db2.gz OHUDZPZKJIIVAM-MOPGFXCFSA-N 2 1 300.490 4.033 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453407524 1046080624 /nfs/dbraw/zinc/08/06/24/1046080624.db2.gz RZPKNRILYKNRSN-ZDUSSCGKSA-N 2 1 309.523 4.100 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453593744 1046095764 /nfs/dbraw/zinc/09/57/64/1046095764.db2.gz HMEQAMXIFDAYCI-FYWRMAATSA-N 2 1 306.881 4.207 20 0 DIADMP Cc1cc2cc(C[NH2+]CCCC[N@H+](C)C3CC3)oc2cc1C ZINC000453602509 1046098265 /nfs/dbraw/zinc/09/82/65/1046098265.db2.gz WFVYCVPCNZPFCU-UHFFFAOYSA-N 2 1 300.446 4.014 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(-c2ccc(F)cc2)o1)C1CC1 ZINC000453606247 1046099442 /nfs/dbraw/zinc/09/94/42/1046099442.db2.gz VMOUVFBAWHRYBX-UHFFFAOYSA-N 2 1 316.420 4.050 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)CC[N@H+]1C ZINC000532216936 1046116569 /nfs/dbraw/zinc/11/65/69/1046116569.db2.gz MGXLSTKJXPRZKG-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2cccs2)CCCCC1 ZINC000532233655 1046122161 /nfs/dbraw/zinc/12/21/61/1046122161.db2.gz BYMRDOQDZPGEGA-BRWVUGGUSA-N 2 1 320.546 4.268 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC001168146253 1046148794 /nfs/dbraw/zinc/14/87/94/1046148794.db2.gz QYGXBTOYAGEUCW-FBRRREGBSA-N 2 1 323.484 4.311 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC001168146253 1046148795 /nfs/dbraw/zinc/14/87/95/1046148795.db2.gz QYGXBTOYAGEUCW-FBRRREGBSA-N 2 1 323.484 4.311 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)c(C)s1 ZINC000903061884 1046153550 /nfs/dbraw/zinc/15/35/50/1046153550.db2.gz MCSHHLBKNHTPSL-JATKITJMSA-N 2 1 304.503 4.173 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069632 1046154790 /nfs/dbraw/zinc/15/47/90/1046154790.db2.gz IPVYBLVPJGBSGD-VXGBXAGGSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069632 1046154795 /nfs/dbraw/zinc/15/47/95/1046154795.db2.gz IPVYBLVPJGBSGD-VXGBXAGGSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)C(C)(C)c1ccccc1 ZINC000903086837 1046160692 /nfs/dbraw/zinc/16/06/92/1046160692.db2.gz ATRYABRKFQGJJR-SHFXZJCHSA-N 2 1 312.501 4.100 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc3cc(C)ccc3[nH]2)CC1 ZINC001138419820 1046174340 /nfs/dbraw/zinc/17/43/40/1046174340.db2.gz FDBWYFDQIVWWDB-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc3cc(C)ccc3[nH]2)CC1 ZINC001138419820 1046174350 /nfs/dbraw/zinc/17/43/50/1046174350.db2.gz FDBWYFDQIVWWDB-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)cc1 ZINC001138545443 1046220694 /nfs/dbraw/zinc/22/06/94/1046220694.db2.gz XKSLWFRKCMRWPN-CQSZACIVSA-N 2 1 319.399 4.048 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)cc1 ZINC001138545443 1046220718 /nfs/dbraw/zinc/22/07/18/1046220718.db2.gz XKSLWFRKCMRWPN-CQSZACIVSA-N 2 1 319.399 4.048 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)CCc2ccc(C)cc2)cc1 ZINC001138547128 1046221453 /nfs/dbraw/zinc/22/14/53/1046221453.db2.gz FMNNCECMUGANNP-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)CCc2ccc(C)cc2)cc1 ZINC001138547128 1046221468 /nfs/dbraw/zinc/22/14/68/1046221468.db2.gz FMNNCECMUGANNP-UHFFFAOYSA-N 2 1 319.452 4.164 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)cc1 ZINC001138549012 1046221695 /nfs/dbraw/zinc/22/16/95/1046221695.db2.gz NRRBIPFBYCKKBU-QUCCMNQESA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)cc1 ZINC001138549012 1046221709 /nfs/dbraw/zinc/22/17/09/1046221709.db2.gz NRRBIPFBYCKKBU-QUCCMNQESA-N 2 1 309.457 4.335 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2Cc3ccccc3C[C@H]2C)cc1 ZINC001138549406 1046222925 /nfs/dbraw/zinc/22/29/25/1046222925.db2.gz WFIZHSJACFVZBF-MRXNPFEDSA-N 2 1 317.436 4.128 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)cc1 ZINC001138549406 1046222938 /nfs/dbraw/zinc/22/29/38/1046222938.db2.gz WFIZHSJACFVZBF-MRXNPFEDSA-N 2 1 317.436 4.128 20 0 DIADMP c1csc(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000638280805 1046308730 /nfs/dbraw/zinc/30/87/30/1046308730.db2.gz KIZAJAOBJHHQQV-LPHOPBHVSA-N 2 1 312.482 4.206 20 0 DIADMP c1csc(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000638280805 1046308746 /nfs/dbraw/zinc/30/87/46/1046308746.db2.gz KIZAJAOBJHHQQV-LPHOPBHVSA-N 2 1 312.482 4.206 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cccc3[nH]ccc32)C1 ZINC000237679992 1046312793 /nfs/dbraw/zinc/31/27/93/1046312793.db2.gz WDZDZXDAVXKRPU-CALCHBBNSA-N 2 1 313.489 4.016 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1 ZINC000638406357 1046319274 /nfs/dbraw/zinc/31/92/74/1046319274.db2.gz GWMMACOWJJDARO-UYAOXDASSA-N 2 1 310.441 4.046 20 0 DIADMP Cc1occc1C[NH2+][C@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1 ZINC000638406354 1046319723 /nfs/dbraw/zinc/31/97/23/1046319723.db2.gz GWMMACOWJJDARO-AZUAARDMSA-N 2 1 310.441 4.046 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cc2ccccc2o1 ZINC001139064440 1046373705 /nfs/dbraw/zinc/37/37/05/1046373705.db2.gz BCZADGLSKFUPTC-ZWKOTPCHSA-N 2 1 312.457 4.272 20 0 DIADMP CC(C)P(CC[NH2+]C1CC[NH+](C(C)(C)C)CC1)C(C)C ZINC001256567617 1046381061 /nfs/dbraw/zinc/38/10/61/1046381061.db2.gz XCBRFDJJQCUVCB-UHFFFAOYSA-N 2 1 300.471 4.138 20 0 DIADMP c1coc(CCC[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639335729 1046383605 /nfs/dbraw/zinc/38/36/05/1046383605.db2.gz RFWLGWXIUYKRQW-RXVVDRJESA-N 2 1 324.468 4.170 20 0 DIADMP c1coc(CCC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639335729 1046383614 /nfs/dbraw/zinc/38/36/14/1046383614.db2.gz RFWLGWXIUYKRQW-RXVVDRJESA-N 2 1 324.468 4.170 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2nccc3ccccc32)CC1 ZINC000639376568 1046387125 /nfs/dbraw/zinc/38/71/25/1046387125.db2.gz PHFOQQPVYSIAEH-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP CC1CCC([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)CC1 ZINC001168204313 1046418831 /nfs/dbraw/zinc/41/88/31/1046418831.db2.gz KFBJSUYKULKJBR-UHFFFAOYSA-N 2 1 306.881 4.169 20 0 DIADMP CC1CCC([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)CC1 ZINC001168205510 1046421064 /nfs/dbraw/zinc/42/10/64/1046421064.db2.gz DUHJNMAWCFMEMF-UHFFFAOYSA-N 2 1 306.881 4.169 20 0 DIADMP CC1CCC([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001168219076 1046429611 /nfs/dbraw/zinc/42/96/11/1046429611.db2.gz CXPYIFJQYJSNQN-SYYJFZTOSA-N 2 1 300.490 4.019 20 0 DIADMP CC1CCC([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC001168222044 1046432727 /nfs/dbraw/zinc/43/27/27/1046432727.db2.gz VUWJINGKNXDAII-PXMFUHLKSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC001168222044 1046432731 /nfs/dbraw/zinc/43/27/31/1046432731.db2.gz VUWJINGKNXDAII-PXMFUHLKSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CCC([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)CC1 ZINC001168222044 1046432733 /nfs/dbraw/zinc/43/27/33/1046432733.db2.gz VUWJINGKNXDAII-PXMFUHLKSA-N 2 1 312.501 4.019 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000781428092 1046444819 /nfs/dbraw/zinc/44/48/19/1046444819.db2.gz ZNLIGNIKFJYZRA-MDKPJZGXSA-N 2 1 312.501 4.225 20 0 DIADMP CC[C@H]1CCC[C@@H](C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202939855 1046454535 /nfs/dbraw/zinc/45/45/35/1046454535.db2.gz UJRLFDUQJHMKDP-ZSXPUABSSA-N 2 1 314.517 4.138 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2ccccc2)nc1)C1CCN(C)CC1 ZINC001139523202 1046461750 /nfs/dbraw/zinc/46/17/50/1046461750.db2.gz ZCEZDTKFSYWSSE-UHFFFAOYSA-N 2 1 323.484 4.053 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1cc(F)cc2F ZINC000677129740 1046466243 /nfs/dbraw/zinc/46/62/43/1046466243.db2.gz OAEZNMWZBKVYAL-IFXJQAMLSA-N 2 1 322.443 4.196 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000677241688 1046476201 /nfs/dbraw/zinc/47/62/01/1046476201.db2.gz SWUJFTAQDRYTBI-MPGHIAIKSA-N 2 1 306.881 4.254 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000677241688 1046476207 /nfs/dbraw/zinc/47/62/07/1046476207.db2.gz SWUJFTAQDRYTBI-MPGHIAIKSA-N 2 1 306.881 4.254 20 0 DIADMP CCCC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC)cc1 ZINC000677241666 1046477480 /nfs/dbraw/zinc/47/74/80/1046477480.db2.gz RVZXKFSKFWJTGN-BJLQDIEVSA-N 2 1 316.489 4.143 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CCC2)cc1 ZINC000677239998 1046477594 /nfs/dbraw/zinc/47/75/94/1046477594.db2.gz CRRIBQDPJTVYPT-CEXWTWQISA-N 2 1 318.892 4.398 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCCc4ccccc43)CC2)[nH+]1 ZINC000128212905 1046491106 /nfs/dbraw/zinc/49/11/06/1046491106.db2.gz DVFZZNJKNNLKHM-HXUWFJFHSA-N 2 1 321.468 4.026 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000782191497 1046499237 /nfs/dbraw/zinc/49/92/37/1046499237.db2.gz WMEKFDPMBRFAJJ-BEFAXECRSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000782191497 1046499242 /nfs/dbraw/zinc/49/92/42/1046499242.db2.gz WMEKFDPMBRFAJJ-BEFAXECRSA-N 2 1 318.892 4.135 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000677753726 1046522705 /nfs/dbraw/zinc/52/27/05/1046522705.db2.gz PHFABJASGLKEAM-QKNQBKEWSA-N 2 1 312.501 4.404 20 0 DIADMP CN1CCC([N@@H+](C)Cc2cccc3c4ccccc4oc32)CC1 ZINC001139857971 1046534061 /nfs/dbraw/zinc/53/40/61/1046534061.db2.gz UJLDORXOUYGUOK-UHFFFAOYSA-N 2 1 308.425 4.112 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3oc21)C1CC[NH+](C)CC1 ZINC001139857971 1046534071 /nfs/dbraw/zinc/53/40/71/1046534071.db2.gz UJLDORXOUYGUOK-UHFFFAOYSA-N 2 1 308.425 4.112 20 0 DIADMP C[N@@H+](Cc1cccc2c3ccccc3oc21)C1CC[NH+](C)CC1 ZINC001139857971 1046534082 /nfs/dbraw/zinc/53/40/82/1046534082.db2.gz UJLDORXOUYGUOK-UHFFFAOYSA-N 2 1 308.425 4.112 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3cccc4c5ccccc5oc43)C2)C1 ZINC001139858265 1046534386 /nfs/dbraw/zinc/53/43/86/1046534386.db2.gz BQLHEVZGIFCCPF-NRFANRHFSA-N 2 1 320.436 4.114 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3cccc4c5ccccc5oc43)C2)C1 ZINC001139858265 1046534396 /nfs/dbraw/zinc/53/43/96/1046534396.db2.gz BQLHEVZGIFCCPF-NRFANRHFSA-N 2 1 320.436 4.114 20 0 DIADMP c1c2ccccc2[nH]c1C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001137319323 1046541569 /nfs/dbraw/zinc/54/15/69/1046541569.db2.gz WHWQADXURCHGNL-IBGZPJMESA-N 2 1 311.473 4.008 20 0 DIADMP c1c2ccccc2[nH]c1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001137319323 1046541579 /nfs/dbraw/zinc/54/15/79/1046541579.db2.gz WHWQADXURCHGNL-IBGZPJMESA-N 2 1 311.473 4.008 20 0 DIADMP c1c2ccccc2[nH]c1C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001137319324 1046542317 /nfs/dbraw/zinc/54/23/17/1046542317.db2.gz WHWQADXURCHGNL-LJQANCHMSA-N 2 1 311.473 4.008 20 0 DIADMP c1c2ccccc2[nH]c1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001137319324 1046542319 /nfs/dbraw/zinc/54/23/19/1046542319.db2.gz WHWQADXURCHGNL-LJQANCHMSA-N 2 1 311.473 4.008 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)Cc1ccc(C)c(C)c1 ZINC001140027239 1046570434 /nfs/dbraw/zinc/57/04/34/1046570434.db2.gz DJRGQSWWXKWQMA-UHFFFAOYSA-N 2 1 319.452 4.430 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC001140027239 1046570444 /nfs/dbraw/zinc/57/04/44/1046570444.db2.gz DJRGQSWWXKWQMA-UHFFFAOYSA-N 2 1 319.452 4.430 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC001140029212 1046572037 /nfs/dbraw/zinc/57/20/37/1046572037.db2.gz JLLVAKZPPKBJPS-OAQYLSRUSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC001140029212 1046572049 /nfs/dbraw/zinc/57/20/49/1046572049.db2.gz JLLVAKZPPKBJPS-OAQYLSRUSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)ccc1F ZINC000729679388 1046574010 /nfs/dbraw/zinc/57/40/10/1046574010.db2.gz GTXAUPCKBDPOCZ-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@@H]1C[C@H]1C ZINC000322090849 1046583881 /nfs/dbraw/zinc/58/38/81/1046583881.db2.gz WIAHFTPATOIMPZ-XDNMAWCPSA-N 2 1 312.501 4.206 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c(C)n1 ZINC000678412656 1046630515 /nfs/dbraw/zinc/63/05/15/1046630515.db2.gz YOOOTVKAUCBTHI-GOSISDBHSA-N 2 1 323.484 4.014 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000678425758 1046636854 /nfs/dbraw/zinc/63/68/54/1046636854.db2.gz CMTMRPNQXZKZMJ-IEZWGBDMSA-N 2 1 315.505 4.084 20 0 DIADMP Cc1ccc([C@@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547327 1046671035 /nfs/dbraw/zinc/67/10/35/1046671035.db2.gz CUTOYNKPFBJPGU-SFTDATJTSA-N 2 1 320.480 4.349 20 0 DIADMP c1ccc(-c2ccc(CC[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000678598567 1046672238 /nfs/dbraw/zinc/67/22/38/1046672238.db2.gz IWVHGRQXVFPMES-VXKWHMMOSA-N 2 1 320.480 4.113 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548790 1046673499 /nfs/dbraw/zinc/67/34/99/1046673499.db2.gz VGKTWBNACSTNEV-GJZGRUSLSA-N 2 1 312.457 4.321 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533288992 1046687520 /nfs/dbraw/zinc/68/75/20/1046687520.db2.gz MVWOHPYRYJPTDP-CRAIPNDOSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533288992 1046687524 /nfs/dbraw/zinc/68/75/24/1046687524.db2.gz MVWOHPYRYJPTDP-CRAIPNDOSA-N 2 1 306.881 4.351 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2c3ccccc3CC[C@H]2C)C1 ZINC000678769168 1046696812 /nfs/dbraw/zinc/69/68/12/1046696812.db2.gz MUCVHXDARDISHY-FUHIMQAGSA-N 2 1 300.490 4.020 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)cc1Cl ZINC000796678386 1046715784 /nfs/dbraw/zinc/71/57/84/1046715784.db2.gz NPCIWUXEPRNQMS-AWEZNQCLSA-N 2 1 312.885 4.038 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)cc1Cl ZINC000796678386 1046715799 /nfs/dbraw/zinc/71/57/99/1046715799.db2.gz NPCIWUXEPRNQMS-AWEZNQCLSA-N 2 1 312.885 4.038 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533426207 1046720324 /nfs/dbraw/zinc/72/03/24/1046720324.db2.gz PNKIBNSQUUPOKY-RTBURBONSA-N 2 1 304.453 4.227 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533426207 1046720338 /nfs/dbraw/zinc/72/03/38/1046720338.db2.gz PNKIBNSQUUPOKY-RTBURBONSA-N 2 1 304.453 4.227 20 0 DIADMP CSCC[C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000796771305 1046731396 /nfs/dbraw/zinc/73/13/96/1046731396.db2.gz INQUFCCIJNPWJW-IPJUCJBFSA-N 2 1 320.546 4.161 20 0 DIADMP COc1c(C)cc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1Cl ZINC000796800870 1046734184 /nfs/dbraw/zinc/73/41/84/1046734184.db2.gz YVEGHRNFOVQAQT-AWEZNQCLSA-N 2 1 324.896 4.180 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cccc(C(F)(F)F)c1 ZINC000678997716 1046751869 /nfs/dbraw/zinc/75/18/69/1046751869.db2.gz ISPPMXBIWXMDEX-XJKSGUPXSA-N 2 1 314.395 4.230 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1ccc(OC)cc1C)C1CCCCC1 ZINC001203043400 1046760842 /nfs/dbraw/zinc/76/08/42/1046760842.db2.gz OFLFGJAPXWZOSK-UHFFFAOYSA-N 2 1 318.505 4.138 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)s1 ZINC000246843561 1046819920 /nfs/dbraw/zinc/81/99/20/1046819920.db2.gz CGJINFXFHJNPDR-CABCVRRESA-N 2 1 323.550 4.177 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)o1 ZINC000067668284 1046891335 /nfs/dbraw/zinc/89/13/35/1046891335.db2.gz ADDXWPOPCDKULH-INIZCTEOSA-N 2 1 312.457 4.252 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)o1 ZINC000067668284 1046891345 /nfs/dbraw/zinc/89/13/45/1046891345.db2.gz ADDXWPOPCDKULH-INIZCTEOSA-N 2 1 312.457 4.252 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1coc2ccccc12 ZINC001140786534 1046898038 /nfs/dbraw/zinc/89/80/38/1046898038.db2.gz FRDOWHBDOKAYKB-ROUUACIJSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1coc2ccccc12 ZINC001140786534 1046898054 /nfs/dbraw/zinc/89/80/54/1046898054.db2.gz FRDOWHBDOKAYKB-ROUUACIJSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1coc2ccccc12 ZINC001140786534 1046898074 /nfs/dbraw/zinc/89/80/74/1046898074.db2.gz FRDOWHBDOKAYKB-ROUUACIJSA-N 2 1 312.457 4.272 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCOC(C)(C)C)cc1 ZINC000679824947 1046904573 /nfs/dbraw/zinc/90/45/73/1046904573.db2.gz OQWZTJDIJLTWHI-OAHLLOKOSA-N 2 1 315.461 4.037 20 0 DIADMP C1=CC2(CC[NH+](Cc3c[nH]c4cc[nH+]cc34)CC2)c2ccccc21 ZINC001140801124 1046909120 /nfs/dbraw/zinc/90/91/20/1046909120.db2.gz CGDDJUFJKLBRKG-UHFFFAOYSA-N 2 1 315.420 4.124 20 0 DIADMP C[C@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@]1(C)CC[NH2+]C1 ZINC000261897110 1046954851 /nfs/dbraw/zinc/95/48/51/1046954851.db2.gz VCZXQJAXHSGITA-VQIMIIECSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H](c1cccs1)[N@@H+](Cc1ccccc1)C[C@]1(C)CC[NH2+]C1 ZINC000261897110 1046954858 /nfs/dbraw/zinc/95/48/58/1046954858.db2.gz VCZXQJAXHSGITA-VQIMIIECSA-N 2 1 314.498 4.311 20 0 DIADMP CSc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000647282974 1046965862 /nfs/dbraw/zinc/96/58/62/1046965862.db2.gz BXVQZTATCNRMOV-GPMSIDNRSA-N 2 1 316.514 4.002 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccoc1 ZINC000680351856 1046969712 /nfs/dbraw/zinc/96/97/12/1046969712.db2.gz GTLHIPXROXIYKA-XIGKFDRGSA-N 2 1 324.468 4.231 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccncc1 ZINC000647294673 1046970383 /nfs/dbraw/zinc/97/03/83/1046970383.db2.gz KIDBLFYMYDKMMJ-AZUAARDMSA-N 2 1 317.521 4.126 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274277 1046973017 /nfs/dbraw/zinc/97/30/17/1046973017.db2.gz CAWVGDHBOIXTGO-YADHBBJMSA-N 2 1 320.480 4.270 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274277 1046973023 /nfs/dbraw/zinc/97/30/23/1046973023.db2.gz CAWVGDHBOIXTGO-YADHBBJMSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274277 1046973027 /nfs/dbraw/zinc/97/30/27/1046973027.db2.gz CAWVGDHBOIXTGO-YADHBBJMSA-N 2 1 320.480 4.270 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC001168274277 1046973033 /nfs/dbraw/zinc/97/30/33/1046973033.db2.gz CAWVGDHBOIXTGO-YADHBBJMSA-N 2 1 320.480 4.270 20 0 DIADMP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)F ZINC000647318966 1046975238 /nfs/dbraw/zinc/97/52/38/1046975238.db2.gz HDIULEBJBQWHKQ-OWLYRPNTSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)[C@@H](C)c1ccccc1 ZINC000647344628 1046985693 /nfs/dbraw/zinc/98/56/93/1046985693.db2.gz VTWBAUWJHWHVMD-OSZJIOELSA-N 2 1 322.496 4.114 20 0 DIADMP Cc1oc2ccccc2c1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000798956510 1046992251 /nfs/dbraw/zinc/99/22/51/1046992251.db2.gz AVBKRYHUFMMLMK-UHFFFAOYSA-N 2 1 312.457 4.049 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](Cc3cc4ccccc4s3)C2)CC1 ZINC000798957402 1046992367 /nfs/dbraw/zinc/99/23/67/1046992367.db2.gz VZRCTRUWKQWSTR-UHFFFAOYSA-N 2 1 314.498 4.209 20 0 DIADMP C[C@H](c1cccc(Cl)c1F)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799179472 1047009665 /nfs/dbraw/zinc/00/96/65/1047009665.db2.gz MBFMRIZFCRUKLM-CQSZACIVSA-N 2 1 324.871 4.348 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2ccccc2-c2cccs2)CC1 ZINC001141097354 1047011735 /nfs/dbraw/zinc/01/17/35/1047011735.db2.gz IZBQTVMFTSUNDJ-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2ccccc2-c2cccs2)CC1 ZINC001141097354 1047011750 /nfs/dbraw/zinc/01/17/50/1047011750.db2.gz IZBQTVMFTSUNDJ-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC(C)(C)c1cccc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)c1 ZINC001141105718 1047015202 /nfs/dbraw/zinc/01/52/02/1047015202.db2.gz APDJBGLYECVLMK-UHFFFAOYSA-N 2 1 314.517 4.434 20 0 DIADMP C[C@@H](CC[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000648068249 1047035129 /nfs/dbraw/zinc/03/51/29/1047035129.db2.gz MOZJWFMQYIKZIJ-BWAGFHJFSA-N 2 1 322.496 4.115 20 0 DIADMP CCc1ccccc1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001141227905 1047054517 /nfs/dbraw/zinc/05/45/17/1047054517.db2.gz PPRQUEAAIUSPAM-HXUWFJFHSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccccc1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001141227905 1047054530 /nfs/dbraw/zinc/05/45/30/1047054530.db2.gz PPRQUEAAIUSPAM-HXUWFJFHSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccccc1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001141227905 1047054542 /nfs/dbraw/zinc/05/45/42/1047054542.db2.gz PPRQUEAAIUSPAM-HXUWFJFHSA-N 2 1 322.496 4.203 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1cccs1 ZINC000379624685 1047080997 /nfs/dbraw/zinc/08/09/97/1047080997.db2.gz JPYCVHBPRMTJKU-RYRKJORJSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1cccs1 ZINC000379624685 1047081009 /nfs/dbraw/zinc/08/10/09/1047081009.db2.gz JPYCVHBPRMTJKU-RYRKJORJSA-N 2 1 314.498 4.452 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(C)sc1C ZINC000191501476 1047084754 /nfs/dbraw/zinc/08/47/54/1047084754.db2.gz QWMLBEXRIFKORP-UHFFFAOYSA-N 2 1 305.491 4.036 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(C)sc1C ZINC000191501476 1047084771 /nfs/dbraw/zinc/08/47/71/1047084771.db2.gz QWMLBEXRIFKORP-UHFFFAOYSA-N 2 1 305.491 4.036 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(Cl)cc1 ZINC000191505803 1047086543 /nfs/dbraw/zinc/08/65/43/1047086543.db2.gz YRLAQXKMRVDTBJ-UHFFFAOYSA-N 2 1 305.853 4.011 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000191505803 1047086556 /nfs/dbraw/zinc/08/65/56/1047086556.db2.gz YRLAQXKMRVDTBJ-UHFFFAOYSA-N 2 1 305.853 4.011 20 0 DIADMP Cc1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379651976 1047089826 /nfs/dbraw/zinc/08/98/26/1047089826.db2.gz VOJPAGVKISWNKI-NQIIRXRSSA-N 2 1 308.469 4.138 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCCc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379646192 1047090948 /nfs/dbraw/zinc/09/09/48/1047090948.db2.gz DYZRNPAXOPNIHS-DENIHFKCSA-N 2 1 322.496 4.262 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC000379646192 1047090960 /nfs/dbraw/zinc/09/09/60/1047090960.db2.gz DYZRNPAXOPNIHS-DENIHFKCSA-N 2 1 322.496 4.262 20 0 DIADMP CC(C)C1CC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379658524 1047094463 /nfs/dbraw/zinc/09/44/63/1047094463.db2.gz WPJZUPPSOJPRCO-IHJVYAAUSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H]([NH2+]C1(C[NH2+]C2CC(C(F)F)C2)CCCC1)c1ccccc1 ZINC000681091051 1047094691 /nfs/dbraw/zinc/09/46/91/1047094691.db2.gz WUUPGRQXXYIFRN-OOHWJJMZSA-N 2 1 322.443 4.283 20 0 DIADMP CC(C)C1CC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379658524 1047094479 /nfs/dbraw/zinc/09/44/79/1047094479.db2.gz WPJZUPPSOJPRCO-IHJVYAAUSA-N 2 1 300.490 4.064 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)cc1 ZINC000536830610 1047102975 /nfs/dbraw/zinc/10/29/75/1047102975.db2.gz DMNYDFLDNKEIHJ-PXNSSMCTSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000536843466 1047107640 /nfs/dbraw/zinc/10/76/40/1047107640.db2.gz DATWJMODWQAHHW-SEZOEQDJSA-N 2 1 314.517 4.205 20 0 DIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536840221 1047107733 /nfs/dbraw/zinc/10/77/33/1047107733.db2.gz QXAZVPGEYQVQMF-ROUUACIJSA-N 2 1 318.505 4.022 20 0 DIADMP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536840221 1047107744 /nfs/dbraw/zinc/10/77/44/1047107744.db2.gz QXAZVPGEYQVQMF-ROUUACIJSA-N 2 1 318.505 4.022 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000536859501 1047114565 /nfs/dbraw/zinc/11/45/65/1047114565.db2.gz RHVJBVBOFDXTKA-HNBVOPMISA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000536859501 1047114571 /nfs/dbraw/zinc/11/45/71/1047114571.db2.gz RHVJBVBOFDXTKA-HNBVOPMISA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000536859511 1047115344 /nfs/dbraw/zinc/11/53/44/1047115344.db2.gz RHVJBVBOFDXTKA-ZULIPRJHSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000536859511 1047115348 /nfs/dbraw/zinc/11/53/48/1047115348.db2.gz RHVJBVBOFDXTKA-ZULIPRJHSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2sc(C(C)(C)C)nc2C)C1 ZINC001116288072 1047127382 /nfs/dbraw/zinc/12/73/82/1047127382.db2.gz BZSAMJHBICTFRA-DZGCQCFKSA-N 2 1 323.550 4.132 20 0 DIADMP CC[N@H+]1CCC[C@H](CN[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293250 1047127580 /nfs/dbraw/zinc/12/75/80/1047127580.db2.gz KXMPUAWPOBICFL-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293250 1047127581 /nfs/dbraw/zinc/12/75/81/1047127581.db2.gz KXMPUAWPOBICFL-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293250 1047127584 /nfs/dbraw/zinc/12/75/84/1047127584.db2.gz KXMPUAWPOBICFL-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1ccc(F)c(C)c1)C1CC1 ZINC000537015891 1047131978 /nfs/dbraw/zinc/13/19/78/1047131978.db2.gz ORQNKDZKFOPIBH-ORAYPTAESA-N 2 1 315.436 4.016 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccccc1OC(C)C ZINC000537023231 1047133296 /nfs/dbraw/zinc/13/32/96/1047133296.db2.gz QJZWCNMSBOWTCX-INIZCTEOSA-N 2 1 315.461 4.110 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3c(Cl)cccc32)C1 ZINC001116565043 1047156431 /nfs/dbraw/zinc/15/64/31/1047156431.db2.gz FXPOJBISSBAVGV-KSSFIOAISA-N 2 1 306.881 4.039 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC001116604929 1047161954 /nfs/dbraw/zinc/16/19/54/1047161954.db2.gz YNAUDQLVXAQVHH-IAGOWNOFSA-N 2 1 318.505 4.246 20 0 DIADMP CC(C)C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)cc1 ZINC000537307132 1047162551 /nfs/dbraw/zinc/16/25/51/1047162551.db2.gz LJYKLYZDXWOLFE-GOSISDBHSA-N 2 1 306.881 4.279 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072717 1047168686 /nfs/dbraw/zinc/16/86/86/1047168686.db2.gz LWAXPYXVQVFPPU-MSOLQXFVSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072717 1047168688 /nfs/dbraw/zinc/16/86/88/1047168688.db2.gz LWAXPYXVQVFPPU-MSOLQXFVSA-N 2 1 318.505 4.037 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682072717 1047168692 /nfs/dbraw/zinc/16/86/92/1047168692.db2.gz LWAXPYXVQVFPPU-MSOLQXFVSA-N 2 1 318.505 4.037 20 0 DIADMP Cc1cccc2cc[nH+]c(NC3CC[NH+](CC(C)(C)C)CC3)c12 ZINC001161213164 1047181162 /nfs/dbraw/zinc/18/11/62/1047181162.db2.gz RKXZOJYKSQTMSG-UHFFFAOYSA-N 2 1 311.473 4.466 20 0 DIADMP CC[N@@H+](Cc1ccc2c(c1)Cc1ccccc1-2)C1CCN(C)CC1 ZINC001141740076 1047282194 /nfs/dbraw/zinc/28/21/94/1047282194.db2.gz UABGMZWWJODXSW-UHFFFAOYSA-N 2 1 320.480 4.174 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CC4CCC3CC4)C2)cc1 ZINC000394353072 1047310193 /nfs/dbraw/zinc/31/01/93/1047310193.db2.gz IGAXIVSVYZTNEM-BCKAPOECSA-N 2 1 312.501 4.067 20 0 DIADMP FC1(F)CC[C@H](CC[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000898017878 1047311054 /nfs/dbraw/zinc/31/10/54/1047311054.db2.gz WCEQDMRWWSKAQG-MRXNPFEDSA-N 2 1 322.443 4.066 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C3(C4CCC4)CC3)CC23CC3)cc1 ZINC000651984085 1047338301 /nfs/dbraw/zinc/33/83/01/1047338301.db2.gz SLFOYCNFGMOLDU-IBGZPJMESA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C3(C4CCC4)CC3)CC23CC3)cc1 ZINC000651984085 1047338310 /nfs/dbraw/zinc/33/83/10/1047338310.db2.gz SLFOYCNFGMOLDU-IBGZPJMESA-N 2 1 310.485 4.106 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1 ZINC000652140362 1047343280 /nfs/dbraw/zinc/34/32/80/1047343280.db2.gz MDXYDHBONHNRMR-QYZOEREBSA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1 ZINC000652140360 1047344483 /nfs/dbraw/zinc/34/44/83/1047344483.db2.gz MDXYDHBONHNRMR-OTWHNJEPSA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC000652204775 1047346715 /nfs/dbraw/zinc/34/67/15/1047346715.db2.gz BTENAESUJNSTES-IPQPSQTFSA-N 2 1 304.453 4.128 20 0 DIADMP C[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1cc(F)c(Cl)cc1Cl ZINC000044532754 1047347023 /nfs/dbraw/zinc/34/70/23/1047347023.db2.gz GRKFDIBUFBSHLL-QWRGUYRKSA-N 2 1 319.251 4.125 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C2(C3CCC3)CC2)CC1 ZINC000652272265 1047351535 /nfs/dbraw/zinc/35/15/35/1047351535.db2.gz GIGXDWWCEOZZMB-UHFFFAOYSA-N 2 1 312.501 4.352 20 0 DIADMP CSc1ccc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)s1 ZINC001142025967 1047351795 /nfs/dbraw/zinc/35/17/95/1047351795.db2.gz UMLGAAVEZMUAIY-UHFFFAOYSA-N 2 1 312.548 4.022 20 0 DIADMP c1ccc(-c2ccccc2C[NH+]2CCC([NH+]3CCC3)CC2)cc1 ZINC001142349187 1047433540 /nfs/dbraw/zinc/43/35/40/1047433540.db2.gz ULJNORAPBGNEIQ-UHFFFAOYSA-N 2 1 306.453 4.024 20 0 DIADMP CCC[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3-c3ccccc3)C[C@@H]2C1 ZINC001142348942 1047434590 /nfs/dbraw/zinc/43/45/90/1047434590.db2.gz NYFGRKFVERRBKR-OYRHEFFESA-N 2 1 320.480 4.127 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3-c3ccccc3)C[C@@H]2C1 ZINC001142348942 1047434597 /nfs/dbraw/zinc/43/45/97/1047434597.db2.gz NYFGRKFVERRBKR-OYRHEFFESA-N 2 1 320.480 4.127 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3-c3ccccc3)C[C@@H]2C1 ZINC001142348942 1047434598 /nfs/dbraw/zinc/43/45/98/1047434598.db2.gz NYFGRKFVERRBKR-OYRHEFFESA-N 2 1 320.480 4.127 20 0 DIADMP CCCc1ccc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)cc1 ZINC001142367415 1047436438 /nfs/dbraw/zinc/43/64/38/1047436438.db2.gz NVYKBRPOXSLQNK-UHFFFAOYSA-N 2 1 300.490 4.089 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)cc1 ZINC000086279300 1047439975 /nfs/dbraw/zinc/43/99/75/1047439975.db2.gz UPEFFGIVIQHJGI-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000119392084 1047451721 /nfs/dbraw/zinc/45/17/21/1047451721.db2.gz UWPYXYVJKQZXMN-VBYQOHBCSA-N 2 1 318.892 4.348 20 0 DIADMP Cc1c[nH+]c(CC[NH3+])n1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168334357 1047481543 /nfs/dbraw/zinc/48/15/43/1047481543.db2.gz RLCGFCAQMJMGSF-UHFFFAOYSA-N 2 1 317.864 4.245 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cccc(-c2cccnc2)c1 ZINC000537632265 1047504913 /nfs/dbraw/zinc/50/49/13/1047504913.db2.gz FPOGJKPJARZVDR-OAQYLSRUSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cccc(-c2cccnc2)c1 ZINC000537632265 1047504919 /nfs/dbraw/zinc/50/49/19/1047504919.db2.gz FPOGJKPJARZVDR-OAQYLSRUSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cccc(-c2cccnc2)c1 ZINC000537632265 1047504927 /nfs/dbraw/zinc/50/49/27/1047504927.db2.gz FPOGJKPJARZVDR-OAQYLSRUSA-N 2 1 323.484 4.055 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(C(F)F)CC1 ZINC000537635353 1047513590 /nfs/dbraw/zinc/51/35/90/1047513590.db2.gz PAGDYEXUFGQBQV-UHFFFAOYSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1Cl)[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843363916 1047543061 /nfs/dbraw/zinc/54/30/61/1047543061.db2.gz UUQMTSYPVYSPSK-LBPRGKRZSA-N 2 1 313.272 4.130 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000843363607 1047543077 /nfs/dbraw/zinc/54/30/77/1047543077.db2.gz BTXXLUQJVUWYFP-GFCCVEGCSA-N 2 1 313.272 4.130 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2CCCSc1ccccc1Cl ZINC000843361309 1047543414 /nfs/dbraw/zinc/54/34/14/1047543414.db2.gz XKOPYCNHGQICKH-GOOCMWNKSA-N 2 1 324.921 4.166 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2CCCSc1ccccc1Cl ZINC000843361309 1047543419 /nfs/dbraw/zinc/54/34/19/1047543419.db2.gz XKOPYCNHGQICKH-GOOCMWNKSA-N 2 1 324.921 4.166 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537648918 1047562683 /nfs/dbraw/zinc/56/26/83/1047562683.db2.gz YHHYOZSQZGSTAN-QGZVFWFLSA-N 2 1 314.473 4.213 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537648918 1047562687 /nfs/dbraw/zinc/56/26/87/1047562687.db2.gz YHHYOZSQZGSTAN-QGZVFWFLSA-N 2 1 314.473 4.213 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccc1N(C)C ZINC000537655602 1047569045 /nfs/dbraw/zinc/56/90/45/1047569045.db2.gz ZLCXMSVDKVJPAS-MSOLQXFVSA-N 2 1 317.521 4.058 20 0 DIADMP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694168 1047577663 /nfs/dbraw/zinc/57/76/63/1047577663.db2.gz ASWCLUVVFKTRSD-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694168 1047577669 /nfs/dbraw/zinc/57/76/69/1047577669.db2.gz ASWCLUVVFKTRSD-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694168 1047577671 /nfs/dbraw/zinc/57/76/71/1047577671.db2.gz ASWCLUVVFKTRSD-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3c(Cl)oc4ccccc43)CC[C@H]21 ZINC000537694168 1047577673 /nfs/dbraw/zinc/57/76/73/1047577673.db2.gz ASWCLUVVFKTRSD-CZUORRHYSA-N 2 1 318.848 4.002 20 0 DIADMP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c(C)o1 ZINC000163533620 1047589915 /nfs/dbraw/zinc/58/99/15/1047589915.db2.gz ZSGLSTDCUSLXAP-UHFFFAOYSA-N 2 1 300.446 4.026 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCCC[C@H](C[NH3+])C3)c2)cc1 ZINC001206640699 1047594355 /nfs/dbraw/zinc/59/43/55/1047594355.db2.gz LFTBCLQEWATKMH-LJQANCHMSA-N 2 1 308.469 4.223 20 0 DIADMP CCOc1ccccc1[C@@H](C)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946792 1047647878 /nfs/dbraw/zinc/64/78/78/1047647878.db2.gz TZMWYXBJTVKDRF-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000537946792 1047647882 /nfs/dbraw/zinc/64/78/82/1047647882.db2.gz TZMWYXBJTVKDRF-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946792 1047647884 /nfs/dbraw/zinc/64/78/84/1047647884.db2.gz TZMWYXBJTVKDRF-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1[nH+]c(N(CC[NH3+])c2cccc3ccccc32)cc2[nH]ccc21 ZINC001154683093 1047654433 /nfs/dbraw/zinc/65/44/33/1047654433.db2.gz GCWDWCCEGKQUIR-UHFFFAOYSA-N 2 1 316.408 4.121 20 0 DIADMP CC(C)CCOc1ccc([C@@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000538406273 1047672195 /nfs/dbraw/zinc/67/21/95/1047672195.db2.gz XOHDTOGMJNUMCX-QGZVFWFLSA-N 2 1 316.489 4.024 20 0 DIADMP C[N@@H+]1CC=C(C[NH2+][C@@H](Cc2ccccc2)C2CCCCC2)CC1 ZINC000538406890 1047672975 /nfs/dbraw/zinc/67/29/75/1047672975.db2.gz YGGRLKCSQJIGKI-NRFANRHFSA-N 2 1 312.501 4.030 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000538393720 1047674445 /nfs/dbraw/zinc/67/44/45/1047674445.db2.gz QMILHIBIKNRCGD-JKSUJKDBSA-N 2 1 314.473 4.296 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000538393720 1047674447 /nfs/dbraw/zinc/67/44/47/1047674447.db2.gz QMILHIBIKNRCGD-JKSUJKDBSA-N 2 1 314.473 4.296 20 0 DIADMP CC(C)(C)C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1 ZINC000538398077 1047674978 /nfs/dbraw/zinc/67/49/78/1047674978.db2.gz DDRWCGPBTQQQDV-BEFAXECRSA-N 2 1 318.480 4.377 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000538408816 1047676246 /nfs/dbraw/zinc/67/62/46/1047676246.db2.gz SBXRMVZQDZRUBW-OAHLLOKOSA-N 2 1 312.457 4.216 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000538452016 1047678810 /nfs/dbraw/zinc/67/88/10/1047678810.db2.gz ZYVFTYMDTQMRRP-BEFAXECRSA-N 2 1 300.446 4.061 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2csc3ccccc23)[C@H](C)C1 ZINC000538717312 1047699284 /nfs/dbraw/zinc/69/92/84/1047699284.db2.gz TVPQFGBJUGZOFE-PBHICJAKSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2csc3ccccc23)[C@H](C)C1 ZINC000538717312 1047699286 /nfs/dbraw/zinc/69/92/86/1047699286.db2.gz TVPQFGBJUGZOFE-PBHICJAKSA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2csc3ccccc23)[C@H](C)C1 ZINC000538717312 1047699289 /nfs/dbraw/zinc/69/92/89/1047699289.db2.gz TVPQFGBJUGZOFE-PBHICJAKSA-N 2 1 302.487 4.063 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OCC(C)C)cc2)C[C@@H]1C ZINC000538738358 1047704823 /nfs/dbraw/zinc/70/48/23/1047704823.db2.gz QAKSICCJYWJIOG-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OCC(C)C)cc2)C[C@@H]1C ZINC000538738358 1047704825 /nfs/dbraw/zinc/70/48/25/1047704825.db2.gz QAKSICCJYWJIOG-PKOBYXMFSA-N 2 1 318.505 4.026 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCCn1cc[nH+]c1C ZINC000538781410 1047710472 /nfs/dbraw/zinc/71/04/72/1047710472.db2.gz ACAYHWITSQFGRV-UXHICEINSA-N 2 1 311.473 4.240 20 0 DIADMP CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCCn1cc[nH+]c1C ZINC000538781410 1047710476 /nfs/dbraw/zinc/71/04/76/1047710476.db2.gz ACAYHWITSQFGRV-UXHICEINSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000539058928 1047729581 /nfs/dbraw/zinc/72/95/81/1047729581.db2.gz APRHABXVOVTOFH-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000539058928 1047729587 /nfs/dbraw/zinc/72/95/87/1047729587.db2.gz APRHABXVOVTOFH-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000539048769 1047733021 /nfs/dbraw/zinc/73/30/21/1047733021.db2.gz CWCJFYRIWNHQLL-HOTGVXAUSA-N 2 1 308.535 4.329 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000643521704 1047749394 /nfs/dbraw/zinc/74/93/94/1047749394.db2.gz XQKBNJLKNZKRNR-UWVGGRQHSA-N 2 1 321.679 4.440 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1csc(Cl)c1 ZINC000477920155 1047759630 /nfs/dbraw/zinc/75/96/30/1047759630.db2.gz SZQCJDJDWVWOQG-LBPRGKRZSA-N 2 1 300.899 4.174 20 0 DIADMP Cc1ccc2c(C)cc(NCC34CC[NH+](CC3)CC4)[nH+]c2c1C ZINC001158828851 1047800996 /nfs/dbraw/zinc/80/09/96/1047800996.db2.gz PLOYHGAAALANHO-UHFFFAOYSA-N 2 1 309.457 4.058 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048386 1047833463 /nfs/dbraw/zinc/83/34/63/1047833463.db2.gz ASNHONLBPYFSIF-HNAYVOBHSA-N 2 1 324.459 4.372 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1cc(F)ccc1F ZINC000479048386 1047833472 /nfs/dbraw/zinc/83/34/72/1047833472.db2.gz ASNHONLBPYFSIF-HNAYVOBHSA-N 2 1 324.459 4.372 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1cc(F)ccc1F)C(C)C ZINC000479080419 1047836894 /nfs/dbraw/zinc/83/68/94/1047836894.db2.gz RORLXAJANOXPCN-UGSOOPFHSA-N 2 1 321.415 4.093 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C2CCCCCC2)[C@@H]1c1cccs1 ZINC000553514294 1047867297 /nfs/dbraw/zinc/86/72/97/1047867297.db2.gz LMUJTBCJUFXAPH-CRAIPNDOSA-N 2 1 306.519 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C2CCCCCC2)[C@@H]1c1cccs1 ZINC000553514294 1047867308 /nfs/dbraw/zinc/86/73/08/1047867308.db2.gz LMUJTBCJUFXAPH-CRAIPNDOSA-N 2 1 306.519 4.443 20 0 DIADMP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@H+]1Cc1cccc(C(C)(C)C)c1 ZINC001197929969 1047902549 /nfs/dbraw/zinc/90/25/49/1047902549.db2.gz NIDJIBDVRHZOMA-QGZVFWFLSA-N 2 1 323.484 4.090 20 0 DIADMP C[C@H](C[NH+]1CCC(C)([NH+]2CCCC2)CC1)c1cccc(Cl)c1 ZINC001183226455 1047905398 /nfs/dbraw/zinc/90/53/98/1047905398.db2.gz ICHCKNOWZHBCJY-MRXNPFEDSA-N 2 1 320.908 4.394 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000479510559 1047915193 /nfs/dbraw/zinc/91/51/93/1047915193.db2.gz JJNXZTZUNKDHJW-DRUAIGIBSA-N 2 1 316.464 4.056 20 0 DIADMP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479510559 1047915199 /nfs/dbraw/zinc/91/51/99/1047915199.db2.gz JJNXZTZUNKDHJW-DRUAIGIBSA-N 2 1 316.464 4.056 20 0 DIADMP c1cc(Nc2ccc3c[nH+]ccc3c2)cc(C2CC[NH2+]CC2)c1 ZINC001159758066 1047915232 /nfs/dbraw/zinc/91/52/32/1047915232.db2.gz UZUKXJZDJCQDML-UHFFFAOYSA-N 2 1 303.409 4.445 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000479537145 1047920915 /nfs/dbraw/zinc/92/09/15/1047920915.db2.gz GMFJSSXBYKLPHX-KPACCLEDSA-N 2 1 312.501 4.208 20 0 DIADMP Cc1cc([C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)C2CC2)ccc1F ZINC000479549250 1047925424 /nfs/dbraw/zinc/92/54/24/1047925424.db2.gz GESSCADGVLNBCJ-AFMYVXGZSA-N 2 1 316.464 4.192 20 0 DIADMP C[C@H](C[NH+]1CCCCCC1)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000479604778 1047938865 /nfs/dbraw/zinc/93/88/65/1047938865.db2.gz NREFFKFPTYPONG-QQFBHYJXSA-N 2 1 320.443 4.209 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC001183509939 1047939459 /nfs/dbraw/zinc/93/94/59/1047939459.db2.gz AXHQTVUFUVNXFV-NHCUHLMSSA-N 2 1 314.517 4.378 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC001205274312 1047941903 /nfs/dbraw/zinc/94/19/03/1047941903.db2.gz VFIGZRYJXOLDJW-SFHVURJKSA-N 2 1 300.471 4.118 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878858 1047990693 /nfs/dbraw/zinc/99/06/93/1047990693.db2.gz DJLSDLYWIUORFR-STQMWFEESA-N 2 1 314.395 4.019 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878858 1047990698 /nfs/dbraw/zinc/99/06/98/1047990698.db2.gz DJLSDLYWIUORFR-STQMWFEESA-N 2 1 314.395 4.019 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878857 1047991583 /nfs/dbraw/zinc/99/15/83/1047991583.db2.gz DJLSDLYWIUORFR-QWHCGFSZSA-N 2 1 314.395 4.019 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878857 1047991593 /nfs/dbraw/zinc/99/15/93/1047991593.db2.gz DJLSDLYWIUORFR-QWHCGFSZSA-N 2 1 314.395 4.019 20 0 DIADMP CC[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(F)cc1F ZINC000480045022 1048036542 /nfs/dbraw/zinc/03/65/42/1048036542.db2.gz ZCXCROQZZRFZBC-MRXNPFEDSA-N 2 1 310.432 4.315 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](CCC(C)C)c2ccc(OC)cc2)CC1 ZINC000480050558 1048041229 /nfs/dbraw/zinc/04/12/29/1048041229.db2.gz WMUBWFBWIKTWCN-FQEVSTJZSA-N 2 1 318.505 4.246 20 0 DIADMP CCCc1ccc(C[NH2+]CCC[N@@H+]2CCc3ccccc3C2)cc1 ZINC001199238285 1048047459 /nfs/dbraw/zinc/04/74/59/1048047459.db2.gz NFZIDZMSUBBFIO-UHFFFAOYSA-N 2 1 322.496 4.177 20 0 DIADMP CCCc1ccc(C[NH2+]CCC[N@H+]2CCc3ccccc3C2)cc1 ZINC001199238285 1048047469 /nfs/dbraw/zinc/04/74/69/1048047469.db2.gz NFZIDZMSUBBFIO-UHFFFAOYSA-N 2 1 322.496 4.177 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]C1CCCCC1 ZINC001199265468 1048048916 /nfs/dbraw/zinc/04/89/16/1048048916.db2.gz AGUWCRVIXZBRHJ-KRWDZBQOSA-N 2 1 300.490 4.483 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cccc(C3CC3)c2)C1 ZINC001199319589 1048056679 /nfs/dbraw/zinc/05/66/79/1048056679.db2.gz FXGDXDHTHBZTTG-HDICACEKSA-N 2 1 314.517 4.412 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC001199336758 1048057242 /nfs/dbraw/zinc/05/72/42/1048057242.db2.gz WLAINSDTVOYKCL-MRXNPFEDSA-N 2 1 308.897 4.393 20 0 DIADMP Cc1cccc2cc[nH+]c(N(Cc3ccccc3)C[C@H](C)C[NH3+])c12 ZINC001160666371 1048075196 /nfs/dbraw/zinc/07/51/96/1048075196.db2.gz VZTBIAAVVLDCAR-MRXNPFEDSA-N 2 1 319.452 4.145 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc3oc4ccccc4c3c2)C1 ZINC001199743655 1048095690 /nfs/dbraw/zinc/09/56/90/1048095690.db2.gz ZXKZTKXXJMABHX-QGZVFWFLSA-N 2 1 322.452 4.408 20 0 DIADMP C[C@H](NCc1ccsc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000480275585 1048108200 /nfs/dbraw/zinc/10/82/00/1048108200.db2.gz RWVFEIKQGIZJJV-GXTWGEPZSA-N 2 1 312.910 4.144 20 0 DIADMP Cc1ccc2cc[nH+]c(NCC3CC[NH+](CC4CCC4)CC3)c2c1 ZINC001161233241 1048115361 /nfs/dbraw/zinc/11/53/61/1048115361.db2.gz LEBRLLROGVDKAM-UHFFFAOYSA-N 2 1 323.484 4.467 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1F ZINC000480611140 1048190938 /nfs/dbraw/zinc/19/09/38/1048190938.db2.gz KEPAVDHLWMVUGO-GJZGRUSLSA-N 2 1 310.432 4.128 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000480606099 1048193956 /nfs/dbraw/zinc/19/39/56/1048193956.db2.gz DKRMPTUXWQOJJD-UYAOXDASSA-N 2 1 317.521 4.413 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(F)c1 ZINC000480607464 1048195084 /nfs/dbraw/zinc/19/50/84/1048195084.db2.gz GDWSGMYXYKBFLI-HOTGVXAUSA-N 2 1 322.468 4.140 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000480606265 1048195169 /nfs/dbraw/zinc/19/51/69/1048195169.db2.gz CEZJVMGPAZKMMQ-NQIIRXRSSA-N 2 1 314.517 4.252 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)c2ccccc12 ZINC000480633697 1048201826 /nfs/dbraw/zinc/20/18/26/1048201826.db2.gz YNTSJNIQDNVAMG-BEVDRBHNSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)c2ccccc12 ZINC000480633697 1048201840 /nfs/dbraw/zinc/20/18/40/1048201840.db2.gz YNTSJNIQDNVAMG-BEVDRBHNSA-N 2 1 324.468 4.126 20 0 DIADMP Cc1c2[nH+]c[nH]c2ccc1N(CC[NH3+])c1cccc2ccccc21 ZINC001162005486 1048211198 /nfs/dbraw/zinc/21/11/98/1048211198.db2.gz OWHOBYXZNJOSDL-UHFFFAOYSA-N 2 1 316.408 4.121 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccsc1Cl ZINC000480663420 1048214154 /nfs/dbraw/zinc/21/41/54/1048214154.db2.gz NQDFYIQOQSJJLU-CYBMUJFWSA-N 2 1 300.899 4.146 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000480693318 1048217328 /nfs/dbraw/zinc/21/73/28/1048217328.db2.gz BIWBNICZGSMLHA-QLFBSQMISA-N 2 1 320.443 4.350 20 0 DIADMP [NH3+][C@H]1CC[C@H](N(CC2CCCC2)c2cc(C3CC3)cc[nH+]2)CC1 ZINC001162187430 1048239661 /nfs/dbraw/zinc/23/96/61/1048239661.db2.gz QZLOSRQTXLFCIJ-WGSAOQKQSA-N 2 1 313.489 4.226 20 0 DIADMP Cc1[nH+]ccn1Cc1ccc(Nc2cccc(C[NH+](C)C)c2)cc1 ZINC001201396866 1048247769 /nfs/dbraw/zinc/24/77/69/1048247769.db2.gz DTCFDEBHVYSHSI-UHFFFAOYSA-N 2 1 320.440 4.045 20 0 DIADMP CC[C@@H](C[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1)[NH+]1CCCC1 ZINC000480803278 1048249682 /nfs/dbraw/zinc/24/96/82/1048249682.db2.gz IOLQWGKNVWMHCY-UWJYYQICSA-N 2 1 323.484 4.274 20 0 DIADMP C[NH+]1CCC([N@@H+](Cc2ccc(F)cc2)CC2CCCCC2)CC1 ZINC001201401483 1048250391 /nfs/dbraw/zinc/25/03/91/1048250391.db2.gz JPTWRAYXWHBAPF-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[NH+]1CCC([N@H+](Cc2ccc(F)cc2)CC2CCCCC2)CC1 ZINC001201401483 1048250398 /nfs/dbraw/zinc/25/03/98/1048250398.db2.gz JPTWRAYXWHBAPF-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](C[C@H]3CC=CCC3)C[C@@H]21 ZINC001201416887 1048260978 /nfs/dbraw/zinc/26/09/78/1048260978.db2.gz QETGBJNSCFBFOU-MQGJPIDWSA-N 2 1 324.512 4.453 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](C[C@H]3CC=CCC3)C[C@@H]21 ZINC001201416887 1048260987 /nfs/dbraw/zinc/26/09/87/1048260987.db2.gz QETGBJNSCFBFOU-MQGJPIDWSA-N 2 1 324.512 4.453 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+](C[C@H]3CC=CCC3)C[C@@H]21 ZINC001201416887 1048261002 /nfs/dbraw/zinc/26/10/02/1048261002.db2.gz QETGBJNSCFBFOU-MQGJPIDWSA-N 2 1 324.512 4.453 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](C[C@@H]3CC=CCC3)C[C@@H]21 ZINC001201416880 1048261236 /nfs/dbraw/zinc/26/12/36/1048261236.db2.gz QETGBJNSCFBFOU-MNAPGUCWSA-N 2 1 324.512 4.453 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](C[C@@H]3CC=CCC3)C[C@@H]21 ZINC001201416880 1048261243 /nfs/dbraw/zinc/26/12/43/1048261243.db2.gz QETGBJNSCFBFOU-MNAPGUCWSA-N 2 1 324.512 4.453 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+](C[C@@H]3CC=CCC3)C[C@@H]21 ZINC001201416880 1048261254 /nfs/dbraw/zinc/26/12/54/1048261254.db2.gz QETGBJNSCFBFOU-MNAPGUCWSA-N 2 1 324.512 4.453 20 0 DIADMP CC(C)(C)C[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201434246 1048273736 /nfs/dbraw/zinc/27/37/36/1048273736.db2.gz IBQSQFABFHIWGO-UHFFFAOYSA-N 2 1 306.519 4.082 20 0 DIADMP CC(C)=CCC[C@H](C)C[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001201486659 1048278010 /nfs/dbraw/zinc/27/80/10/1048278010.db2.gz LTQOLGZBESEITP-KRWDZBQOSA-N 2 1 315.505 4.311 20 0 DIADMP Cc1cn2cc(Nc3ccc(C[NH+]4CCCCC4)cc3)ccc2[nH+]1 ZINC001175362097 1048278535 /nfs/dbraw/zinc/27/85/35/1048278535.db2.gz DVSALIQJPIDFCQ-UHFFFAOYSA-N 2 1 320.440 4.372 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+][C@H]2CCC[C@@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC001201491423 1048282692 /nfs/dbraw/zinc/28/26/92/1048282692.db2.gz JTDRPIYFFCVWMD-JYRKZWEQSA-N 2 1 314.517 4.455 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC000481028230 1048294361 /nfs/dbraw/zinc/29/43/61/1048294361.db2.gz YEAYJPYQMLLNSD-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OCC(C)C)cc2)C1 ZINC000481029412 1048295048 /nfs/dbraw/zinc/29/50/48/1048295048.db2.gz YHEGRWSXJQKDGV-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026050 1048295877 /nfs/dbraw/zinc/29/58/77/1048295877.db2.gz RKJLQFNFZSXBHE-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026050 1048295890 /nfs/dbraw/zinc/29/58/90/1048295890.db2.gz RKJLQFNFZSXBHE-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1 ZINC001201559501 1048318459 /nfs/dbraw/zinc/31/84/59/1048318459.db2.gz ZCSISKNWKXPTBZ-OALUTQOASA-N 2 1 302.506 4.138 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC[N@H+]1C ZINC000481178445 1048320721 /nfs/dbraw/zinc/32/07/21/1048320721.db2.gz GJRYOGBMOUEISM-QFBILLFUSA-N 2 1 318.480 4.100 20 0 DIADMP CC(C)CC[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001201627372 1048338090 /nfs/dbraw/zinc/33/80/90/1048338090.db2.gz YDYLMPOGEOJVQC-UHFFFAOYSA-N 2 1 314.517 4.411 20 0 DIADMP CCCCCC[NH+]1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001201755889 1048366819 /nfs/dbraw/zinc/36/68/19/1048366819.db2.gz BCZQVRCYKRDXKZ-UHFFFAOYSA-N 2 1 306.469 4.302 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2)C1 ZINC000481324278 1048367488 /nfs/dbraw/zinc/36/74/88/1048367488.db2.gz YATOKPFQGBZMBE-RBBKRZOGSA-N 2 1 322.496 4.292 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000481332092 1048370536 /nfs/dbraw/zinc/37/05/36/1048370536.db2.gz JBTBELBHNPAGDJ-OAHLLOKOSA-N 2 1 318.530 4.324 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OCCC(C)C)cc2)C1 ZINC000481337692 1048371161 /nfs/dbraw/zinc/37/11/61/1048371161.db2.gz NLRPILRSEOIJRW-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1c(Cl)cccc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC001201857962 1048380948 /nfs/dbraw/zinc/38/09/48/1048380948.db2.gz VWRDFABEHCRWSE-UHFFFAOYSA-N 2 1 320.908 4.393 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2-c2cccc(C3=[NH+]CCC3)c2)c1 ZINC001162913541 1048386261 /nfs/dbraw/zinc/38/62/61/1048386261.db2.gz HRNGEKYCTLLCBY-AWEZNQCLSA-N 2 1 303.409 4.233 20 0 DIADMP Cc1ccc2c(c1)[C@@H](Nc1c(C)cc[nH+]c1C)CC21CC[NH2+]CC1 ZINC001163033306 1048406157 /nfs/dbraw/zinc/40/61/57/1048406157.db2.gz CIUHTBKBYNOREY-IBGZPJMESA-N 2 1 321.468 4.185 20 0 DIADMP C[C@@H](CC[NH2+]Cc1csc(C(F)(F)F)c1)[NH+]1CCCCC1 ZINC001201963151 1048412754 /nfs/dbraw/zinc/41/27/54/1048412754.db2.gz NMBAAAVLUFAVME-LBPRGKRZSA-N 2 1 320.424 4.121 20 0 DIADMP Cc1cc[nH+]c2cc(N[C@@H]3CC[NH2+][C@H]3c3ccccc3)ccc12 ZINC001163214940 1048437878 /nfs/dbraw/zinc/43/78/78/1048437878.db2.gz AOEMRQQLGMYCFR-QUCCMNQESA-N 2 1 303.409 4.058 20 0 DIADMP CC(C)(C)CC[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001202086494 1048446896 /nfs/dbraw/zinc/44/68/96/1048446896.db2.gz BETUARRLGYDGIU-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001202086494 1048446899 /nfs/dbraw/zinc/44/68/99/1048446899.db2.gz BETUARRLGYDGIU-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)(C)CC[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001202086494 1048446904 /nfs/dbraw/zinc/44/69/04/1048446904.db2.gz BETUARRLGYDGIU-FQEVSTJZSA-N 2 1 300.490 4.021 20 0 DIADMP C[N@@H+](CCC(C)(C)C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001202096211 1048449025 /nfs/dbraw/zinc/44/90/25/1048449025.db2.gz KNWWXQDGZCZLLO-UHFFFAOYSA-N 2 1 302.506 4.267 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001202114987 1048453523 /nfs/dbraw/zinc/45/35/23/1048453523.db2.gz LCZKDSWICMNGQJ-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](CCC(C)(C)C)CC1 ZINC001202114987 1048453526 /nfs/dbraw/zinc/45/35/26/1048453526.db2.gz LCZKDSWICMNGQJ-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[NH+]1CCC(c2ccc(Cl)cc2)CC1 ZINC000481813091 1048494140 /nfs/dbraw/zinc/49/41/40/1048494140.db2.gz GXYNAHDWOHOLCJ-UHFFFAOYSA-N 2 1 317.864 4.115 20 0 DIADMP Cc1cc2[nH]c(C[N@@H+](C)C3CC[NH+](C(C)C)CC3)cc2c(C)c1 ZINC000481917942 1048528219 /nfs/dbraw/zinc/52/82/19/1048528219.db2.gz PNQDYXPMJAFNMT-UHFFFAOYSA-N 2 1 313.489 4.089 20 0 DIADMP Cc1cc2[nH]c(C[N@H+](C)C3CC[NH+](C(C)C)CC3)cc2c(C)c1 ZINC000481917942 1048528235 /nfs/dbraw/zinc/52/82/35/1048528235.db2.gz PNQDYXPMJAFNMT-UHFFFAOYSA-N 2 1 313.489 4.089 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2ccccc21 ZINC000481989030 1048540767 /nfs/dbraw/zinc/54/07/67/1048540767.db2.gz DWQVPFMGIVHRNO-UHYCVJNDSA-N 2 1 312.501 4.406 20 0 DIADMP C[N@@H+](CCCC(F)(F)F)C1CC[NH+](C2CCCCC2)CC1 ZINC001202445308 1048554888 /nfs/dbraw/zinc/55/48/88/1048554888.db2.gz WFANKRIEQAMGPI-UHFFFAOYSA-N 2 1 306.416 4.058 20 0 DIADMP CC[C@@H]1CCC[C@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001202456739 1048556302 /nfs/dbraw/zinc/55/63/02/1048556302.db2.gz LZHNXHRLAGEEHY-MOPGFXCFSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](CCc1ccc(Cl)cc1)C(C)C ZINC000482136874 1048561572 /nfs/dbraw/zinc/56/15/72/1048561572.db2.gz QHSSGRCDCPUIJR-GOSISDBHSA-N 2 1 319.880 4.092 20 0 DIADMP Cc1cc(C(F)(F)F)cc(NCc2cccc(C[NH+](C)C)c2)[nH+]1 ZINC001163987802 1048565397 /nfs/dbraw/zinc/56/53/97/1048565397.db2.gz CASFJTIMKPGHME-UHFFFAOYSA-N 2 1 323.362 4.083 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(F)c(Cl)c2)C1 ZINC000482321591 1048587565 /nfs/dbraw/zinc/58/75/65/1048587565.db2.gz PSRCKKQKJQNGGJ-ZIAGYGMSSA-N 2 1 312.860 4.250 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482438079 1048609030 /nfs/dbraw/zinc/60/90/30/1048609030.db2.gz LESARQUQTXOFHI-TZIWHRDSSA-N 2 1 322.496 4.210 20 0 DIADMP Cc1ccc(C)c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)[nH+]1 ZINC001164486710 1048633701 /nfs/dbraw/zinc/63/37/01/1048633701.db2.gz QGRUDFQZQBYSLF-XUVXKRRUSA-N 2 1 321.468 4.021 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC000850381621 1048644143 /nfs/dbraw/zinc/64/41/43/1048644143.db2.gz HUXKJJCVSZVIBI-ILXRZTDVSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC000850381621 1048644153 /nfs/dbraw/zinc/64/41/53/1048644153.db2.gz HUXKJJCVSZVIBI-ILXRZTDVSA-N 2 1 318.427 4.104 20 0 DIADMP Cc1ccc2c(C)cc(N3CCCCC34CC[NH2+]CC4)[nH+]c2c1C ZINC001165340017 1048685249 /nfs/dbraw/zinc/68/52/49/1048685249.db2.gz JBFILAXEVWGKAI-UHFFFAOYSA-N 2 1 323.484 4.273 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000482862482 1048691671 /nfs/dbraw/zinc/69/16/71/1048691671.db2.gz DVMIANAHCMIFMV-FUHWJXTLSA-N 2 1 318.530 4.021 20 0 DIADMP CCc1cccc2cc(CN(C)C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)oc21 ZINC000668146997 1048694087 /nfs/dbraw/zinc/69/40/87/1048694087.db2.gz WQHZJDIDIFNQJX-JWTNVVGKSA-N 2 1 312.457 4.052 20 0 DIADMP CCc1cccc2cc(C[N@H+](C)C3C[C@H]4CC[C@@H](C3)[NH+]4C)oc21 ZINC000668146997 1048694089 /nfs/dbraw/zinc/69/40/89/1048694089.db2.gz WQHZJDIDIFNQJX-JWTNVVGKSA-N 2 1 312.457 4.052 20 0 DIADMP CCc1cccc2cc(C[N@@H+](C)C3C[C@H]4CC[C@@H](C3)[NH+]4C)oc21 ZINC000668146997 1048694095 /nfs/dbraw/zinc/69/40/95/1048694095.db2.gz WQHZJDIDIFNQJX-JWTNVVGKSA-N 2 1 312.457 4.052 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H]2CCc3c2cccc3F)CC1 ZINC001190405899 1048730330 /nfs/dbraw/zinc/73/03/30/1048730330.db2.gz CRERZSKUEZWHST-HXUWFJFHSA-N 2 1 318.480 4.257 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](Cc1ccc2ccccc2c1)C1CC1 ZINC001190510800 1048746410 /nfs/dbraw/zinc/74/64/10/1048746410.db2.gz QAWTVSXOCDYEER-HXUWFJFHSA-N 2 1 308.469 4.289 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001190510800 1048746419 /nfs/dbraw/zinc/74/64/19/1048746419.db2.gz QAWTVSXOCDYEER-HXUWFJFHSA-N 2 1 308.469 4.289 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001190510800 1048746424 /nfs/dbraw/zinc/74/64/24/1048746424.db2.gz QAWTVSXOCDYEER-HXUWFJFHSA-N 2 1 308.469 4.289 20 0 DIADMP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1cc(F)c(F)c(F)c1 ZINC000483205034 1048754011 /nfs/dbraw/zinc/75/40/11/1048754011.db2.gz UDYRKXMIDFUSEF-IAQYHMDHSA-N 2 1 316.411 4.121 20 0 DIADMP CC[C@@H](CC(F)F)C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001190650761 1048773831 /nfs/dbraw/zinc/77/38/31/1048773831.db2.gz GDILJWNMMKHYHF-IRXDYDNUSA-N 2 1 316.480 4.112 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](CCCc3cccc4ccccc43)CC[C@H]21 ZINC000483494399 1048808037 /nfs/dbraw/zinc/80/80/37/1048808037.db2.gz USAFJNDUOPKTFG-RBBKRZOGSA-N 2 1 322.496 4.189 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](CCCc3cccc4ccccc43)CC[C@H]21 ZINC000483494399 1048808048 /nfs/dbraw/zinc/80/80/48/1048808048.db2.gz USAFJNDUOPKTFG-RBBKRZOGSA-N 2 1 322.496 4.189 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000483507746 1048809540 /nfs/dbraw/zinc/80/95/40/1048809540.db2.gz ZOSSBJWFARRRGC-KBAYOESNSA-N 2 1 306.881 4.207 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483507746 1048809552 /nfs/dbraw/zinc/80/95/52/1048809552.db2.gz ZOSSBJWFARRRGC-KBAYOESNSA-N 2 1 306.881 4.207 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1ccc2occc2c1)Cc1ccccc1 ZINC001177136598 1048837602 /nfs/dbraw/zinc/83/76/02/1048837602.db2.gz SDHOKFAYPXYUPL-UHFFFAOYSA-N 2 1 308.425 4.045 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206295170 1048839718 /nfs/dbraw/zinc/83/97/18/1048839718.db2.gz LTHJLLKQMITLBY-HKUYNNGSSA-N 2 1 312.542 4.059 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206295261 1048842382 /nfs/dbraw/zinc/84/23/82/1048842382.db2.gz LTHJLLKQMITLBY-PKOBYXMFSA-N 2 1 312.542 4.059 20 0 DIADMP CC[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181183 1048842919 /nfs/dbraw/zinc/84/29/19/1048842919.db2.gz PHIGAHXVNVJEHT-IEBWSBKVSA-N 2 1 300.490 4.177 20 0 DIADMP CC[C@H](C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181183 1048842933 /nfs/dbraw/zinc/84/29/33/1048842933.db2.gz PHIGAHXVNVJEHT-IEBWSBKVSA-N 2 1 300.490 4.177 20 0 DIADMP CCC(CC)[C@H](C[NH2+]CC1C2CC3CC(C2)CC1C3)[NH+](C)C ZINC001177209978 1048844363 /nfs/dbraw/zinc/84/43/63/1048844363.db2.gz VHJUGOZVBNFZMR-VMALJAOGSA-N 2 1 306.538 4.015 20 0 DIADMP CC[NH+](CC)[C@@H](C[NH2+][C@H]1CCCc2ccccc2C1)CC(C)C ZINC001177210213 1048847154 /nfs/dbraw/zinc/84/71/54/1048847154.db2.gz ZWBQIFSJZFVURC-LEWJYISDSA-N 2 1 316.533 4.280 20 0 DIADMP C[NH+](C)[C@H](C[NH2+]C1CCC(C2CCC2)CC1)C1CCCCC1 ZINC001177294071 1048858596 /nfs/dbraw/zinc/85/85/96/1048858596.db2.gz DKIFNPUCHTVBGN-LYBXBRPPSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cccc3ccoc32)C1 ZINC001177298890 1048861091 /nfs/dbraw/zinc/86/10/91/1048861091.db2.gz HPRCGVYSGSMWIC-INIZCTEOSA-N 2 1 300.446 4.035 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H](C)[N@@H+]1CCCC[C@H]1C ZINC001177278363 1048865369 /nfs/dbraw/zinc/86/53/69/1048865369.db2.gz WSZSKBBKKISGQU-GUDVDZBRSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC001177278363 1048865383 /nfs/dbraw/zinc/86/53/83/1048865383.db2.gz WSZSKBBKKISGQU-GUDVDZBRSA-N 2 1 302.506 4.108 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]Cc2c(C)cccc2C)CC1 ZINC001177314926 1048870191 /nfs/dbraw/zinc/87/01/91/1048870191.db2.gz BFQSMYAOGZDMTH-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1F ZINC001177453599 1048885892 /nfs/dbraw/zinc/88/58/92/1048885892.db2.gz CBYRQYKLCCNNLO-JKIFEVAISA-N 2 1 315.436 4.234 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2CC[C@@H]2CCC[NH+]2C)cc1 ZINC001191180954 1048889322 /nfs/dbraw/zinc/88/93/22/1048889322.db2.gz BRTUERIMGSBRBY-HOJAQTOUSA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[NH+]2CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC001191180954 1048889342 /nfs/dbraw/zinc/88/93/42/1048889342.db2.gz BRTUERIMGSBRBY-HOJAQTOUSA-N 2 1 300.490 4.252 20 0 DIADMP Cc1ccc([C@@H]2[C@H](C)CCC[NH+]2CC[C@@H]2CCC[N@H+]2C)cc1 ZINC001191180954 1048889364 /nfs/dbraw/zinc/88/93/64/1048889364.db2.gz BRTUERIMGSBRBY-HOJAQTOUSA-N 2 1 300.490 4.252 20 0 DIADMP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1 ZINC001177565532 1048915815 /nfs/dbraw/zinc/91/58/15/1048915815.db2.gz DRJPFXXXIIGVDA-HNNXBMFYSA-N 2 1 316.876 4.437 20 0 DIADMP CC(C)[NH+]1CCC([NH2+]C2c3ccccc3-c3ccccc32)CC1 ZINC000194795899 1048921275 /nfs/dbraw/zinc/92/12/75/1048921275.db2.gz VASHSFUVERIWGE-UHFFFAOYSA-N 2 1 306.453 4.219 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000484316252 1048925063 /nfs/dbraw/zinc/92/50/63/1048925063.db2.gz YHDSIACOSSORFB-LNLFQRSKSA-N 2 1 320.525 4.015 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001191381949 1048930107 /nfs/dbraw/zinc/93/01/07/1048930107.db2.gz NOHNIUHBIAQSOT-QNDFHXLGSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001191381949 1048930122 /nfs/dbraw/zinc/93/01/22/1048930122.db2.gz NOHNIUHBIAQSOT-QNDFHXLGSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001191381949 1048930135 /nfs/dbraw/zinc/93/01/35/1048930135.db2.gz NOHNIUHBIAQSOT-QNDFHXLGSA-N 2 1 312.501 4.017 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)C[C@@H]2C[C@H]3C[C@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001191381949 1048930148 /nfs/dbraw/zinc/93/01/48/1048930148.db2.gz NOHNIUHBIAQSOT-QNDFHXLGSA-N 2 1 312.501 4.017 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccc(O)c1 ZINC000194849464 1048933678 /nfs/dbraw/zinc/93/36/78/1048933678.db2.gz AGAYDQMTUKYVSJ-MRXNPFEDSA-N 2 1 312.457 4.083 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743798 1048939088 /nfs/dbraw/zinc/93/90/88/1048939088.db2.gz OFNWUMCBYMGACR-RBUKOAKNSA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743798 1048939099 /nfs/dbraw/zinc/93/90/99/1048939099.db2.gz OFNWUMCBYMGACR-RBUKOAKNSA-N 2 1 300.490 4.352 20 0 DIADMP CC(C)CC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191522071 1048956827 /nfs/dbraw/zinc/95/68/27/1048956827.db2.gz ZUOMUALVNQSYEQ-UXHICEINSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191522071 1048956844 /nfs/dbraw/zinc/95/68/44/1048956844.db2.gz ZUOMUALVNQSYEQ-UXHICEINSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)CC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191522071 1048956860 /nfs/dbraw/zinc/95/68/60/1048956860.db2.gz ZUOMUALVNQSYEQ-UXHICEINSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1)C(C)(C)C ZINC001203698366 1048968802 /nfs/dbraw/zinc/96/88/02/1048968802.db2.gz IOHKZJIQQZYDPS-QGZVFWFLSA-N 2 1 304.522 4.416 20 0 DIADMP C[C@@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1)C(C)(C)C ZINC001203698365 1048969467 /nfs/dbraw/zinc/96/94/67/1048969467.db2.gz IOHKZJIQQZYDPS-KRWDZBQOSA-N 2 1 304.522 4.416 20 0 DIADMP CCC1(CC)CCC([NH2+]C2CC[NH+](CCOC(C)C)CC2)CC1 ZINC001177972799 1048976605 /nfs/dbraw/zinc/97/66/05/1048976605.db2.gz XWRFHRVFQRKLEA-UHFFFAOYSA-N 2 1 324.553 4.214 20 0 DIADMP Cc1ccc(C[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c(C)c1 ZINC001203729339 1048984147 /nfs/dbraw/zinc/98/41/47/1048984147.db2.gz LCJYLJUWVDUXBW-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c(C)c1 ZINC001203729339 1048984158 /nfs/dbraw/zinc/98/41/58/1048984158.db2.gz LCJYLJUWVDUXBW-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3cccc4cccc2c43)CC1(C)C ZINC001203750794 1048988812 /nfs/dbraw/zinc/98/88/12/1048988812.db2.gz PIJPXSONVBXMEJ-HKUYNNGSSA-N 2 1 308.469 4.290 20 0 DIADMP Cc1cc([C@@H]([NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)C2CC2)ccc1F ZINC001178218716 1049005522 /nfs/dbraw/zinc/00/55/22/1049005522.db2.gz XLLZCQBYNMYGNU-AEFFLSMTSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)c1Cl ZINC001206324429 1049009102 /nfs/dbraw/zinc/00/91/02/1049009102.db2.gz BFLAUOMPLLEVNL-MRXNPFEDSA-N 2 1 315.288 4.253 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000195133447 1049070315 /nfs/dbraw/zinc/07/03/15/1049070315.db2.gz CYCGYWGHUMUOAG-ZWKOTPCHSA-N 2 1 314.498 4.311 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@@H]1CC[C@H](C)SC1)c1ccccc1 ZINC001204063341 1049076419 /nfs/dbraw/zinc/07/64/19/1049076419.db2.gz DKTPNPPSCQUJNM-UHOSZYNNSA-N 2 1 320.546 4.333 20 0 DIADMP Cc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001192326982 1049077621 /nfs/dbraw/zinc/07/76/21/1049077621.db2.gz YRBSMVXUFLAAJZ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001192326982 1049077634 /nfs/dbraw/zinc/07/76/34/1049077634.db2.gz YRBSMVXUFLAAJZ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001192326982 1049077644 /nfs/dbraw/zinc/07/76/44/1049077644.db2.gz YRBSMVXUFLAAJZ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001192326982 1049077656 /nfs/dbraw/zinc/07/76/56/1049077656.db2.gz YRBSMVXUFLAAJZ-QFBILLFUSA-N 2 1 318.892 4.097 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001178916699 1049109863 /nfs/dbraw/zinc/10/98/63/1049109863.db2.gz NAJCMPWJOOXPSW-OKACTXMXSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2(C3CCC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001178921596 1049110244 /nfs/dbraw/zinc/11/02/44/1049110244.db2.gz ADSCJNCCWJTMIL-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2(C3CCC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001178921596 1049110249 /nfs/dbraw/zinc/11/02/49/1049110249.db2.gz ADSCJNCCWJTMIL-PXNSSMCTSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2(C3CCC3)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001178921595 1049110274 /nfs/dbraw/zinc/11/02/74/1049110274.db2.gz ADSCJNCCWJTMIL-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2(C3CCC3)CCC2)CC[N@H+]1Cc1ccccc1 ZINC001178921595 1049110280 /nfs/dbraw/zinc/11/02/80/1049110280.db2.gz ADSCJNCCWJTMIL-FXAWDEMLSA-N 2 1 312.501 4.352 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCSC(C)C)CC1)CC(C)C ZINC001192491079 1049110815 /nfs/dbraw/zinc/11/08/15/1049110815.db2.gz ZTMYZJCPZACOAM-UHFFFAOYSA-N 2 1 314.583 4.208 20 0 DIADMP CCCCCOc1ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1 ZINC001179160092 1049138300 /nfs/dbraw/zinc/13/83/00/1049138300.db2.gz TYBRGRNAFBXXGD-IBGZPJMESA-N 2 1 318.505 4.077 20 0 DIADMP c1ccc2nc(C[N@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2c1 ZINC001204503632 1049176669 /nfs/dbraw/zinc/17/66/69/1049176669.db2.gz FWXSAZXPOFGQOP-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc2nc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)ccc2c1 ZINC001204503632 1049176675 /nfs/dbraw/zinc/17/66/75/1049176675.db2.gz FWXSAZXPOFGQOP-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc2ccccc2n1 ZINC001204505554 1049176998 /nfs/dbraw/zinc/17/69/98/1049176998.db2.gz LPCBYJWOFPSORB-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc2ccccc2n1 ZINC001204505554 1049177001 /nfs/dbraw/zinc/17/70/01/1049177001.db2.gz LPCBYJWOFPSORB-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc2ccccc2n1 ZINC001204505554 1049177008 /nfs/dbraw/zinc/17/70/08/1049177008.db2.gz LPCBYJWOFPSORB-VQTJNVASSA-N 2 1 323.484 4.074 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001204552667 1049187082 /nfs/dbraw/zinc/18/70/82/1049187082.db2.gz PLDZCKXTPQIPMQ-GWQNQTGSSA-N 2 1 314.517 4.289 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001204552667 1049187092 /nfs/dbraw/zinc/18/70/92/1049187092.db2.gz PLDZCKXTPQIPMQ-GWQNQTGSSA-N 2 1 314.517 4.289 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@@H]3CC[C@@H]4C[N@H+](C)C[C@@H]34)c2)cc1 ZINC001179815319 1049211461 /nfs/dbraw/zinc/21/14/61/1049211461.db2.gz FXQWNFBTOPEUNU-YPAWHYETSA-N 2 1 320.480 4.092 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2NCC)CC1 ZINC001204652106 1049211859 /nfs/dbraw/zinc/21/18/59/1049211859.db2.gz URKYFFLFBZYZJV-UHFFFAOYSA-N 2 1 317.521 4.062 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001204657161 1049214764 /nfs/dbraw/zinc/21/47/64/1049214764.db2.gz AJCCSYXWUGFOLE-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H]1CCCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001193517166 1049222217 /nfs/dbraw/zinc/22/22/17/1049222217.db2.gz OQGUNUQNOCNCCV-GOSISDBHSA-N 2 1 300.490 4.295 20 0 DIADMP C[C@H](c1nccc2ccccc21)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001179877730 1049226373 /nfs/dbraw/zinc/22/63/73/1049226373.db2.gz IKZUNAYEUXISBC-MSOLQXFVSA-N 2 1 323.484 4.104 20 0 DIADMP CC1(C)CCC[C@H](C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)C1 ZINC001179926505 1049231574 /nfs/dbraw/zinc/23/15/74/1049231574.db2.gz YPCYSZYTQHXLRY-JENIJYKNSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001179926505 1049231586 /nfs/dbraw/zinc/23/15/86/1049231586.db2.gz YPCYSZYTQHXLRY-JENIJYKNSA-N 2 1 304.522 4.152 20 0 DIADMP CC1(C)CCC[C@H](C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001179926505 1049231598 /nfs/dbraw/zinc/23/15/98/1049231598.db2.gz YPCYSZYTQHXLRY-JENIJYKNSA-N 2 1 304.522 4.152 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC001179904457 1049238171 /nfs/dbraw/zinc/23/81/71/1049238171.db2.gz BZUSWHZRJQYOSU-RLLQIKCJSA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)C[C@@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC001179904457 1049238182 /nfs/dbraw/zinc/23/81/82/1049238182.db2.gz BZUSWHZRJQYOSU-RLLQIKCJSA-N 2 1 302.506 4.088 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)C[C@@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC001179904457 1049238194 /nfs/dbraw/zinc/23/81/94/1049238194.db2.gz BZUSWHZRJQYOSU-RLLQIKCJSA-N 2 1 302.506 4.088 20 0 DIADMP Cc1cccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000195615399 1049240580 /nfs/dbraw/zinc/24/05/80/1049240580.db2.gz LBVHOMKVJBGDCR-SFHVURJKSA-N 2 1 308.469 4.310 20 0 DIADMP CC(C)(C)C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1 ZINC000195616659 1049240995 /nfs/dbraw/zinc/24/09/95/1049240995.db2.gz UVPBWJAKPPGGIM-IBGZPJMESA-N 2 1 300.490 4.380 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204735405 1049247257 /nfs/dbraw/zinc/24/72/57/1049247257.db2.gz SYTNKGRSVXRWGN-UHFFFAOYSA-N 2 1 308.469 4.114 20 0 DIADMP CC[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)CC1CCC1 ZINC001193762000 1049259687 /nfs/dbraw/zinc/25/96/87/1049259687.db2.gz KHCSPLTYOAFQPX-UHFFFAOYSA-N 2 1 300.490 4.295 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2CCCC[C@H]2C)CC1 ZINC001193872533 1049277348 /nfs/dbraw/zinc/27/73/48/1049277348.db2.gz OJCJITOJDANZDI-WBVHZDCISA-N 2 1 302.462 4.060 20 0 DIADMP C[C@H]1CCC[N@H+]1Cc1ccc(-c2cncc([C@@H]3CCC[NH2+]3)c2)cc1 ZINC000906157139 1049292362 /nfs/dbraw/zinc/29/23/62/1049292362.db2.gz CFUQMDONCSVHET-KKSFZXQISA-N 2 1 321.468 4.157 20 0 DIADMP C[C@H]1CCC[N@H+]1Cc1cccc(-c2cncc([C@@H]3CCC[NH2+]3)c2)c1 ZINC000906157585 1049292690 /nfs/dbraw/zinc/29/26/90/1049292690.db2.gz DOAFLNHTWIFXJE-KKSFZXQISA-N 2 1 321.468 4.157 20 0 DIADMP C[C@H]1CCC[N@H+]1Cc1cccc(-c2cncc([C@H]3CCC[NH2+]3)c2)c1 ZINC000906157199 1049292859 /nfs/dbraw/zinc/29/28/59/1049292859.db2.gz DOAFLNHTWIFXJE-HRAATJIYSA-N 2 1 321.468 4.157 20 0 DIADMP C[C@@H]1CCC[N@H+]1Cc1ccc(-c2cncc([C@@H]3CCC[NH2+]3)c2)cc1 ZINC000906157136 1049293711 /nfs/dbraw/zinc/29/37/11/1049293711.db2.gz CFUQMDONCSVHET-IERDGZPVSA-N 2 1 321.468 4.157 20 0 DIADMP C[C@H]1CCC[N@H+]1Cc1ccc(-c2cncc([C@H]3CCC[NH2+]3)c2)cc1 ZINC000906157134 1049293756 /nfs/dbraw/zinc/29/37/56/1049293756.db2.gz CFUQMDONCSVHET-HRAATJIYSA-N 2 1 321.468 4.157 20 0 DIADMP CC[C@H](C)[C@H](C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1)OC ZINC001180225662 1049309570 /nfs/dbraw/zinc/30/95/70/1049309570.db2.gz VNKUMVOOPTWAMG-NSHGMRRFSA-N 2 1 324.553 4.024 20 0 DIADMP Cc1scc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1C ZINC001180208351 1049309689 /nfs/dbraw/zinc/30/96/89/1049309689.db2.gz JSRLLURXKNRGIL-SFHVURJKSA-N 2 1 320.546 4.453 20 0 DIADMP Cc1scc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1C ZINC001180208351 1049309703 /nfs/dbraw/zinc/30/97/03/1049309703.db2.gz JSRLLURXKNRGIL-SFHVURJKSA-N 2 1 320.546 4.453 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001204931885 1049315008 /nfs/dbraw/zinc/31/50/08/1049315008.db2.gz GCFOCLBIUUEDLE-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001204931885 1049315021 /nfs/dbraw/zinc/31/50/21/1049315021.db2.gz GCFOCLBIUUEDLE-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@@]1([NH3+])CCC[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204940213 1049317399 /nfs/dbraw/zinc/31/73/99/1049317399.db2.gz WJRDRZOBQWLIQS-LJQANCHMSA-N 2 1 310.466 4.368 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001204940213 1049317408 /nfs/dbraw/zinc/31/74/08/1049317408.db2.gz WJRDRZOBQWLIQS-LJQANCHMSA-N 2 1 310.466 4.368 20 0 DIADMP CCCC[N@@H+](CC1CC[NH+](CC)CC1)[C@@H](C)c1ccc(C)o1 ZINC001180238844 1049319161 /nfs/dbraw/zinc/31/91/61/1049319161.db2.gz DCOTVYWHGYHEGX-KRWDZBQOSA-N 2 1 306.494 4.483 20 0 DIADMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2c(F)cccc2F)CC1 ZINC000485854983 1049354130 /nfs/dbraw/zinc/35/41/30/1049354130.db2.gz LLVVZMQSHXVXPF-MRXNPFEDSA-N 2 1 322.443 4.019 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2c(F)cccc2F)CC1 ZINC000485854983 1049354143 /nfs/dbraw/zinc/35/41/43/1049354143.db2.gz LLVVZMQSHXVXPF-MRXNPFEDSA-N 2 1 322.443 4.019 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC001205117915 1049384184 /nfs/dbraw/zinc/38/41/84/1049384184.db2.gz YVTQALXSBRJYEV-IBGZPJMESA-N 2 1 314.860 4.320 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC001194640926 1049403004 /nfs/dbraw/zinc/40/30/04/1049403004.db2.gz JZKCWQFHFRATTG-DYESRHJHSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC001194640926 1049403008 /nfs/dbraw/zinc/40/30/08/1049403008.db2.gz JZKCWQFHFRATTG-DYESRHJHSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC001194640926 1049403011 /nfs/dbraw/zinc/40/30/11/1049403011.db2.gz JZKCWQFHFRATTG-DYESRHJHSA-N 2 1 314.517 4.463 20 0 DIADMP CCc1cccc2cc(C[N@H+](C)C3CC[NH+](C(C)C)CC3)oc21 ZINC001205184625 1049403486 /nfs/dbraw/zinc/40/34/86/1049403486.db2.gz FYVBBVHBEBLHCB-UHFFFAOYSA-N 2 1 314.473 4.300 20 0 DIADMP CCc1cccc2cc(C[N@@H+](C)C3CC[NH+](C(C)C)CC3)oc21 ZINC001205184625 1049403492 /nfs/dbraw/zinc/40/34/92/1049403492.db2.gz FYVBBVHBEBLHCB-UHFFFAOYSA-N 2 1 314.473 4.300 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)[C@H](C)c2nccc3ccccc32)CC1 ZINC001205185354 1049405159 /nfs/dbraw/zinc/40/51/59/1049405159.db2.gz MQPDJNNFHYBENP-MRXNPFEDSA-N 2 1 311.473 4.100 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)[C@H](C)c2nccc3ccccc32)CC1 ZINC001205185354 1049405164 /nfs/dbraw/zinc/40/51/64/1049405164.db2.gz MQPDJNNFHYBENP-MRXNPFEDSA-N 2 1 311.473 4.100 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC001194692630 1049412083 /nfs/dbraw/zinc/41/20/83/1049412083.db2.gz QWIXEOVKDJJKQO-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC001194692630 1049412087 /nfs/dbraw/zinc/41/20/87/1049412087.db2.gz QWIXEOVKDJJKQO-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(C4CCCCC4)cc3)C2)C1 ZINC001194692630 1049412093 /nfs/dbraw/zinc/41/20/93/1049412093.db2.gz QWIXEOVKDJJKQO-NRFANRHFSA-N 2 1 312.501 4.262 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@](C)([NH3+])CC2)cc1 ZINC001205257248 1049417867 /nfs/dbraw/zinc/41/78/67/1049417867.db2.gz UUPMEPGBOUKYKH-YLJYHZDGSA-N 2 1 302.506 4.192 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)CC1 ZINC001205266299 1049420993 /nfs/dbraw/zinc/42/09/93/1049420993.db2.gz SRWCZELUWJXQFD-GOSISDBHSA-N 2 1 318.848 4.303 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205266789 1049421091 /nfs/dbraw/zinc/42/10/91/1049421091.db2.gz XWTMGGVYQLBSIK-FQEVSTJZSA-N 2 1 318.505 4.349 20 0 DIADMP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205280488 1049427697 /nfs/dbraw/zinc/42/76/97/1049427697.db2.gz AMEQFFMSCCQCKE-CQSZACIVSA-N 2 1 320.786 4.062 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205280488 1049427698 /nfs/dbraw/zinc/42/76/98/1049427698.db2.gz AMEQFFMSCCQCKE-CQSZACIVSA-N 2 1 320.786 4.062 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@@](C)([NH3+])CC2)cccc1-c1ccccc1 ZINC001205289556 1049429672 /nfs/dbraw/zinc/42/96/72/1049429672.db2.gz YXFYJACUOLLKNU-OAQYLSRUSA-N 2 1 308.469 4.365 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@H+]2CCC[C@](C)([NH3+])CC2)c1 ZINC001205288752 1049429688 /nfs/dbraw/zinc/42/96/88/1049429688.db2.gz ODNITYAFPPWIPR-NRFANRHFSA-N 2 1 324.468 4.066 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC001205296369 1049431010 /nfs/dbraw/zinc/43/10/10/1049431010.db2.gz NQMBNCRCTIZGSW-PKOBYXMFSA-N 2 1 318.505 4.062 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc2[nH]ccc21 ZINC001205297582 1049431644 /nfs/dbraw/zinc/43/16/44/1049431644.db2.gz BNVAKYMQXJFLTI-ZWKOTPCHSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc2[nH]ccc21 ZINC001205297582 1049431646 /nfs/dbraw/zinc/43/16/46/1049431646.db2.gz BNVAKYMQXJFLTI-ZWKOTPCHSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC001205297582 1049431647 /nfs/dbraw/zinc/43/16/47/1049431647.db2.gz BNVAKYMQXJFLTI-ZWKOTPCHSA-N 2 1 311.473 4.007 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C[C@H]1C[NH3+] ZINC001205303650 1049432958 /nfs/dbraw/zinc/43/29/58/1049432958.db2.gz JBTBZNXMEMRIGA-GDBMZVCRSA-N 2 1 308.425 4.003 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCC1(F)F ZINC001194832986 1049437680 /nfs/dbraw/zinc/43/76/80/1049437680.db2.gz FLMMTAGBLSQMJI-MRXNPFEDSA-N 2 1 322.443 4.150 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385391 1049455573 /nfs/dbraw/zinc/45/55/73/1049455573.db2.gz DTZUMTHPBXQNNX-MANSERQUSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001205385833 1049455899 /nfs/dbraw/zinc/45/58/99/1049455899.db2.gz RRTLIPQRFTWZPZ-JCHJZTRSSA-N 2 1 304.522 4.198 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(C3CC3)c(C3CC3)c2)CC1 ZINC001205409540 1049464146 /nfs/dbraw/zinc/46/41/46/1049464146.db2.gz UHXHTSOJUSNSIF-LJQANCHMSA-N 2 1 312.501 4.358 20 0 DIADMP CC[C@]1(C)CCC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001181349059 1049470785 /nfs/dbraw/zinc/47/07/85/1049470785.db2.gz KGINFQQCHXBCCH-XUVXKRRUSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H](CC1CCCCC1)C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC001181514223 1049486281 /nfs/dbraw/zinc/48/62/81/1049486281.db2.gz BCVBQDPXKSIOTA-PXNSSMCTSA-N 2 1 306.538 4.257 20 0 DIADMP CC[N@@H+](Cc1ccc(SC)o1)Cc1ccc(C[NH+](C)C)cc1 ZINC001181487038 1049488246 /nfs/dbraw/zinc/48/82/46/1049488246.db2.gz PCMFVZVWFFHHHI-UHFFFAOYSA-N 2 1 318.486 4.085 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)cc1 ZINC001205545566 1049495114 /nfs/dbraw/zinc/49/51/14/1049495114.db2.gz JJBBMOUZHBFXSD-PXNSSMCTSA-N 2 1 320.496 4.142 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(Cl)cs1 ZINC000486949624 1049495548 /nfs/dbraw/zinc/49/55/48/1049495548.db2.gz ISAHONUKQWXPBU-ZDUSSCGKSA-N 2 1 300.899 4.146 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccc(-c3cccs3)s2)CC1 ZINC001205558514 1049496760 /nfs/dbraw/zinc/49/67/60/1049496760.db2.gz FULLGYZJUVZRKO-INIZCTEOSA-N 2 1 324.490 4.130 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1sccc1Cl ZINC000486936633 1049496667 /nfs/dbraw/zinc/49/66/67/1049496667.db2.gz GCGSQQJLZINIMR-CYBMUJFWSA-N 2 1 300.899 4.146 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC1 ZINC001205578941 1049503276 /nfs/dbraw/zinc/50/32/76/1049503276.db2.gz KKRSHKACDSAJMO-INIZCTEOSA-N 2 1 324.490 4.130 20 0 DIADMP CC(C)c1cc(C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)ccc1Cl ZINC001205592502 1049504996 /nfs/dbraw/zinc/50/49/96/1049504996.db2.gz VUJMGOJHYABSRA-KRWDZBQOSA-N 2 1 312.860 4.116 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001181707041 1049505441 /nfs/dbraw/zinc/50/54/41/1049505441.db2.gz IHAVTSBJHVCRDJ-NOPDSDTESA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001181707041 1049505444 /nfs/dbraw/zinc/50/54/44/1049505444.db2.gz IHAVTSBJHVCRDJ-NOPDSDTESA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1C ZINC001181707041 1049505446 /nfs/dbraw/zinc/50/54/46/1049505446.db2.gz IHAVTSBJHVCRDJ-NOPDSDTESA-N 2 1 312.501 4.182 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC001181707041 1049505449 /nfs/dbraw/zinc/50/54/49/1049505449.db2.gz IHAVTSBJHVCRDJ-NOPDSDTESA-N 2 1 312.501 4.182 20 0 DIADMP C[C@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)CC[C@H]1C[NH3+] ZINC001205599857 1049506514 /nfs/dbraw/zinc/50/65/14/1049506514.db2.gz AIQTXPYRVQRCCY-RXVVDRJESA-N 2 1 322.496 4.125 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])CC2)cc1 ZINC001205603092 1049509689 /nfs/dbraw/zinc/50/96/89/1049509689.db2.gz NQIMLPKVZPOHQM-PKOBYXMFSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)CC[C@H]1C[NH3+] ZINC001205618257 1049513443 /nfs/dbraw/zinc/51/34/43/1049513443.db2.gz TWOBJJZBVMCVQL-WBVHZDCISA-N 2 1 322.452 4.393 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC[C@H]1C[NH3+] ZINC001205638676 1049517314 /nfs/dbraw/zinc/51/73/14/1049517314.db2.gz QQXKVQFEGGZPDH-KBPBESRZSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CC[C@@H](C)[C@@H](C[NH3+])CC3)c(C)c12 ZINC001205638672 1049517410 /nfs/dbraw/zinc/51/74/10/1049517410.db2.gz QQWIIXOERHTEKW-BXUZGUMPSA-N 2 1 322.543 4.386 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@@H](C[NH3+])[C@@H](C)CC1 ZINC001205638636 1049517567 /nfs/dbraw/zinc/51/75/67/1049517567.db2.gz QKAWWISYWWXAIB-HKUYNNGSSA-N 2 1 322.496 4.469 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC[C@H]1C[NH3+] ZINC001205638677 1049518646 /nfs/dbraw/zinc/51/86/46/1049518646.db2.gz QQXKVQFEGGZPDH-KGLIPLIRSA-N 2 1 320.527 4.283 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CC[C@H]1C[NH3+] ZINC001205638588 1049518775 /nfs/dbraw/zinc/51/87/75/1049518775.db2.gz POQSBFFLDIMOHN-AVRDEDQJSA-N 2 1 322.496 4.084 20 0 DIADMP C[C@H]1CCC[C@@H](C[N@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702944 1049537468 /nfs/dbraw/zinc/53/74/68/1049537468.db2.gz RYBIFXCSSIBDKO-AZUAARDMSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]1CCC[C@@H](C[N@@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702944 1049537480 /nfs/dbraw/zinc/53/74/80/1049537480.db2.gz RYBIFXCSSIBDKO-AZUAARDMSA-N 2 1 314.517 4.409 20 0 DIADMP CCC(CC)(C[NH2+]C[C@H]1CCSC1)[NH2+][C@@H](C)c1ccccc1 ZINC000487288268 1049545472 /nfs/dbraw/zinc/54/54/72/1049545472.db2.gz MOAGYHZHRBEJIB-DLBZAZTESA-N 2 1 320.546 4.239 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001205903872 1049597096 /nfs/dbraw/zinc/59/70/96/1049597096.db2.gz RLVVEMLEKFHZBZ-LSDHHAIUSA-N 2 1 308.425 4.145 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001205903263 1049597300 /nfs/dbraw/zinc/59/73/00/1049597300.db2.gz NURVQIRBOHJRDB-KXBFYZLASA-N 2 1 312.432 4.052 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@H](C[NH3+])[C@@H]2C)cc1 ZINC001205902242 1049598161 /nfs/dbraw/zinc/59/81/61/1049598161.db2.gz JDQGJARCZHTMEK-FUHIMQAGSA-N 2 1 302.506 4.048 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001205904723 1049598364 /nfs/dbraw/zinc/59/83/64/1049598364.db2.gz WSPZEDGHCWAMJZ-IRXDYDNUSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001205912843 1049600003 /nfs/dbraw/zinc/60/00/03/1049600003.db2.gz DBAARMHMWPAIJM-CABCVRRESA-N 2 1 316.470 4.100 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@H](C[NH3+])[C@@H]2C)cccc1-c1ccccc1 ZINC001205912384 1049600323 /nfs/dbraw/zinc/60/03/23/1049600323.db2.gz ABMIMSDXQUPPOW-PKOBYXMFSA-N 2 1 308.469 4.221 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@@H+]3CCCC[C@H]([NH3+])C3)ccc21 ZINC001205933049 1049607222 /nfs/dbraw/zinc/60/72/22/1049607222.db2.gz WQGBJQNRNMOWJT-KRWDZBQOSA-N 2 1 321.468 4.128 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@H+]3CCCC[C@H]([NH3+])C3)ccc21 ZINC001205933049 1049607227 /nfs/dbraw/zinc/60/72/27/1049607227.db2.gz WQGBJQNRNMOWJT-KRWDZBQOSA-N 2 1 321.468 4.128 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(Oc3ccccc3)c2)CCC[C@H]1C[NH3+] ZINC001205995803 1049620967 /nfs/dbraw/zinc/62/09/67/1049620967.db2.gz QPGWHGSPAKDTDV-HKUYNNGSSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CCC[C@@H]1C[NH3+] ZINC001205996316 1049621347 /nfs/dbraw/zinc/62/13/47/1049621347.db2.gz WBVVPCVRGVSPAK-IEBWSBKVSA-N 2 1 324.468 4.286 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)cc1 ZINC001205993415 1049621401 /nfs/dbraw/zinc/62/14/01/1049621401.db2.gz HPPMJVNRPDDYKX-IEBWSBKVSA-N 2 1 318.505 4.062 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)cc1 ZINC001205993420 1049621426 /nfs/dbraw/zinc/62/14/26/1049621426.db2.gz HPPMJVNRPDDYKX-PKOBYXMFSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(Oc3ccccc3)c2)CCC[C@@H]1C[NH3+] ZINC001205995804 1049622292 /nfs/dbraw/zinc/62/22/92/1049622292.db2.gz QPGWHGSPAKDTDV-IEBWSBKVSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3cccs3)s2)CCC[C@@H]1C[NH3+] ZINC001206002792 1049626300 /nfs/dbraw/zinc/62/63/00/1049626300.db2.gz BFSVGZSEWSTVQW-ZIAGYGMSSA-N 2 1 320.527 4.283 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3)s2)CCC[C@H]1C[NH3+] ZINC001206003513 1049626333 /nfs/dbraw/zinc/62/63/33/1049626333.db2.gz IUYDUTJMUJPBGC-WBVHZDCISA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc3c4ccccc4oc32)CCC[C@@H]1C[NH3+] ZINC001206003605 1049626544 /nfs/dbraw/zinc/62/65/44/1049626544.db2.gz KDNHJNPGQSTTHB-JKSUJKDBSA-N 2 1 322.452 4.393 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001206011085 1049628138 /nfs/dbraw/zinc/62/81/38/1049628138.db2.gz ABZQFEDPXSAAGM-HIFRSBDPSA-N 2 1 302.487 4.017 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3cccs3)cc2)CCC[C@@H]1C[NH3+] ZINC001206012016 1049629017 /nfs/dbraw/zinc/62/90/17/1049629017.db2.gz IBFOVBKGWQWZIL-CRAIPNDOSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1cc(Cl)c(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(Cl)c1 ZINC001206024606 1049632733 /nfs/dbraw/zinc/63/27/33/1049632733.db2.gz KSKGNSPZWLPUOE-QWHCGFSZSA-N 2 1 315.288 4.109 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cc(-c3ccsc3)cs2)CCC[C@@H]1C[NH3+] ZINC001206021753 1049632931 /nfs/dbraw/zinc/63/29/31/1049632931.db2.gz AVXNAMZOOWACTN-ZIAGYGMSSA-N 2 1 320.527 4.283 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2cccc(OC)c2)CC1 ZINC000488434026 1049653465 /nfs/dbraw/zinc/65/34/65/1049653465.db2.gz IJJGJJXTUOCUCC-QGZVFWFLSA-N 2 1 318.505 4.200 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CS[C@H](C(C)(C)C)C1 ZINC000488435857 1049654688 /nfs/dbraw/zinc/65/46/88/1049654688.db2.gz SNUJIGCYEZUUEA-ZACQAIPSSA-N 2 1 312.567 4.151 20 0 DIADMP CC(C)C1CC([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)C1 ZINC000488450999 1049658163 /nfs/dbraw/zinc/65/81/63/1049658163.db2.gz RGZLZJCONUMDJS-IDMDMSBLSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)C1CC([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)C1 ZINC000488450999 1049658170 /nfs/dbraw/zinc/65/81/70/1049658170.db2.gz RGZLZJCONUMDJS-IDMDMSBLSA-N 2 1 306.519 4.155 20 0 DIADMP Cc1ccc(C[C@]2(C)CCC[N@H+]2CCC[NH+]2CCCCC2)cc1 ZINC001196595279 1049672913 /nfs/dbraw/zinc/67/29/13/1049672913.db2.gz RMIKFEXSRVOFBB-NRFANRHFSA-N 2 1 314.517 4.268 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)CCC2 ZINC000339070332 1049673510 /nfs/dbraw/zinc/67/35/10/1049673510.db2.gz MNGQSUGDHADKPL-FXAWDEMLSA-N 2 1 300.490 4.082 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@@H+]1Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001206263016 1049692503 /nfs/dbraw/zinc/69/25/03/1049692503.db2.gz LMCZLMCAFHXPPO-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001206263016 1049692510 /nfs/dbraw/zinc/69/25/10/1049692510.db2.gz LMCZLMCAFHXPPO-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001206262763 1049692834 /nfs/dbraw/zinc/69/28/34/1049692834.db2.gz FXUAYISRKHBALG-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001206262763 1049692841 /nfs/dbraw/zinc/69/28/41/1049692841.db2.gz FXUAYISRKHBALG-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC001206263639 1049693297 /nfs/dbraw/zinc/69/32/97/1049693297.db2.gz POZCCAVAMNUPNM-TWKWOARYSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC001206263639 1049693301 /nfs/dbraw/zinc/69/33/01/1049693301.db2.gz POZCCAVAMNUPNM-TWKWOARYSA-N 2 1 320.908 4.439 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC001206263262 1049693395 /nfs/dbraw/zinc/69/33/95/1049693395.db2.gz JUJCRTFCNIWDGF-APWZRJJASA-N 2 1 320.908 4.440 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2-c2ccccc2)CC1 ZINC001206311073 1049708975 /nfs/dbraw/zinc/70/89/75/1049708975.db2.gz HTHCJHSUNAMQQP-OAQYLSRUSA-N 2 1 308.469 4.305 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC1 ZINC001206324748 1049711064 /nfs/dbraw/zinc/71/10/64/1049711064.db2.gz DBFRQYIOTOYMKT-KRWDZBQOSA-N 2 1 320.527 4.428 20 0 DIADMP COc1cc(C)c(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)cc1C(C)C ZINC001206318951 1049711328 /nfs/dbraw/zinc/71/13/28/1049711328.db2.gz VNVSYYVMLCVYKT-FQEVSTJZSA-N 2 1 318.505 4.078 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(O)cc3)cc2)CC1 ZINC001206324352 1049711816 /nfs/dbraw/zinc/71/18/16/1049711816.db2.gz AFWMXNCOMIQATE-NRFANRHFSA-N 2 1 324.468 4.010 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2c(F)cc(Cl)cc2Cl)CC1 ZINC001206325170 1049712022 /nfs/dbraw/zinc/71/20/22/1049712022.db2.gz GBBCQTYFPTZICQ-OAHLLOKOSA-N 2 1 319.251 4.083 20 0 DIADMP Cc1cnc(-c2ccccc2)c(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)c1 ZINC001206326453 1049713300 /nfs/dbraw/zinc/71/33/00/1049713300.db2.gz NRELZQSIXYFDAD-OAQYLSRUSA-N 2 1 323.484 4.008 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001206343797 1049716670 /nfs/dbraw/zinc/71/66/70/1049716670.db2.gz IKYCDBQVHMOLCC-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001206343797 1049716677 /nfs/dbraw/zinc/71/66/77/1049716677.db2.gz IKYCDBQVHMOLCC-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC001206352373 1049719593 /nfs/dbraw/zinc/71/95/93/1049719593.db2.gz VKFWRNWXAJSQFV-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC001206352373 1049719600 /nfs/dbraw/zinc/71/96/00/1049719600.db2.gz VKFWRNWXAJSQFV-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001206541886 1049752943 /nfs/dbraw/zinc/75/29/43/1049752943.db2.gz MOSPMUXKXWKCRK-NRFANRHFSA-N 2 1 308.469 4.305 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)C1 ZINC001206540160 1049753456 /nfs/dbraw/zinc/75/34/56/1049753456.db2.gz AQKYWYHZRSJEEF-OAQYLSRUSA-N 2 1 324.468 4.430 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCC[C@](C)(C[NH3+])C1 ZINC001206542239 1049754174 /nfs/dbraw/zinc/75/41/74/1049754174.db2.gz VXSZBRRRMHRYMZ-IEBWSBKVSA-N 2 1 312.542 4.059 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(-c3ccsc3)c2)C1 ZINC001206554520 1049754967 /nfs/dbraw/zinc/75/49/67/1049754967.db2.gz DNPRMEXMCVNTQB-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(-c3ccsc3)c2)C1 ZINC001206554519 1049755476 /nfs/dbraw/zinc/75/54/76/1049755476.db2.gz DNPRMEXMCVNTQB-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2ccc(Cl)cc12)[C@H]1CCC[NH2+]CC1 ZINC001206579936 1049761231 /nfs/dbraw/zinc/76/12/31/1049761231.db2.gz BICPOOSGQQSBJG-INIZCTEOSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@H+](Cc1cc(Cl)ccc1Cl)[C@H]1CCC[NH2+]CC1 ZINC001206583839 1049762216 /nfs/dbraw/zinc/76/22/16/1049762216.db2.gz XFKHMNBRVAKWFF-HNNXBMFYSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1cc(Cl)ccc1Cl)[C@H]1CCC[NH2+]CC1 ZINC001206583839 1049762221 /nfs/dbraw/zinc/76/22/21/1049762221.db2.gz XFKHMNBRVAKWFF-HNNXBMFYSA-N 2 1 315.288 4.346 20 0 DIADMP CCOc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1CC ZINC001206589971 1049763812 /nfs/dbraw/zinc/76/38/12/1049763812.db2.gz JQLRYMZLFQJISQ-LJQANCHMSA-N 2 1 318.505 4.000 20 0 DIADMP CC(C)[N@@H+](Cc1csc2ccccc12)[C@@H]1CCC[NH2+]CC1 ZINC001206591642 1049764167 /nfs/dbraw/zinc/76/41/67/1049764167.db2.gz UPNSGFFPQKNGSF-MRXNPFEDSA-N 2 1 302.487 4.254 20 0 DIADMP CCc1cccc2c(C[N@@H+](C(C)C)[C@@H]3CCC[NH2+]CC3)c[nH]c21 ZINC001206591691 1049764478 /nfs/dbraw/zinc/76/44/78/1049764478.db2.gz VIGVWNSNAIRZMF-GOSISDBHSA-N 2 1 313.489 4.083 20 0 DIADMP CCn1ccc2ccc(C[N@@H+](C(C)C)[C@@H]3CCC[NH2+]CC3)cc21 ZINC001206590001 1049764513 /nfs/dbraw/zinc/76/45/13/1049764513.db2.gz KETTUVSRCUNWPX-LJQANCHMSA-N 2 1 313.489 4.014 20 0 DIADMP CSc1cc(C)cc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1 ZINC001206606077 1049768617 /nfs/dbraw/zinc/76/86/17/1049768617.db2.gz CLOBRPWXCZWXFG-KRWDZBQOSA-N 2 1 306.519 4.069 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@H]2CC[N@@H+](C3CCCCC3)C2)cc1 ZINC001206715792 1049783465 /nfs/dbraw/zinc/78/34/65/1049783465.db2.gz XYHNALIHBSGSOO-FQEVSTJZSA-N 2 1 314.517 4.349 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@H]2CC[N@H+](C3CCCCC3)C2)cc1 ZINC001206715792 1049783470 /nfs/dbraw/zinc/78/34/70/1049783470.db2.gz XYHNALIHBSGSOO-FQEVSTJZSA-N 2 1 314.517 4.349 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001206770484 1049796612 /nfs/dbraw/zinc/79/66/12/1049796612.db2.gz SIYXXCGNMPJDKO-LSDHHAIUSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001206770479 1049797004 /nfs/dbraw/zinc/79/70/04/1049797004.db2.gz SIYXXCGNMPJDKO-CABCVRRESA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC001206799793 1049800876 /nfs/dbraw/zinc/80/08/76/1049800876.db2.gz GBFYBYJYGLAZEE-OYNPSCLESA-N 2 1 314.517 4.232 20 0 DIADMP Fc1ccc(C2CCC([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000490150468 1049802910 /nfs/dbraw/zinc/80/29/10/1049802910.db2.gz MWCIEQKDETXHQK-DXBWTPJFSA-N 2 1 316.464 4.068 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(C2CCCCC2)cc1 ZINC001206807221 1049803309 /nfs/dbraw/zinc/80/33/09/1049803309.db2.gz HTSIFBYPYNWKEK-FUHWJXTLSA-N 2 1 300.490 4.294 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@@H]3C)cc2)c1 ZINC001206809696 1049804111 /nfs/dbraw/zinc/80/41/11/1049804111.db2.gz MJLNSJOBBDCTKY-HKUYNNGSSA-N 2 1 308.469 4.221 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CSc2ccccc2)C(C)C)C1 ZINC000490171211 1049807410 /nfs/dbraw/zinc/80/74/10/1049807410.db2.gz AQBSDVDPTLWIGL-PKOBYXMFSA-N 2 1 320.546 4.125 20 0 DIADMP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167557 1049808295 /nfs/dbraw/zinc/80/82/95/1049808295.db2.gz KQDULMMXUBGWKY-GHTZIAJQSA-N 2 1 308.469 4.016 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)C1 ZINC000490167557 1049808300 /nfs/dbraw/zinc/80/83/00/1049808300.db2.gz KQDULMMXUBGWKY-GHTZIAJQSA-N 2 1 308.469 4.016 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c1C ZINC001207093624 1049833947 /nfs/dbraw/zinc/83/39/47/1049833947.db2.gz MUETXFRPKKLWIS-AUUYWEPGSA-N 2 1 320.546 4.498 20 0 DIADMP FC(F)c1cccc(C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001207130962 1049839965 /nfs/dbraw/zinc/83/99/65/1049839965.db2.gz NAFUOBFNZGUHSF-SFHVURJKSA-N 2 1 322.443 4.465 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)c1 ZINC001207130962 1049839978 /nfs/dbraw/zinc/83/99/78/1049839978.db2.gz NAFUOBFNZGUHSF-SFHVURJKSA-N 2 1 322.443 4.465 20 0 DIADMP FC(F)c1cccc(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001207130961 1049840000 /nfs/dbraw/zinc/84/00/00/1049840000.db2.gz NAFUOBFNZGUHSF-GOSISDBHSA-N 2 1 322.443 4.465 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001207130961 1049840008 /nfs/dbraw/zinc/84/00/08/1049840008.db2.gz NAFUOBFNZGUHSF-GOSISDBHSA-N 2 1 322.443 4.465 20 0 DIADMP C[C@@H]1[C@@H](C)CCC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207290386 1049875378 /nfs/dbraw/zinc/87/53/78/1049875378.db2.gz AYRNYUDKAPWXSG-ZWKOTPCHSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207292372 1049876069 /nfs/dbraw/zinc/87/60/69/1049876069.db2.gz QCDBDIDXKUFEKA-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC(C[N@H+]3CCC[C@@H]4CCC[C@H]43)CC2)cc1 ZINC001207290716 1049876142 /nfs/dbraw/zinc/87/61/42/1049876142.db2.gz BFMKAWWAFDVAAR-LEWJYISDSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)[C@@H]1C ZINC001207290384 1049876420 /nfs/dbraw/zinc/87/64/20/1049876420.db2.gz AYRNYUDKAPWXSG-QZTJIDSGSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)[C@H]1C ZINC001207290382 1049876441 /nfs/dbraw/zinc/87/64/41/1049876441.db2.gz AYRNYUDKAPWXSG-MSOLQXFVSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@@H+](CCC1CC[NH+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC001207480012 1049897135 /nfs/dbraw/zinc/89/71/35/1049897135.db2.gz SVEHWVRLAXOUSC-UHFFFAOYSA-N 2 1 322.496 4.440 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001207485636 1049897270 /nfs/dbraw/zinc/89/72/70/1049897270.db2.gz ZAAXFBNMGXAZLT-GOSISDBHSA-N 2 1 306.881 4.209 20 0 DIADMP Fc1ccccc1CCC[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001207494395 1049898686 /nfs/dbraw/zinc/89/86/86/1049898686.db2.gz TYHQLIQPZPIRLO-LJQANCHMSA-N 2 1 318.480 4.099 20 0 DIADMP Fc1ccccc1CCC[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001207494393 1049899078 /nfs/dbraw/zinc/89/90/78/1049899078.db2.gz TYHQLIQPZPIRLO-IBGZPJMESA-N 2 1 318.480 4.099 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)CCCc2cccc(Cl)c2)CC1 ZINC001207592898 1049913256 /nfs/dbraw/zinc/91/32/56/1049913256.db2.gz BJHQKAVYMKRHKP-UHFFFAOYSA-N 2 1 322.924 4.469 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1CCCCc1ccccc1 ZINC001207616667 1049918109 /nfs/dbraw/zinc/91/81/09/1049918109.db2.gz HKNVKYKWNQLQJQ-SFTDATJTSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1CCCCc1ccccc1 ZINC001207616667 1049918116 /nfs/dbraw/zinc/91/81/16/1049918116.db2.gz HKNVKYKWNQLQJQ-SFTDATJTSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1CCCCc1ccccc1 ZINC001207616667 1049918124 /nfs/dbraw/zinc/91/81/24/1049918124.db2.gz HKNVKYKWNQLQJQ-SFTDATJTSA-N 2 1 314.517 4.348 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)C1CC[NH+](CC2CC2)CC1 ZINC001168380383 1049944800 /nfs/dbraw/zinc/94/48/00/1049944800.db2.gz RRQXPAWRFHAISG-UHFFFAOYSA-N 2 1 308.469 4.146 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168380742 1049946141 /nfs/dbraw/zinc/94/61/41/1049946141.db2.gz SZOSZRRUFDKQQF-FQEVSTJZSA-N 2 1 316.464 4.227 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168380742 1049946145 /nfs/dbraw/zinc/94/61/45/1049946145.db2.gz SZOSZRRUFDKQQF-FQEVSTJZSA-N 2 1 316.464 4.227 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(OCC)c2)CC1 ZINC000164473672 1049947556 /nfs/dbraw/zinc/94/75/56/1049947556.db2.gz WRTDGVHYCLYBKE-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@H+](C)C1CC[NH+](C)CC1 ZINC001207913284 1049954700 /nfs/dbraw/zinc/95/47/00/1049954700.db2.gz IZIKEJQAYQLKDT-KRWDZBQOSA-N 2 1 316.533 4.189 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C1CC[NH+](C)CC1 ZINC001207913284 1049954707 /nfs/dbraw/zinc/95/47/07/1049954707.db2.gz IZIKEJQAYQLKDT-KRWDZBQOSA-N 2 1 316.533 4.189 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+](C)C2CC[NH+](C)CC2)cc1 ZINC001207932996 1049957683 /nfs/dbraw/zinc/95/76/83/1049957683.db2.gz TZVWATMEYAYQAV-QGZVFWFLSA-N 2 1 302.506 4.015 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@@H+](C)C2CC[NH+](C)CC2)cc1 ZINC001207932996 1049957689 /nfs/dbraw/zinc/95/76/89/1049957689.db2.gz TZVWATMEYAYQAV-QGZVFWFLSA-N 2 1 302.506 4.015 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)cc1 ZINC001207936474 1049960144 /nfs/dbraw/zinc/96/01/44/1049960144.db2.gz HFULEJFDGYXRPK-NQIIRXRSSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)cc1 ZINC001207936474 1049960150 /nfs/dbraw/zinc/96/01/50/1049960150.db2.gz HFULEJFDGYXRPK-NQIIRXRSSA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)cc1 ZINC001207936474 1049960159 /nfs/dbraw/zinc/96/01/59/1049960159.db2.gz HFULEJFDGYXRPK-NQIIRXRSSA-N 2 1 314.517 4.016 20 0 DIADMP CC[NH+]1CCC([N@H+](C)C[C@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001207936767 1049960210 /nfs/dbraw/zinc/96/02/10/1049960210.db2.gz JLXBFXIVDOWDLF-GOSISDBHSA-N 2 1 316.533 4.405 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)C[C@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001207936767 1049960213 /nfs/dbraw/zinc/96/02/13/1049960213.db2.gz JLXBFXIVDOWDLF-GOSISDBHSA-N 2 1 316.533 4.405 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C/C=C\c1ccccc1 ZINC000588177557 1049973197 /nfs/dbraw/zinc/97/31/97/1049973197.db2.gz CFZFNNFPBYZUKV-XFXZXTDPSA-N 2 1 308.469 4.330 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001208110838 1049973616 /nfs/dbraw/zinc/97/36/16/1049973616.db2.gz HGIYTOZGDVAFPK-KRWDZBQOSA-N 2 1 306.881 4.209 20 0 DIADMP CC/C=C\CCC[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001208138371 1049976778 /nfs/dbraw/zinc/97/67/78/1049976778.db2.gz PAITXYRRXUTBIB-ARJAWSKDSA-N 2 1 312.501 4.256 20 0 DIADMP Cc1ccc([C@H](C)CC[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)o1 ZINC001208170447 1049981437 /nfs/dbraw/zinc/98/14/37/1049981437.db2.gz XDSOCSHGOSKXRR-NEWSRXKRSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@H](C)CC[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)o1 ZINC001208170447 1049981442 /nfs/dbraw/zinc/98/14/42/1049981442.db2.gz XDSOCSHGOSKXRR-NEWSRXKRSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@H](C)CC[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)o1 ZINC001208170447 1049981446 /nfs/dbraw/zinc/98/14/46/1049981446.db2.gz XDSOCSHGOSKXRR-NEWSRXKRSA-N 2 1 318.505 4.420 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)CC[C@H](C)CCCC(C)(C)OC ZINC001208213861 1049986406 /nfs/dbraw/zinc/98/64/06/1049986406.db2.gz PYAFIFWMKHOQBE-GOSISDBHSA-N 2 1 314.558 4.272 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001208219593 1049987853 /nfs/dbraw/zinc/98/78/53/1049987853.db2.gz PWTUQHSQKUOTMQ-KRWDZBQOSA-N 2 1 324.553 4.167 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+](C)Cc1ccccc1-c1ccccc1 ZINC000572132108 1049995567 /nfs/dbraw/zinc/99/55/67/1049995567.db2.gz YLUDODBKMXNNLT-UHFFFAOYSA-N 2 1 319.452 4.152 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000572132108 1049995571 /nfs/dbraw/zinc/99/55/71/1049995571.db2.gz YLUDODBKMXNNLT-UHFFFAOYSA-N 2 1 319.452 4.152 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH+]2CCC(c3ccc4ccccc4c3)CC2)C1 ZINC001208610151 1049998000 /nfs/dbraw/zinc/99/80/00/1049998000.db2.gz YXGUZRNXUBVIKK-GOSISDBHSA-N 2 1 322.496 4.361 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206349 1049998464 /nfs/dbraw/zinc/99/84/64/1049998464.db2.gz PUOYKCZOLCUVSX-SDEKRAFDSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206349 1049998469 /nfs/dbraw/zinc/99/84/69/1049998469.db2.gz PUOYKCZOLCUVSX-SDEKRAFDSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206349 1049998474 /nfs/dbraw/zinc/99/84/74/1049998474.db2.gz PUOYKCZOLCUVSX-SDEKRAFDSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206349 1049998477 /nfs/dbraw/zinc/99/84/77/1049998477.db2.gz PUOYKCZOLCUVSX-SDEKRAFDSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206347 1049998939 /nfs/dbraw/zinc/99/89/39/1049998939.db2.gz PUOYKCZOLCUVSX-CZOVOBHWSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206347 1049998942 /nfs/dbraw/zinc/99/89/42/1049998942.db2.gz PUOYKCZOLCUVSX-CZOVOBHWSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206347 1049998946 /nfs/dbraw/zinc/99/89/46/1049998946.db2.gz PUOYKCZOLCUVSX-CZOVOBHWSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)CC1CCC(c2ccccc2)CC1 ZINC000572206347 1049998950 /nfs/dbraw/zinc/99/89/50/1049998950.db2.gz PUOYKCZOLCUVSX-CZOVOBHWSA-N 2 1 314.517 4.232 20 0 DIADMP CN1CCC([N@@H+](CCc2ccc(Cl)cc2)C2CCCC2)CC1 ZINC001208741550 1050008307 /nfs/dbraw/zinc/00/83/07/1050008307.db2.gz FQKDCUDGSXCJNQ-UHFFFAOYSA-N 2 1 320.908 4.221 20 0 DIADMP C[C@H]1CCCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935113 1050024234 /nfs/dbraw/zinc/02/42/34/1050024234.db2.gz IHOBOLGXQQBLNS-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935113 1050024236 /nfs/dbraw/zinc/02/42/36/1050024236.db2.gz IHOBOLGXQQBLNS-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208935113 1050024241 /nfs/dbraw/zinc/02/42/41/1050024241.db2.gz IHOBOLGXQQBLNS-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208935113 1050024249 /nfs/dbraw/zinc/02/42/49/1050024249.db2.gz IHOBOLGXQQBLNS-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CCCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931794 1050024376 /nfs/dbraw/zinc/02/43/76/1050024376.db2.gz MVMFFXHRURRPMO-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931794 1050024381 /nfs/dbraw/zinc/02/43/81/1050024381.db2.gz MVMFFXHRURRPMO-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931794 1050024384 /nfs/dbraw/zinc/02/43/84/1050024384.db2.gz MVMFFXHRURRPMO-AZUAARDMSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCC[C@H]4CCCC[C@@H]43)C2)cc1 ZINC001208947800 1050026380 /nfs/dbraw/zinc/02/63/80/1050026380.db2.gz DAEIYJURFZIXDV-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CCC[C@H]4CCCC[C@@H]43)C2)cc1 ZINC001208947800 1050026384 /nfs/dbraw/zinc/02/63/84/1050026384.db2.gz DAEIYJURFZIXDV-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CCC[C@H]4CCCC[C@@H]43)C2)cc1 ZINC001208947800 1050026390 /nfs/dbraw/zinc/02/63/90/1050026390.db2.gz DAEIYJURFZIXDV-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP CCC[N@H+](CC(C)C)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208942081 1050026880 /nfs/dbraw/zinc/02/68/80/1050026880.db2.gz FXOAKPIXYFPMEH-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[N@@H+](CC(C)C)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208942081 1050026886 /nfs/dbraw/zinc/02/68/86/1050026886.db2.gz FXOAKPIXYFPMEH-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[NH+](CC(C)C)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208942081 1050026893 /nfs/dbraw/zinc/02/68/93/1050026893.db2.gz FXOAKPIXYFPMEH-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[NH+](CC(C)C)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208942081 1050026899 /nfs/dbraw/zinc/02/68/99/1050026899.db2.gz FXOAKPIXYFPMEH-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP C[C@@H]1C[N@@H+](C[C@H]2CC[NH+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208945236 1050027652 /nfs/dbraw/zinc/02/76/52/1050027652.db2.gz BOEMXHYJNKKXSU-QUCCMNQESA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1C[NH+](C[C@H]2CC[N@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208945236 1050027658 /nfs/dbraw/zinc/02/76/58/1050027658.db2.gz BOEMXHYJNKKXSU-QUCCMNQESA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1C[NH+](C[C@H]2CC[N@@H+](Cc3ccccc3)C2)Cc2ccccc21 ZINC001208945236 1050027663 /nfs/dbraw/zinc/02/76/63/1050027663.db2.gz BOEMXHYJNKKXSU-QUCCMNQESA-N 2 1 320.480 4.128 20 0 DIADMP CC(C)C[NH+](CC(C)C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208945808 1050028199 /nfs/dbraw/zinc/02/81/99/1050028199.db2.gz DNZZUAPHSNQCGO-FQEVSTJZSA-N 2 1 302.506 4.123 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC[C@@H]4CCC[C@@H]43)C2)cc1 ZINC001208939918 1050028286 /nfs/dbraw/zinc/02/82/86/1050028286.db2.gz LHPPAQALTNZKKE-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCC[C@@H]4CCC[C@@H]43)C2)cc1 ZINC001208939918 1050028289 /nfs/dbraw/zinc/02/82/89/1050028289.db2.gz LHPPAQALTNZKKE-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCC[C@@H]4CCC[C@@H]43)C2)cc1 ZINC001208939918 1050028291 /nfs/dbraw/zinc/02/82/91/1050028291.db2.gz LHPPAQALTNZKKE-ACRUOGEOSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CC4CCC(CC4)C3)C2)cc1 ZINC001208943588 1050028479 /nfs/dbraw/zinc/02/84/79/1050028479.db2.gz LZAJFIQHVZRBPZ-XVAXZDLZSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC001208957150 1050029571 /nfs/dbraw/zinc/02/95/71/1050029571.db2.gz CXPYIFJQYJSNQN-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC001208957150 1050029576 /nfs/dbraw/zinc/02/95/76/1050029576.db2.gz CXPYIFJQYJSNQN-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP C[C@H]1CC[C@H]([NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001208957150 1050029581 /nfs/dbraw/zinc/02/95/81/1050029581.db2.gz CXPYIFJQYJSNQN-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1C[C@H]1C[N@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001209433882 1050058836 /nfs/dbraw/zinc/05/88/36/1050058836.db2.gz WGJZEEQLHWGJHI-QUCCMNQESA-N 2 1 312.501 4.021 20 0 DIADMP Nc1cc[nH+]cc1C[NH+]1CCC(c2ccc3ccccc3c2)CC1 ZINC001209734481 1050080073 /nfs/dbraw/zinc/08/00/73/1050080073.db2.gz QVEXTNZSOYGTRN-UHFFFAOYSA-N 2 1 317.436 4.027 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCCC23CCCCC3)cn1 ZINC000823677505 1050150320 /nfs/dbraw/zinc/15/03/20/1050150320.db2.gz VLQFDNAXUNZCCU-SFHVURJKSA-N 2 1 324.472 4.168 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@H]2CCc3c(Cl)cccc3C2)C1 ZINC001171032585 1050156191 /nfs/dbraw/zinc/15/61/91/1050156191.db2.gz GSHGYKWFUZERPF-RDJZCZTQSA-N 2 1 320.908 4.038 20 0 DIADMP CCCC[C@H](COC)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348033541 1050172726 /nfs/dbraw/zinc/17/27/26/1050172726.db2.gz ARGLXVYLXCBJHD-CRAIPNDOSA-N 2 1 315.461 4.037 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)c1 ZINC000591692604 1050197127 /nfs/dbraw/zinc/19/71/27/1050197127.db2.gz VUNFFJSWKUWHKD-FCHUYYIVSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)c1 ZINC000591692604 1050197129 /nfs/dbraw/zinc/19/71/29/1050197129.db2.gz VUNFFJSWKUWHKD-FCHUYYIVSA-N 2 1 320.480 4.378 20 0 DIADMP CCCc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)cc1 ZINC000591709906 1050200389 /nfs/dbraw/zinc/20/03/89/1050200389.db2.gz ZTQZLQLBEHSGTC-UHFFFAOYSA-N 2 1 310.485 4.381 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C/C(C)=C\c2ccccc2)c1 ZINC000591709820 1050201712 /nfs/dbraw/zinc/20/17/12/1050201712.db2.gz YETBNGKVEWQNKA-AQTBWJFISA-N 2 1 308.469 4.331 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CC[NH2+][C@H](C)CC2)c1 ZINC001210499269 1050269958 /nfs/dbraw/zinc/26/99/58/1050269958.db2.gz ULDJZYIGCCEJMO-GOSISDBHSA-N 2 1 308.469 4.154 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[NH2+][C@H](C)CC2)c1 ZINC001210499269 1050269973 /nfs/dbraw/zinc/26/99/73/1050269973.db2.gz ULDJZYIGCCEJMO-GOSISDBHSA-N 2 1 308.469 4.154 20 0 DIADMP CCCCN(c1ccccc1)c1ccc(C[NH+]2CC(C[NH3+])C2)cc1 ZINC001210546632 1050290822 /nfs/dbraw/zinc/29/08/22/1050290822.db2.gz YWZGPRJHXMUASJ-UHFFFAOYSA-N 2 1 323.484 4.015 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480220707 1050351669 /nfs/dbraw/zinc/35/16/69/1050351669.db2.gz DKOSTAIMRGHIEX-LXTVHRRPSA-N 2 1 308.432 4.064 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480220707 1050351678 /nfs/dbraw/zinc/35/16/78/1050351678.db2.gz DKOSTAIMRGHIEX-LXTVHRRPSA-N 2 1 308.432 4.064 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(Cl)ccc2C1 ZINC001171111544 1050378475 /nfs/dbraw/zinc/37/84/75/1050378475.db2.gz SVEURAMGOGIETM-GUDVDZBRSA-N 2 1 320.908 4.178 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000178750610 1050481422 /nfs/dbraw/zinc/48/14/22/1050481422.db2.gz FSAZRIZLIPHJDA-RHSMWYFYSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000178750610 1050481427 /nfs/dbraw/zinc/48/14/27/1050481427.db2.gz FSAZRIZLIPHJDA-RHSMWYFYSA-N 2 1 322.493 4.073 20 0 DIADMP C[NH2+]Cc1ccc(Nc2ccc([NH+]3CCCCC3)cc2C)cc1 ZINC001211131951 1050492127 /nfs/dbraw/zinc/49/21/27/1050492127.db2.gz YQEBIGUFHXNUJT-UHFFFAOYSA-N 2 1 309.457 4.448 20 0 DIADMP Fc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000574571791 1050497284 /nfs/dbraw/zinc/49/72/84/1050497284.db2.gz OOYJIUJLJZSVOL-HXUWFJFHSA-N 2 1 324.443 4.113 20 0 DIADMP Fc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000574571791 1050497294 /nfs/dbraw/zinc/49/72/94/1050497294.db2.gz OOYJIUJLJZSVOL-HXUWFJFHSA-N 2 1 324.443 4.113 20 0 DIADMP CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1 ZINC000766223737 1050503501 /nfs/dbraw/zinc/50/35/01/1050503501.db2.gz LWIINITWCSIJBS-RPVQJOFSSA-N 2 1 315.486 4.115 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000786679008 1050510297 /nfs/dbraw/zinc/51/02/97/1050510297.db2.gz VJWGUDNGVMOJGP-MJGOQNOKSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000786679008 1050510306 /nfs/dbraw/zinc/51/03/06/1050510306.db2.gz VJWGUDNGVMOJGP-MJGOQNOKSA-N 2 1 318.892 4.278 20 0 DIADMP CC(C)CCC[C@@H](C)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170072232 1050595735 /nfs/dbraw/zinc/59/57/35/1050595735.db2.gz ZLYDAMDUDSWVRB-MISYRCLQSA-N 2 1 317.521 4.368 20 0 DIADMP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000742374902 1050835486 /nfs/dbraw/zinc/83/54/86/1050835486.db2.gz KCVFPRDJEKSQOB-IEBWSBKVSA-N 2 1 318.505 4.218 20 0 DIADMP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000742375918 1050837683 /nfs/dbraw/zinc/83/76/83/1050837683.db2.gz XZVOPJMUPITOGX-PKOBYXMFSA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccccc2-c2ccccc2)C1 ZINC000742733874 1050928676 /nfs/dbraw/zinc/92/86/76/1050928676.db2.gz HSDYBLABUNVZOO-GOSISDBHSA-N 2 1 308.469 4.174 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)Cc2ccoc2)cc1 ZINC000348099904 1050986324 /nfs/dbraw/zinc/98/63/24/1050986324.db2.gz XOJHTYCHTHHAPE-CABCVRRESA-N 2 1 309.413 4.056 20 0 DIADMP CCOc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000773074742 1051050405 /nfs/dbraw/zinc/05/04/05/1051050405.db2.gz HNKPMQUZXQRXDM-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000773074746 1051051718 /nfs/dbraw/zinc/05/17/18/1051051718.db2.gz HNKPMQUZXQRXDM-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170196599 1051153935 /nfs/dbraw/zinc/15/39/35/1051153935.db2.gz SFIARYFSEVVOKI-WTGUMLROSA-N 2 1 322.537 4.096 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(C)c1C ZINC001170204267 1051155550 /nfs/dbraw/zinc/15/55/50/1051155550.db2.gz BBGBRTKNGWYNSX-YOFSQIOKSA-N 2 1 314.517 4.286 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C)c1C ZINC001170204267 1051155554 /nfs/dbraw/zinc/15/55/54/1051155554.db2.gz BBGBRTKNGWYNSX-YOFSQIOKSA-N 2 1 314.517 4.286 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)c1C ZINC001170204267 1051155559 /nfs/dbraw/zinc/15/55/59/1051155559.db2.gz BBGBRTKNGWYNSX-YOFSQIOKSA-N 2 1 314.517 4.286 20 0 DIADMP COc1c(F)cccc1[C@@H](C)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171629500 1051171615 /nfs/dbraw/zinc/17/16/15/1051171615.db2.gz UCXFLKGUMFBIBK-CYBMUJFWSA-N 2 1 322.468 4.136 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(Cl)s2)CC1(C)C ZINC001171618811 1051177328 /nfs/dbraw/zinc/17/73/28/1051177328.db2.gz DBTFVYPJJXBJHJ-UHFFFAOYSA-N 2 1 300.899 4.143 20 0 DIADMP CCCOc1cccc(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171623150 1051179742 /nfs/dbraw/zinc/17/97/42/1051179742.db2.gz MCLVNDUCVROPQG-UHFFFAOYSA-N 2 1 318.505 4.216 20 0 DIADMP Cc1cc[nH+]c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1C ZINC001170330960 1051185198 /nfs/dbraw/zinc/18/51/98/1051185198.db2.gz ZOOLMSVVJUEYML-OWZKRDHZSA-N 2 1 321.468 4.306 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171667267 1051188956 /nfs/dbraw/zinc/18/89/56/1051188956.db2.gz VIGQEAKWUZYGEK-DUXKGJEZSA-N 2 1 314.517 4.298 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171667447 1051189120 /nfs/dbraw/zinc/18/91/20/1051189120.db2.gz VRPWMYXIZMHSES-YFVAEKQCSA-N 2 1 314.517 4.441 20 0 DIADMP Cc1cccc(CC[N@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171639376 1051195427 /nfs/dbraw/zinc/19/54/27/1051195427.db2.gz IBCWJVKOSMGICK-UHFFFAOYSA-N 2 1 302.506 4.121 20 0 DIADMP Cc1ccc(CC[N@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171639341 1051195563 /nfs/dbraw/zinc/19/55/63/1051195563.db2.gz GODFHRZCRSGBNK-UHFFFAOYSA-N 2 1 302.506 4.121 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)CC1(C)C ZINC001171642239 1051196522 /nfs/dbraw/zinc/19/65/22/1051196522.db2.gz HHTJSJLBMHOHKE-IYBDPMFKSA-N 2 1 312.501 4.225 20 0 DIADMP Cc1ccc2c(c1)CC[N@H+](C1CC(C)(C)[NH+](C)C(C)(C)C1)C2 ZINC001171642198 1051197235 /nfs/dbraw/zinc/19/72/35/1051197235.db2.gz ZDYDDVDJNADGNU-UHFFFAOYSA-N 2 1 300.490 4.005 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1C ZINC001171641699 1051198131 /nfs/dbraw/zinc/19/81/31/1051198131.db2.gz UCGZMISMBZGABM-UHFFFAOYSA-N 2 1 302.506 4.387 20 0 DIADMP CC1(C)C[C@@H]([NH2+]Cc2ccsc2)CC[N@@H+]1Cc1ccccc1 ZINC001171967392 1051248201 /nfs/dbraw/zinc/24/82/01/1051248201.db2.gz ZFKUQWSZBRPGOG-SFHVURJKSA-N 2 1 314.498 4.281 20 0 DIADMP CC1(C)C[C@@H]([NH2+]Cc2ccsc2)CC[N@H+]1Cc1ccccc1 ZINC001171967392 1051248212 /nfs/dbraw/zinc/24/82/12/1051248212.db2.gz ZFKUQWSZBRPGOG-SFHVURJKSA-N 2 1 314.498 4.281 20 0 DIADMP CC(C)(C)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171965736 1051248374 /nfs/dbraw/zinc/24/83/74/1051248374.db2.gz QWDPXFUBCYGAIK-GOSISDBHSA-N 2 1 302.506 4.455 20 0 DIADMP CC(C)(C)CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171965738 1051248600 /nfs/dbraw/zinc/24/86/00/1051248600.db2.gz QWDPXFUBCYGAIK-SFHVURJKSA-N 2 1 302.506 4.455 20 0 DIADMP CC1(C)C[C@@H]([NH2+]CCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001171964268 1051249321 /nfs/dbraw/zinc/24/93/21/1051249321.db2.gz LFXBFNMPEZWOCM-NRFANRHFSA-N 2 1 322.496 4.262 20 0 DIADMP CC(C)(C)C(=[NH2+])N[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964678 1051250281 /nfs/dbraw/zinc/25/02/81/1051250281.db2.gz MFINSEYJLUACRC-INIZCTEOSA-N 2 1 301.478 4.043 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2C3)CC[N@H+]1Cc1ccccc1 ZINC001171970905 1051261035 /nfs/dbraw/zinc/26/10/35/1051261035.db2.gz GEZRDSYOQCVQSW-MTQWCTHYSA-N 2 1 312.501 4.208 20 0 DIADMP CC1(C)C[C@@H]([NH2+]CCC2CCC2)CC[N@H+]1Cc1ccccc1 ZINC001171981781 1051266614 /nfs/dbraw/zinc/26/66/14/1051266614.db2.gz DBQMIFIJFFPJMS-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP CCC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCC1 ZINC001171980889 1051267490 /nfs/dbraw/zinc/26/74/90/1051267490.db2.gz UNEDTYCCASYOFH-SFHVURJKSA-N 2 1 300.490 4.352 20 0 DIADMP CC1(C)C[C@H]([NH2+]C2CC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171980877 1051267533 /nfs/dbraw/zinc/26/75/33/1051267533.db2.gz UIYBMWJEDHTRME-GOSISDBHSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983923 1051268463 /nfs/dbraw/zinc/26/84/63/1051268463.db2.gz BAVJOLVRUYVVJY-HKUYNNGSSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983923 1051268467 /nfs/dbraw/zinc/26/84/67/1051268467.db2.gz BAVJOLVRUYVVJY-HKUYNNGSSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983923 1051268472 /nfs/dbraw/zinc/26/84/72/1051268472.db2.gz BAVJOLVRUYVVJY-HKUYNNGSSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C2(CC2)C1 ZINC001171983923 1051268484 /nfs/dbraw/zinc/26/84/84/1051268484.db2.gz BAVJOLVRUYVVJY-HKUYNNGSSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@]1(CF)CC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978004 1051268506 /nfs/dbraw/zinc/26/85/06/1051268506.db2.gz VQUVWKHEDGEYQG-ICSRJNTNSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@@]1(CF)CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978004 1051268518 /nfs/dbraw/zinc/26/85/18/1051268518.db2.gz VQUVWKHEDGEYQG-ICSRJNTNSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@@]1(CF)CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171978004 1051268529 /nfs/dbraw/zinc/26/85/29/1051268529.db2.gz VQUVWKHEDGEYQG-ICSRJNTNSA-N 2 1 318.480 4.111 20 0 DIADMP CCC[N@H+](CC)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080334 1051276879 /nfs/dbraw/zinc/27/68/79/1051276879.db2.gz UCDFCWAJDVBVGL-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCC[N@@H+](CC)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080334 1051276886 /nfs/dbraw/zinc/27/68/86/1051276886.db2.gz UCDFCWAJDVBVGL-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCC[NH+](CC)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172080334 1051276894 /nfs/dbraw/zinc/27/68/94/1051276894.db2.gz UCDFCWAJDVBVGL-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCC[NH+](CC)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172080334 1051276903 /nfs/dbraw/zinc/27/69/03/1051276903.db2.gz UCDFCWAJDVBVGL-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCCC24CC4)C3)cc1 ZINC001172079205 1051277706 /nfs/dbraw/zinc/27/77/06/1051277706.db2.gz MUSFWLXLQQBXPW-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCCC24CC4)C3)cc1 ZINC001172079205 1051277713 /nfs/dbraw/zinc/27/77/13/1051277713.db2.gz MUSFWLXLQQBXPW-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@@H+]2CCCC24CC4)C3)cc1 ZINC001172079205 1051277718 /nfs/dbraw/zinc/27/77/18/1051277718.db2.gz MUSFWLXLQQBXPW-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@H+]2CCCC24CC4)C3)cc1 ZINC001172079205 1051277731 /nfs/dbraw/zinc/27/77/31/1051277731.db2.gz MUSFWLXLQQBXPW-ACDBMABISA-N 2 1 310.485 4.201 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2CC24CCCC4)C3)cc1 ZINC001172077622 1051278395 /nfs/dbraw/zinc/27/83/95/1051278395.db2.gz ULNIJQMXXPUDOB-WOZUAGRISA-N 2 1 324.512 4.494 20 0 DIADMP CC[N@H+](C(C)C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079221 1051278608 /nfs/dbraw/zinc/27/86/08/1051278608.db2.gz NDOKMLITKQYHFS-ACDBMABISA-N 2 1 300.490 4.302 20 0 DIADMP CC[N@@H+](C(C)C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079221 1051278616 /nfs/dbraw/zinc/27/86/16/1051278616.db2.gz NDOKMLITKQYHFS-ACDBMABISA-N 2 1 300.490 4.302 20 0 DIADMP CC[NH+](C(C)C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172079221 1051278627 /nfs/dbraw/zinc/27/86/27/1051278627.db2.gz NDOKMLITKQYHFS-ACDBMABISA-N 2 1 300.490 4.302 20 0 DIADMP CC[NH+](C(C)C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172079221 1051278637 /nfs/dbraw/zinc/27/86/37/1051278637.db2.gz NDOKMLITKQYHFS-ACDBMABISA-N 2 1 300.490 4.302 20 0 DIADMP CC[N@H+](C(C)C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079222 1051279645 /nfs/dbraw/zinc/27/96/45/1051279645.db2.gz NDOKMLITKQYHFS-PMOLBWCYSA-N 2 1 300.490 4.302 20 0 DIADMP CC[N@@H+](C(C)C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079222 1051279657 /nfs/dbraw/zinc/27/96/57/1051279657.db2.gz NDOKMLITKQYHFS-PMOLBWCYSA-N 2 1 300.490 4.302 20 0 DIADMP CC[NH+](C(C)C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172079222 1051279670 /nfs/dbraw/zinc/27/96/70/1051279670.db2.gz NDOKMLITKQYHFS-PMOLBWCYSA-N 2 1 300.490 4.302 20 0 DIADMP CC[NH+](C(C)C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172079222 1051279682 /nfs/dbraw/zinc/27/96/82/1051279682.db2.gz NDOKMLITKQYHFS-PMOLBWCYSA-N 2 1 300.490 4.302 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1ccc(Cl)cc1)C2 ZINC001172101597 1051279986 /nfs/dbraw/zinc/27/99/86/1051279986.db2.gz FSUQSVFQYYZYPI-BCDXTJNWSA-N 2 1 320.908 4.266 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1ccc(Cl)cc1)C2 ZINC001172101597 1051279998 /nfs/dbraw/zinc/27/99/98/1051279998.db2.gz FSUQSVFQYYZYPI-BCDXTJNWSA-N 2 1 320.908 4.266 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075624 1051280021 /nfs/dbraw/zinc/28/00/21/1051280021.db2.gz COKVPGUTYFPSGJ-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075624 1051280031 /nfs/dbraw/zinc/28/00/31/1051280031.db2.gz COKVPGUTYFPSGJ-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172075624 1051280039 /nfs/dbraw/zinc/28/00/39/1051280039.db2.gz COKVPGUTYFPSGJ-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172075624 1051280053 /nfs/dbraw/zinc/28/00/53/1051280053.db2.gz COKVPGUTYFPSGJ-AYWYSENESA-N 2 1 312.501 4.447 20 0 DIADMP Cc1occc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172063667 1051283728 /nfs/dbraw/zinc/28/37/28/1051283728.db2.gz CJFIRPZGGDDJGC-WKCHPHFGSA-N 2 1 324.468 4.263 20 0 DIADMP Cc1occc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172063667 1051283741 /nfs/dbraw/zinc/28/37/41/1051283741.db2.gz CJFIRPZGGDDJGC-WKCHPHFGSA-N 2 1 324.468 4.263 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2CC24CCC4)C3)cc1 ZINC001172065839 1051286140 /nfs/dbraw/zinc/28/61/40/1051286140.db2.gz ACPDCHXUSSISLW-HAGHYFMRSA-N 2 1 310.485 4.104 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2C=CCCC2)C3)cc1 ZINC001172067584 1051286812 /nfs/dbraw/zinc/28/68/12/1051286812.db2.gz HDNGEYXAYZXGNQ-XSDIEEQYSA-N 2 1 310.485 4.270 20 0 DIADMP c1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001172069963 1051288838 /nfs/dbraw/zinc/28/88/38/1051288838.db2.gz YVHABIXUTJDLBT-DKUWSORSSA-N 2 1 320.480 4.362 20 0 DIADMP CC[C@H](C)[N@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069072 1051288998 /nfs/dbraw/zinc/28/89/98/1051288998.db2.gz NSVZKDXNPHQWBI-IJXRJRJASA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H](C)[N@@H+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069072 1051289004 /nfs/dbraw/zinc/28/90/04/1051289004.db2.gz NSVZKDXNPHQWBI-IJXRJRJASA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H](C)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069072 1051289008 /nfs/dbraw/zinc/28/90/08/1051289008.db2.gz NSVZKDXNPHQWBI-IJXRJRJASA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H](C)[NH+](C)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069072 1051289017 /nfs/dbraw/zinc/28/90/17/1051289017.db2.gz NSVZKDXNPHQWBI-IJXRJRJASA-N 2 1 300.490 4.302 20 0 DIADMP CCC(C)(C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069233 1051289794 /nfs/dbraw/zinc/28/97/94/1051289794.db2.gz SGUHCLBPWZYRHP-REPLKXPHSA-N 2 1 300.490 4.350 20 0 DIADMP CCC(C)(C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069233 1051289808 /nfs/dbraw/zinc/28/98/08/1051289808.db2.gz SGUHCLBPWZYRHP-REPLKXPHSA-N 2 1 300.490 4.350 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127405 1051290010 /nfs/dbraw/zinc/29/00/10/1051290010.db2.gz JCTMLUKOXOIJDU-UWHLTILDSA-N 2 1 312.501 4.271 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127405 1051290018 /nfs/dbraw/zinc/29/00/18/1051290018.db2.gz JCTMLUKOXOIJDU-UWHLTILDSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127405 1051290023 /nfs/dbraw/zinc/29/00/23/1051290023.db2.gz JCTMLUKOXOIJDU-UWHLTILDSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127405 1051290036 /nfs/dbraw/zinc/29/00/36/1051290036.db2.gz JCTMLUKOXOIJDU-UWHLTILDSA-N 2 1 312.501 4.271 20 0 DIADMP CC(C)[N@H+]([C@@H](C)c1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133627 1051291616 /nfs/dbraw/zinc/29/16/16/1051291616.db2.gz UBHCHFKJUBLQQO-FFGOWVMKSA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133627 1051291631 /nfs/dbraw/zinc/29/16/31/1051291631.db2.gz UBHCHFKJUBLQQO-FFGOWVMKSA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[NH+]([C@@H](C)c1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172133627 1051291644 /nfs/dbraw/zinc/29/16/44/1051291644.db2.gz UBHCHFKJUBLQQO-FFGOWVMKSA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[NH+]([C@@H](C)c1ccccc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172133627 1051291651 /nfs/dbraw/zinc/29/16/51/1051291651.db2.gz UBHCHFKJUBLQQO-FFGOWVMKSA-N 2 1 300.490 4.473 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104798 1051295498 /nfs/dbraw/zinc/29/54/98/1051295498.db2.gz CWZVOFCEXPGZIO-OKYOBFRVSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104798 1051295509 /nfs/dbraw/zinc/29/55/09/1051295509.db2.gz CWZVOFCEXPGZIO-OKYOBFRVSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(C)(C)c1ccc(Cl)cc1)C2 ZINC001172104129 1051295589 /nfs/dbraw/zinc/29/55/89/1051295589.db2.gz DBSJSKMKRSBXDI-BJWYYQGGSA-N 2 1 306.881 4.180 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(C)(C)c1ccc(Cl)cc1)C2 ZINC001172104129 1051295602 /nfs/dbraw/zinc/29/56/02/1051295602.db2.gz DBSJSKMKRSBXDI-BJWYYQGGSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103102 1051295739 /nfs/dbraw/zinc/29/57/39/1051295739.db2.gz RWQFEVKJUYBCNI-JAJHAACTSA-N 2 1 316.533 4.196 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103102 1051295754 /nfs/dbraw/zinc/29/57/54/1051295754.db2.gz RWQFEVKJUYBCNI-JAJHAACTSA-N 2 1 316.533 4.196 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105026 1051296227 /nfs/dbraw/zinc/29/62/27/1051296227.db2.gz HOLYEDMGYJRYSY-FCGDIQPGSA-N 2 1 300.490 4.379 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105026 1051296239 /nfs/dbraw/zinc/29/62/39/1051296239.db2.gz HOLYEDMGYJRYSY-FCGDIQPGSA-N 2 1 300.490 4.379 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)C2 ZINC001172103770 1051297176 /nfs/dbraw/zinc/29/71/76/1051297176.db2.gz XPQVHHVEBBXFJU-LDLYASANSA-N 2 1 300.490 4.089 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc3sccc3c1)C2 ZINC001172104542 1051297306 /nfs/dbraw/zinc/29/73/06/1051297306.db2.gz CNBDYZNCSGIGGD-OSYLJGHBSA-N 2 1 300.471 4.006 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c2ccccc12 ZINC001172106471 1051298375 /nfs/dbraw/zinc/29/83/75/1051298375.db2.gz PDAKIIOOGFGSFO-REPLKXPHSA-N 2 1 308.469 4.253 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)cc(Cl)c1 ZINC001172110456 1051299675 /nfs/dbraw/zinc/29/96/75/1051299675.db2.gz MZUPKRKWVYVLAW-AHBIMHKDSA-N 2 1 310.844 4.145 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001172109098 1051299832 /nfs/dbraw/zinc/29/98/32/1051299832.db2.gz AXSQBOFKUXUCPN-LUYSREMJSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCC[C@H](c3ccccc3)C1)C2 ZINC001172109098 1051299845 /nfs/dbraw/zinc/29/98/45/1051299845.db2.gz AXSQBOFKUXUCPN-LUYSREMJSA-N 2 1 312.501 4.318 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(C)c1 ZINC001172110415 1051300139 /nfs/dbraw/zinc/30/01/39/1051300139.db2.gz MNXUOHVGIYQRIV-IYWMVGAKSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(C)c1 ZINC001172110415 1051300151 /nfs/dbraw/zinc/30/01/51/1051300151.db2.gz MNXUOHVGIYQRIV-IYWMVGAKSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC001172110450 1051300173 /nfs/dbraw/zinc/30/01/73/1051300173.db2.gz MXTMBSGAWZCZGZ-IYWMVGAKSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC001172110450 1051300186 /nfs/dbraw/zinc/30/01/86/1051300186.db2.gz MXTMBSGAWZCZGZ-IYWMVGAKSA-N 2 1 300.490 4.441 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110313 1051302242 /nfs/dbraw/zinc/30/22/42/1051302242.db2.gz MKYWHGLZIDHXFK-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110313 1051302250 /nfs/dbraw/zinc/30/22/50/1051302250.db2.gz MKYWHGLZIDHXFK-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3Cl)CCC1)C2 ZINC001172113486 1051302333 /nfs/dbraw/zinc/30/23/33/1051302333.db2.gz HSSMCEITQRNESG-MUJYYYPQSA-N 2 1 318.892 4.324 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCCCc1ccc(Cl)cc1)C2 ZINC001172110272 1051302726 /nfs/dbraw/zinc/30/27/26/1051302726.db2.gz JIDBUMNHYNSFGT-LDLYASANSA-N 2 1 320.908 4.268 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc4ccccc43)CC1)C2 ZINC001172116041 1051305373 /nfs/dbraw/zinc/30/53/73/1051305373.db2.gz XJUPLVTVUHABJJ-LDLYASANSA-N 2 1 320.480 4.434 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3cccc4ccccc43)CC1)C2 ZINC001172116041 1051305378 /nfs/dbraw/zinc/30/53/78/1051305378.db2.gz XJUPLVTVUHABJJ-LDLYASANSA-N 2 1 320.480 4.434 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1[C@@H]3CC[C@@H](C3)[C@@H]1c1ccccc1)C2 ZINC001172119010 1051305638 /nfs/dbraw/zinc/30/56/38/1051305638.db2.gz UXJNYZVXIFZMQN-FAGWYDQESA-N 2 1 324.512 4.174 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1[C@@H]3CC[C@@H](C3)[C@@H]1c1ccccc1)C2 ZINC001172119010 1051305649 /nfs/dbraw/zinc/30/56/49/1051305649.db2.gz UXJNYZVXIFZMQN-FAGWYDQESA-N 2 1 324.512 4.174 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1[C@@H]3CC[C@@H](C3)[C@@H]1c1ccccc1)C2 ZINC001172119012 1051306648 /nfs/dbraw/zinc/30/66/48/1051306648.db2.gz UXJNYZVXIFZMQN-NWDASVTGSA-N 2 1 324.512 4.174 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1[C@@H]3CC[C@@H](C3)[C@@H]1c1ccccc1)C2 ZINC001172119012 1051306655 /nfs/dbraw/zinc/30/66/55/1051306655.db2.gz UXJNYZVXIFZMQN-NWDASVTGSA-N 2 1 324.512 4.174 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)C1(c2ccccc2)CCCC1 ZINC000186754674 1051349759 /nfs/dbraw/zinc/34/97/59/1051349759.db2.gz LQTBSINKSLNCAQ-YSIASYRMSA-N 2 1 312.501 4.103 20 0 DIADMP CC[C@H](C)OCC[C@H](C)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001172362240 1051373967 /nfs/dbraw/zinc/37/39/67/1051373967.db2.gz SBIJLVISTICIPK-ROUUACIJSA-N 2 1 324.553 4.309 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC001172370114 1051377762 /nfs/dbraw/zinc/37/77/62/1051377762.db2.gz VOAGHUARVYUKMA-HBFSDRIKSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H](CC(C)C)[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172387933 1051392813 /nfs/dbraw/zinc/39/28/13/1051392813.db2.gz ZJPIIJCYYUDFOE-PMACEKPBSA-N 2 1 302.506 4.313 20 0 DIADMP CCCCCC[C@@H](CCC)[NH2+][C@@H]1CC[N@H+](CC2CCOCC2)C1 ZINC001172391982 1051394198 /nfs/dbraw/zinc/39/41/98/1051394198.db2.gz UZAPNFTVDBLGLJ-WOJBJXKFSA-N 2 1 324.553 4.216 20 0 DIADMP CCCCCC[C@@H](CCC)[NH2+][C@@H]1CC[N@@H+](CC2CCOCC2)C1 ZINC001172391982 1051394208 /nfs/dbraw/zinc/39/42/08/1051394208.db2.gz UZAPNFTVDBLGLJ-WOJBJXKFSA-N 2 1 324.553 4.216 20 0 DIADMP CCCCCC[C@H](CCC)[NH2+][C@@H]1CC[N@H+](CC2CCOCC2)C1 ZINC001172391980 1051394828 /nfs/dbraw/zinc/39/48/28/1051394828.db2.gz UZAPNFTVDBLGLJ-VQTJNVASSA-N 2 1 324.553 4.216 20 0 DIADMP CCCCCC[C@H](CCC)[NH2+][C@@H]1CC[N@@H+](CC2CCOCC2)C1 ZINC001172391980 1051394832 /nfs/dbraw/zinc/39/48/32/1051394832.db2.gz UZAPNFTVDBLGLJ-VQTJNVASSA-N 2 1 324.553 4.216 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001172400967 1051400375 /nfs/dbraw/zinc/40/03/75/1051400375.db2.gz LDZMFXKJECGPPX-RLLQIKCJSA-N 2 1 302.506 4.311 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001172400967 1051400383 /nfs/dbraw/zinc/40/03/83/1051400383.db2.gz LDZMFXKJECGPPX-RLLQIKCJSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)OCC[C@@H](C)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172436682 1051406066 /nfs/dbraw/zinc/40/60/66/1051406066.db2.gz GTRTVZBJTZYXJV-MISYRCLQSA-N 2 1 324.553 4.342 20 0 DIADMP CC(C)COCC[C@H](C)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172468037 1051416354 /nfs/dbraw/zinc/41/63/54/1051416354.db2.gz NLDOVFDLAJQMJE-BZSNNMDCSA-N 2 1 312.542 4.056 20 0 DIADMP [NH3+]CCC[C@@H]1CCCC[N@H+]([C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001172555854 1051438642 /nfs/dbraw/zinc/43/86/42/1051438642.db2.gz JYNZQQZPJDJYBA-SXLOBPIMSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172557202 1051438748 /nfs/dbraw/zinc/43/87/48/1051438748.db2.gz PAKVHJNCQGJKMQ-VBSBHUPXSA-N 2 1 300.490 4.031 20 0 DIADMP CCC[N@@H+](CCC[NH3+])[C@@H](C)CCc1c(F)cc(Cl)cc1F ZINC001172567044 1051445130 /nfs/dbraw/zinc/44/51/30/1051445130.db2.gz BRQUHRZOOHBQOT-LBPRGKRZSA-N 2 1 318.839 4.000 20 0 DIADMP [NH3+]CC[N@H+](Cc1ccccc1)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538785 1051451577 /nfs/dbraw/zinc/45/15/77/1051451577.db2.gz SVOMFBQICSCISX-NHCUHLMSSA-N 2 1 308.469 4.174 20 0 DIADMP [NH3+]CC[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172538785 1051451581 /nfs/dbraw/zinc/45/15/81/1051451581.db2.gz SVOMFBQICSCISX-NHCUHLMSSA-N 2 1 308.469 4.174 20 0 DIADMP CCCC[NH+](CCCC)CC[NH2+]C1CC(C)(C)OC(C)(C)C1 ZINC001172649877 1051469974 /nfs/dbraw/zinc/46/99/74/1051469974.db2.gz XKKUHMNAEAEPEY-UHFFFAOYSA-N 2 1 312.542 4.214 20 0 DIADMP CC1(C)CC([N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)CC(C)(C)O1 ZINC001172658283 1051474354 /nfs/dbraw/zinc/47/43/54/1051474354.db2.gz MNLQJRIJFHYDKZ-KRWDZBQOSA-N 2 1 322.537 4.063 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172723493 1051483759 /nfs/dbraw/zinc/48/37/59/1051483759.db2.gz SYXBPPZWNJMJBB-LJQANCHMSA-N 2 1 320.908 4.004 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001169061496 1051502226 /nfs/dbraw/zinc/50/22/26/1051502226.db2.gz LLFIZTRCUMGSMZ-NCYKPQTJSA-N 2 1 314.517 4.249 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001169061496 1051502234 /nfs/dbraw/zinc/50/22/34/1051502234.db2.gz LLFIZTRCUMGSMZ-NCYKPQTJSA-N 2 1 314.517 4.249 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001169061494 1051502330 /nfs/dbraw/zinc/50/23/30/1051502330.db2.gz LLFIZTRCUMGSMZ-BURNTYAHSA-N 2 1 314.517 4.249 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001169061494 1051502340 /nfs/dbraw/zinc/50/23/40/1051502340.db2.gz LLFIZTRCUMGSMZ-BURNTYAHSA-N 2 1 314.517 4.249 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C(C)C)C[C@@H]1C ZINC001169070418 1051506450 /nfs/dbraw/zinc/50/64/50/1051506450.db2.gz QCTOMPZCUMVUHF-CEWLAPEOSA-N 2 1 316.533 4.352 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001169099668 1051508799 /nfs/dbraw/zinc/50/87/99/1051508799.db2.gz DNEIPIBBZSVGQS-AKHDSKFASA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001169101638 1051511140 /nfs/dbraw/zinc/51/11/40/1051511140.db2.gz USCKXQJOSUXHQT-YYAJDYIMSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001169101638 1051511159 /nfs/dbraw/zinc/51/11/59/1051511159.db2.gz USCKXQJOSUXHQT-YYAJDYIMSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001169084252 1051513439 /nfs/dbraw/zinc/51/34/39/1051513439.db2.gz IKGVTLYYOCPBTH-FQEVSTJZSA-N 2 1 314.517 4.062 20 0 DIADMP C[N@@H+](CC1CC[NH+](C)CC1)C1CCC(Cc2ccccc2)CC1 ZINC001172821763 1051514786 /nfs/dbraw/zinc/51/47/86/1051514786.db2.gz HXQQZSCUJLZMAT-UHFFFAOYSA-N 2 1 314.517 4.062 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1)C2 ZINC001169081270 1051515008 /nfs/dbraw/zinc/51/50/08/1051515008.db2.gz PNHAHCQELJAGRW-LRSLUSHPSA-N 2 1 320.480 4.185 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001169085266 1051516718 /nfs/dbraw/zinc/51/67/18/1051516718.db2.gz MVDCKEGLIWUSOE-NRFANRHFSA-N 2 1 314.517 4.202 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139649 1051528445 /nfs/dbraw/zinc/52/84/45/1051528445.db2.gz CSVMEVIZSBYGKI-BASYENTBSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139649 1051528454 /nfs/dbraw/zinc/52/84/54/1051528454.db2.gz CSVMEVIZSBYGKI-BASYENTBSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139649 1051528459 /nfs/dbraw/zinc/52/84/59/1051528459.db2.gz CSVMEVIZSBYGKI-BASYENTBSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@H]([N@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139649 1051528468 /nfs/dbraw/zinc/52/84/68/1051528468.db2.gz CSVMEVIZSBYGKI-BASYENTBSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139652 1051529778 /nfs/dbraw/zinc/52/97/78/1051529778.db2.gz CSVMEVIZSBYGKI-LDDOYCOJSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139652 1051529788 /nfs/dbraw/zinc/52/97/88/1051529788.db2.gz CSVMEVIZSBYGKI-LDDOYCOJSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139652 1051529800 /nfs/dbraw/zinc/52/98/00/1051529800.db2.gz CSVMEVIZSBYGKI-LDDOYCOJSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccccc1Cl)C2 ZINC001169139652 1051529813 /nfs/dbraw/zinc/52/98/13/1051529813.db2.gz CSVMEVIZSBYGKI-LDDOYCOJSA-N 2 1 304.865 4.102 20 0 DIADMP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142627 1051533766 /nfs/dbraw/zinc/53/37/66/1051533766.db2.gz DRTACHJURWTTNI-ZOBORPQBSA-N 2 1 310.894 4.164 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142627 1051533780 /nfs/dbraw/zinc/53/37/80/1051533780.db2.gz DRTACHJURWTTNI-ZOBORPQBSA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142627 1051533793 /nfs/dbraw/zinc/53/37/93/1051533793.db2.gz DRTACHJURWTTNI-ZOBORPQBSA-N 2 1 310.894 4.164 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@@H]1c1ccc(Cl)s1)C2 ZINC001169142627 1051533806 /nfs/dbraw/zinc/53/38/06/1051533806.db2.gz DRTACHJURWTTNI-ZOBORPQBSA-N 2 1 310.894 4.164 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172852735 1051539368 /nfs/dbraw/zinc/53/93/68/1051539368.db2.gz UJINZWLCCPULNQ-TUVASFSCSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@H](Cc1c(F)cccc1Cl)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172852735 1051539381 /nfs/dbraw/zinc/53/93/81/1051539381.db2.gz UJINZWLCCPULNQ-TUVASFSCSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172857583 1051543344 /nfs/dbraw/zinc/54/33/44/1051543344.db2.gz XFSVPRKKKBEITC-VDNDLQMASA-N 2 1 324.871 4.015 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172857583 1051543354 /nfs/dbraw/zinc/54/33/54/1051543354.db2.gz XFSVPRKKKBEITC-VDNDLQMASA-N 2 1 324.871 4.015 20 0 DIADMP Cn1c2ccccc2[nH+]c1Nc1ccc(C2CC[NH+](C)CC2)cc1 ZINC001212687845 1051552893 /nfs/dbraw/zinc/55/28/93/1051552893.db2.gz PXXXPYXRWIFNSK-UHFFFAOYSA-N 2 1 320.440 4.126 20 0 DIADMP CC[NH+]1CCC([NH2+]C(C)(C)c2cc(Cl)cc(Cl)c2)CC1 ZINC001169230084 1051557324 /nfs/dbraw/zinc/55/73/24/1051557324.db2.gz OQIGHXUHLYXNAW-UHFFFAOYSA-N 2 1 315.288 4.302 20 0 DIADMP CC[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC)CC1 ZINC001169262344 1051559955 /nfs/dbraw/zinc/55/99/55/1051559955.db2.gz YYWJVPOIPOSWRW-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC)CC1 ZINC001169262344 1051559965 /nfs/dbraw/zinc/55/99/65/1051559965.db2.gz YYWJVPOIPOSWRW-UHFFFAOYSA-N 2 1 314.395 4.012 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000178254228 1051564528 /nfs/dbraw/zinc/56/45/28/1051564528.db2.gz ZOYSPOKOFAUEMS-CYBMUJFWSA-N 2 1 321.534 4.100 20 0 DIADMP Cc1ccsc1C[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001204023625 1051566050 /nfs/dbraw/zinc/56/60/50/1051566050.db2.gz MAHDONOXBPCYLE-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccsc1 ZINC000178335753 1051569105 /nfs/dbraw/zinc/56/91/05/1051569105.db2.gz NHQSHZHBRNWUIL-TXPKVOOTSA-N 2 1 314.498 4.452 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccsc1 ZINC000178335753 1051569118 /nfs/dbraw/zinc/56/91/18/1051569118.db2.gz NHQSHZHBRNWUIL-TXPKVOOTSA-N 2 1 314.498 4.452 20 0 DIADMP FC1(F)CCC[C@@H]1CC[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC001170469748 1051584821 /nfs/dbraw/zinc/58/48/21/1051584821.db2.gz RCYHDNKPBGHGCB-QGZVFWFLSA-N 2 1 322.443 4.066 20 0 DIADMP CCCC[NH+](CCCC)CC[NH2+]C1CCC2(CCOCC2)CC1 ZINC001173040951 1051590734 /nfs/dbraw/zinc/59/07/34/1051590734.db2.gz QNZPFGSXUQJWFW-UHFFFAOYSA-N 2 1 324.553 4.218 20 0 DIADMP CCCC[NH+](CCCC)CC[NH2+]C1CCC(OCCC)CC1 ZINC001173092227 1051598082 /nfs/dbraw/zinc/59/80/82/1051598082.db2.gz JZGFFAAYAHSCTJ-UHFFFAOYSA-N 2 1 312.542 4.216 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCCC[C@H]2c2cccnc2)CC1 ZINC001173111450 1051610314 /nfs/dbraw/zinc/61/03/14/1051610314.db2.gz FPHIWRYCOKXJGY-MHJFOBGBSA-N 2 1 315.505 4.262 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCC(F)(F)C(C)(C)C2)CC1 ZINC001173110894 1051610543 /nfs/dbraw/zinc/61/05/43/1051610543.db2.gz ZQZIXELDEXAZLU-UHFFFAOYSA-N 2 1 302.453 4.007 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@@H](C)c2ccc(OC)cc2)CC1 ZINC001173114987 1051611736 /nfs/dbraw/zinc/61/17/36/1051611736.db2.gz VLSNCVKWOJFFNJ-IVMQYODDSA-N 2 1 318.505 4.341 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)CCc2ccccc2Cl)CC1 ZINC001173114411 1051611985 /nfs/dbraw/zinc/61/19/85/1051611985.db2.gz IYWDOPAULFTWLS-UHFFFAOYSA-N 2 1 322.924 4.467 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)CCc2cccc(C)c2)CC1 ZINC001173115161 1051612066 /nfs/dbraw/zinc/61/20/66/1051612066.db2.gz XEEPQBHWPWKXBN-UHFFFAOYSA-N 2 1 302.506 4.122 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCC[C@@H]2c2ccc(C)nc2)CC1 ZINC001173113376 1051612084 /nfs/dbraw/zinc/61/20/84/1051612084.db2.gz OMZMMWAONJKEFF-SOAGJPPSSA-N 2 1 315.505 4.180 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](Cc2ccccc2)C2CC2)CC1 ZINC001173113182 1051612140 /nfs/dbraw/zinc/61/21/40/1051612140.db2.gz KPLPZOWCIVLMGM-UHFFFAOYSA-N 2 1 300.490 4.304 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](c3cccc(F)c3)C2)CC1 ZINC001173115199 1051612180 /nfs/dbraw/zinc/61/21/80/1051612180.db2.gz YSMKNKKVQFALGS-QHGAOEGBSA-N 2 1 318.480 4.268 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+]CCCC2CCCCC2)[C@H](C)C1 ZINC001169557750 1051644984 /nfs/dbraw/zinc/64/49/84/1051644984.db2.gz ZHSCVWBUYHBWRV-QUCCMNQESA-N 2 1 324.553 4.074 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(Cl)c1Cl ZINC001206013099 1051649872 /nfs/dbraw/zinc/64/98/72/1051649872.db2.gz PFCBTCANWFVLAZ-CHWSQXEVSA-N 2 1 315.288 4.109 20 0 DIADMP C[C@@H](C[NH3+])C[N@@H+](C)[C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001173211532 1051650265 /nfs/dbraw/zinc/65/02/65/1051650265.db2.gz QZZKAPDCGXJQMO-ROUUACIJSA-N 2 1 310.485 4.124 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173265366 1051665138 /nfs/dbraw/zinc/66/51/38/1051665138.db2.gz SSLCWTOHNDBEMO-LELZANKISA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001173269092 1051666881 /nfs/dbraw/zinc/66/68/81/1051666881.db2.gz SSLCWTOHNDBEMO-PPQDBTBKSA-N 2 1 312.501 4.350 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293433 1051675407 /nfs/dbraw/zinc/67/54/07/1051675407.db2.gz LLRTULYBRNAWKZ-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001173293433 1051675412 /nfs/dbraw/zinc/67/54/12/1051675412.db2.gz LLRTULYBRNAWKZ-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001173292505 1051675625 /nfs/dbraw/zinc/67/56/25/1051675625.db2.gz GZINFETXHHBEMD-RLLQIKCJSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001173292505 1051675633 /nfs/dbraw/zinc/67/56/33/1051675633.db2.gz GZINFETXHHBEMD-RLLQIKCJSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001173292505 1051675637 /nfs/dbraw/zinc/67/56/37/1051675637.db2.gz GZINFETXHHBEMD-RLLQIKCJSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc2[nH]c[nH+]c2c1C ZINC001169698623 1051677652 /nfs/dbraw/zinc/67/76/52/1051677652.db2.gz SAJMKVLCASKDKJ-HNNXBMFYSA-N 2 1 306.413 4.111 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001173276394 1051684634 /nfs/dbraw/zinc/68/46/34/1051684634.db2.gz QHEJVBIMSCVSEI-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001173280689 1051685859 /nfs/dbraw/zinc/68/58/59/1051685859.db2.gz PMNPSKCCMGGLFM-IEBWSBKVSA-N 2 1 316.489 4.146 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291777 1051690314 /nfs/dbraw/zinc/69/03/14/1051690314.db2.gz CLGMSLMYJXKJKH-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@H]1CC[C@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001173291777 1051690320 /nfs/dbraw/zinc/69/03/20/1051690320.db2.gz CLGMSLMYJXKJKH-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822113 1051706262 /nfs/dbraw/zinc/70/62/62/1051706262.db2.gz RGJFYYOSZZISPO-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822113 1051706276 /nfs/dbraw/zinc/70/62/76/1051706276.db2.gz RGJFYYOSZZISPO-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822113 1051706289 /nfs/dbraw/zinc/70/62/89/1051706289.db2.gz RGJFYYOSZZISPO-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC001169822113 1051706306 /nfs/dbraw/zinc/70/63/06/1051706306.db2.gz RGJFYYOSZZISPO-MSOLQXFVSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173347843 1051706724 /nfs/dbraw/zinc/70/67/24/1051706724.db2.gz BYBMZWULLBNUPZ-IBGZPJMESA-N 2 1 304.522 4.438 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183196574 1051709522 /nfs/dbraw/zinc/70/95/22/1051709522.db2.gz VIPRKIAJZPYSKD-OWCLPIDISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183196574 1051709538 /nfs/dbraw/zinc/70/95/38/1051709538.db2.gz VIPRKIAJZPYSKD-OWCLPIDISA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1F ZINC000183196535 1051710835 /nfs/dbraw/zinc/71/08/35/1051710835.db2.gz VIPRKIAJZPYSKD-HRCADAONSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1F ZINC000183196535 1051710849 /nfs/dbraw/zinc/71/08/49/1051710849.db2.gz VIPRKIAJZPYSKD-HRCADAONSA-N 2 1 304.453 4.129 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001206025684 1051732246 /nfs/dbraw/zinc/73/22/46/1051732246.db2.gz OZBSLYSRKBAJHF-STQMWFEESA-N 2 1 315.288 4.109 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000185517282 1051771782 /nfs/dbraw/zinc/77/17/82/1051771782.db2.gz UTVWYLRNAFKCNM-LMPOIIKSSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000185517282 1051771789 /nfs/dbraw/zinc/77/17/89/1051771789.db2.gz UTVWYLRNAFKCNM-LMPOIIKSSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CC2CCC(C(F)(F)F)CC2)[C@H](C)C1 ZINC000185517282 1051771798 /nfs/dbraw/zinc/77/17/98/1051771798.db2.gz UTVWYLRNAFKCNM-LMPOIIKSSA-N 2 1 320.443 4.017 20 0 DIADMP CCSc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000185518068 1051772603 /nfs/dbraw/zinc/77/26/03/1051772603.db2.gz YBGJDMTVAZEHTL-KRWDZBQOSA-N 2 1 306.519 4.009 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000186299920 1051807651 /nfs/dbraw/zinc/80/76/51/1051807651.db2.gz JPALNPSUSBGLLT-WBVHZDCISA-N 2 1 306.519 4.128 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000186299920 1051807663 /nfs/dbraw/zinc/80/76/63/1051807663.db2.gz JPALNPSUSBGLLT-WBVHZDCISA-N 2 1 306.519 4.128 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)C2CCSCC2)c1 ZINC000187096579 1051835319 /nfs/dbraw/zinc/83/53/19/1051835319.db2.gz WSVPELVKVRVURO-INIZCTEOSA-N 2 1 320.546 4.148 20 0 DIADMP CC[C@H](NC[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330005 1051873695 /nfs/dbraw/zinc/87/36/95/1051873695.db2.gz GJHSRJXEOOENLT-APWZRJJASA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccccc1F ZINC000494330005 1051873704 /nfs/dbraw/zinc/87/37/04/1051873704.db2.gz GJHSRJXEOOENLT-APWZRJJASA-N 2 1 306.469 4.234 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1F ZINC000494330005 1051873715 /nfs/dbraw/zinc/87/37/15/1051873715.db2.gz GJHSRJXEOOENLT-APWZRJJASA-N 2 1 306.469 4.234 20 0 DIADMP c1ccc(CC[NH+]2CCC([NH2+][C@H]3CCC34CCCC4)CC2)cc1 ZINC000189062608 1051874523 /nfs/dbraw/zinc/87/45/23/1051874523.db2.gz IQYRXNMWMZLACO-FQEVSTJZSA-N 2 1 312.501 4.006 20 0 DIADMP C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)o1 ZINC000768215796 1051905313 /nfs/dbraw/zinc/90/53/13/1051905313.db2.gz YIPYLNKBCPJNJS-KXBFYZLASA-N 2 1 312.457 4.097 20 0 DIADMP Cc1cccc(N2CCC([NH2+]CC[C@H](C)c3ccccc3)CC2)[nH+]1 ZINC000191098175 1051960828 /nfs/dbraw/zinc/96/08/28/1051960828.db2.gz YQXNZNCLAKXQLS-KRWDZBQOSA-N 2 1 323.484 4.142 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168467308 1051993259 /nfs/dbraw/zinc/99/32/59/1051993259.db2.gz IRRQFFFJDPWYEM-SNRMKQJTSA-N 2 1 320.496 4.375 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000192708464 1052016742 /nfs/dbraw/zinc/01/67/42/1052016742.db2.gz OERDUJKGDRXOAJ-YVAYNOFSSA-N 2 1 312.501 4.333 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000226128621 1052047537 /nfs/dbraw/zinc/04/75/37/1052047537.db2.gz VXEAFZVPIZNYIE-KFWWJZLASA-N 2 1 308.432 4.208 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2C)C2CCCC2)C1 ZINC000494890687 1052157946 /nfs/dbraw/zinc/15/79/46/1052157946.db2.gz OAJFQHGPMOOBGJ-FXAWDEMLSA-N 2 1 300.490 4.158 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2C)C2CCCC2)C1 ZINC000494890689 1052158867 /nfs/dbraw/zinc/15/88/67/1052158867.db2.gz OAJFQHGPMOOBGJ-XLIONFOSSA-N 2 1 300.490 4.158 20 0 DIADMP Cc1ccccc1[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000494919994 1052171868 /nfs/dbraw/zinc/17/18/68/1052171868.db2.gz FZKNFUPIUYJEAG-LAUBAEHRSA-N 2 1 312.501 4.300 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)[C@H]1C ZINC000495077910 1052211102 /nfs/dbraw/zinc/21/11/02/1052211102.db2.gz HISVIZFLVKYFFV-GUXCAODWSA-N 2 1 312.457 4.046 20 0 DIADMP CCC(CC)[C@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218294612 1052219522 /nfs/dbraw/zinc/21/95/22/1052219522.db2.gz BGQXDTGJSXTYGX-IBGZPJMESA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccc([C@H](C)Oc2ccccc2C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218343869 1052228967 /nfs/dbraw/zinc/22/89/67/1052228967.db2.gz LWYYRGVFHKITAG-KRWDZBQOSA-N 2 1 324.468 4.058 20 0 DIADMP CCCC[C@@H](CCC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218354217 1052229812 /nfs/dbraw/zinc/22/98/12/1052229812.db2.gz CPWAFKZMUFRSDY-LJQANCHMSA-N 2 1 318.505 4.347 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309716083 1052235953 /nfs/dbraw/zinc/23/59/53/1052235953.db2.gz KVDUGXHJARSGQP-RLLQIKCJSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309720349 1052235992 /nfs/dbraw/zinc/23/59/92/1052235992.db2.gz MCDYVACTNWIJOC-NRSPTQNISA-N 2 1 314.517 4.457 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309813019 1052251429 /nfs/dbraw/zinc/25/14/29/1052251429.db2.gz NFVBXTNRCWRFHN-AZUAARDMSA-N 2 1 302.506 4.170 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1 ZINC000310334130 1052265154 /nfs/dbraw/zinc/26/51/54/1052265154.db2.gz AUHLXJVYUYTKOE-NRFANRHFSA-N 2 1 322.496 4.224 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCSC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000089516531 1052379810 /nfs/dbraw/zinc/37/98/10/1052379810.db2.gz FZOYZDGJDJLURK-SJLPKXTDSA-N 2 1 320.546 4.161 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCSC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC000089516531 1052379817 /nfs/dbraw/zinc/37/98/17/1052379817.db2.gz FZOYZDGJDJLURK-SJLPKXTDSA-N 2 1 320.546 4.161 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000236729786 1052429939 /nfs/dbraw/zinc/42/99/39/1052429939.db2.gz UJQDOLGTLOFGKF-LJQANCHMSA-N 2 1 302.506 4.365 20 0 DIADMP C[N@@H+](CCC[NH2+]C1CC(c2ccccc2)C1)Cc1ccccc1 ZINC000237077877 1052434766 /nfs/dbraw/zinc/43/47/66/1052434766.db2.gz RLNQLVJQPBWGLZ-UHFFFAOYSA-N 2 1 308.469 4.044 20 0 DIADMP C[C@@H]1CCCC[C@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237382952 1052439680 /nfs/dbraw/zinc/43/96/80/1052439680.db2.gz HWLKTNDBFGBEIV-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000237494641 1052441200 /nfs/dbraw/zinc/44/12/00/1052441200.db2.gz VJYUNLGFJKDOFQ-CMAIMYMYSA-N 2 1 300.490 4.192 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CC[C@@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222141397 1052449793 /nfs/dbraw/zinc/44/97/93/1052449793.db2.gz KIENYHJQKZWZCD-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222141397 1052449797 /nfs/dbraw/zinc/44/97/97/1052449797.db2.gz KIENYHJQKZWZCD-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)cc2)c1 ZINC001222148098 1052450640 /nfs/dbraw/zinc/45/06/40/1052450640.db2.gz KBDSNQWVIOWUBN-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222148994 1052450779 /nfs/dbraw/zinc/45/07/79/1052450779.db2.gz UAXGYXVVDFVXAY-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)cc2)cc1 ZINC001222149293 1052451576 /nfs/dbraw/zinc/45/15/76/1052451576.db2.gz XNUABWMOWFHQHI-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP Fc1ccccc1CCC[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222153968 1052451709 /nfs/dbraw/zinc/45/17/09/1052451709.db2.gz DRKCISQOWGPMCR-HXUWFJFHSA-N 2 1 318.480 4.004 20 0 DIADMP FC1(F)CCC(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)CC1 ZINC001222155280 1052452892 /nfs/dbraw/zinc/45/28/92/1052452892.db2.gz ZCRXFKRIVBGLLB-QGZVFWFLSA-N 2 1 314.464 4.058 20 0 DIADMP FC(F)c1ccccc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222160610 1052454079 /nfs/dbraw/zinc/45/40/79/1052454079.db2.gz HBBKZHQSXNTGNE-IBGZPJMESA-N 2 1 322.443 4.370 20 0 DIADMP c1oc2ccccc2c1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222166815 1052454987 /nfs/dbraw/zinc/45/49/87/1052454987.db2.gz CMBXYSYZNNZXBC-HXUWFJFHSA-N 2 1 312.457 4.179 20 0 DIADMP CSc1ccccc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222167222 1052456156 /nfs/dbraw/zinc/45/61/56/1052456156.db2.gz IGNRTTGUKJGVEL-IBGZPJMESA-N 2 1 318.530 4.154 20 0 DIADMP FC(F)c1ccc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222168239 1052456218 /nfs/dbraw/zinc/45/62/18/1052456218.db2.gz YJCOWQCBPJKDOE-LJQANCHMSA-N 2 1 322.443 4.370 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222173754 1052457100 /nfs/dbraw/zinc/45/71/00/1052457100.db2.gz XEVLDAGATHZFAZ-FQEVSTJZSA-N 2 1 317.521 4.058 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c1 ZINC001222173754 1052457103 /nfs/dbraw/zinc/45/71/03/1052457103.db2.gz XEVLDAGATHZFAZ-FQEVSTJZSA-N 2 1 317.521 4.058 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222173755 1052457249 /nfs/dbraw/zinc/45/72/49/1052457249.db2.gz XEVLDAGATHZFAZ-HXUWFJFHSA-N 2 1 317.521 4.058 20 0 DIADMP CC(C)(C)c1c[nH]c(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c1 ZINC001222173755 1052457253 /nfs/dbraw/zinc/45/72/53/1052457253.db2.gz XEVLDAGATHZFAZ-HXUWFJFHSA-N 2 1 317.521 4.058 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)([NH+](C)C)C1 ZINC000316209923 1052458329 /nfs/dbraw/zinc/45/83/29/1052458329.db2.gz VSXUTMNZRIZJKE-UGUYLWEFSA-N 2 1 320.443 4.208 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@]12CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222231620 1052465232 /nfs/dbraw/zinc/46/52/32/1052465232.db2.gz OJYMUIRFRWGWPX-DYESRHJHSA-N 2 1 308.469 4.161 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222259468 1052470370 /nfs/dbraw/zinc/47/03/70/1052470370.db2.gz QPJDKLSQOILEOD-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222259468 1052470373 /nfs/dbraw/zinc/47/03/73/1052470373.db2.gz QPJDKLSQOILEOD-JOCHJYFZSA-N 2 1 320.480 4.380 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000316783436 1052472867 /nfs/dbraw/zinc/47/28/67/1052472867.db2.gz MXWHIDMSFVFRCC-KKUMJFAQSA-N 2 1 300.446 4.129 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000316783436 1052472874 /nfs/dbraw/zinc/47/28/74/1052472874.db2.gz MXWHIDMSFVFRCC-KKUMJFAQSA-N 2 1 300.446 4.129 20 0 DIADMP CC(C)(C)C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000316903643 1052474910 /nfs/dbraw/zinc/47/49/10/1052474910.db2.gz ZOKBDVPKPMOWCV-OTWHNJEPSA-N 2 1 300.490 4.380 20 0 DIADMP Clc1ccc([C@@H]2C[C@@H]2C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001222309792 1052478736 /nfs/dbraw/zinc/47/87/36/1052478736.db2.gz SJGMJKUOFPKMBI-NZSAHSFTSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc(C[N@@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1Cl ZINC001222309265 1052479034 /nfs/dbraw/zinc/47/90/34/1052479034.db2.gz PDJTZCYJBDZBFW-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1Cl ZINC001222309265 1052479036 /nfs/dbraw/zinc/47/90/36/1052479036.db2.gz PDJTZCYJBDZBFW-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)cc1 ZINC001222316461 1052480932 /nfs/dbraw/zinc/48/09/32/1052480932.db2.gz WNCWIFJDUCSOFG-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c2ccccc12 ZINC001222315637 1052480951 /nfs/dbraw/zinc/48/09/51/1052480951.db2.gz PCFGFIUCHRAZLT-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222315534 1052481051 /nfs/dbraw/zinc/48/10/51/1052481051.db2.gz OHLKXIGHPNQDEM-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c1C ZINC001222321599 1052481720 /nfs/dbraw/zinc/48/17/20/1052481720.db2.gz ZYLGYYQPYNEELO-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@H](C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345076 1052487657 /nfs/dbraw/zinc/48/76/57/1052487657.db2.gz IFTGRNZKPGCLDP-UTKZUKDTSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345076 1052487660 /nfs/dbraw/zinc/48/76/60/1052487660.db2.gz IFTGRNZKPGCLDP-UTKZUKDTSA-N 2 1 308.469 4.161 20 0 DIADMP Cc1c(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222361521 1052490653 /nfs/dbraw/zinc/49/06/53/1052490653.db2.gz ZLOKMMXMCNPUDY-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222361521 1052490658 /nfs/dbraw/zinc/49/06/58/1052490658.db2.gz ZLOKMMXMCNPUDY-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@]3(CCCC[NH2+]3)C2)c2ccccc12 ZINC001222385389 1052494021 /nfs/dbraw/zinc/49/40/21/1052494021.db2.gz LTUFAKWPXDWJAT-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]3(CCCC[NH2+]3)C2)c2ccccc12 ZINC001222385389 1052494030 /nfs/dbraw/zinc/49/40/30/1052494030.db2.gz LTUFAKWPXDWJAT-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP c1ccc(C(C[N@@H+]2CC[C@]3(C2)CCCC[NH2+]3)c2ccccc2)cc1 ZINC001222422031 1052498311 /nfs/dbraw/zinc/49/83/11/1052498311.db2.gz QEPIPSKOAXECAW-QFIPXVFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc(C(C[N@H+]2CC[C@]3(C2)CCCC[NH2+]3)c2ccccc2)cc1 ZINC001222422031 1052498318 /nfs/dbraw/zinc/49/83/18/1052498318.db2.gz QEPIPSKOAXECAW-QFIPXVFZSA-N 2 1 320.480 4.037 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)[C@H]1CC1(C)C ZINC000397602570 1052529872 /nfs/dbraw/zinc/52/98/72/1052529872.db2.gz ALOWXFALOIXGGM-RNIPGJKVSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)[C@H]1CC1(C)C ZINC000397602570 1052529878 /nfs/dbraw/zinc/52/98/78/1052529878.db2.gz ALOWXFALOIXGGM-RNIPGJKVSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000398024649 1052562522 /nfs/dbraw/zinc/56/25/22/1052562522.db2.gz LONIPBNYVRKZLP-KNQAVFIVSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000398024649 1052562530 /nfs/dbraw/zinc/56/25/30/1052562530.db2.gz LONIPBNYVRKZLP-KNQAVFIVSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398157311 1052565988 /nfs/dbraw/zinc/56/59/88/1052565988.db2.gz RBSMTKGNSVLMML-LQWHRVPQSA-N 2 1 308.469 4.248 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398157311 1052565996 /nfs/dbraw/zinc/56/59/96/1052565996.db2.gz RBSMTKGNSVLMML-LQWHRVPQSA-N 2 1 308.469 4.248 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@H]2CC=CCC2)[C@@H]1c1cccs1 ZINC000123562141 1052632169 /nfs/dbraw/zinc/63/21/69/1052632169.db2.gz AOIGORQUFUMFEQ-LZLYRXPVSA-N 2 1 304.503 4.077 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@H]2CC=CCC2)[C@@H]1c1cccs1 ZINC000123562141 1052632173 /nfs/dbraw/zinc/63/21/73/1052632173.db2.gz AOIGORQUFUMFEQ-LZLYRXPVSA-N 2 1 304.503 4.077 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000125473849 1052649040 /nfs/dbraw/zinc/64/90/40/1052649040.db2.gz FUSVUBOPHXYTIP-UHFFFAOYSA-N 2 1 317.864 4.290 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000125473849 1052649042 /nfs/dbraw/zinc/64/90/42/1052649042.db2.gz FUSVUBOPHXYTIP-UHFFFAOYSA-N 2 1 317.864 4.290 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000154726426 1052796922 /nfs/dbraw/zinc/79/69/22/1052796922.db2.gz XKGXGTYPOHWWGF-CYBMUJFWSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587199 1052797687 /nfs/dbraw/zinc/79/76/87/1052797687.db2.gz FVLAAJNPEJEFGM-NTZNESFSSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587199 1052797691 /nfs/dbraw/zinc/79/76/91/1052797691.db2.gz FVLAAJNPEJEFGM-NTZNESFSSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@@H]1C ZINC000322011437 1052800648 /nfs/dbraw/zinc/80/06/48/1052800648.db2.gz PEZJHDLBBUKSOD-LVCYWYKZSA-N 2 1 314.517 4.108 20 0 DIADMP CC(C)CC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000556117655 1052803438 /nfs/dbraw/zinc/80/34/38/1052803438.db2.gz FGJDRCJZZDFPAM-RBUKOAKNSA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)CC1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CC1 ZINC000556117655 1052803443 /nfs/dbraw/zinc/80/34/43/1052803443.db2.gz FGJDRCJZZDFPAM-RBUKOAKNSA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)CC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000556117653 1052803494 /nfs/dbraw/zinc/80/34/94/1052803494.db2.gz FGJDRCJZZDFPAM-MOPGFXCFSA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)CC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000556117653 1052803495 /nfs/dbraw/zinc/80/34/95/1052803495.db2.gz FGJDRCJZZDFPAM-MOPGFXCFSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)CC[N@@H+]1C ZINC000498353584 1052820363 /nfs/dbraw/zinc/82/03/63/1052820363.db2.gz MXWPZAVTOQPQHD-RSPOEFSDSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)CC[N@H+]1C ZINC000498353584 1052820364 /nfs/dbraw/zinc/82/03/64/1052820364.db2.gz MXWPZAVTOQPQHD-RSPOEFSDSA-N 2 1 300.490 4.175 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)C2CC2)C[C@H]1c1ccccc1 ZINC000556255045 1052827652 /nfs/dbraw/zinc/82/76/52/1052827652.db2.gz VFBUDGFGYZGCIF-MOPGFXCFSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCC(C)(C)C2CC2)C[C@H]1c1ccccc1 ZINC000556255045 1052827657 /nfs/dbraw/zinc/82/76/57/1052827657.db2.gz VFBUDGFGYZGCIF-MOPGFXCFSA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000556584040 1052867507 /nfs/dbraw/zinc/86/75/07/1052867507.db2.gz OKBMTHBTBFPGPK-CABCVRRESA-N 2 1 324.896 4.120 20 0 DIADMP CC(C)Oc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000556584042 1052867908 /nfs/dbraw/zinc/86/79/08/1052867908.db2.gz OKBMTHBTBFPGPK-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP COCC[N@H+](C)CC[C@@H]([NH2+]C1CCCCCC1)c1ccccc1 ZINC000556769239 1052880607 /nfs/dbraw/zinc/88/06/07/1052880607.db2.gz MYAKUADMOHHWJT-HXUWFJFHSA-N 2 1 318.505 4.008 20 0 DIADMP COCC[N@@H+](C)CC[C@@H]([NH2+]C1CCCCCC1)c1ccccc1 ZINC000556769239 1052880611 /nfs/dbraw/zinc/88/06/11/1052880611.db2.gz MYAKUADMOHHWJT-HXUWFJFHSA-N 2 1 318.505 4.008 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)cc12 ZINC001226784812 1052930916 /nfs/dbraw/zinc/93/09/16/1052930916.db2.gz NZQZGWVWKYHKGA-UHFFFAOYSA-N 2 1 320.436 4.304 20 0 DIADMP c1csc(-c2ccccc2C[NH+]2CCC3(CCC[NH2+]3)CC2)c1 ZINC001226784781 1052931259 /nfs/dbraw/zinc/93/12/59/1052931259.db2.gz NLHAYMJWFNHWFB-UHFFFAOYSA-N 2 1 312.482 4.133 20 0 DIADMP CC[C@@H](C)[C@@H](C)[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000179841507 1053031429 /nfs/dbraw/zinc/03/14/29/1053031429.db2.gz YEPBTZFWNUYJDF-HZPDHXFCSA-N 2 1 303.494 4.064 20 0 DIADMP CC(C)CCC[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236453335 1053040648 /nfs/dbraw/zinc/04/06/48/1053040648.db2.gz PXTWEKZJXXFQPF-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP Cc1nc2ccc(O[C@@H](CC[NH+](C)C)c3cccs3)cc2[nH]1 ZINC001228327578 1053073286 /nfs/dbraw/zinc/07/32/86/1053073286.db2.gz RTZDABRUPOKIIY-INIZCTEOSA-N 2 1 315.442 4.005 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000519435171 1053142140 /nfs/dbraw/zinc/14/21/40/1053142140.db2.gz JGIKZVRYRWPGSY-LRSLUSHPSA-N 2 1 320.480 4.215 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)C[C@H]1c1ccccc1 ZINC000519435171 1053142147 /nfs/dbraw/zinc/14/21/47/1053142147.db2.gz JGIKZVRYRWPGSY-LRSLUSHPSA-N 2 1 320.480 4.215 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187324 1053224693 /nfs/dbraw/zinc/22/46/93/1053224693.db2.gz MEVDWFYHSSNVIT-RHSMWYFYSA-N 2 1 324.896 4.121 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC)C1)c1cc(Cl)ccc1OC ZINC001319187324 1053224703 /nfs/dbraw/zinc/22/47/03/1053224703.db2.gz MEVDWFYHSSNVIT-RHSMWYFYSA-N 2 1 324.896 4.121 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC001319192156 1053226946 /nfs/dbraw/zinc/22/69/46/1053226946.db2.gz JHMVAZGRDBBMRR-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP Cc1cccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000251203989 1053227128 /nfs/dbraw/zinc/22/71/28/1053227128.db2.gz VSVLWAPOGQMAGW-UYAOXDASSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000251203989 1053227136 /nfs/dbraw/zinc/22/71/36/1053227136.db2.gz VSVLWAPOGQMAGW-UYAOXDASSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000251203989 1053227143 /nfs/dbraw/zinc/22/71/43/1053227143.db2.gz VSVLWAPOGQMAGW-UYAOXDASSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000251203984 1053227582 /nfs/dbraw/zinc/22/75/82/1053227582.db2.gz VSVLWAPOGQMAGW-QUCCMNQESA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000251203984 1053227587 /nfs/dbraw/zinc/22/75/87/1053227587.db2.gz VSVLWAPOGQMAGW-QUCCMNQESA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000251203984 1053227600 /nfs/dbraw/zinc/22/76/00/1053227600.db2.gz VSVLWAPOGQMAGW-QUCCMNQESA-N 2 1 300.490 4.081 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000251348065 1053231375 /nfs/dbraw/zinc/23/13/75/1053231375.db2.gz FRUSOJWBTRGXAX-UBHSHLNASA-N 2 1 313.272 4.271 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000251348067 1053231516 /nfs/dbraw/zinc/23/15/16/1053231516.db2.gz FRUSOJWBTRGXAX-YUTCNCBUSA-N 2 1 313.272 4.271 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccccn1 ZINC000090586171 1053237031 /nfs/dbraw/zinc/23/70/31/1053237031.db2.gz CCSSGXPPWSOLKS-AZUAARDMSA-N 2 1 317.521 4.126 20 0 DIADMP CC(C)C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccn1 ZINC000090586171 1053237045 /nfs/dbraw/zinc/23/70/45/1053237045.db2.gz CCSSGXPPWSOLKS-AZUAARDMSA-N 2 1 317.521 4.126 20 0 DIADMP CC[N@H+]1CCC[C@H](CN[C@@H](C)c2cc(Cl)sc2Cl)C1 ZINC001319383069 1053240135 /nfs/dbraw/zinc/24/01/35/1053240135.db2.gz IZBZPEINSOWNCI-WDEREUQCSA-N 2 1 321.317 4.437 20 0 DIADMP Fc1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000091284484 1053259182 /nfs/dbraw/zinc/25/91/82/1053259182.db2.gz MRZGQDZWUBVECD-QRWLVFNGSA-N 2 1 316.464 4.131 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC001319756495 1053272197 /nfs/dbraw/zinc/27/21/97/1053272197.db2.gz XRFICXOHMJYUCX-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC001319908216 1053285229 /nfs/dbraw/zinc/28/52/29/1053285229.db2.gz WUUOGNWRJGFTDE-SFHVURJKSA-N 2 1 308.469 4.098 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC001319908216 1053285237 /nfs/dbraw/zinc/28/52/37/1053285237.db2.gz WUUOGNWRJGFTDE-SFHVURJKSA-N 2 1 308.469 4.098 20 0 DIADMP CC1(C)CC[N@@H+](Cc2cccc(-c3ccccn3)c2)CC(C)(C)[NH2+]1 ZINC001474755545 1053392816 /nfs/dbraw/zinc/39/28/16/1053392816.db2.gz NFXAHTPLCSOFKO-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc(Cl)c2C)c1 ZINC001200243573 1053493303 /nfs/dbraw/zinc/49/33/03/1053493303.db2.gz KCRBTJZCPGDXBO-UHFFFAOYSA-N 2 1 316.876 4.390 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)cc1 ZINC000763620109 1053665111 /nfs/dbraw/zinc/66/51/11/1053665111.db2.gz FCMARJCHAWIPCL-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@@H]1c1ccccc1 ZINC000414175717 1053674159 /nfs/dbraw/zinc/67/41/59/1053674159.db2.gz ZKYISRRBMBEQLH-XIGKFDRGSA-N 2 1 324.443 4.107 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@@H]1c1ccccc1 ZINC000414175717 1053674167 /nfs/dbraw/zinc/67/41/67/1053674167.db2.gz ZKYISRRBMBEQLH-XIGKFDRGSA-N 2 1 324.443 4.107 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2cccs2)C2CCCC2)C1 ZINC001324836077 1053682901 /nfs/dbraw/zinc/68/29/01/1053682901.db2.gz VIWRWXOQUIBGGW-MAUKXSAKSA-N 2 1 306.519 4.301 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+]2CCC3(C2)CC[NH+](C)CC3)c(C)c1C ZINC001231493635 1053769931 /nfs/dbraw/zinc/76/99/31/1053769931.db2.gz BODRKXNHIVJSLN-UHFFFAOYSA-N 2 1 314.517 4.146 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2c(C)c(C)c(C)c(C)c2C)CC1 ZINC001231494954 1053772463 /nfs/dbraw/zinc/77/24/63/1053772463.db2.gz VCFKYSSJWQOSPH-UHFFFAOYSA-N 2 1 302.506 4.145 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2c(C)c(C)c(C)c(C)c2C)CC1 ZINC001231494954 1053772473 /nfs/dbraw/zinc/77/24/73/1053772473.db2.gz VCFKYSSJWQOSPH-UHFFFAOYSA-N 2 1 302.506 4.145 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)CC3CC[NH+](C)CC3)cc2)o1 ZINC001231597188 1053795866 /nfs/dbraw/zinc/79/58/66/1053795866.db2.gz HMDCHOCZBZSSNN-UHFFFAOYSA-N 2 1 312.457 4.029 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2c(C)sc3ccccc32)CC1 ZINC001231647654 1053816370 /nfs/dbraw/zinc/81/63/70/1053816370.db2.gz NWCOUTVKYXOOKJ-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2c(C)sc3ccccc32)CC1 ZINC001231647654 1053816387 /nfs/dbraw/zinc/81/63/87/1053816387.db2.gz NWCOUTVKYXOOKJ-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP Cc1ccc(C[N@@H+](C)CC2CC[NH+](C)CC2)c(Cl)c1Cl ZINC001231667232 1053825641 /nfs/dbraw/zinc/82/56/41/1053825641.db2.gz FQBHAAYCNMALFS-UHFFFAOYSA-N 2 1 315.288 4.075 20 0 DIADMP Cc1csc2sc(C[NH+]3CC[C@@]4(CC[N@H+](C)C4)C3)c(C)c12 ZINC001231830879 1053886716 /nfs/dbraw/zinc/88/67/16/1053886716.db2.gz FUDLDQOCTPHPAR-QGZVFWFLSA-N 2 1 320.527 4.107 20 0 DIADMP Cc1csc2sc(C[N@H+]3CC[C@@]4(CC[NH+](C)C4)C3)c(C)c12 ZINC001231830879 1053886726 /nfs/dbraw/zinc/88/67/26/1053886726.db2.gz FUDLDQOCTPHPAR-QGZVFWFLSA-N 2 1 320.527 4.107 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CC[C@@]4(CC[NH+](C)C4)C3)c(C)c12 ZINC001231830879 1053886733 /nfs/dbraw/zinc/88/67/33/1053886733.db2.gz FUDLDQOCTPHPAR-QGZVFWFLSA-N 2 1 320.527 4.107 20 0 DIADMP Cc1csc2sc(C[NH+]3CC[C@]4(CC[N@H+](C)C4)C3)c(C)c12 ZINC001231830876 1053887906 /nfs/dbraw/zinc/88/79/06/1053887906.db2.gz FUDLDQOCTPHPAR-KRWDZBQOSA-N 2 1 320.527 4.107 20 0 DIADMP Cc1csc2sc(C[N@H+]3CC[C@]4(CC[NH+](C)C4)C3)c(C)c12 ZINC001231830876 1053887925 /nfs/dbraw/zinc/88/79/25/1053887925.db2.gz FUDLDQOCTPHPAR-KRWDZBQOSA-N 2 1 320.527 4.107 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CC[C@]4(CC[NH+](C)C4)C3)c(C)c12 ZINC001231830876 1053887939 /nfs/dbraw/zinc/88/79/39/1053887939.db2.gz FUDLDQOCTPHPAR-KRWDZBQOSA-N 2 1 320.527 4.107 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)s2)C1 ZINC000314867162 1053891865 /nfs/dbraw/zinc/89/18/65/1053891865.db2.gz FOGOVKBPOGUEMV-MRXNPFEDSA-N 2 1 314.498 4.235 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000158653837 1053914435 /nfs/dbraw/zinc/91/44/35/1053914435.db2.gz VDPUINRQUNTIGT-ZWKOTPCHSA-N 2 1 303.494 4.025 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1ccc(C(F)F)cc1)C1CCCCC1 ZINC000316447578 1053941639 /nfs/dbraw/zinc/94/16/39/1053941639.db2.gz FSLPSEZOFYITJK-UHFFFAOYSA-N 2 1 310.432 4.368 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1ccc(C(F)F)cc1)C1CCCCC1 ZINC000316447578 1053941646 /nfs/dbraw/zinc/94/16/46/1053941646.db2.gz FSLPSEZOFYITJK-UHFFFAOYSA-N 2 1 310.432 4.368 20 0 DIADMP c1c2c[nH+]ccc2[nH]c1C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001232015450 1053944374 /nfs/dbraw/zinc/94/43/74/1053944374.db2.gz JBASZDQUNPWFNK-KRWDZBQOSA-N 2 1 305.425 4.333 20 0 DIADMP C[N@@H+](Cc1cc2c[nH+]ccc2[nH]1)Cc1ccc2ccccc2c1 ZINC001232016737 1053945062 /nfs/dbraw/zinc/94/50/62/1053945062.db2.gz DSZFVWYQDYKGJX-UHFFFAOYSA-N 2 1 301.393 4.348 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccccc2)s1 ZINC001329428695 1053989080 /nfs/dbraw/zinc/98/90/80/1053989080.db2.gz UNMAHJULNRIJKU-ALOPSCKCSA-N 2 1 312.482 4.259 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CCc1ccccc1)C(C)C ZINC000164683856 1054061545 /nfs/dbraw/zinc/06/15/45/1054061545.db2.gz SGJAUWWUVPLSDK-HXUWFJFHSA-N 2 1 313.489 4.219 20 0 DIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000164702380 1054061973 /nfs/dbraw/zinc/06/19/73/1054061973.db2.gz XQCPTDHHEAQSPY-QGZVFWFLSA-N 2 1 305.853 4.366 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)C1CCCC1 ZINC000165006207 1054067525 /nfs/dbraw/zinc/06/75/25/1054067525.db2.gz LOYMCARCJTXPFY-ZVZYQTTQSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)C1CCCC1 ZINC000165006207 1054067538 /nfs/dbraw/zinc/06/75/38/1054067538.db2.gz LOYMCARCJTXPFY-ZVZYQTTQSA-N 2 1 306.519 4.299 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CC[N@@H+]1C ZINC000166406429 1054089747 /nfs/dbraw/zinc/08/97/47/1054089747.db2.gz SMRYGSODEMGHCR-JRPNMDOOSA-N 2 1 313.272 4.053 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2ccccc2s1 ZINC000296560273 1054090781 /nfs/dbraw/zinc/09/07/81/1054090781.db2.gz SFEGHXCIXWRIBN-OHRKKDJYSA-N 2 1 300.471 4.177 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]CCCC(F)(F)F)[C@@H]1c1cccs1 ZINC001355263088 1054097200 /nfs/dbraw/zinc/09/72/00/1054097200.db2.gz HTPRWTFWEPKKAJ-TZMCWYRMSA-N 2 1 320.424 4.063 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]CCCC(F)(F)F)[C@@H]1c1cccs1 ZINC001355263088 1054097217 /nfs/dbraw/zinc/09/72/17/1054097217.db2.gz HTPRWTFWEPKKAJ-TZMCWYRMSA-N 2 1 320.424 4.063 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421706 1054153614 /nfs/dbraw/zinc/15/36/14/1054153614.db2.gz MCLQHKDJEJGSKE-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421706 1054153618 /nfs/dbraw/zinc/15/36/18/1054153618.db2.gz MCLQHKDJEJGSKE-QWHCGFSZSA-N 2 1 315.288 4.376 20 0 DIADMP Cc1cccc(-c2ccc(C[NH+]3CC[C@@]4(CC[N@H+](C)C4)C3)cc2)c1 ZINC001233224258 1054206550 /nfs/dbraw/zinc/20/65/50/1054206550.db2.gz AEJGTWUYRBCULR-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CC[C@@]4(CC[NH+](C)C4)C3)cc2)c1 ZINC001233224258 1054206560 /nfs/dbraw/zinc/20/65/60/1054206560.db2.gz AEJGTWUYRBCULR-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3CC[C@@]4(CC[NH+](C)C4)C3)cc2)c1 ZINC001233224258 1054206570 /nfs/dbraw/zinc/20/65/70/1054206570.db2.gz AEJGTWUYRBCULR-JOCHJYFZSA-N 2 1 320.480 4.190 20 0 DIADMP CCN1CCC([N@@H+](C)Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001233331382 1054235240 /nfs/dbraw/zinc/23/52/40/1054235240.db2.gz TXPFZHNNOANRKL-UHFFFAOYSA-N 2 1 322.496 4.194 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001233331382 1054235248 /nfs/dbraw/zinc/23/52/48/1054235248.db2.gz TXPFZHNNOANRKL-UHFFFAOYSA-N 2 1 322.496 4.194 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3cc(C)c(C)cc32)C1 ZINC001338445630 1054306824 /nfs/dbraw/zinc/30/68/24/1054306824.db2.gz GKKANOIEBNQQDS-WMZOPIPTSA-N 2 1 318.530 4.162 20 0 DIADMP Cc1cc(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)sc1C ZINC001233693306 1054333822 /nfs/dbraw/zinc/33/38/22/1054333822.db2.gz UEGMFQYSAMXSOK-IRXDYDNUSA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)sc1C ZINC001233693306 1054333838 /nfs/dbraw/zinc/33/38/38/1054333838.db2.gz UEGMFQYSAMXSOK-IRXDYDNUSA-N 2 1 306.519 4.204 20 0 DIADMP Cc1cc(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)sc1C ZINC001233693306 1054333855 /nfs/dbraw/zinc/33/38/55/1054333855.db2.gz UEGMFQYSAMXSOK-IRXDYDNUSA-N 2 1 306.519 4.204 20 0 DIADMP CC(C)[C@H]1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC001340977205 1054371369 /nfs/dbraw/zinc/37/13/69/1054371369.db2.gz QFWLJMLFPMYGTN-HLLBOEOZSA-N 2 1 323.550 4.003 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccccc3s2)C1 ZINC001343272323 1054440819 /nfs/dbraw/zinc/44/08/19/1054440819.db2.gz HLUOVVWWXPLVPG-HUUCEWRRSA-N 2 1 302.487 4.284 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000671309296 1054554025 /nfs/dbraw/zinc/55/40/25/1054554025.db2.gz SBMRLSJVTBEGPG-MOPGFXCFSA-N 2 1 320.908 4.440 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000623335743 1054563185 /nfs/dbraw/zinc/56/31/85/1054563185.db2.gz BTDFYVYUBVBPAQ-IUODEOHRSA-N 2 1 314.395 4.229 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623363040 1054570594 /nfs/dbraw/zinc/57/05/94/1054570594.db2.gz VOMUTNRACNFHTQ-CABCVRRESA-N 2 1 300.446 4.265 20 0 DIADMP Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623363040 1054570605 /nfs/dbraw/zinc/57/06/05/1054570605.db2.gz VOMUTNRACNFHTQ-CABCVRRESA-N 2 1 300.446 4.265 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409764 1054586597 /nfs/dbraw/zinc/58/65/97/1054586597.db2.gz OCUDWENNWWETKE-ZFWWWQNUSA-N 2 1 302.487 4.425 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409764 1054586614 /nfs/dbraw/zinc/58/66/14/1054586614.db2.gz OCUDWENNWWETKE-ZFWWWQNUSA-N 2 1 302.487 4.425 20 0 DIADMP CC[C@@H](CSc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623470843 1054601865 /nfs/dbraw/zinc/60/18/65/1054601865.db2.gz DYMPHOBUQFFAFV-JKSUJKDBSA-N 2 1 306.519 4.020 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)CC1(C)C ZINC000623512909 1054610254 /nfs/dbraw/zinc/61/02/54/1054610254.db2.gz YMXKXSXVFDQYKC-XIRDDKMYSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc2ccccc2c1 ZINC000177295388 1054617729 /nfs/dbraw/zinc/61/77/29/1054617729.db2.gz MRNYBBQLNUMOLL-HZPDHXFCSA-N 2 1 307.441 4.332 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234993513 1054637032 /nfs/dbraw/zinc/63/70/32/1054637032.db2.gz PZPOSVMDFVIGMJ-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234993765 1054637272 /nfs/dbraw/zinc/63/72/72/1054637272.db2.gz RVURACZLPZFFOP-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CCC[C@]4(CC[NH2+]C4)C3)s2)c1 ZINC001234991524 1054638811 /nfs/dbraw/zinc/63/88/11/1054638811.db2.gz GIJMKXKIHQFMML-QGZVFWFLSA-N 2 1 318.511 4.052 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)s2)c1 ZINC001234991524 1054638818 /nfs/dbraw/zinc/63/88/18/1054638818.db2.gz GIJMKXKIHQFMML-QGZVFWFLSA-N 2 1 318.511 4.052 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001234995259 1054638900 /nfs/dbraw/zinc/63/89/00/1054638900.db2.gz VBJIRYNYPNXBSE-GHTZIAJQSA-N 2 1 314.517 4.064 20 0 DIADMP Fc1ccc(-c2ccccc2C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001235003012 1054640230 /nfs/dbraw/zinc/64/02/30/1054640230.db2.gz YZYWCKZATZYLDW-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP C[N@H+]1CC[C@H](NCc2c(Cl)oc3ccccc32)CC1(C)C ZINC000623645112 1054640812 /nfs/dbraw/zinc/64/08/12/1054640812.db2.gz OQCOFSOKCSUBMX-LBPRGKRZSA-N 2 1 306.837 4.049 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001234997326 1054641693 /nfs/dbraw/zinc/64/16/93/1054641693.db2.gz AXOADVLLBRQAJP-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP Fc1cccc2c(C[N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)cccc12 ZINC001235038402 1054643896 /nfs/dbraw/zinc/64/38/96/1054643896.db2.gz IZNQXPGTWIVZFN-FQEVSTJZSA-N 2 1 312.432 4.087 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c2ccccc12 ZINC001235047322 1054646840 /nfs/dbraw/zinc/64/68/40/1054646840.db2.gz VHPOEEFRVMUIKN-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)c2)cc1 ZINC001235047175 1054647401 /nfs/dbraw/zinc/64/74/01/1054647401.db2.gz SOLUZRKUQSKDJI-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000178302262 1054649601 /nfs/dbraw/zinc/64/96/01/1054649601.db2.gz MFLLNONTVNWBNM-HHXXYDBFSA-N 2 1 312.457 4.292 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)o1 ZINC000178302262 1054649608 /nfs/dbraw/zinc/64/96/08/1054649608.db2.gz MFLLNONTVNWBNM-HHXXYDBFSA-N 2 1 312.457 4.292 20 0 DIADMP C(=C/c1ccc(C[N@@H+]2CCC23CC[NH2+]CC3)cc1)\c1ccccc1 ZINC001235101888 1054655853 /nfs/dbraw/zinc/65/58/53/1054655853.db2.gz HYEGVFMRODHJJY-VOTSOKGWSA-N 2 1 318.464 4.185 20 0 DIADMP C(=C/c1ccc(C[N@H+]2CCC23CC[NH2+]CC3)cc1)\c1ccccc1 ZINC001235101888 1054655861 /nfs/dbraw/zinc/65/58/61/1054655861.db2.gz HYEGVFMRODHJJY-VOTSOKGWSA-N 2 1 318.464 4.185 20 0 DIADMP CCCCCCc1csc(C[NH+]2CCC3(CC[NH2+]3)CC2)c1 ZINC001235112177 1054660411 /nfs/dbraw/zinc/66/04/11/1054660411.db2.gz XWKQBFYZNREKKF-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CCCC23CC[NH2+]CC3)cc1 ZINC001235141762 1054665468 /nfs/dbraw/zinc/66/54/68/1054665468.db2.gz YGLBMZGOYUWPHQ-UHFFFAOYSA-N 2 1 322.452 4.197 20 0 DIADMP CSc1cc(C)cc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1 ZINC001235157803 1054666706 /nfs/dbraw/zinc/66/67/06/1054666706.db2.gz SBJUKUVGHJTUKA-IBGZPJMESA-N 2 1 318.530 4.071 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235155322 1054666764 /nfs/dbraw/zinc/66/67/64/1054666764.db2.gz OHSIONJVAFFITD-GOSISDBHSA-N 2 1 314.498 4.255 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235158518 1054667244 /nfs/dbraw/zinc/66/72/44/1054667244.db2.gz KRAVGYKKQGTGKO-FQEVSTJZSA-N 2 1 324.468 4.301 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235152797 1054667357 /nfs/dbraw/zinc/66/73/57/1054667357.db2.gz BIARXBZSXACZLI-SFHVURJKSA-N 2 1 318.530 4.153 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c(C)c1Cl ZINC001235157063 1054667732 /nfs/dbraw/zinc/66/77/32/1054667732.db2.gz QOCJIYSDAYUDBZ-SFHVURJKSA-N 2 1 320.908 4.311 20 0 DIADMP c1ccc2cc(C[N@H+]3CCCC[C@@H]3C3CC[NH2+]CC3)ccc2c1 ZINC001235152533 1054667939 /nfs/dbraw/zinc/66/79/39/1054667939.db2.gz GKWTXEZNDWOWBJ-OAQYLSRUSA-N 2 1 308.469 4.194 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCCC[C@]23CCC[NH2+]C3)cc1 ZINC001235167430 1054669858 /nfs/dbraw/zinc/66/98/58/1054669858.db2.gz JCWTUMVZZOKYJI-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCCC[C@]23CCC[NH2+]C3)cc1 ZINC001235167430 1054669866 /nfs/dbraw/zinc/66/98/66/1054669866.db2.gz JCWTUMVZZOKYJI-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCCC[C@]12CCC[NH2+]C2 ZINC001235167042 1054670025 /nfs/dbraw/zinc/67/00/25/1054670025.db2.gz DXLIUCBZBZBNBD-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc(C[N@@H+]2CCCC[C@]23CCC[NH2+]C3)c2ccccc12 ZINC001235168777 1054670129 /nfs/dbraw/zinc/67/01/29/1054670129.db2.gz UIELDAUVYNEGQJ-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@]23CCC[NH2+]C3)c2ccccc12 ZINC001235168777 1054670138 /nfs/dbraw/zinc/67/01/38/1054670138.db2.gz UIELDAUVYNEGQJ-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc(Cl)cc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235161687 1054670437 /nfs/dbraw/zinc/67/04/37/1054670437.db2.gz UJCXZAJLJXLNRC-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)CC1 ZINC001235193932 1054681148 /nfs/dbraw/zinc/68/11/48/1054681148.db2.gz SSMQAUBMDJQFRX-VAMGGRTRSA-N 2 1 302.506 4.001 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001235191689 1054681254 /nfs/dbraw/zinc/68/12/54/1054681254.db2.gz VWXUHPVIZBCMQU-SFHVURJKSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235191689 1054681262 /nfs/dbraw/zinc/68/12/62/1054681262.db2.gz VWXUHPVIZBCMQU-SFHVURJKSA-N 2 1 324.553 4.216 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)cc1C ZINC001235249522 1054692097 /nfs/dbraw/zinc/69/20/97/1054692097.db2.gz QUHVILYTSDRUGW-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)cc1C ZINC001235249522 1054692100 /nfs/dbraw/zinc/69/21/00/1054692100.db2.gz QUHVILYTSDRUGW-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1ccc(C)c(C[N@@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1 ZINC001235249559 1054692736 /nfs/dbraw/zinc/69/27/36/1054692736.db2.gz RSXLDOMULLXHPY-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1ccc(C)c(C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c1 ZINC001235249559 1054692741 /nfs/dbraw/zinc/69/27/41/1054692741.db2.gz RSXLDOMULLXHPY-FGZHOGPDSA-N 2 1 320.480 4.025 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(F)c(F)c1)C(C)C ZINC000179676565 1054694236 /nfs/dbraw/zinc/69/42/36/1054694236.db2.gz JCSKEDNTIMBWFP-ACJLOTCBSA-N 2 1 321.415 4.093 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cc2s1 ZINC001235425996 1054714603 /nfs/dbraw/zinc/71/46/03/1054714603.db2.gz KNTKOZSTTZAECF-QZTJIDSGSA-N 2 1 314.498 4.113 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235424628 1054714692 /nfs/dbraw/zinc/71/46/92/1054714692.db2.gz HUHILFXELIGRBA-QZTJIDSGSA-N 2 1 300.490 4.022 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235425374 1054715935 /nfs/dbraw/zinc/71/59/35/1054715935.db2.gz IXWSMVUQTRSKBO-CVEARBPZSA-N 2 1 314.498 4.113 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235428598 1054717873 /nfs/dbraw/zinc/71/78/73/1054717873.db2.gz OPNIDBIPNZJDLG-VQTJNVASSA-N 2 1 322.496 4.360 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c(C)c1Cl ZINC001235430092 1054718804 /nfs/dbraw/zinc/71/88/04/1054718804.db2.gz DFOSFTBXEXKXHL-FUHWJXTLSA-N 2 1 320.908 4.168 20 0 DIADMP Cc1c(C[N@@H+](C)CC2CC[NH2+]CC2)cccc1-c1ccccc1 ZINC001235432114 1054719676 /nfs/dbraw/zinc/71/96/76/1054719676.db2.gz IOWJPHNVEHMUCA-UHFFFAOYSA-N 2 1 308.469 4.093 20 0 DIADMP C[N@H+](CCC[NH3+])Cc1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC001235435407 1054721375 /nfs/dbraw/zinc/72/13/75/1054721375.db2.gz MQQQXIOZVLCOMJ-UHFFFAOYSA-N 2 1 313.228 4.034 20 0 DIADMP C[N@@H+](CCC[NH3+])Cc1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC001235435407 1054721391 /nfs/dbraw/zinc/72/13/91/1054721391.db2.gz MQQQXIOZVLCOMJ-UHFFFAOYSA-N 2 1 313.228 4.034 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccc(Cl)cc1)C1CC1 ZINC000180093610 1054734133 /nfs/dbraw/zinc/73/41/33/1054734133.db2.gz LDWSOLQAJFBVLM-UGSOOPFHSA-N 2 1 317.864 4.222 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1 ZINC001235530610 1054738728 /nfs/dbraw/zinc/73/87/28/1054738728.db2.gz URKGKPDNIYENDL-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@](C)(Cc1ccccc1)c1ccccc1 ZINC001473551264 1054744527 /nfs/dbraw/zinc/74/45/27/1054744527.db2.gz VUDHLCBSPMKESO-FGZHOGPDSA-N 2 1 322.496 4.218 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000180402028 1054754541 /nfs/dbraw/zinc/75/45/41/1054754541.db2.gz BKWOYYPYVDLAJB-OAHLLOKOSA-N 2 1 306.519 4.322 20 0 DIADMP CC[NH+](CC)C1CC[NH+](Cc2ccccc2-c2ccncc2)CC1 ZINC001235619119 1054756499 /nfs/dbraw/zinc/75/64/99/1054756499.db2.gz QLRIVTIGJPUVSW-UHFFFAOYSA-N 2 1 323.484 4.055 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001235673513 1054766526 /nfs/dbraw/zinc/76/65/26/1054766526.db2.gz BITFKPOTZQZOBG-HNNXBMFYSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001235673556 1054768634 /nfs/dbraw/zinc/76/86/34/1054768634.db2.gz NVSGHXVPDBCCDU-INIZCTEOSA-N 2 1 319.452 4.006 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001235693587 1054782313 /nfs/dbraw/zinc/78/23/13/1054782313.db2.gz DJOMCXKDDQKXLM-IBGZPJMESA-N 2 1 312.844 4.280 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H]2C[NH3+])cc(C)c1-c1ccc(F)cc1 ZINC001235723803 1054789354 /nfs/dbraw/zinc/78/93/54/1054789354.db2.gz BRTSUJFUYVGJGK-IBGZPJMESA-N 2 1 312.432 4.033 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H]2C[NH3+])cc(C)c1-c1ccc(F)cc1 ZINC001235723803 1054789370 /nfs/dbraw/zinc/78/93/70/1054789370.db2.gz BRTSUJFUYVGJGK-IBGZPJMESA-N 2 1 312.432 4.033 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1cccc(-c2ccsc2)c1 ZINC001235716776 1054789876 /nfs/dbraw/zinc/78/98/76/1054789876.db2.gz KUSYZCCZFUBKHY-UHFFFAOYSA-N 2 1 314.498 4.237 20 0 DIADMP Cc1ccc(C[N@@H+](C)CCC2CC[NH2+]CC2)c(Cl)c1Cl ZINC001235716956 1054790072 /nfs/dbraw/zinc/79/00/72/1054790072.db2.gz OSIQXFQILLHLJK-UHFFFAOYSA-N 2 1 315.288 4.123 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1cc(-c2ccsc2)cs1 ZINC001235717832 1054790451 /nfs/dbraw/zinc/79/04/51/1054790451.db2.gz NKSHDUWCKRHTNS-UHFFFAOYSA-N 2 1 320.527 4.298 20 0 DIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1nc(C)cs1 ZINC000623855375 1054796199 /nfs/dbraw/zinc/79/61/99/1054796199.db2.gz YXKXQQIKKGRNHE-OAHLLOKOSA-N 2 1 317.502 4.144 20 0 DIADMP CC(C)(C)c1cc(C[N@H+]2CC[C@H](C[NH3+])C2)cc(C(C)(C)C)c1 ZINC001235751203 1054797674 /nfs/dbraw/zinc/79/76/74/1054797674.db2.gz WXQGHIVWWQBMOB-OAHLLOKOSA-N 2 1 302.506 4.062 20 0 DIADMP CC[N@@H+](Cc1ccc2oc3ccccc3c2c1)C1CC[NH2+]CC1 ZINC001235760722 1054800048 /nfs/dbraw/zinc/80/00/48/1054800048.db2.gz JADRYBPNEFMWON-UHFFFAOYSA-N 2 1 308.425 4.160 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CCc2ccccc2[C@@H]1c1ccccc1 ZINC001235797615 1054805560 /nfs/dbraw/zinc/80/55/60/1054805560.db2.gz YHLVXNHJOKZLHL-NRFANRHFSA-N 2 1 308.469 4.153 20 0 DIADMP c1ccc([C@H]2CSCC[N@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001235812487 1054811852 /nfs/dbraw/zinc/81/18/52/1054811852.db2.gz XNAJAQDDSRVFLW-LJQANCHMSA-N 2 1 318.530 4.089 20 0 DIADMP c1ccc([C@H]2CSCC[N@@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001235812487 1054811861 /nfs/dbraw/zinc/81/18/61/1054811861.db2.gz XNAJAQDDSRVFLW-LJQANCHMSA-N 2 1 318.530 4.089 20 0 DIADMP [NH3+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc2c3ccccc3oc21 ZINC001235808767 1054812445 /nfs/dbraw/zinc/81/24/45/1054812445.db2.gz GPPCJBPJQQKERY-MUJYYYPQSA-N 2 1 306.409 4.040 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)c1 ZINC001235808860 1054812568 /nfs/dbraw/zinc/81/25/68/1054812568.db2.gz IGPFNVPJPSHOEJ-WKCHPHFGSA-N 2 1 320.480 4.425 20 0 DIADMP [NH3+]CCCC[N@H+]1CCCC[C@@H]1C(c1ccccc1)c1ccccc1 ZINC001235825018 1054816595 /nfs/dbraw/zinc/81/65/95/1054816595.db2.gz GIADCTGHXRRYDM-OAQYLSRUSA-N 2 1 322.496 4.412 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3sc21)C[C@@H]1CC[NH2+]C1 ZINC001235841732 1054817981 /nfs/dbraw/zinc/81/79/81/1054817981.db2.gz IHSJTFTWAZKBPV-CQSZACIVSA-N 2 1 310.466 4.096 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2CC2CC3(C2)CC[NH2+]CC3)s1 ZINC001235839043 1054819199 /nfs/dbraw/zinc/81/91/99/1054819199.db2.gz HOQOCDREDZSDMU-CQSZACIVSA-N 2 1 324.921 4.318 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@H+]3CCC[C@H]3CC[NH3+])ccc21 ZINC001235925122 1054848992 /nfs/dbraw/zinc/84/89/92/1054848992.db2.gz BNBVRYSHWFCMGJ-KRWDZBQOSA-N 2 1 321.468 4.128 20 0 DIADMP C[N@@H+](CCC12CC([NH3+])(C1)C2)Cc1sc2ccccc2c1Cl ZINC001235947539 1054863919 /nfs/dbraw/zinc/86/39/19/1054863919.db2.gz DZUAIGWLUQNPHH-UHFFFAOYSA-N 2 1 320.889 4.258 20 0 DIADMP CC1(C[N@@H+](CCc2ccccc2)Cc2ccccc2)CC[NH2+]CC1 ZINC001235947367 1054864659 /nfs/dbraw/zinc/86/46/59/1054864659.db2.gz ANCBBNNMKXPQMY-UHFFFAOYSA-N 2 1 322.496 4.121 20 0 DIADMP [NH3+]CCCCCC[N@@H+](CCc1ccccc1)Cc1ccccc1 ZINC001235948658 1054865074 /nfs/dbraw/zinc/86/50/74/1054865074.db2.gz RYZCDJVERJQMHG-UHFFFAOYSA-N 2 1 310.485 4.250 20 0 DIADMP C[N@@H+](CCCCCC[NH3+])Cc1ccc(Oc2ccccc2)cc1 ZINC001235949615 1054866662 /nfs/dbraw/zinc/86/66/62/1054866662.db2.gz DNLWAEDYUFYJCB-UHFFFAOYSA-N 2 1 312.457 4.430 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)C[C@@H]1CCC[NH2+]C1 ZINC001235951365 1054866781 /nfs/dbraw/zinc/86/67/81/1054866781.db2.gz RLDUPVPFZCMGFD-MRXNPFEDSA-N 2 1 308.425 4.017 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+](C)C[C@H]2CCC[NH2+]C2)CC1 ZINC001235951385 1054867182 /nfs/dbraw/zinc/86/71/82/1054867182.db2.gz RSRXBKZCCPDXCR-UXHICEINSA-N 2 1 304.522 4.391 20 0 DIADMP C[N@H+](Cc1cccc2c3ccccc3sc21)C[C@@H]1CCC[NH2+]C1 ZINC001235950356 1054867439 /nfs/dbraw/zinc/86/74/39/1054867439.db2.gz BTGJKPUTZBGDPP-OAHLLOKOSA-N 2 1 324.493 4.486 20 0 DIADMP C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001235950844 1054867550 /nfs/dbraw/zinc/86/75/50/1054867550.db2.gz NWUVJWKQSLDZQY-PKOBYXMFSA-N 2 1 316.533 4.094 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+](C)C[C@@H]3CCC[NH2+]C3)c2)cc1 ZINC001235957683 1054870317 /nfs/dbraw/zinc/87/03/17/1054870317.db2.gz SANKBUMNMUSLRN-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000624122487 1054885125 /nfs/dbraw/zinc/88/51/25/1054885125.db2.gz SGMUULPPBNPZMO-OXJNMPFZSA-N 2 1 316.464 4.083 20 0 DIADMP C[N@@H+](CC1CC2(C1)CC[NH2+]CC2)C1CCC(C(C)(C)C)CC1 ZINC001236007454 1054894319 /nfs/dbraw/zinc/89/43/19/1054894319.db2.gz CIXXFPTXTPVRRN-UHFFFAOYSA-N 2 1 306.538 4.303 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046366 1054913041 /nfs/dbraw/zinc/91/30/41/1054913041.db2.gz GBBOMCHLAFRART-HIFRSBDPSA-N 2 1 310.466 4.224 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236046366 1054913056 /nfs/dbraw/zinc/91/30/56/1054913056.db2.gz GBBOMCHLAFRART-HIFRSBDPSA-N 2 1 310.466 4.224 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051692 1054916049 /nfs/dbraw/zinc/91/60/49/1054916049.db2.gz XZPALSMNFPPSFT-PBHICJAKSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051692 1054916060 /nfs/dbraw/zinc/91/60/60/1054916060.db2.gz XZPALSMNFPPSFT-PBHICJAKSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481276 1054917285 /nfs/dbraw/zinc/91/72/85/1054917285.db2.gz VUPRAVWDMICOOR-QWHCGFSZSA-N 2 1 318.848 4.221 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481276 1054917298 /nfs/dbraw/zinc/91/72/98/1054917298.db2.gz VUPRAVWDMICOOR-QWHCGFSZSA-N 2 1 318.848 4.221 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236067206 1054924098 /nfs/dbraw/zinc/92/40/98/1054924098.db2.gz NXXSSKJIKLTPBF-MRXNPFEDSA-N 2 1 314.860 4.048 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236066841 1054925138 /nfs/dbraw/zinc/92/51/38/1054925138.db2.gz LRGMUTVAEGOMPA-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000181634753 1054927813 /nfs/dbraw/zinc/92/78/13/1054927813.db2.gz FEYADYNLFFOTTJ-GOSISDBHSA-N 2 1 321.415 4.237 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728533 1054931857 /nfs/dbraw/zinc/93/18/57/1054931857.db2.gz SJDUTUTWQWLVIR-CHWSQXEVSA-N 2 1 306.837 4.079 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728533 1054931870 /nfs/dbraw/zinc/93/18/70/1054931870.db2.gz SJDUTUTWQWLVIR-CHWSQXEVSA-N 2 1 306.837 4.079 20 0 DIADMP C[C@H]1C[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)CCC[NH2+]1 ZINC001236094777 1054939605 /nfs/dbraw/zinc/93/96/05/1054939605.db2.gz ITFXPCRPQGBTNC-INIZCTEOSA-N 2 1 319.452 4.019 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[NH2+][C@@H](C)C2)c1 ZINC001236101063 1054946390 /nfs/dbraw/zinc/94/63/90/1054946390.db2.gz SNWUIMNHPCIETG-SFHVURJKSA-N 2 1 308.469 4.154 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[NH2+][C@@H](C)C2)c1 ZINC001236101063 1054946402 /nfs/dbraw/zinc/94/64/02/1054946402.db2.gz SNWUIMNHPCIETG-SFHVURJKSA-N 2 1 308.469 4.154 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(C[NH3+])cc1 ZINC001236107707 1054951056 /nfs/dbraw/zinc/95/10/56/1054951056.db2.gz ARPPWHIRXZYQDC-GOSISDBHSA-N 2 1 312.482 4.204 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1CC[C@H]1CCCC[NH2+]1 ZINC001236108071 1054951694 /nfs/dbraw/zinc/95/16/94/1054951694.db2.gz IGLMHMRJCSCBAD-NVXWUHKLSA-N 2 1 304.503 4.078 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000182234928 1054972405 /nfs/dbraw/zinc/97/24/05/1054972405.db2.gz WSCLOSRFNJAOBX-QGZVFWFLSA-N 2 1 322.880 4.018 20 0 DIADMP C[N@H+](Cc1ccc2ccccc2c1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC001236184797 1054984588 /nfs/dbraw/zinc/98/45/88/1054984588.db2.gz UNBMSGQQIYQFDL-UHFFFAOYSA-N 2 1 316.448 4.118 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@H]2c2c[nH]c3ccccc23)CC1 ZINC001236190521 1054986556 /nfs/dbraw/zinc/98/65/56/1054986556.db2.gz GRCZEYRSZRLRFR-IBGZPJMESA-N 2 1 311.473 4.037 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001236189246 1054988240 /nfs/dbraw/zinc/98/82/40/1054988240.db2.gz CRDRLOLIBQFJHD-FQEVSTJZSA-N 2 1 316.408 4.381 20 0 DIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@H]2CCCC[C@@H]2[NH3+])cc1 ZINC001236215245 1055001844 /nfs/dbraw/zinc/00/18/44/1055001844.db2.gz GDDHFWZQTZDBQZ-PMACEKPBSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@H]2CCCC[C@@H]2[NH3+])cc1 ZINC001236215245 1055001853 /nfs/dbraw/zinc/00/18/53/1055001853.db2.gz GDDHFWZQTZDBQZ-PMACEKPBSA-N 2 1 324.468 4.064 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(-c3ccc(O)cc3)cc2)CC1 ZINC001236215269 1055003039 /nfs/dbraw/zinc/00/30/39/1055003039.db2.gz MODGKUTZIOEKPK-UHFFFAOYSA-N 2 1 324.468 4.022 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236217602 1055004787 /nfs/dbraw/zinc/00/47/87/1055004787.db2.gz PJXVNXXPOWTYOV-WOJBJXKFSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236218449 1055006715 /nfs/dbraw/zinc/00/67/15/1055006715.db2.gz RXSQBYQXPDJFPC-WOJBJXKFSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236218449 1055006730 /nfs/dbraw/zinc/00/67/30/1055006730.db2.gz RXSQBYQXPDJFPC-WOJBJXKFSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@H+](Cc1ccc(-c2cccs2)cc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236219477 1055007691 /nfs/dbraw/zinc/00/76/91/1055007691.db2.gz WUDULGHFYNOPQT-DLBZAZTESA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccs2)cc1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236219477 1055007702 /nfs/dbraw/zinc/00/77/02/1055007702.db2.gz WUDULGHFYNOPQT-DLBZAZTESA-N 2 1 300.471 4.117 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2)s1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236219815 1055008524 /nfs/dbraw/zinc/00/85/24/1055008524.db2.gz XUMYKPPITTVMGK-SJORKVTESA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236219815 1055008537 /nfs/dbraw/zinc/00/85/37/1055008537.db2.gz XUMYKPPITTVMGK-SJORKVTESA-N 2 1 300.471 4.117 20 0 DIADMP C[N@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236219110 1055009756 /nfs/dbraw/zinc/00/97/56/1055009756.db2.gz ULTHBRUYULGZTL-WMZOPIPTSA-N 2 1 313.489 4.167 20 0 DIADMP C[N@@H+](Cc1c2ccccc2[nH]c1C(C)(C)C)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236219110 1055009765 /nfs/dbraw/zinc/00/97/65/1055009765.db2.gz ULTHBRUYULGZTL-WMZOPIPTSA-N 2 1 313.489 4.167 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236218486 1055010060 /nfs/dbraw/zinc/01/00/60/1055010060.db2.gz SGNDGOCHEXMAOC-NHCUHLMSSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1cc(Cl)ccc1C(F)(F)F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236220928 1055012091 /nfs/dbraw/zinc/01/20/91/1055012091.db2.gz APKHQOSWQZMOOW-JOCQHMNTSA-N 2 1 320.786 4.061 20 0 DIADMP C[N@@H+](Cc1sccc1Oc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236222055 1055012892 /nfs/dbraw/zinc/01/28/92/1055012892.db2.gz KQEOVIKITUOUDX-SHTZXODSSA-N 2 1 316.470 4.242 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+](C)[C@H]3CC[C@H]([NH3+])CC3)cc2)cc1 ZINC001236222066 1055013373 /nfs/dbraw/zinc/01/33/73/1055013373.db2.gz KTEGCYOIQFCBTK-MEMLXQNLSA-N 2 1 308.469 4.364 20 0 DIADMP C[N@@H+](Cc1ccc(C(F)(F)F)c(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224057 1055014630 /nfs/dbraw/zinc/01/46/30/1055014630.db2.gz QVPYRMIXJYEUIU-HAQNSBGRSA-N 2 1 320.786 4.061 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236224617 1055015137 /nfs/dbraw/zinc/01/51/37/1055015137.db2.gz VSRXNRSIIMSMRA-WGSAOQKQSA-N 2 1 318.505 4.347 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccs2)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224071 1055015528 /nfs/dbraw/zinc/01/55/28/1055015528.db2.gz RGMHSNIESGRCIW-QAQDUYKDSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C1(C)CC[NH2+]CC1 ZINC001236226849 1055018217 /nfs/dbraw/zinc/01/82/17/1055018217.db2.gz VFWKUXHSNVYCNU-CMDGGOBGSA-N 2 1 320.480 4.431 20 0 DIADMP [NH3+]C1CCC([N@@H+](CCC2CCCC2)Cc2ccccc2)CC1 ZINC001236228708 1055018820 /nfs/dbraw/zinc/01/88/20/1055018820.db2.gz YFONEDAYGWDYNZ-UHFFFAOYSA-N 2 1 300.490 4.339 20 0 DIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(C(C)C)s2)CC1 ZINC000182988883 1055021389 /nfs/dbraw/zinc/02/13/89/1055021389.db2.gz PRQHVUBOVMXHDH-UHFFFAOYSA-N 2 1 323.550 4.210 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ncc(C(C)C)s2)CC1 ZINC000182988883 1055021402 /nfs/dbraw/zinc/02/14/02/1055021402.db2.gz PRQHVUBOVMXHDH-UHFFFAOYSA-N 2 1 323.550 4.210 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1cccc(C[NH3+])c1 ZINC001236238824 1055028291 /nfs/dbraw/zinc/02/82/91/1055028291.db2.gz CIKJYBQZBGNYKD-UHFFFAOYSA-N 2 1 322.374 4.186 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2cc(C)cc(C)c2)C1 ZINC000183465966 1055046759 /nfs/dbraw/zinc/04/67/59/1055046759.db2.gz VFJRGDWHBSSSQH-IBGZPJMESA-N 2 1 311.473 4.078 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2cc(C)cc(C)c2)C1 ZINC000183465966 1055046774 /nfs/dbraw/zinc/04/67/74/1055046774.db2.gz VFJRGDWHBSSSQH-IBGZPJMESA-N 2 1 311.473 4.078 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CC1 ZINC001236285246 1055051020 /nfs/dbraw/zinc/05/10/20/1055051020.db2.gz DTBYXRWROVNFHA-UYAOXDASSA-N 2 1 312.501 4.233 20 0 DIADMP Cc1cc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)sc1C ZINC001236300501 1055051153 /nfs/dbraw/zinc/05/11/53/1055051153.db2.gz GNFUBCSAMZRJKL-UHFFFAOYSA-N 2 1 314.498 4.119 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000184377693 1055075257 /nfs/dbraw/zinc/07/52/57/1055075257.db2.gz CGWDISPFSQQZTF-KGLIPLIRSA-N 2 1 313.470 4.393 20 0 DIADMP Fc1cccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1Cl ZINC001236373991 1055078330 /nfs/dbraw/zinc/07/83/30/1055078330.db2.gz BELPYZAPIJNSSH-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1cccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1Cl ZINC001236373991 1055078345 /nfs/dbraw/zinc/07/83/45/1055078345.db2.gz BELPYZAPIJNSSH-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)CC1 ZINC001236372587 1055080071 /nfs/dbraw/zinc/08/00/71/1055080071.db2.gz QPURLUCQEAZENY-FHWLQOOXSA-N 2 1 304.522 4.223 20 0 DIADMP CCCc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236373786 1055080543 /nfs/dbraw/zinc/08/05/43/1055080543.db2.gz LCZGXRHGPIYKTG-INIZCTEOSA-N 2 1 320.546 4.445 20 0 DIADMP c1cc2c(cccc2C[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)o1 ZINC001236376167 1055081723 /nfs/dbraw/zinc/08/17/23/1055081723.db2.gz PYWJBWFYQRXEKL-INIZCTEOSA-N 2 1 312.457 4.177 20 0 DIADMP Cc1c(F)ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1F ZINC001236376883 1055082146 /nfs/dbraw/zinc/08/21/46/1055082146.db2.gz VMHVDWMFDKFRHG-OAHLLOKOSA-N 2 1 322.443 4.017 20 0 DIADMP c1oc2ccccc2c1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376858 1055082484 /nfs/dbraw/zinc/08/24/84/1055082484.db2.gz UYKLSJAZKKETPB-INIZCTEOSA-N 2 1 312.457 4.177 20 0 DIADMP Cc1c(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)ccc(F)c1F ZINC001236376649 1055082540 /nfs/dbraw/zinc/08/25/40/1055082540.db2.gz UVIGXCZCLYNJJN-HNNXBMFYSA-N 2 1 322.443 4.017 20 0 DIADMP c1cc(C2CC2)ccc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374452 1055083590 /nfs/dbraw/zinc/08/35/90/1055083590.db2.gz CQFQDYALLYQSLU-SFHVURJKSA-N 2 1 312.501 4.308 20 0 DIADMP Fc1ccc(Cl)cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236375061 1055083616 /nfs/dbraw/zinc/08/36/16/1055083616.db2.gz VHSYTGBAIMOXHV-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cccnc1 ZINC000185033777 1055087193 /nfs/dbraw/zinc/08/71/93/1055087193.db2.gz OAJJFAGUMYFDPS-PKOBYXMFSA-N 2 1 303.494 4.167 20 0 DIADMP CC[N@H+](Cc1ccc(/C=C/c2ccccc2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236407808 1055098304 /nfs/dbraw/zinc/09/83/04/1055098304.db2.gz HTHLGAPZGTXLEK-HYGBKTPJSA-N 2 1 320.480 4.288 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+](CC)C[C@@H]1CC[NH2+]C1 ZINC001236407342 1055099693 /nfs/dbraw/zinc/09/96/93/1055099693.db2.gz DIRLEXAFSAYBSG-GOSISDBHSA-N 2 1 318.505 4.077 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](CC)C[C@@H]1CC[NH2+]C1 ZINC001236407342 1055099706 /nfs/dbraw/zinc/09/97/06/1055099706.db2.gz DIRLEXAFSAYBSG-GOSISDBHSA-N 2 1 318.505 4.077 20 0 DIADMP CC[N@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C[C@H]1CC[NH2+]C1 ZINC001236408453 1055101030 /nfs/dbraw/zinc/10/10/30/1055101030.db2.gz MRKPSGSQJJXMKB-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CC[N@H+](Cc1sc2scc(C)c2c1C)C[C@H]1CC[NH2+]C1 ZINC001236410298 1055102700 /nfs/dbraw/zinc/10/27/00/1055102700.db2.gz YLDKIEPIGMKOSD-ZDUSSCGKSA-N 2 1 308.516 4.011 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415476 1055103753 /nfs/dbraw/zinc/10/37/53/1055103753.db2.gz OKIDJDCEAGTZOA-SWLSCSKDSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@H+]1CC(C)(C)Sc1ccc(Cl)cc1 ZINC001236415476 1055103762 /nfs/dbraw/zinc/10/37/62/1055103762.db2.gz OKIDJDCEAGTZOA-SWLSCSKDSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419169 1055105777 /nfs/dbraw/zinc/10/57/77/1055105777.db2.gz HBXFWYBPMLLPMA-HNAYVOBHSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236419169 1055105783 /nfs/dbraw/zinc/10/57/83/1055105783.db2.gz HBXFWYBPMLLPMA-HNAYVOBHSA-N 2 1 319.452 4.147 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)CC[NH2+]C3)c1 ZINC001236428305 1055110862 /nfs/dbraw/zinc/11/08/62/1055110862.db2.gz IGZNIEIHEZSIDT-QFIPXVFZSA-N 2 1 320.480 4.286 20 0 DIADMP CC(C)(C)CC[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236451464 1055120417 /nfs/dbraw/zinc/12/04/17/1055120417.db2.gz ROOCFTAIVRQPDP-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP CC(C)(C)CC[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001236451464 1055120424 /nfs/dbraw/zinc/12/04/24/1055120424.db2.gz ROOCFTAIVRQPDP-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP Clc1ccc(C[N@@H+](C[C@H]2CC=CCC2)C2CC[NH2+]CC2)cc1 ZINC001236454232 1055122024 /nfs/dbraw/zinc/12/20/24/1055122024.db2.gz XBDKGMNHYLYQQI-INIZCTEOSA-N 2 1 318.892 4.250 20 0 DIADMP CSc1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001236456384 1055123931 /nfs/dbraw/zinc/12/39/31/1055123931.db2.gz CZRHKXBQZIPOKH-UHFFFAOYSA-N 2 1 306.519 4.009 20 0 DIADMP Cc1cccc(Cl)c1C[N@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458141 1055124121 /nfs/dbraw/zinc/12/41/21/1055124121.db2.gz RJQMGDKLYGBRAQ-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236458141 1055124131 /nfs/dbraw/zinc/12/41/31/1055124131.db2.gz RJQMGDKLYGBRAQ-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1Cl ZINC001236456671 1055125393 /nfs/dbraw/zinc/12/53/93/1055125393.db2.gz DBLKWFXALXTCRL-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(F)cc(Cl)c1)C1CC[NH2+]CC1 ZINC001236458585 1055127648 /nfs/dbraw/zinc/12/76/48/1055127648.db2.gz YFFWFLXRZHPYMT-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CC=CCC2)C2CC[NH2+]CC2)c(F)c1 ZINC001236489612 1055143581 /nfs/dbraw/zinc/14/35/81/1055143581.db2.gz POGRHLWVHCPUKE-KRWDZBQOSA-N 2 1 316.464 4.044 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236489534 1055143899 /nfs/dbraw/zinc/14/38/99/1055143899.db2.gz MBVJUCLPFXETMX-INIZCTEOSA-N 2 1 306.469 4.124 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236534037 1055164958 /nfs/dbraw/zinc/16/49/58/1055164958.db2.gz NMRGAUGWQXPJLT-IYARVYRRSA-N 2 1 306.469 4.334 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc(F)c1F ZINC001236540139 1055168766 /nfs/dbraw/zinc/16/87/66/1055168766.db2.gz IICCBDQNJCYEOX-QAQDUYKDSA-N 2 1 322.443 4.145 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236540499 1055170180 /nfs/dbraw/zinc/17/01/80/1055170180.db2.gz FHIXLEIEFJNSIR-LEAZDLGRSA-N 2 1 304.522 4.351 20 0 DIADMP C[C@H](C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236540673 1055170210 /nfs/dbraw/zinc/17/02/10/1055170210.db2.gz JMIPHJWLJSAJOO-NSISKUIASA-N 2 1 300.490 4.162 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cccc(Cl)c2)CC2CCC2)CC1 ZINC001236541452 1055170443 /nfs/dbraw/zinc/17/04/43/1055170443.db2.gz KYIYDSDKJZWZJA-WGSAOQKQSA-N 2 1 320.908 4.255 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cc3ccccc3o2)CC2CCC2)CC1 ZINC001236540910 1055170864 /nfs/dbraw/zinc/17/08/64/1055170864.db2.gz FLYCQHPHMMZPSL-IYARVYRRSA-N 2 1 312.457 4.305 20 0 DIADMP C[C@@H](C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236540674 1055171083 /nfs/dbraw/zinc/17/10/83/1055171083.db2.gz JMIPHJWLJSAJOO-VDGAXYAQSA-N 2 1 300.490 4.162 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3ncccc23)CC2CCC2)CC1 ZINC001236540806 1055171314 /nfs/dbraw/zinc/17/13/14/1055171314.db2.gz CIPBFWCHRONTSF-WGSAOQKQSA-N 2 1 323.484 4.107 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1F ZINC001236542936 1055172224 /nfs/dbraw/zinc/17/22/24/1055172224.db2.gz XWUCMMPWZXMYJA-QAQDUYKDSA-N 2 1 322.443 4.145 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236542463 1055173073 /nfs/dbraw/zinc/17/30/73/1055173073.db2.gz RAURLIHHCGEMPY-WGSAOQKQSA-N 2 1 300.490 4.175 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236542195 1055173151 /nfs/dbraw/zinc/17/31/51/1055173151.db2.gz PFCAGQQHHTYAGE-IYARVYRRSA-N 2 1 304.453 4.006 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1C1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550746 1055177454 /nfs/dbraw/zinc/17/74/54/1055177454.db2.gz MNABBRIRHDXZRG-WGSAOQKQSA-N 2 1 300.490 4.292 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236550030 1055177758 /nfs/dbraw/zinc/17/77/58/1055177758.db2.gz BKFWYINUHFQBSA-SHTZXODSSA-N 2 1 324.871 4.269 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236549976 1055177977 /nfs/dbraw/zinc/17/79/77/1055177977.db2.gz ASCINKXTWKMMLK-WBAXXEDZSA-N 2 1 304.478 4.064 20 0 DIADMP Cc1cc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc(F)c1F ZINC001236550276 1055178337 /nfs/dbraw/zinc/17/83/37/1055178337.db2.gz BNDUGUAOZCVSRE-WKILWMFISA-N 2 1 310.432 4.001 20 0 DIADMP Cc1cc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc(C)c1Cl ZINC001236552007 1055179298 /nfs/dbraw/zinc/17/92/98/1055179298.db2.gz RHVWZTBSAOPIGQ-IYARVYRRSA-N 2 1 320.908 4.439 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236552890 1055179883 /nfs/dbraw/zinc/17/98/83/1055179883.db2.gz UURBARCITUCFOQ-QAQDUYKDSA-N 2 1 306.881 4.130 20 0 DIADMP CCc1cccc(C)c1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552165 1055180031 /nfs/dbraw/zinc/18/00/31/1055180031.db2.gz SJTSAVVXFPUIIZ-WGSAOQKQSA-N 2 1 300.490 4.039 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc2scnc2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552423 1055180085 /nfs/dbraw/zinc/18/00/85/1055180085.db2.gz QBEYGDIQXKNDHR-WKILWMFISA-N 2 1 317.502 4.024 20 0 DIADMP Cc1cc(C)c(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236552603 1055180169 /nfs/dbraw/zinc/18/01/69/1055180169.db2.gz YDHQJZYXHZZNHI-WGSAOQKQSA-N 2 1 302.506 4.340 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236553230 1055181018 /nfs/dbraw/zinc/18/10/18/1055181018.db2.gz UWHXSZZRASFXDX-SHTZXODSSA-N 2 1 324.871 4.269 20 0 DIADMP C[C@@H]([NH2+]C1CCC(C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381774754 1055181723 /nfs/dbraw/zinc/18/17/23/1055181723.db2.gz ABLJTDIIFPXQCF-VXLIZBOYSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1cc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)cc1Cl ZINC001236553258 1055181787 /nfs/dbraw/zinc/18/17/87/1055181787.db2.gz YLUFXVKMXSNSKW-WKILWMFISA-N 2 1 324.871 4.269 20 0 DIADMP CCc1cc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1Cl ZINC001236553115 1055182327 /nfs/dbraw/zinc/18/23/27/1055182327.db2.gz XAGOVMCWTPAGPQ-IYARVYRRSA-N 2 1 320.908 4.384 20 0 DIADMP CCCC[C@H](CC)C[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236559153 1055184162 /nfs/dbraw/zinc/18/41/62/1055184162.db2.gz BUKSWSZZJMJEKR-IHPCNDPISA-N 2 1 317.521 4.370 20 0 DIADMP COc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236565885 1055185796 /nfs/dbraw/zinc/18/57/96/1055185796.db2.gz RAKBIQCQADSLFF-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccnc2Cl)C2CCCCC2)CC1 ZINC001236565654 1055186236 /nfs/dbraw/zinc/18/62/36/1055186236.db2.gz LGDQDUCLZYZXLH-JCNLHEQBSA-N 2 1 321.896 4.140 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCC2CCCC2)Cc2cccnc2)CC1 ZINC001236565168 1055186679 /nfs/dbraw/zinc/18/66/79/1055186679.db2.gz XFESIXZAMHNJDF-MXVIHJGJSA-N 2 1 315.505 4.124 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccc(F)c(F)c2)C2CCCC2)CC1 ZINC001236566979 1055188230 /nfs/dbraw/zinc/18/82/30/1055188230.db2.gz PWPFZNVTYIFECP-JCNLHEQBSA-N 2 1 322.443 4.022 20 0 DIADMP CCOc1cccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236567011 1055188287 /nfs/dbraw/zinc/18/82/87/1055188287.db2.gz RAHLCMCXOXYMSZ-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3[nH]ccc32)C2CCCC2)CC1 ZINC001236566502 1055188296 /nfs/dbraw/zinc/18/82/96/1055188296.db2.gz JOJWUGXNUUTDAB-SAABIXHNSA-N 2 1 311.473 4.182 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3cccnc32)C2CCCC2)CC1 ZINC001236567055 1055188402 /nfs/dbraw/zinc/18/84/02/1055188402.db2.gz RQVMKIYLZCABBC-KESTWPANSA-N 2 1 323.484 4.249 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccc(F)cc2)C2CCCC2)CC1 ZINC001236566779 1055188691 /nfs/dbraw/zinc/18/86/91/1055188691.db2.gz LJEQLXDOBYSCHE-KESTWPANSA-N 2 1 318.480 4.273 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892936 1055189342 /nfs/dbraw/zinc/18/93/42/1055189342.db2.gz FFKTZUYQLVCJOU-PKOBYXMFSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892936 1055189347 /nfs/dbraw/zinc/18/93/47/1055189347.db2.gz FFKTZUYQLVCJOU-PKOBYXMFSA-N 2 1 312.457 4.233 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ncccc2Cl)C2CCCCC2)CC1 ZINC001236568391 1055190335 /nfs/dbraw/zinc/19/03/35/1055190335.db2.gz YNISHZUOCZFZBV-KOMQPUFPSA-N 2 1 321.896 4.140 20 0 DIADMP CCCOc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236571292 1055191810 /nfs/dbraw/zinc/19/18/10/1055191810.db2.gz BEVMTPHJBATBQP-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)n1 ZINC001236570928 1055191920 /nfs/dbraw/zinc/19/19/20/1055191920.db2.gz GBPCQWPWFKOOPB-JCNLHEQBSA-N 2 1 321.896 4.058 20 0 DIADMP CCOc1ccc(C)cc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571912 1055192813 /nfs/dbraw/zinc/19/28/13/1055192813.db2.gz JSCCAYZLXJVJOL-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP CC1=CC[C@@H](CC[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)C1(C)C ZINC001236571744 1055192827 /nfs/dbraw/zinc/19/28/27/1055192827.db2.gz FOTZCBYEHHKJNQ-LNLFQRSKSA-N 2 1 304.522 4.493 20 0 DIADMP CC(C)c1ccccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571831 1055193301 /nfs/dbraw/zinc/19/33/01/1055193301.db2.gz FBFUBTCRZVILCR-UAPYVXQJSA-N 2 1 300.490 4.434 20 0 DIADMP Cc1ccc(Cl)cc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572472 1055193450 /nfs/dbraw/zinc/19/34/50/1055193450.db2.gz NCEMFDNXVIHZRE-SAABIXHNSA-N 2 1 306.881 4.273 20 0 DIADMP CSc1ccccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572568 1055193832 /nfs/dbraw/zinc/19/38/32/1055193832.db2.gz OMIJWTNAPDKRQE-JCNLHEQBSA-N 2 1 304.503 4.033 20 0 DIADMP C[C@@H](CCCC(C)(C)O)CC[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236573249 1055195049 /nfs/dbraw/zinc/19/50/49/1055195049.db2.gz ZXMUDMBBKMLQEO-LNLFQRSKSA-N 2 1 324.553 4.078 20 0 DIADMP Cc1cc(F)c(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1 ZINC001236573403 1055195237 /nfs/dbraw/zinc/19/52/37/1055195237.db2.gz BRUWYSIVRFEFSS-KOMQPUFPSA-N 2 1 322.443 4.288 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)sc1C ZINC001236573840 1055195298 /nfs/dbraw/zinc/19/52/98/1055195298.db2.gz GSUQGFJCEREFCW-JCNLHEQBSA-N 2 1 306.519 4.379 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)cc1F ZINC001236574784 1055196604 /nfs/dbraw/zinc/19/66/04/1055196604.db2.gz SUDOWJWVKNKHKC-JCNLHEQBSA-N 2 1 322.443 4.288 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001236616369 1055205872 /nfs/dbraw/zinc/20/58/72/1055205872.db2.gz MQWSWUZNFJEUCN-LJQANCHMSA-N 2 1 310.466 4.225 20 0 DIADMP CC(C)(C)c1cccc(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)c1 ZINC001236638273 1055208362 /nfs/dbraw/zinc/20/83/62/1055208362.db2.gz XUHVKDWBFIPKJB-UHFFFAOYSA-N 2 1 300.490 4.091 20 0 DIADMP CCCC[C@H](CC)C[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236662267 1055216565 /nfs/dbraw/zinc/21/65/65/1055216565.db2.gz AYJSSXYSDCPEGK-BJLQDIEVSA-N 2 1 317.521 4.370 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236681201 1055227547 /nfs/dbraw/zinc/22/75/47/1055227547.db2.gz DNVLYCFMRHKXME-IYARVYRRSA-N 2 1 314.498 4.329 20 0 DIADMP CNc1ccccc1C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236693326 1055234245 /nfs/dbraw/zinc/23/42/45/1055234245.db2.gz BUDOQSDKLYHRQW-MXVIHJGJSA-N 2 1 323.484 4.000 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc2ccoc21 ZINC001236734892 1055244072 /nfs/dbraw/zinc/24/40/72/1055244072.db2.gz GCPFCXGNYUOGHG-OALUTQOASA-N 2 1 312.457 4.272 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)C[C@H]2CC=CCC2)CC1 ZINC001236741687 1055246922 /nfs/dbraw/zinc/24/69/22/1055246922.db2.gz IDCICNXAOXHFKB-VDGAXYAQSA-N 2 1 316.464 4.254 20 0 DIADMP CCC(CC)C[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236741236 1055247924 /nfs/dbraw/zinc/24/79/24/1055247924.db2.gz AVISRHQQMLKZBJ-WGSAOQKQSA-N 2 1 306.469 4.334 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)cc1O ZINC001236767650 1055252923 /nfs/dbraw/zinc/25/29/23/1055252923.db2.gz PARAMVXDNKVZJU-IYARVYRRSA-N 2 1 318.505 4.127 20 0 DIADMP Cc1ccnc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236779216 1055254503 /nfs/dbraw/zinc/25/45/03/1055254503.db2.gz GLZQCDRMOLDXMJ-SHTZXODSSA-N 2 1 323.912 4.161 20 0 DIADMP Cc1c(F)cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1F ZINC001236780895 1055256370 /nfs/dbraw/zinc/25/63/70/1055256370.db2.gz WHACIZWHELOYFO-WKILWMFISA-N 2 1 324.459 4.391 20 0 DIADMP CCc1ccccc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768164 1055256471 /nfs/dbraw/zinc/25/64/71/1055256471.db2.gz SHHUICUKLXRLLJ-WGSAOQKQSA-N 2 1 302.506 4.367 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(F)cc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783785 1055258624 /nfs/dbraw/zinc/25/86/24/1055258624.db2.gz ZQXVKKJPQWMPTI-JCNLHEQBSA-N 2 1 310.432 4.225 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(F)c1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783574 1055258717 /nfs/dbraw/zinc/25/87/17/1055258717.db2.gz UWNYHKMBKIHTDU-KOMQPUFPSA-N 2 1 310.432 4.225 20 0 DIADMP CCC(CC)[N@@H+](CCc1ccc(F)c(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781893 1055259631 /nfs/dbraw/zinc/25/96/31/1055259631.db2.gz ARXMNLYUOSCFDZ-JCNLHEQBSA-N 2 1 324.459 4.268 20 0 DIADMP CCC(CC)[N@@H+](CCc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781919 1055259745 /nfs/dbraw/zinc/25/97/45/1055259745.db2.gz BJTGZKXPFNGGAF-KESTWPANSA-N 2 1 302.506 4.298 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(COC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790467 1055260491 /nfs/dbraw/zinc/26/04/91/1055260491.db2.gz HVZGAHUUIXZLJH-KESTWPANSA-N 2 1 318.505 4.094 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)CC1 ZINC001236821968 1055277032 /nfs/dbraw/zinc/27/70/32/1055277032.db2.gz XBMYIHBQFCXBRD-MUGJNUQGSA-N 2 1 302.506 4.128 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1 ZINC001236829500 1055278520 /nfs/dbraw/zinc/27/85/20/1055278520.db2.gz KVJVRIALXGVKKY-ACRUOGEOSA-N 2 1 320.480 4.140 20 0 DIADMP CCC[N@H+](Cc1cccc2c3ccccc3oc21)C[C@@H]1CC[NH2+]C1 ZINC001236833411 1055284039 /nfs/dbraw/zinc/28/40/39/1055284039.db2.gz ASQMGGOESQMCSO-MRXNPFEDSA-N 2 1 322.452 4.408 20 0 DIADMP CCC[N@H+](Cc1cccc(-c2ccsc2)c1)C[C@H]1CC[NH2+]C1 ZINC001236834889 1055285255 /nfs/dbraw/zinc/28/52/55/1055285255.db2.gz JLCQFBSXLJWWIM-KRWDZBQOSA-N 2 1 314.498 4.237 20 0 DIADMP CCC[N@H+](Cc1cccc(-c2ccccc2)c1C)C[C@H]1CC[NH2+]C1 ZINC001236843202 1055289572 /nfs/dbraw/zinc/28/95/72/1055289572.db2.gz LPHOTFBGBOBUMI-IBGZPJMESA-N 2 1 322.496 4.484 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2cccs2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236845226 1055289707 /nfs/dbraw/zinc/28/97/07/1055289707.db2.gz ZXHAWTYGCNZEOH-KRWDZBQOSA-N 2 1 314.498 4.237 20 0 DIADMP CCC[N@@H+](Cc1cc(C)c(Cl)cc1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236843874 1055290136 /nfs/dbraw/zinc/29/01/36/1055290136.db2.gz RXPNOJACIPOJPG-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP CCC[N@H+](Cc1cc(C)c(Cl)cc1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236843874 1055290145 /nfs/dbraw/zinc/29/01/45/1055290145.db2.gz RXPNOJACIPOJPG-CYBMUJFWSA-N 2 1 315.288 4.123 20 0 DIADMP CC[C@H]([NH3+])C[N@H+](C)Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236867854 1055297861 /nfs/dbraw/zinc/29/78/61/1055297861.db2.gz COBRTBWFDIPFHX-INIZCTEOSA-N 2 1 307.441 4.004 20 0 DIADMP CC[C@H]([NH3+])C[N@@H+](C)Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236867854 1055297870 /nfs/dbraw/zinc/29/78/70/1055297870.db2.gz COBRTBWFDIPFHX-INIZCTEOSA-N 2 1 307.441 4.004 20 0 DIADMP CC[C@H]([NH3+])C[N@H+](C)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236869600 1055300101 /nfs/dbraw/zinc/30/01/01/1055300101.db2.gz LXBXUYVEJRPIPX-KRWDZBQOSA-N 2 1 302.849 4.176 20 0 DIADMP CC[C@H]([NH3+])C[N@@H+](C)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236869600 1055300115 /nfs/dbraw/zinc/30/01/15/1055300115.db2.gz LXBXUYVEJRPIPX-KRWDZBQOSA-N 2 1 302.849 4.176 20 0 DIADMP C[C@H]([NH2+]C/C=C/c1ccccc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383944350 1055309246 /nfs/dbraw/zinc/30/92/46/1055309246.db2.gz VQHYBIOYLBHOTP-SQQDLWTQSA-N 2 1 320.480 4.200 20 0 DIADMP Clc1cc(C[N@H+]2CCC3(CCCC3)C2)ccc1-n1ccnc1 ZINC001236914893 1055316883 /nfs/dbraw/zinc/31/68/83/1055316883.db2.gz WVFLMJRUTOLPQC-UHFFFAOYSA-N 2 1 315.848 4.292 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001237055255 1055353604 /nfs/dbraw/zinc/35/36/04/1055353604.db2.gz BXHYTNDGYCOHMQ-HXUWFJFHSA-N 2 1 308.425 4.147 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC001237059857 1055359698 /nfs/dbraw/zinc/35/96/98/1055359698.db2.gz WJLOEGDGBKCNSX-FQEVSTJZSA-N 2 1 308.425 4.147 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2CCc2ccccc2)C1 ZINC001237080226 1055365547 /nfs/dbraw/zinc/36/55/47/1055365547.db2.gz FWHFIQIIEPYBKK-JOCHJYFZSA-N 2 1 322.496 4.033 20 0 DIADMP CC(C)Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000385935620 1055397621 /nfs/dbraw/zinc/39/76/21/1055397621.db2.gz CJDMACROMRHLSA-MRXNPFEDSA-N 2 1 300.490 4.163 20 0 DIADMP c1ccc2c(c1)CC[NH2+]C21CC[NH+](CCC2CCCCC2)CC1 ZINC001237274963 1055413509 /nfs/dbraw/zinc/41/35/09/1055413509.db2.gz IBLPFAYDXWAJTN-UHFFFAOYSA-N 2 1 312.501 4.094 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237380820 1055444392 /nfs/dbraw/zinc/44/43/92/1055444392.db2.gz HOPGWVBPCUSUNT-UIFIKXQLSA-N 2 1 314.517 4.063 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001620872961 1055501907 /nfs/dbraw/zinc/50/19/07/1055501907.db2.gz LLIZUYUQANHCJX-QHAWAJNXSA-N 2 1 314.517 4.313 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1 ZINC000386957259 1055536810 /nfs/dbraw/zinc/53/68/10/1055536810.db2.gz VEZCBCZWHWRLIE-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]1CCC[C@@H]1C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001620913110 1055537683 /nfs/dbraw/zinc/53/76/83/1055537683.db2.gz UMGHPOFFBZRWBY-PKOBYXMFSA-N 2 1 302.506 4.170 20 0 DIADMP CC1=CCC[C@H](C)[C@H]1C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001620921244 1055543743 /nfs/dbraw/zinc/54/37/43/1055543743.db2.gz RPBDRMXVUJKFFM-TYPHKJRUSA-N 2 1 312.501 4.091 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCCC[C@H](c2ccccc2)C1 ZINC001620924808 1055544646 /nfs/dbraw/zinc/54/46/46/1055544646.db2.gz NGGKGPRUHFGFJR-YZGWKJHDSA-N 2 1 302.506 4.423 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CCc4sccc4C3)cc21 ZINC001237879134 1055548579 /nfs/dbraw/zinc/54/85/79/1055548579.db2.gz ULZUVJPEUIQFGB-UHFFFAOYSA-N 2 1 324.493 4.308 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCc4sccc4C3)cc21 ZINC001237879134 1055548595 /nfs/dbraw/zinc/54/85/95/1055548595.db2.gz ULZUVJPEUIQFGB-UHFFFAOYSA-N 2 1 324.493 4.308 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]Cc1ccc(C(C)C)cc1 ZINC001620946298 1055562066 /nfs/dbraw/zinc/56/20/66/1055562066.db2.gz MKWYMIUPTRPLIC-FQEVSTJZSA-N 2 1 302.506 4.410 20 0 DIADMP c1[nH+]cn2c1cccc2C[NH+]1CCC(CCc2ccccc2)CC1 ZINC001238115014 1055607966 /nfs/dbraw/zinc/60/79/66/1055607966.db2.gz ZFZAWXUXULRVCB-UHFFFAOYSA-N 2 1 319.452 4.179 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)Cc1ccccc1-c1ccc(F)cc1F ZINC001238579795 1055691008 /nfs/dbraw/zinc/69/10/08/1055691008.db2.gz DZZVKHPIDBJGQO-UHFFFAOYSA-N 2 1 318.411 4.015 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(OCC)ccc2C)CC1 ZINC001238711001 1055727578 /nfs/dbraw/zinc/72/75/78/1055727578.db2.gz IEHKCZOMAIQOPB-UHFFFAOYSA-N 2 1 318.505 4.090 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(OCC)ccc2C)CC1 ZINC001238711001 1055727593 /nfs/dbraw/zinc/72/75/93/1055727593.db2.gz IEHKCZOMAIQOPB-UHFFFAOYSA-N 2 1 318.505 4.090 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCC[C@]2(CCC[NH+](CCOC)C2)C1 ZINC001278273471 1055736781 /nfs/dbraw/zinc/73/67/81/1055736781.db2.gz XOMCWZWDWWHDND-PMACEKPBSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCC[C@]2(CCC[N@H+](CCOC)C2)C1 ZINC001278273471 1055736792 /nfs/dbraw/zinc/73/67/92/1055736792.db2.gz XOMCWZWDWWHDND-PMACEKPBSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCC[C@]2(CCC[N@@H+](CCOC)C2)C1 ZINC001278273471 1055736807 /nfs/dbraw/zinc/73/68/07/1055736807.db2.gz XOMCWZWDWWHDND-PMACEKPBSA-N 2 1 324.553 4.027 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)s2)C1 ZINC000058061171 1055794405 /nfs/dbraw/zinc/79/44/05/1055794405.db2.gz FOGOVKBPOGUEMV-INIZCTEOSA-N 2 1 314.498 4.235 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)cc2C)c1 ZINC001620778445 1055945958 /nfs/dbraw/zinc/94/59/58/1055945958.db2.gz UPSHKUWOQLFWLF-UHFFFAOYSA-N 2 1 316.876 4.390 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1CC[NH2+]C[C@H](c1ccccc1)C(C)C ZINC001620785880 1055959610 /nfs/dbraw/zinc/95/96/10/1055959610.db2.gz QLQUQKCFPFPXFU-UXHICEINSA-N 2 1 302.506 4.280 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1CC[NH2+]C[C@H](c1ccccc1)C(C)C ZINC001620785880 1055959618 /nfs/dbraw/zinc/95/96/18/1055959618.db2.gz QLQUQKCFPFPXFU-UXHICEINSA-N 2 1 302.506 4.280 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@@H]3[C@@H](CC[NH+]3C)C2)c(C(C)C)c1 ZINC001620506729 1055961868 /nfs/dbraw/zinc/96/18/68/1055961868.db2.gz MPGOIKMXGXJCDL-PZJWPPBQSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)c(C(C)C)c1 ZINC001620506729 1055961872 /nfs/dbraw/zinc/96/18/72/1055961872.db2.gz MPGOIKMXGXJCDL-PZJWPPBQSA-N 2 1 314.517 4.459 20 0 DIADMP CC(C)c1ccc(C[NH+]2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c(C(C)C)c1 ZINC001620506729 1055961881 /nfs/dbraw/zinc/96/18/81/1055961881.db2.gz MPGOIKMXGXJCDL-PZJWPPBQSA-N 2 1 314.517 4.459 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC001621006695 1055974478 /nfs/dbraw/zinc/97/44/78/1055974478.db2.gz RAJOKERRPKJCBX-GOSISDBHSA-N 2 1 300.490 4.166 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c1Cl ZINC001621006845 1055976722 /nfs/dbraw/zinc/97/67/22/1055976722.db2.gz XCXANXWIVWODOK-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP Cc1c(Cl)ccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)c1Cl ZINC001621006845 1055976730 /nfs/dbraw/zinc/97/67/30/1055976730.db2.gz XCXANXWIVWODOK-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP CC[C@@H](C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1 ZINC001620724087 1055986332 /nfs/dbraw/zinc/98/63/32/1055986332.db2.gz HDXVDFMLPWPCEY-OTWHNJEPSA-N 2 1 302.506 4.138 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCC(F)(F)C2)CC1 ZINC000671757923 1055991914 /nfs/dbraw/zinc/99/19/14/1055991914.db2.gz STIITFZPRGRNBZ-ADKAHSJRSA-N 2 1 322.443 4.207 20 0 DIADMP CCc1cccc(C[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC001621030283 1055993129 /nfs/dbraw/zinc/99/31/29/1055993129.db2.gz AITSXASXXYXHEG-XMSQKQJNSA-N 2 1 322.496 4.107 20 0 DIADMP CCc1cccc(C[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC001621030281 1055993222 /nfs/dbraw/zinc/99/32/22/1055993222.db2.gz AITSXASXXYXHEG-GCJKJVERSA-N 2 1 322.496 4.107 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001620798696 1055994603 /nfs/dbraw/zinc/99/46/03/1055994603.db2.gz TVPCHKMDKWZXMF-LXGFNABISA-N 2 1 312.501 4.380 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)c1 ZINC001620808269 1056001953 /nfs/dbraw/zinc/00/19/53/1056001953.db2.gz HNGMMFQNXFGNQT-YRWFTTLQSA-N 2 1 300.490 4.195 20 0 DIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000671766336 1056005966 /nfs/dbraw/zinc/00/59/66/1056005966.db2.gz GXFUUOWUSUGPLM-ROUUACIJSA-N 2 1 315.505 4.270 20 0 DIADMP Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000671766334 1056006354 /nfs/dbraw/zinc/00/63/54/1056006354.db2.gz GXFUUOWUSUGPLM-MSOLQXFVSA-N 2 1 315.505 4.270 20 0 DIADMP Clc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCC2)cc1 ZINC000166513572 1056173368 /nfs/dbraw/zinc/17/33/68/1056173368.db2.gz CRRIBQDPJTVYPT-IPMKNSEASA-N 2 1 318.892 4.398 20 0 DIADMP CC[C@H](C[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1)[NH+]1CCCC1 ZINC000474473831 1056317346 /nfs/dbraw/zinc/31/73/46/1056317346.db2.gz GNYFNKPVQAFBQQ-PRLABOORSA-N 2 1 320.443 4.208 20 0 DIADMP CCC[N@H+](CC)CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474823628 1056361219 /nfs/dbraw/zinc/36/12/19/1056361219.db2.gz VHVAFTJUIUQUHP-NFOMZHRRSA-N 2 1 308.432 4.065 20 0 DIADMP CCC[N@@H+](CC)CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474823628 1056361237 /nfs/dbraw/zinc/36/12/37/1056361237.db2.gz VHVAFTJUIUQUHP-NFOMZHRRSA-N 2 1 308.432 4.065 20 0 DIADMP CC(C)(C)[NH2+]Cc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)cc1 ZINC001240362168 1056447087 /nfs/dbraw/zinc/44/70/87/1056447087.db2.gz YAFXNHMEJPHANL-UHFFFAOYSA-N 2 1 323.362 4.238 20 0 DIADMP CC(C)([NH3+])c1ccc(C2=CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001240389106 1056473997 /nfs/dbraw/zinc/47/39/97/1056473997.db2.gz VZCGOKHPJSQTIM-UHFFFAOYSA-N 2 1 306.453 4.170 20 0 DIADMP [NH3+]C1(c2ccccc2C2=CCC[N@@H+](Cc3ccccc3)C2)CCC1 ZINC001240389002 1056474015 /nfs/dbraw/zinc/47/40/15/1056474015.db2.gz RESGQXDYEXVCNF-UHFFFAOYSA-N 2 1 318.464 4.314 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CC3CCC4(CC4)CC3)C2)CC1 ZINC001615342507 1056497697 /nfs/dbraw/zinc/49/76/97/1056497697.db2.gz BKCSJLJTSPTNMN-FQEVSTJZSA-N 2 1 318.549 4.401 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001615577903 1056538714 /nfs/dbraw/zinc/53/87/14/1056538714.db2.gz MLDWYXXQKXTASY-INIZCTEOSA-N 2 1 306.881 4.099 20 0 DIADMP Cc1cccc(Cl)c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001615577903 1056538734 /nfs/dbraw/zinc/53/87/34/1056538734.db2.gz MLDWYXXQKXTASY-INIZCTEOSA-N 2 1 306.881 4.099 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)C[C@@H](C)C1 ZINC001615577639 1056539603 /nfs/dbraw/zinc/53/96/03/1056539603.db2.gz JMRAUKQJYIBVEL-NMLBUPMWSA-N 2 1 306.538 4.399 20 0 DIADMP CC(C)C[C@H](C)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615845996 1056584914 /nfs/dbraw/zinc/58/49/14/1056584914.db2.gz FJIZRWZKYBJNSI-CEWLAPEOSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615845996 1056584928 /nfs/dbraw/zinc/58/49/28/1056584928.db2.gz FJIZRWZKYBJNSI-CEWLAPEOSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615845996 1056584938 /nfs/dbraw/zinc/58/49/38/1056584938.db2.gz FJIZRWZKYBJNSI-CEWLAPEOSA-N 2 1 314.517 4.408 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC001616382373 1056646704 /nfs/dbraw/zinc/64/67/04/1056646704.db2.gz KJDVDABZAPZJNF-VQTJNVASSA-N 2 1 300.490 4.382 20 0 DIADMP COc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001620831100 1056651338 /nfs/dbraw/zinc/65/13/38/1056651338.db2.gz JGGLKKHSPXLHFM-WMZOPIPTSA-N 2 1 318.505 4.245 20 0 DIADMP C=C/C=C/CC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001616935793 1056743272 /nfs/dbraw/zinc/74/32/72/1056743272.db2.gz OGBBLJVFLPWPKR-ONEGZZNKSA-N 2 1 310.485 4.107 20 0 DIADMP Cc1ccc(-c2ccc3c(C4C[NH2+]C4)[nH+]cn3c2)c2ccccc12 ZINC001241004552 1056807923 /nfs/dbraw/zinc/80/79/23/1056807923.db2.gz LFPZILCYDIXCFB-UHFFFAOYSA-N 2 1 313.404 4.150 20 0 DIADMP Cc1cc(C)cc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000065932188 1056813674 /nfs/dbraw/zinc/81/36/74/1056813674.db2.gz UBEIBNNWEACFTO-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(F)cc2F)c1 ZINC000065976606 1056818430 /nfs/dbraw/zinc/81/84/30/1056818430.db2.gz MQPRMFWUEJCUOT-UHFFFAOYSA-N 2 1 318.411 4.095 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc2[nH]ccc2c1 ZINC000682559693 1056904003 /nfs/dbraw/zinc/90/40/03/1056904003.db2.gz SUAQIWOJIAVLNF-UHFFFAOYSA-N 2 1 321.468 4.252 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001618048269 1056918264 /nfs/dbraw/zinc/91/82/64/1056918264.db2.gz KROQCOCRWXVEPE-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001618048269 1056918275 /nfs/dbraw/zinc/91/82/75/1056918275.db2.gz KROQCOCRWXVEPE-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001618048269 1056918283 /nfs/dbraw/zinc/91/82/83/1056918283.db2.gz KROQCOCRWXVEPE-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001618048269 1056918288 /nfs/dbraw/zinc/91/82/88/1056918288.db2.gz KROQCOCRWXVEPE-ROUUACIJSA-N 2 1 306.881 4.209 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CCSc2c(F)cccc21)C[NH+]1CCCC1 ZINC000357874986 1056969532 /nfs/dbraw/zinc/96/95/32/1056969532.db2.gz LTEQZYQFMJXFBV-MRXNPFEDSA-N 2 1 322.493 4.074 20 0 DIADMP C[NH+](C)CC(C)(C)C[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000359367735 1057007134 /nfs/dbraw/zinc/00/71/34/1057007134.db2.gz DUVZLIJYRCBTRH-AWEZNQCLSA-N 2 1 312.910 4.054 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000480630533 1057010038 /nfs/dbraw/zinc/01/00/38/1057010038.db2.gz JWSLNBFWCNOOJP-HNAYVOBHSA-N 2 1 304.453 4.057 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000480630531 1057010112 /nfs/dbraw/zinc/01/01/12/1057010112.db2.gz JWSLNBFWCNOOJP-BEFAXECRSA-N 2 1 304.453 4.057 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@@H]1CCSc2c(Cl)cccc21 ZINC000359646066 1057013275 /nfs/dbraw/zinc/01/32/75/1057013275.db2.gz TYKDZJPWQHMFAG-OAHLLOKOSA-N 2 1 312.910 4.197 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H]1CCSc2c(Cl)cccc21 ZINC000359646066 1057013281 /nfs/dbraw/zinc/01/32/81/1057013281.db2.gz TYKDZJPWQHMFAG-OAHLLOKOSA-N 2 1 312.910 4.197 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)C(C)(C)C(F)F ZINC000657836679 1057024486 /nfs/dbraw/zinc/02/44/86/1057024486.db2.gz VFUKQCNGYYIQAS-AWEZNQCLSA-N 2 1 312.448 4.296 20 0 DIADMP C[NH+](C)Cc1ccccc1C1=CC[N@@H+](Cc2ccccc2)CC1 ZINC001241503561 1057073513 /nfs/dbraw/zinc/07/35/13/1057073513.db2.gz VEQBANMOIWQTJW-UHFFFAOYSA-N 2 1 306.453 4.038 20 0 DIADMP [NH3+]C1(c2ccc(C3=CC[N@@H+](Cc4ccccc4)CC3)cc2)CCC1 ZINC001241504700 1057075357 /nfs/dbraw/zinc/07/53/57/1057075357.db2.gz YRPJDGICQWKWHF-UHFFFAOYSA-N 2 1 318.464 4.314 20 0 DIADMP [NH3+]C1(c2ccccc2C2=CC[N@@H+](Cc3ccccc3)CC2)CCC1 ZINC001241507172 1057076491 /nfs/dbraw/zinc/07/64/91/1057076491.db2.gz QQEUUEVQHRMTNS-UHFFFAOYSA-N 2 1 318.464 4.314 20 0 DIADMP c1ccc(C[N@@H+]2CC=C(c3ccc([C@H]4CC[NH2+]C4)cc3)CC2)cc1 ZINC001241506683 1057076645 /nfs/dbraw/zinc/07/66/45/1057076645.db2.gz JTPPXZWAOSERBY-QFIPXVFZSA-N 2 1 318.464 4.053 20 0 DIADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc(C[NH3+])cc2)nc1 ZINC001241913240 1057209102 /nfs/dbraw/zinc/20/91/02/1057209102.db2.gz SADFPQHABWSTSJ-HXUWFJFHSA-N 2 1 309.457 4.144 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)Cc2cccs2)c1 ZINC000675779821 1057410686 /nfs/dbraw/zinc/41/06/86/1057410686.db2.gz IZCFKSSIZKMHAZ-INIZCTEOSA-N 2 1 316.514 4.309 20 0 DIADMP CC[N@H+]1CCc2cc(C3=CC[C@@H]([NH+]4CCCC4)CC3)ccc2C1 ZINC001242694828 1057450633 /nfs/dbraw/zinc/45/06/33/1057450633.db2.gz NTYDZGVGHJSQTM-OAQYLSRUSA-N 2 1 310.485 4.096 20 0 DIADMP Cc1nc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(C)s1 ZINC000676490322 1057479389 /nfs/dbraw/zinc/47/93/89/1057479389.db2.gz NINLMLZSHSVGBE-UONOGXRCSA-N 2 1 309.523 4.065 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366757 1057502617 /nfs/dbraw/zinc/50/26/17/1057502617.db2.gz XHIJNPBGYAODJH-DOTOQJQBSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366757 1057502620 /nfs/dbraw/zinc/50/26/20/1057502620.db2.gz XHIJNPBGYAODJH-DOTOQJQBSA-N 2 1 324.459 4.168 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-c2cccc(C[NH2+]C)c2)nc1 ZINC001242997157 1057540184 /nfs/dbraw/zinc/54/01/84/1057540184.db2.gz WWWGGIBMFYBGDY-HXUWFJFHSA-N 2 1 309.457 4.015 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000161614859 1057597952 /nfs/dbraw/zinc/59/79/52/1057597952.db2.gz LFMTVCUPJWKPDI-VAMGGRTRSA-N 2 1 300.490 4.004 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](CC)c2ccc(Cl)s2)CC1 ZINC000161651058 1057599337 /nfs/dbraw/zinc/59/93/37/1057599337.db2.gz VUUWCRAHOBIHEP-CYBMUJFWSA-N 2 1 300.899 4.317 20 0 DIADMP CC[NH+](CC)Cc1ccccc1-c1ccc2c(c1)CC[N@H+](C)C2 ZINC001243337548 1057651285 /nfs/dbraw/zinc/65/12/85/1057651285.db2.gz MVEWMENEUFFOIH-UHFFFAOYSA-N 2 1 308.469 4.183 20 0 DIADMP Fc1ccccc1[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)C1CCCC1 ZINC000166825671 1057677506 /nfs/dbraw/zinc/67/75/06/1057677506.db2.gz GHKQSYRWIDZRBS-MBOZVWFJSA-N 2 1 316.464 4.273 20 0 DIADMP CCCCCCOc1cccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000731041628 1057733044 /nfs/dbraw/zinc/73/30/44/1057733044.db2.gz KXYFRBULENIMQV-IBGZPJMESA-N 2 1 318.505 4.077 20 0 DIADMP C[NH+]1CCC(c2ccc(-c3ccc4c(c3)CC[N@H+](C)C4)cc2)CC1 ZINC001243658168 1057746775 /nfs/dbraw/zinc/74/67/75/1057746775.db2.gz SKBWGHYFFMQWCA-UHFFFAOYSA-N 2 1 320.480 4.151 20 0 DIADMP CCC[N@H+]1CCCC[C@H]1c1ccc(/C=C/C2CC[NH2+]CC2)nc1 ZINC001243893485 1057800856 /nfs/dbraw/zinc/80/08/56/1057800856.db2.gz FQXMCBNYURAOJP-IEJURRBGSA-N 2 1 313.489 4.031 20 0 DIADMP CCCC[C@H](CC)C[N@@H+]1CCO[C@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391377 1058064939 /nfs/dbraw/zinc/06/49/39/1058064939.db2.gz QARQGPWLDPGMMZ-PMACEKPBSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCO[C@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391377 1058064941 /nfs/dbraw/zinc/06/49/41/1058064941.db2.gz QARQGPWLDPGMMZ-PMACEKPBSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCO[C@]2(CCC[N@H+](CC(C)C)C2)C1 ZINC001278391377 1058064946 /nfs/dbraw/zinc/06/49/46/1058064946.db2.gz QARQGPWLDPGMMZ-PMACEKPBSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCO[C@]2(CCC[N@@H+](CC(C)C)C2)C1 ZINC001278391377 1058064949 /nfs/dbraw/zinc/06/49/49/1058064949.db2.gz QARQGPWLDPGMMZ-PMACEKPBSA-N 2 1 324.553 4.026 20 0 DIADMP Cc1ccc(C2([NH2+][C@@H]3CC[C@H](c4[nH+]ccn4C)C3)CCC2)cc1 ZINC001550512886 1058341990 /nfs/dbraw/zinc/34/19/90/1058341990.db2.gz IULPOMOJSPRALO-FUHWJXTLSA-N 2 1 309.457 4.034 20 0 DIADMP Cc1ccc(C2([NH2+][C@H]3CC[C@@H](c4[nH+]ccn4C)C3)CCC2)cc1 ZINC001550512885 1058343481 /nfs/dbraw/zinc/34/34/81/1058343481.db2.gz IULPOMOJSPRALO-AEFFLSMTSA-N 2 1 309.457 4.034 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001552080675 1058426322 /nfs/dbraw/zinc/42/63/22/1058426322.db2.gz AHQJXAFFNJMXTN-VYIQXXGSSA-N 2 1 320.480 4.324 20 0 DIADMP Fc1ccccc1C1CC([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)C1 ZINC001552080694 1058428482 /nfs/dbraw/zinc/42/84/82/1058428482.db2.gz HWJYIHOQJRMMTB-ZTNRTKLDSA-N 2 1 324.443 4.155 20 0 DIADMP FC1CC([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)(c2ccccc2)C1 ZINC001552312467 1058433391 /nfs/dbraw/zinc/43/33/91/1058433391.db2.gz PWABGAUPIBYHBV-JWFWCLOMSA-N 2 1 324.443 4.097 20 0 DIADMP CC(C)CC[N@@H+]1C[C@@H]2CC[NH+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278423634 1058655482 /nfs/dbraw/zinc/65/54/82/1058655482.db2.gz UPWWVWKWEILVEP-IYBDPMFKSA-N 2 1 320.443 4.019 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CC[N@@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278423634 1058655491 /nfs/dbraw/zinc/65/54/91/1058655491.db2.gz UPWWVWKWEILVEP-IYBDPMFKSA-N 2 1 320.443 4.019 20 0 DIADMP CC(C)CC[NH+]1C[C@@H]2CC[N@H+](CCCC(F)(F)F)CC[C@@H]2C1 ZINC001278423634 1058655500 /nfs/dbraw/zinc/65/55/00/1058655500.db2.gz UPWWVWKWEILVEP-IYBDPMFKSA-N 2 1 320.443 4.019 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C2CCC(C)CC2)CC[NH2+]1 ZINC001246066474 1058660787 /nfs/dbraw/zinc/66/07/87/1058660787.db2.gz QYOLWRVKKXHAFU-ZDZDDUJFSA-N 2 1 304.453 4.096 20 0 DIADMP Fc1cc(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)ccc1Cl ZINC001246087563 1058669708 /nfs/dbraw/zinc/66/97/08/1058669708.db2.gz PASFSYKRKSGWHZ-YJBOKZPZSA-N 2 1 318.823 4.062 20 0 DIADMP Cc1csc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)c1 ZINC001246078240 1058669946 /nfs/dbraw/zinc/66/99/46/1058669946.db2.gz CGMIVFSLVAMBIV-CRAIPNDOSA-N 2 1 318.461 4.087 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)C[NH2+]1 ZINC001246085330 1058671627 /nfs/dbraw/zinc/67/16/27/1058671627.db2.gz QILANMPZWNQWRN-HKFAYQRXSA-N 2 1 306.881 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246092044 1058674876 /nfs/dbraw/zinc/67/48/76/1058674876.db2.gz BXOGOUVNEFTTNZ-LLYILUEJSA-N 2 1 318.480 4.343 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)ccc1Cl ZINC001246115961 1058684536 /nfs/dbraw/zinc/68/45/36/1058684536.db2.gz LWFKTTZZQGDIOD-JQWIXIFHSA-N 2 1 301.261 4.175 20 0 DIADMP Cc1ccc(CCC[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC001246127704 1058690229 /nfs/dbraw/zinc/69/02/29/1058690229.db2.gz MMVIIVPYLFQFDM-IEBWSBKVSA-N 2 1 314.498 4.072 20 0 DIADMP CC(C)c1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246163122 1058706023 /nfs/dbraw/zinc/70/60/23/1058706023.db2.gz VUSKCOTUAZVGJD-NHCUHLMSSA-N 2 1 308.469 4.393 20 0 DIADMP Clc1ccc(C2CCC([NH2+]C[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC001246170991 1058717409 /nfs/dbraw/zinc/71/74/09/1058717409.db2.gz VGYPELHPYSXIRW-VMWRSERWSA-N 2 1 306.881 4.098 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@@H]1CCCC[NH2+]1 ZINC001246174867 1058720146 /nfs/dbraw/zinc/72/01/46/1058720146.db2.gz FOLAFDYFDDTCBJ-JSGCOSHPSA-N 2 1 315.288 4.046 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]CC34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246174496 1058720522 /nfs/dbraw/zinc/72/05/22/1058720522.db2.gz XDOOJQIGMTYEDF-HXTOSXCISA-N 2 1 324.512 4.286 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246185418 1058731362 /nfs/dbraw/zinc/73/13/62/1058731362.db2.gz WEBFENQSQISXQT-QMMLZNLJSA-N 2 1 324.443 4.204 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246200981 1058740012 /nfs/dbraw/zinc/74/00/12/1058740012.db2.gz SWMIVTRYIXTDHM-ZSHCYNCHSA-N 2 1 304.437 4.019 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Cl)c(F)c2)C[C@H](CC)[NH2+]1 ZINC001246211462 1058743213 /nfs/dbraw/zinc/74/32/13/1058743213.db2.gz JXVXOCUFAOMRAE-REBRKWNGSA-N 2 1 312.860 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246214367 1058747441 /nfs/dbraw/zinc/74/74/41/1058747441.db2.gz ZTQYMYOGAHDYKS-PBASOCQRSA-N 2 1 324.443 4.073 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+]CCC3CCCCCC3)CC[NH2+]2)cc1 ZINC001246230467 1058752975 /nfs/dbraw/zinc/75/29/75/1058752975.db2.gz BLBQCVZBGVOGGL-VQTJNVASSA-N 2 1 300.490 4.430 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246235100 1058756210 /nfs/dbraw/zinc/75/62/10/1058756210.db2.gz XTTBGAYMSMXGMM-YRMAPFEESA-N 2 1 306.469 4.342 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246235532 1058757207 /nfs/dbraw/zinc/75/72/07/1058757207.db2.gz HTIKGSQYXWFMOF-SJORKVTESA-N 2 1 306.881 4.230 20 0 DIADMP C=Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)cc1 ZINC001246233822 1058758188 /nfs/dbraw/zinc/75/81/88/1058758188.db2.gz FFSKCOSSVKZZET-PZJWPPBQSA-N 2 1 324.443 4.360 20 0 DIADMP Clc1cccc(C2([NH2+][C@@H]3CC[NH2+]C4(CCCCC4)C3)CC2)c1 ZINC001246237409 1058762016 /nfs/dbraw/zinc/76/20/16/1058762016.db2.gz NTSRNOGNQSSAMN-QGZVFWFLSA-N 2 1 318.892 4.374 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H](C)C2CCCC2)CC[NH2+]1 ZINC001246242937 1058764213 /nfs/dbraw/zinc/76/42/13/1058764213.db2.gz JYHAVBYGLWPVJS-YJLNNSPDSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]C(C(C)C)C(C)C)CC[NH2+]1 ZINC001246241268 1058766224 /nfs/dbraw/zinc/76/62/24/1058766224.db2.gz YTRXONFJXVPUKY-AEFFLSMTSA-N 2 1 306.469 4.197 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246251543 1058770432 /nfs/dbraw/zinc/77/04/32/1058770432.db2.gz DQQVWUBVYBDLGA-UVBJJODRSA-N 2 1 315.288 4.421 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccccc1F ZINC001246271586 1058782744 /nfs/dbraw/zinc/78/27/44/1058782744.db2.gz JXUABMRLDHSJOP-RCJHGTSTSA-N 2 1 304.453 4.176 20 0 DIADMP CCC[NH2+]CC[NH2+][C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001246269917 1058784672 /nfs/dbraw/zinc/78/46/72/1058784672.db2.gz NQVLMHKJXJEFCB-SFHVURJKSA-N 2 1 310.485 4.186 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccccc1F ZINC001246271585 1058785418 /nfs/dbraw/zinc/78/54/18/1058785418.db2.gz JXUABMRLDHSJOP-PASDCYSWSA-N 2 1 304.453 4.176 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccccc1F ZINC001246272148 1058787671 /nfs/dbraw/zinc/78/76/71/1058787671.db2.gz LEBIVDGWHQAQCT-CRAIPNDOSA-N 2 1 304.453 4.177 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)C)C1)c1ccccc1F ZINC001246274327 1058787846 /nfs/dbraw/zinc/78/78/46/1058787846.db2.gz WBDDZQZTYPYZAA-MNEFBYGVSA-N 2 1 306.469 4.279 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CC2CCCCCC2)CC[NH2+]1 ZINC001246273970 1058788855 /nfs/dbraw/zinc/78/88/55/1058788855.db2.gz TVUBRCPSENFMQI-ICSRJNTNSA-N 2 1 318.480 4.487 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+]C(C)(C)c2cc(F)cc(F)c2)C[C@H](CC)[NH2+]1 ZINC001246275586 1058790937 /nfs/dbraw/zinc/79/09/37/1058790937.db2.gz AQICQYRSGGEXOF-FVQHAEBGSA-N 2 1 310.432 4.099 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1ccccc1F ZINC001246277268 1058793774 /nfs/dbraw/zinc/79/37/74/1058793774.db2.gz QKWRLNFQMVWPSE-WBAXXEDZSA-N 2 1 306.469 4.423 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246290996 1058805480 /nfs/dbraw/zinc/80/54/80/1058805480.db2.gz PTRMZUBPWMEJFK-UFYCRDLUSA-N 2 1 312.432 4.360 20 0 DIADMP Cc1cc(C)cc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246297867 1058811812 /nfs/dbraw/zinc/81/18/12/1058811812.db2.gz QGRMPUHLNALICQ-UIFIKXQLSA-N 2 1 308.469 4.447 20 0 DIADMP CCCC[C@H]1CC[C@H](C2CCC(N[C@H]([NH3+])CCC[NH3+])CC2)CC1 ZINC001246299328 1058813429 /nfs/dbraw/zinc/81/34/29/1058813429.db2.gz HIGXCLGZMBQFQS-QNGUGAFLSA-N 2 1 323.569 4.155 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246309252 1058814816 /nfs/dbraw/zinc/81/48/16/1058814816.db2.gz JEBUKQNABJUZPB-GJZGRUSLSA-N 2 1 308.897 4.476 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246318082 1058831845 /nfs/dbraw/zinc/83/18/45/1058831845.db2.gz PTRMZUBPWMEJFK-ZCNNSNEGSA-N 2 1 312.432 4.360 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246318078 1058832189 /nfs/dbraw/zinc/83/21/89/1058832189.db2.gz PTRMZUBPWMEJFK-VAMGGRTRSA-N 2 1 312.432 4.360 20 0 DIADMP C[C@H]1[NH2+]CCC[C@@H]1[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246326401 1058837867 /nfs/dbraw/zinc/83/78/67/1058837867.db2.gz OKCOMJBUAKYQQR-YPCVUPECSA-N 2 1 306.881 4.096 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C1CCCCC1 ZINC001246350363 1058859544 /nfs/dbraw/zinc/85/95/44/1058859544.db2.gz HEPXVXVOANJNRO-RTBURBONSA-N 2 1 300.490 4.428 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)C1CCCCC1 ZINC001246350361 1058860099 /nfs/dbraw/zinc/86/00/99/1058860099.db2.gz HEPXVXVOANJNRO-OALUTQOASA-N 2 1 300.490 4.428 20 0 DIADMP COc1cccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246363683 1058867989 /nfs/dbraw/zinc/86/79/89/1058867989.db2.gz SNOJEIMCFPOXFR-AZUAARDMSA-N 2 1 324.468 4.013 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]Cc3cccc(C4CC4)c3)CC[NH2+]2)cc1 ZINC001246361846 1058871365 /nfs/dbraw/zinc/87/13/65/1058871365.db2.gz JPPHADNNSHLGQC-SFTDATJTSA-N 2 1 306.453 4.147 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246370680 1058876066 /nfs/dbraw/zinc/87/60/66/1058876066.db2.gz FXISSSARWNASDW-HBGVWJBISA-N 2 1 308.469 4.393 20 0 DIADMP CCCC[C@H](CC)[NH2+]C1(c2ccccc2Cl)CC[NH2+]CC1 ZINC001246377035 1058883153 /nfs/dbraw/zinc/88/31/53/1058883153.db2.gz YFTOSSFIURXMRE-HNNXBMFYSA-N 2 1 308.897 4.477 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](c2ccncc2Cl)C2CC2)CC[NH2+]1 ZINC001246398144 1058901414 /nfs/dbraw/zinc/90/14/14/1058901414.db2.gz UWZZBBCTEJLKEU-RKVPGOIHSA-N 2 1 321.896 4.087 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](c2cncc(Cl)c2)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246401011 1058905777 /nfs/dbraw/zinc/90/57/77/1058905777.db2.gz QUBFULLMNXGRMA-NUJGCVRESA-N 2 1 321.896 4.085 20 0 DIADMP CCOc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246414917 1058916535 /nfs/dbraw/zinc/91/65/35/1058916535.db2.gz VDSNDAKDFZEPGE-LKUPVBHCSA-N 2 1 324.468 4.229 20 0 DIADMP Cc1ccc(C)c([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246416643 1058918322 /nfs/dbraw/zinc/91/83/22/1058918322.db2.gz SKJKPBBLUXAZFA-HFSMHLIXSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1ccccc1C(C)(C)[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246440506 1058935687 /nfs/dbraw/zinc/93/56/87/1058935687.db2.gz VFUGNOWZQKLZRL-AZUAARDMSA-N 2 1 308.469 4.313 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](c2cccnc2Cl)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246455780 1058939413 /nfs/dbraw/zinc/93/94/13/1058939413.db2.gz HOYRKTMHURPUPX-CPUCHLNUSA-N 2 1 321.896 4.085 20 0 DIADMP CC[C@@]1(C[NH2+][C@H](C)Cc2ccc(Cl)cc2Cl)CCC[NH2+]1 ZINC001246454201 1058939888 /nfs/dbraw/zinc/93/98/88/1058939888.db2.gz APIBYTZLDHTEII-WBMJQRKESA-N 2 1 315.288 4.046 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](c2cccnc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246455781 1058940245 /nfs/dbraw/zinc/94/02/45/1058940245.db2.gz HOYRKTMHURPUPX-HWMZRRJGSA-N 2 1 321.896 4.085 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](c2cccnc2Cl)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246455783 1058941368 /nfs/dbraw/zinc/94/13/68/1058941368.db2.gz HOYRKTMHURPUPX-JYYAWHABSA-N 2 1 321.896 4.085 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cc(F)cc(F)c1 ZINC001246460654 1058943486 /nfs/dbraw/zinc/94/34/86/1058943486.db2.gz GLRQWVJNAFSRNT-GVDBMIGSSA-N 2 1 310.432 4.172 20 0 DIADMP CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001246502984 1058974921 /nfs/dbraw/zinc/97/49/21/1058974921.db2.gz IQOHHMBWCXXTPV-OCCSQVGLSA-N 2 1 317.304 4.278 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2OC)C2CC2)C[C@H](CC)[NH2+]1 ZINC001246466857 1058952422 /nfs/dbraw/zinc/95/24/22/1058952422.db2.gz BKXLJRAUBUNSLO-XLSPSMHOSA-N 2 1 316.489 4.045 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+]CC[C@@H]1CC[NH2+]CC1(F)F ZINC001246486533 1058963896 /nfs/dbraw/zinc/96/38/96/1058963896.db2.gz KDTAEZJHIGNPDA-ZWKOTPCHSA-N 2 1 324.459 4.012 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cc(F)cc(Cl)c1 ZINC001246490228 1058966975 /nfs/dbraw/zinc/96/69/75/1058966975.db2.gz OCQVDQRBMKIVBH-RLCCDNCMSA-N 2 1 312.860 4.296 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c3ccccc3)C1)CCC2 ZINC001246496185 1058970152 /nfs/dbraw/zinc/97/01/52/1058970152.db2.gz DCWQEPCNJBICCW-FCEUIQTBSA-N 2 1 320.480 4.455 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246499555 1058973467 /nfs/dbraw/zinc/97/34/67/1058973467.db2.gz LCHQGLPOFTUGLX-CLCXKQKWSA-N 2 1 322.443 4.243 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H]2CCOc3ccc(Cl)cc32)CC[NH2+]1 ZINC001246508258 1058976473 /nfs/dbraw/zinc/97/64/73/1058976473.db2.gz BQOPBQOOJGBVFZ-VYDXJSESSA-N 2 1 322.880 4.064 20 0 DIADMP CC(C)C[C@@H](C[NH3+])[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246504709 1058978881 /nfs/dbraw/zinc/97/88/81/1058978881.db2.gz RRSALIGUQIEDQL-VJFUWPCTSA-N 2 1 308.897 4.329 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246521807 1058980449 /nfs/dbraw/zinc/98/04/49/1058980449.db2.gz RMFVKNBGMGPBAB-IBGZPJMESA-N 2 1 300.490 4.352 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001246521766 1058980760 /nfs/dbraw/zinc/98/07/60/1058980760.db2.gz FBLSLNXDQIOQEF-HXUWFJFHSA-N 2 1 314.517 4.254 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246519405 1058981415 /nfs/dbraw/zinc/98/14/15/1058981415.db2.gz NEZNPJSPNDQVLX-UYAOXDASSA-N 2 1 300.490 4.209 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246521952 1058983089 /nfs/dbraw/zinc/98/30/89/1058983089.db2.gz DAUKLRWWNJPZEX-FQEVSTJZSA-N 2 1 320.480 4.383 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246520178 1058984013 /nfs/dbraw/zinc/98/40/13/1058984013.db2.gz RMLGCEYRJOMLCO-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246529933 1058985841 /nfs/dbraw/zinc/98/58/41/1058985841.db2.gz LKTASDSBYYYAOS-IBGZPJMESA-N 2 1 308.469 4.238 20 0 DIADMP Clc1ccc(C2=CC[N@H+]([C@H]3C[C@H]4CCC[C@@H](C3)[NH2+]4)CC2)cc1 ZINC001246536869 1058987390 /nfs/dbraw/zinc/98/73/90/1058987390.db2.gz SZJZMSLWRTXQQE-BWTSREIZSA-N 2 1 316.876 4.102 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@@H]([NH3+])C2(CC2)C1 ZINC001246535310 1058987549 /nfs/dbraw/zinc/98/75/49/1058987549.db2.gz XCZAFVXBIHUXPJ-LAUBAEHRSA-N 2 1 320.480 4.020 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]([NH3+])C2(CC2)C1 ZINC001246535310 1058987567 /nfs/dbraw/zinc/98/75/67/1058987567.db2.gz XCZAFVXBIHUXPJ-LAUBAEHRSA-N 2 1 320.480 4.020 20 0 DIADMP CCC[N@H+]([C@H](C)CC)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532121 1058988186 /nfs/dbraw/zinc/98/81/86/1058988186.db2.gz XRENZFGLFJYJID-SUMDDJOVSA-N 2 1 306.469 4.438 20 0 DIADMP CCC[N@@H+]([C@H](C)CC)[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532121 1058988210 /nfs/dbraw/zinc/98/82/10/1058988210.db2.gz XRENZFGLFJYJID-SUMDDJOVSA-N 2 1 306.469 4.438 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCc3ccc(Cl)cc3C2)C[C@@H](CC)[NH2+]1 ZINC001246536462 1058988496 /nfs/dbraw/zinc/98/84/96/1058988496.db2.gz FTXHUUJLFLQKFB-IAGOWNOFSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCc3ccc(Cl)cc3C2)C[C@@H](CC)[NH2+]1 ZINC001246536462 1058988513 /nfs/dbraw/zinc/98/85/13/1058988513.db2.gz FTXHUUJLFLQKFB-IAGOWNOFSA-N 2 1 306.881 4.007 20 0 DIADMP Clc1ccc(C2=CC[N@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)[NH2+]4)CC2)cc1 ZINC001246536870 1058988761 /nfs/dbraw/zinc/98/87/61/1058988761.db2.gz SZJZMSLWRTXQQE-REPLKXPHSA-N 2 1 316.876 4.102 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+]2CCc3ccc(Cl)cc3C2)C[C@H](CC)[NH2+]1 ZINC001246536461 1058989603 /nfs/dbraw/zinc/98/96/03/1058989603.db2.gz FTXHUUJLFLQKFB-BCDXTJNWSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCc3ccc(Cl)cc3C2)C[C@H](CC)[NH2+]1 ZINC001246536461 1058989626 /nfs/dbraw/zinc/98/96/26/1058989626.db2.gz FTXHUUJLFLQKFB-BCDXTJNWSA-N 2 1 306.881 4.007 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H]([NH3+])CC1 ZINC001246541036 1058991328 /nfs/dbraw/zinc/99/13/28/1058991328.db2.gz LKVWGRJSOSFWEJ-WIYYLYMNSA-N 2 1 322.496 4.410 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246537650 1058992808 /nfs/dbraw/zinc/99/28/08/1058992808.db2.gz XFXLUJQUCGKPQM-RBUKOAKNSA-N 2 1 318.892 4.206 20 0 DIADMP C[C@]1([NH3+])CCC[N@H+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001246549161 1058997593 /nfs/dbraw/zinc/99/75/93/1058997593.db2.gz HNHXECNVMGVZLD-CKHPTIKVSA-N 2 1 312.501 4.017 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001246556942 1058997667 /nfs/dbraw/zinc/99/76/67/1058997667.db2.gz IOOVIEKXBRKZEZ-MISYRCLQSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@H]1CC[N@H+](C2CCC(c3ccccc3)CC2)CC[C@@H]1C[NH3+] ZINC001246557035 1058999747 /nfs/dbraw/zinc/99/97/47/1058999747.db2.gz JOCNWTZKFKRWRV-OXHPOLQJSA-N 2 1 300.490 4.020 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@H+]1CC=C(c2cc(Cl)cc(Cl)c2)CC1 ZINC001246547803 1058999789 /nfs/dbraw/zinc/99/97/89/1058999789.db2.gz GHWNJFURKLQGBO-GFCCVEGCSA-N 2 1 313.272 4.081 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@@H+]1CC=C(c2cc(Cl)cc(Cl)c2)CC1 ZINC001246547803 1058999804 /nfs/dbraw/zinc/99/98/04/1058999804.db2.gz GHWNJFURKLQGBO-GFCCVEGCSA-N 2 1 313.272 4.081 20 0 DIADMP C[C@H]1C[N@H+](C2CCC(c3ccccc3)CC2)CCC[C@H]1C[NH3+] ZINC001246565070 1059003218 /nfs/dbraw/zinc/00/32/18/1059003218.db2.gz GZYQDEATDPSIFR-VHBXLISGSA-N 2 1 300.490 4.020 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246564076 1059004410 /nfs/dbraw/zinc/00/44/10/1059004410.db2.gz WRGFOFKRXVOCSB-RTBURBONSA-N 2 1 316.464 4.418 20 0 DIADMP C[C@H]1C[N@H+](C2CCC(c3ccccc3)CC2)CCC[C@@H]1C[NH3+] ZINC001246565066 1059004473 /nfs/dbraw/zinc/00/44/73/1059004473.db2.gz GZYQDEATDPSIFR-OXHPOLQJSA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246561230 1059004997 /nfs/dbraw/zinc/00/49/97/1059004997.db2.gz JMAPEFPRSRMLRT-SQNIBIBYSA-N 2 1 304.453 4.129 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246565030 1059006342 /nfs/dbraw/zinc/00/63/42/1059006342.db2.gz ZZEDGMQKQAEKGU-FCGDIQPGSA-N 2 1 304.453 4.272 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2ccc(F)cc2)C[C@@H](CC)[NH2+]1 ZINC001246565039 1059007600 /nfs/dbraw/zinc/00/76/00/1059007600.db2.gz ZZEDGMQKQAEKGU-ZHALLVOQSA-N 2 1 304.453 4.272 20 0 DIADMP CCC1CC[NH+]([C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CC1 ZINC001246587021 1059009683 /nfs/dbraw/zinc/00/96/83/1059009683.db2.gz DGRPJCXRMGSVBQ-MJGOQNOKSA-N 2 1 304.453 4.049 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@H+](C2CCC(c3ccccc3)CC2)C1 ZINC001246585180 1059010648 /nfs/dbraw/zinc/01/06/48/1059010648.db2.gz OOUOMADJPFHADR-MHJFOBGBSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001246579524 1059012152 /nfs/dbraw/zinc/01/21/52/1059012152.db2.gz FJGJJKDKZFCRIX-PMACEKPBSA-N 2 1 302.506 4.095 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001246581804 1059012620 /nfs/dbraw/zinc/01/26/20/1059012620.db2.gz AWEMXCGDUDCYMX-AZUAARDMSA-N 2 1 302.506 4.169 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+](C2CCC(Cc3ccccc3)CC2)CC1 ZINC001246580392 1059013227 /nfs/dbraw/zinc/01/32/27/1059013227.db2.gz MIBOTVUMDRYXPZ-XVAXZDLZSA-N 2 1 314.517 4.239 20 0 DIADMP C[C@H]1C[N@@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596846 1059015869 /nfs/dbraw/zinc/01/58/69/1059015869.db2.gz KKNPDDGZTFHTFF-LDQXTDLNSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1C[N@H+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246596846 1059015892 /nfs/dbraw/zinc/01/58/92/1059015892.db2.gz KKNPDDGZTFHTFF-LDQXTDLNSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1C[C@H](C[NH3+])CC[C@H]1C ZINC001246593661 1059016595 /nfs/dbraw/zinc/01/65/95/1059016595.db2.gz SINXNHIFWRBTPP-OAGGEKHMSA-N 2 1 324.534 4.129 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001246609171 1059025911 /nfs/dbraw/zinc/02/59/11/1059025911.db2.gz XQRMKXGLQROVGF-RDTXWAMCSA-N 2 1 324.871 4.018 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246610184 1059027138 /nfs/dbraw/zinc/02/71/38/1059027138.db2.gz QDMZERVCMFTBEC-PXNSSMCTSA-N 2 1 318.480 4.003 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246609274 1059027185 /nfs/dbraw/zinc/02/71/85/1059027185.db2.gz MCKMRSGADHUSGM-YLJYHZDGSA-N 2 1 318.480 4.003 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@@H+]3CCC[C@]34CCC[NH2+]CC4)C2)cc1 ZINC001246608691 1059027419 /nfs/dbraw/zinc/02/74/19/1059027419.db2.gz VBOLUJNPKYJPSC-NJYVYQBISA-N 2 1 312.501 4.321 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246609268 1059028091 /nfs/dbraw/zinc/02/80/91/1059028091.db2.gz MCKMRSGADHUSGM-FXAWDEMLSA-N 2 1 318.480 4.003 20 0 DIADMP c1ccc(C2CCC([NH+]3CCC4(CCCC[NH2+]4)CC3)CC2)cc1 ZINC001246612519 1059029258 /nfs/dbraw/zinc/02/92/58/1059029258.db2.gz QSMBFKIYDFNTCQ-UHFFFAOYSA-N 2 1 312.501 4.321 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001246619858 1059031085 /nfs/dbraw/zinc/03/10/85/1059031085.db2.gz JAAPAMDEOFYISC-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH+]2CCC3(CCC3)CC2)CC[NH2+]1 ZINC001246623506 1059031215 /nfs/dbraw/zinc/03/12/15/1059031215.db2.gz UEGQAOBYIVSBEM-PKOBYXMFSA-N 2 1 316.464 4.193 20 0 DIADMP c1ccc(C[C@@H]2C[C@@H]([N@H+]3CCCC4(CCCC4)C3)CC[NH2+]2)cc1 ZINC001246614680 1059035492 /nfs/dbraw/zinc/03/54/92/1059035492.db2.gz PABWAVMLSQHAAF-UXHICEINSA-N 2 1 312.501 4.006 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001246616283 1059035894 /nfs/dbraw/zinc/03/58/94/1059035894.db2.gz GXMZNHMFKVINSE-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246634545 1059039356 /nfs/dbraw/zinc/03/93/56/1059039356.db2.gz OEOFUZHIYNYYBI-KBXCAEBGSA-N 2 1 324.871 4.018 20 0 DIADMP CC(C)CC(CC(C)C)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246624421 1059040265 /nfs/dbraw/zinc/04/02/65/1059040265.db2.gz PKXDYQRUDHTCTO-HXUWFJFHSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001246628650 1059040699 /nfs/dbraw/zinc/04/06/99/1059040699.db2.gz BXTQUYZCOJCCTI-IEBWSBKVSA-N 2 1 318.530 4.084 20 0 DIADMP CCCCCC[C@H](C)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246623846 1059041112 /nfs/dbraw/zinc/04/11/12/1059041112.db2.gz NTRJOODZROMBQI-PKOBYXMFSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246629338 1059041456 /nfs/dbraw/zinc/04/14/56/1059041456.db2.gz YWPHCZSXJZHJHJ-BJLQDIEVSA-N 2 1 314.517 4.136 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246634549 1059042301 /nfs/dbraw/zinc/04/23/01/1059042301.db2.gz OEOFUZHIYNYYBI-RDTXWAMCSA-N 2 1 324.871 4.018 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246636280 1059044648 /nfs/dbraw/zinc/04/46/48/1059044648.db2.gz ULHIMBUZPQVXSO-NHCUHLMSSA-N 2 1 314.517 4.396 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246635517 1059045831 /nfs/dbraw/zinc/04/58/31/1059045831.db2.gz RWGJTUHIYUUUMR-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+]1CCCC12CC[NH2+]CC2 ZINC001246644546 1059047587 /nfs/dbraw/zinc/04/75/87/1059047587.db2.gz KLQQPANXICVUPA-CQSZACIVSA-N 2 1 324.921 4.039 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001246641237 1059048908 /nfs/dbraw/zinc/04/89/08/1059048908.db2.gz CIXLZQSGGYSVMU-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246644719 1059050568 /nfs/dbraw/zinc/05/05/68/1059050568.db2.gz LKNPBNARFCJGAP-DNVCBOLYSA-N 2 1 320.908 4.125 20 0 DIADMP Clc1ccc(C2CCC([N@@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)CC2)cc1 ZINC001246655818 1059052508 /nfs/dbraw/zinc/05/25/08/1059052508.db2.gz ATAWCUXZERWCKD-DHRZBBNESA-N 2 1 318.892 4.050 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@H]4[NH2+]CC[C@H]4C3)CC2)cc1 ZINC001246655818 1059052531 /nfs/dbraw/zinc/05/25/31/1059052531.db2.gz ATAWCUXZERWCKD-DHRZBBNESA-N 2 1 318.892 4.050 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001246651007 1059054975 /nfs/dbraw/zinc/05/49/75/1059054975.db2.gz VOZFMVWRUBTHCN-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP CCCC[C@H](CC)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246675924 1059058348 /nfs/dbraw/zinc/05/83/48/1059058348.db2.gz BKXHYHIOZIZUJR-XUVXKRRUSA-N 2 1 300.490 4.034 20 0 DIADMP FC(F)(F)CCC[N@@H+]1CCC[C@]2(CC[NH+](C3CCCC3)C2)C1 ZINC001278460807 1059058799 /nfs/dbraw/zinc/05/87/99/1059058799.db2.gz FGMTXKGZRGTTIU-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[N@H+]1CCC[C@]2(CC[NH+](C3CCCC3)C2)C1 ZINC001278460807 1059058822 /nfs/dbraw/zinc/05/88/22/1059058822.db2.gz FGMTXKGZRGTTIU-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CCC[C@]2(CC[N@@H+](C3CCCC3)C2)C1 ZINC001278460807 1059058848 /nfs/dbraw/zinc/05/88/48/1059058848.db2.gz FGMTXKGZRGTTIU-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CCC[C@]2(CC[N@H+](C3CCCC3)C2)C1 ZINC001278460807 1059058871 /nfs/dbraw/zinc/05/88/71/1059058871.db2.gz FGMTXKGZRGTTIU-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CC[C@H]3CCC[C@H]3C2)CC[NH2+]1 ZINC001246659293 1059059304 /nfs/dbraw/zinc/05/93/04/1059059304.db2.gz WTXAAUAGUWBFEB-HNAWSFBYSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CC[C@H]3CCC[C@H]3C2)CC[NH2+]1 ZINC001246659293 1059059325 /nfs/dbraw/zinc/05/93/25/1059059325.db2.gz WTXAAUAGUWBFEB-HNAWSFBYSA-N 2 1 316.464 4.049 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C[C@@H]1C ZINC001246676826 1059062853 /nfs/dbraw/zinc/06/28/53/1059062853.db2.gz SXGBOFIYXYLPDP-KZEVZHLLSA-N 2 1 312.501 4.033 20 0 DIADMP C[C@@H]1CC[C@@H]([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C[C@H]1C ZINC001246676827 1059064202 /nfs/dbraw/zinc/06/42/02/1059064202.db2.gz SXGBOFIYXYLPDP-XGAGZNTDSA-N 2 1 312.501 4.033 20 0 DIADMP CCCC[C@@H](CC)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246682285 1059064569 /nfs/dbraw/zinc/06/45/69/1059064569.db2.gz BKXHYHIOZIZUJR-AQNXPRMDSA-N 2 1 300.490 4.034 20 0 DIADMP CCCCC[C@@H](C)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246681817 1059064660 /nfs/dbraw/zinc/06/46/60/1059064660.db2.gz JEFDYKRXDPSAJY-MISYRCLQSA-N 2 1 300.490 4.034 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246680749 1059065079 /nfs/dbraw/zinc/06/50/79/1059065079.db2.gz KZIDPIJCQCPCJL-NZSAHSFTSA-N 2 1 300.490 4.299 20 0 DIADMP C1CCC2(C1)CCC([N@H+]1CCC[C@H]([C@@H]3CCC[NH2+]C3)C1)CC2 ZINC001246679635 1059065265 /nfs/dbraw/zinc/06/52/65/1059065265.db2.gz XCKQXXBUNWGIEL-MSOLQXFVSA-N 2 1 304.522 4.201 20 0 DIADMP FC(F)(F)CCC[NH+]1CCC2(CC[N@H+](C3CCCC3)C2)CC1 ZINC001278461666 1059065651 /nfs/dbraw/zinc/06/56/51/1059065651.db2.gz SPEWQUHYVZHDJP-UHFFFAOYSA-N 2 1 318.427 4.059 20 0 DIADMP CCCCCC1CCC([N@@H+]2C[C@H](C3([NH3+])CC3)[C@H](CF)C2)CC1 ZINC001246698361 1059066545 /nfs/dbraw/zinc/06/65/45/1059066545.db2.gz XTAMOQGKCYPVFO-FPQWYMTMSA-N 2 1 310.501 4.134 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@@]3(C2)C[NH2+]CC[C@@H]3F)CC1 ZINC001246687703 1059066825 /nfs/dbraw/zinc/06/68/25/1059066825.db2.gz DWNHXORARDGOAY-AKSNENBUSA-N 2 1 310.501 4.005 20 0 DIADMP c1ccc(C2CC[NH+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)cc1 ZINC001246688861 1059068558 /nfs/dbraw/zinc/06/85/58/1059068558.db2.gz ICBZQGQCYJAZNT-FCHUYYIVSA-N 2 1 320.480 4.359 20 0 DIADMP CCCCCC1CCC([N@H+]2C[C@H](CF)[C@@H](C3([NH3+])CC3)C2)CC1 ZINC001246698367 1059069130 /nfs/dbraw/zinc/06/91/30/1059069130.db2.gz XTAMOQGKCYPVFO-IKJBURDNSA-N 2 1 310.501 4.134 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688365 1059070467 /nfs/dbraw/zinc/07/04/67/1059070467.db2.gz GTMGMQAKTQJMOZ-CZUORRHYSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246688365 1059070489 /nfs/dbraw/zinc/07/04/89/1059070489.db2.gz GTMGMQAKTQJMOZ-CZUORRHYSA-N 2 1 315.288 4.202 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246767249 1059071038 /nfs/dbraw/zinc/07/10/38/1059071038.db2.gz AXFWMYKOJNYDIY-UXHICEINSA-N 2 1 300.490 4.211 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H](c3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246774593 1059075908 /nfs/dbraw/zinc/07/59/08/1059075908.db2.gz FXWKBBBQMFSXAZ-ZRNYENFQSA-N 2 1 300.490 4.175 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246767248 1059076064 /nfs/dbraw/zinc/07/60/64/1059076064.db2.gz AXFWMYKOJNYDIY-PMACEKPBSA-N 2 1 300.490 4.211 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)cc1 ZINC001246780377 1059078114 /nfs/dbraw/zinc/07/81/14/1059078114.db2.gz LWYAXVNHRJXUAM-FQEVSTJZSA-N 2 1 312.501 4.444 20 0 DIADMP CCCC1CC[NH+]([C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CC1 ZINC001246777753 1059079473 /nfs/dbraw/zinc/07/94/73/1059079473.db2.gz UFNOCZFQLAQAOC-ICSRJNTNSA-N 2 1 318.480 4.439 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H](C[NH3+])C1 ZINC001246779442 1059079517 /nfs/dbraw/zinc/07/95/17/1059079517.db2.gz GYAWZHONPAFBCA-OALUTQOASA-N 2 1 322.496 4.268 20 0 DIADMP c1csc([C@@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)c1 ZINC001246780811 1059080589 /nfs/dbraw/zinc/08/05/89/1059080589.db2.gz AHGHLJMDBQSQNR-INIZCTEOSA-N 2 1 304.503 4.197 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)[C@H]2C)CC[NH2+]1 ZINC001246786932 1059083650 /nfs/dbraw/zinc/08/36/50/1059083650.db2.gz BFNDGEHZMNLAFC-VWMOJTHMSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@H]2C)CC[NH2+]1 ZINC001246786932 1059083673 /nfs/dbraw/zinc/08/36/73/1059083673.db2.gz BFNDGEHZMNLAFC-VWMOJTHMSA-N 2 1 304.453 4.048 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001246786596 1059084950 /nfs/dbraw/zinc/08/49/50/1059084950.db2.gz MCDJPKZPHXEERM-CEXWTWQISA-N 2 1 318.892 4.399 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001246786597 1059085371 /nfs/dbraw/zinc/08/53/71/1059085371.db2.gz MCDJPKZPHXEERM-FHWLQOOXSA-N 2 1 318.892 4.399 20 0 DIADMP c1csc([C@@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785717 1059085611 /nfs/dbraw/zinc/08/56/11/1059085611.db2.gz KWNUWCUSRXCYIU-SQNIBIBYSA-N 2 1 312.482 4.378 20 0 DIADMP c1csc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785717 1059085633 /nfs/dbraw/zinc/08/56/33/1059085633.db2.gz KWNUWCUSRXCYIU-SQNIBIBYSA-N 2 1 312.482 4.378 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1C1CCC2(CC[NH2+]C2)CC1 ZINC001246787543 1059085881 /nfs/dbraw/zinc/08/58/81/1059085881.db2.gz DEJZTISHVDMQOJ-ZCDLSOSASA-N 2 1 318.892 4.399 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246791900 1059089625 /nfs/dbraw/zinc/08/96/25/1059089625.db2.gz PQSADZBDCTWFTO-CRAIPNDOSA-N 2 1 318.892 4.399 20 0 DIADMP Fc1ccc(F)c([C@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246792139 1059090364 /nfs/dbraw/zinc/09/03/64/1059090364.db2.gz NPKAIGXILJVJCM-MAUKXSAKSA-N 2 1 320.427 4.024 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246791841 1059091077 /nfs/dbraw/zinc/09/10/77/1059091077.db2.gz YVFYNUHETSLZTB-RCJHGTSTSA-N 2 1 302.437 4.026 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2Cl)CC[NH2+]1 ZINC001246788947 1059091232 /nfs/dbraw/zinc/09/12/32/1059091232.db2.gz IHRQTTYNWAUOFV-FHLIZLRMSA-N 2 1 306.881 4.254 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246795956 1059094770 /nfs/dbraw/zinc/09/47/70/1059094770.db2.gz JQZOHQQGELBZEZ-WOJBJXKFSA-N 2 1 300.490 4.034 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2cccc(F)c2)C[C@@H](CC)[NH2+]1 ZINC001246793084 1059096043 /nfs/dbraw/zinc/09/60/43/1059096043.db2.gz CZXHNJUJWBJAJH-LMMKCTJWSA-N 2 1 304.453 4.272 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246792465 1059097052 /nfs/dbraw/zinc/09/70/52/1059097052.db2.gz SRHWZHMOOUYHJH-SNRMKQJTSA-N 2 1 318.892 4.399 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2ccccc2F)C[C@@H](CC)[NH2+]1 ZINC001246794603 1059097534 /nfs/dbraw/zinc/09/75/34/1059097534.db2.gz GDIXYIVSTIBNNL-SPYBWZPUSA-N 2 1 304.453 4.272 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2F)C[C@H](CC)[NH2+]1 ZINC001246794607 1059098613 /nfs/dbraw/zinc/09/86/13/1059098613.db2.gz GDIXYIVSTIBNNL-YYAJDYIMSA-N 2 1 304.453 4.272 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2ccccc2OC)C[C@@H](CC)[NH2+]1 ZINC001246792525 1059099141 /nfs/dbraw/zinc/09/91/41/1059099141.db2.gz QLXBIEUVPPTQFA-MDZRGWNJSA-N 2 1 316.489 4.141 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2F)C[C@H](CC)[NH2+]1 ZINC001246794596 1059099347 /nfs/dbraw/zinc/09/93/47/1059099347.db2.gz GDIXYIVSTIBNNL-PASDCYSWSA-N 2 1 304.453 4.272 20 0 DIADMP Fc1ccccc1[C@H]1CCC[N@H+]1C1CCC2(CC[NH2+]CC2)CC1 ZINC001246801093 1059100822 /nfs/dbraw/zinc/10/08/22/1059100822.db2.gz YROZCBOHJVGDKG-LJQANCHMSA-N 2 1 316.464 4.275 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246796067 1059101514 /nfs/dbraw/zinc/10/15/14/1059101514.db2.gz KUOFTFOXXRCWSX-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246796067 1059101521 /nfs/dbraw/zinc/10/15/21/1059101521.db2.gz KUOFTFOXXRCWSX-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246796060 1059101594 /nfs/dbraw/zinc/10/15/94/1059101594.db2.gz KUOFTFOXXRCWSX-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246796060 1059101603 /nfs/dbraw/zinc/10/16/03/1059101603.db2.gz KUOFTFOXXRCWSX-MOPGFXCFSA-N 2 1 314.860 4.265 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCSC[C@@H]2c2ccccc2)C[C@H](CC)[NH2+]1 ZINC001246806684 1059103377 /nfs/dbraw/zinc/10/33/77/1059103377.db2.gz HREACBCWCHGTCT-YDZRNGNQSA-N 2 1 318.530 4.086 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCCCC3)C2)c1 ZINC001246799918 1059103420 /nfs/dbraw/zinc/10/34/20/1059103420.db2.gz PJWHGMTXCBGECW-MOPGFXCFSA-N 2 1 316.464 4.418 20 0 DIADMP [NH3+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246809756 1059105226 /nfs/dbraw/zinc/10/52/26/1059105226.db2.gz SGLJGLZNVKHNJV-LYTPAENLSA-N 2 1 318.892 4.320 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)C[C@H](CC)[NH2+]1 ZINC001246809662 1059106014 /nfs/dbraw/zinc/10/60/14/1059106014.db2.gz KXRVRYPDTDLWRG-MWDXBVQZSA-N 2 1 320.908 4.439 20 0 DIADMP C[Si](C)(C)C[N@@H+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246814247 1059106584 /nfs/dbraw/zinc/10/65/84/1059106584.db2.gz POFGGIKDWLSOMN-BWTSREIZSA-N 2 1 316.565 4.039 20 0 DIADMP CC[N@@H+](CCCNc1cc(C)nc(C2CC2)n1)C1CCCCC1 ZINC001559229548 1059107570 /nfs/dbraw/zinc/10/75/70/1059107570.db2.gz JQEISWODBXJKNP-UHFFFAOYSA-N 2 1 316.493 4.119 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+](C)CCc2cccc(Cl)c2)CC[NH2+]1 ZINC001246822590 1059111771 /nfs/dbraw/zinc/11/17/71/1059111771.db2.gz LZJUUBCUWJUSEC-QZTJIDSGSA-N 2 1 308.897 4.125 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@@H]([NH3+])CC[C@H]1C ZINC001246818422 1059112197 /nfs/dbraw/zinc/11/21/97/1059112197.db2.gz BYJCSQSGOBORTL-BZPMIXESSA-N 2 1 315.288 4.126 20 0 DIADMP Fc1cccc([C@@H]2CC[N@@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC001246836326 1059113696 /nfs/dbraw/zinc/11/36/96/1059113696.db2.gz XDXJTNGHTTWAOZ-GIVPXCGWSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1cccc([C@@H]2CC[N@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC001246836326 1059113704 /nfs/dbraw/zinc/11/37/04/1059113704.db2.gz XDXJTNGHTTWAOZ-GIVPXCGWSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1cccc([C@@H]2CC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)c1 ZINC001246833542 1059114542 /nfs/dbraw/zinc/11/45/42/1059114542.db2.gz LSCZYJSCTJCRMS-MJGOQNOKSA-N 2 1 316.464 4.070 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)s1 ZINC001246826882 1059115191 /nfs/dbraw/zinc/11/51/91/1059115191.db2.gz YZVQCRUTOGNURC-ZIAGYGMSSA-N 2 1 324.921 4.461 20 0 DIADMP Fc1cccc([C@@H]2CC[N@@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC001246836329 1059115238 /nfs/dbraw/zinc/11/52/38/1059115238.db2.gz XDXJTNGHTTWAOZ-NRSPTQNISA-N 2 1 324.443 4.108 20 0 DIADMP Fc1cccc([C@@H]2CC[N@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)c1 ZINC001246836329 1059115253 /nfs/dbraw/zinc/11/52/53/1059115253.db2.gz XDXJTNGHTTWAOZ-NRSPTQNISA-N 2 1 324.443 4.108 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841212 1059117844 /nfs/dbraw/zinc/11/78/44/1059117844.db2.gz NAHGFPYKURNEJU-MJGOQNOKSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841212 1059117849 /nfs/dbraw/zinc/11/78/49/1059117849.db2.gz NAHGFPYKURNEJU-MJGOQNOKSA-N 2 1 304.453 4.049 20 0 DIADMP COc1ccccc1[C@H](C)[N@@H+](C)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246840343 1059117888 /nfs/dbraw/zinc/11/78/88/1059117888.db2.gz NCTNOJKYIDRUPA-INIZCTEOSA-N 2 1 316.489 4.000 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+](CC)Cc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246845729 1059121984 /nfs/dbraw/zinc/12/19/84/1059121984.db2.gz NIKQTEZPUZDMKY-QZTJIDSGSA-N 2 1 308.897 4.473 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246843029 1059122790 /nfs/dbraw/zinc/12/27/90/1059122790.db2.gz DKZJPKFXMSKNRV-AABGKKOBSA-N 2 1 300.490 4.033 20 0 DIADMP CC[C@H]1C[C@@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845528 1059123301 /nfs/dbraw/zinc/12/33/01/1059123301.db2.gz OOUVPVULLSOYSJ-OALUTQOASA-N 2 1 324.468 4.441 20 0 DIADMP CC[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845528 1059123305 /nfs/dbraw/zinc/12/33/05/1059123305.db2.gz OOUVPVULLSOYSJ-OALUTQOASA-N 2 1 324.468 4.441 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@@H]3CCC4(C3)CC[NH2+]CC4)CC2)cc1 ZINC001246845761 1059123351 /nfs/dbraw/zinc/12/33/51/1059123351.db2.gz NTBKJOLNQQCLDD-WOJBJXKFSA-N 2 1 312.501 4.178 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+](CC)Cc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246845730 1059123843 /nfs/dbraw/zinc/12/38/43/1059123843.db2.gz NIKQTEZPUZDMKY-ROUUACIJSA-N 2 1 308.897 4.473 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246843033 1059123989 /nfs/dbraw/zinc/12/39/89/1059123989.db2.gz DKZJPKFXMSKNRV-AQNXPRMDSA-N 2 1 300.490 4.033 20 0 DIADMP C[N@@H+](Cc1sc2ccccc2c1Cl)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246843508 1059124440 /nfs/dbraw/zinc/12/44/40/1059124440.db2.gz WODIPGKJJNNUHY-GFCCVEGCSA-N 2 1 320.889 4.129 20 0 DIADMP COc1ccc([C@H](C)[N@H+](C)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246848787 1059126664 /nfs/dbraw/zinc/12/66/64/1059126664.db2.gz FDBXMLQJSPYOAN-SCWSEQNSSA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246848787 1059126677 /nfs/dbraw/zinc/12/66/77/1059126677.db2.gz FDBXMLQJSPYOAN-SCWSEQNSSA-N 2 1 324.468 4.181 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)C[C@H](CC)[NH2+]1 ZINC001246850125 1059127057 /nfs/dbraw/zinc/12/70/57/1059127057.db2.gz HBEVLSNJBWIHPB-KANFNMMFSA-N 2 1 320.908 4.439 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](C3CCC4(CC[NH2+]C4)CC3)CC2)cc1 ZINC001246847483 1059127465 /nfs/dbraw/zinc/12/74/65/1059127465.db2.gz SLEFTPIURIWZBI-QNGMFEMESA-N 2 1 312.501 4.178 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CCC[NH2+]CC1 ZINC001246849560 1059127852 /nfs/dbraw/zinc/12/78/52/1059127852.db2.gz GCINBLAEYAXVJU-SFHVURJKSA-N 2 1 310.441 4.053 20 0 DIADMP CC[C@@H]1CC([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)C[C@@H](CC)[NH2+]1 ZINC001246848780 1059128311 /nfs/dbraw/zinc/12/83/11/1059128311.db2.gz DZTDJYQBXHXWNL-KBAYOESNSA-N 2 1 320.908 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246847712 1059128722 /nfs/dbraw/zinc/12/87/22/1059128722.db2.gz RSYWSAIAWIDVRJ-YNVMFWSZSA-N 2 1 316.464 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH2+]1 ZINC001246847712 1059128737 /nfs/dbraw/zinc/12/87/37/1059128737.db2.gz RSYWSAIAWIDVRJ-YNVMFWSZSA-N 2 1 316.464 4.049 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+]([C@H]3CCC[C@]4(CC[NH2+]C4)C3)C2)c1 ZINC001246848760 1059128777 /nfs/dbraw/zinc/12/87/77/1059128777.db2.gz DNBYKDDFLUJEBP-NEWSRXKRSA-N 2 1 318.892 4.052 20 0 DIADMP C[N@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246847482 1059129182 /nfs/dbraw/zinc/12/91/82/1059129182.db2.gz XQDIEMZJTLPIOY-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246847482 1059129193 /nfs/dbraw/zinc/12/91/93/1059129193.db2.gz XQDIEMZJTLPIOY-GOSISDBHSA-N 2 1 324.468 4.441 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H]1CC[NH3+] ZINC001246846614 1059129340 /nfs/dbraw/zinc/12/93/40/1059129340.db2.gz PDWSWCNPWZJMFA-OCCSQVGLSA-N 2 1 315.288 4.128 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)C1 ZINC001246850741 1059131380 /nfs/dbraw/zinc/13/13/80/1059131380.db2.gz WREUHTMLEIKOQH-AYBZRNKSSA-N 2 1 304.453 4.049 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)C1 ZINC001246850741 1059131388 /nfs/dbraw/zinc/13/13/88/1059131388.db2.gz WREUHTMLEIKOQH-AYBZRNKSSA-N 2 1 304.453 4.049 20 0 DIADMP F[C@H]1CCC2(C1)CC[NH+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246850619 1059133418 /nfs/dbraw/zinc/13/34/18/1059133418.db2.gz CGCTUQVVGDMDTL-DLBZAZTESA-N 2 1 308.485 4.046 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@@H+]3CC[C@@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851058 1059133442 /nfs/dbraw/zinc/13/34/42/1059133442.db2.gz YDDPYZRMBWKFKT-NJYVYQBISA-N 2 1 312.501 4.382 20 0 DIADMP c1ccc([C@@H]2C[C@H]([N@H+]3CC[C@@H](C4CCCCC4)C3)CC[NH2+]2)cc1 ZINC001246851058 1059133459 /nfs/dbraw/zinc/13/34/59/1059133459.db2.gz YDDPYZRMBWKFKT-NJYVYQBISA-N 2 1 312.501 4.382 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+](C3CCC4(CC[NH2+]C4)CC3)C2)c1 ZINC001246854419 1059134081 /nfs/dbraw/zinc/13/40/81/1059134081.db2.gz TXROGAAFSOIMLP-IPJUCJBFSA-N 2 1 318.892 4.052 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+]([C@@H]3CCC[C@@]4(CC[NH2+]C4)C3)C2)cc1 ZINC001246852950 1059134107 /nfs/dbraw/zinc/13/41/07/1059134107.db2.gz PCMOFKNKXSCRTQ-BHIYHBOVSA-N 2 1 318.892 4.052 20 0 DIADMP CC1(C)CCC[C@@H]([N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)C1 ZINC001246859903 1059136112 /nfs/dbraw/zinc/13/61/12/1059136112.db2.gz LRTOOFSWKDCASG-GOSISDBHSA-N 2 1 312.501 4.092 20 0 DIADMP c1ccc(C2=CC[N@@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)CC2)cc1 ZINC001246858598 1059136203 /nfs/dbraw/zinc/13/62/03/1059136203.db2.gz LKEACAJYIUGZMM-HXUWFJFHSA-N 2 1 310.485 4.231 20 0 DIADMP CC[N@H+](Cc1cccc(F)c1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246858884 1059136402 /nfs/dbraw/zinc/13/64/02/1059136402.db2.gz CULZRHPBVUDLHC-UXHICEINSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246858884 1059136418 /nfs/dbraw/zinc/13/64/18/1059136418.db2.gz CULZRHPBVUDLHC-UXHICEINSA-N 2 1 312.432 4.141 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@H+]2CCC[C@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246863106 1059137081 /nfs/dbraw/zinc/13/70/81/1059137081.db2.gz IZQNTDAOIAMFLQ-IPMKNSEASA-N 2 1 300.490 4.033 20 0 DIADMP CC(C)=CCC[C@H](C)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246863739 1059138463 /nfs/dbraw/zinc/13/84/63/1059138463.db2.gz SOPOEIYPCLNQBY-SFHVURJKSA-N 2 1 312.501 4.258 20 0 DIADMP c1ccc(C[N@H+](C2CC2)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246861096 1059138549 /nfs/dbraw/zinc/13/85/49/1059138549.db2.gz QLRCYWJILKPGAF-NHCUHLMSSA-N 2 1 306.453 4.144 20 0 DIADMP c1ccc(C[N@@H+](C2CC2)[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246861096 1059138552 /nfs/dbraw/zinc/13/85/52/1059138552.db2.gz QLRCYWJILKPGAF-NHCUHLMSSA-N 2 1 306.453 4.144 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246870065 1059140708 /nfs/dbraw/zinc/14/07/08/1059140708.db2.gz YIHZGVZJNTUYEJ-CEMLEFRQSA-N 2 1 320.480 4.489 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246870065 1059140712 /nfs/dbraw/zinc/14/07/12/1059140712.db2.gz YIHZGVZJNTUYEJ-CEMLEFRQSA-N 2 1 320.480 4.489 20 0 DIADMP CC1(C)C[N@H+]([C@H]2CC[NH2+]C3(CCCCC3)C2)Cc2ccccc21 ZINC001246868589 1059142216 /nfs/dbraw/zinc/14/22/16/1059142216.db2.gz AYRMRVPEKQJACV-SFHVURJKSA-N 2 1 312.501 4.235 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC[NH2+]1 ZINC001246871103 1059142888 /nfs/dbraw/zinc/14/28/88/1059142888.db2.gz NXVAYKVLLDHNHH-FNHZYXHNSA-N 2 1 320.908 4.078 20 0 DIADMP c1ccc2c(c1)oc1c2CC[N@H+](C2CCC3(CC[NH2+]CC3)CC2)C1 ZINC001246871778 1059143182 /nfs/dbraw/zinc/14/31/82/1059143182.db2.gz AZCDHMNJQDECME-UHFFFAOYSA-N 2 1 324.468 4.103 20 0 DIADMP CC1(C)C[N@H+]([C@@H]2CC[NH2+]C3(CCCCC3)C2)Cc2ccccc21 ZINC001246868588 1059143201 /nfs/dbraw/zinc/14/32/01/1059143201.db2.gz AYRMRVPEKQJACV-GOSISDBHSA-N 2 1 312.501 4.235 20 0 DIADMP CC1(C)C[N@@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872652 1059143697 /nfs/dbraw/zinc/14/36/97/1059143697.db2.gz WXDOYUQCLAYRRE-CTNGQTDRSA-N 2 1 320.480 4.273 20 0 DIADMP CC1(C)C[N@H+]([C@@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872652 1059143709 /nfs/dbraw/zinc/14/37/09/1059143709.db2.gz WXDOYUQCLAYRRE-CTNGQTDRSA-N 2 1 320.480 4.273 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)CC[NH2+]1 ZINC001246876883 1059146108 /nfs/dbraw/zinc/14/61/08/1059146108.db2.gz DBJDDGGAXTXZSC-FVFSHSICSA-N 2 1 318.464 4.003 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CCN2)cc1 ZINC001246886581 1059150318 /nfs/dbraw/zinc/15/03/18/1059150318.db2.gz HLZWCSBKVYLNAQ-WEMPKCCASA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886581 1059150322 /nfs/dbraw/zinc/15/03/22/1059150322.db2.gz HLZWCSBKVYLNAQ-WEMPKCCASA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886581 1059150336 /nfs/dbraw/zinc/15/03/36/1059150336.db2.gz HLZWCSBKVYLNAQ-WEMPKCCASA-N 2 1 318.464 4.066 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246890369 1059152910 /nfs/dbraw/zinc/15/29/10/1059152910.db2.gz UBVPQZSZOAXQIL-SZMVWBNQSA-N 2 1 318.530 4.322 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c(F)c1 ZINC001246889727 1059155122 /nfs/dbraw/zinc/15/51/22/1059155122.db2.gz YWNPOSZNUKNPHH-YJBOKZPZSA-N 2 1 320.427 4.024 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246890354 1059155316 /nfs/dbraw/zinc/15/53/16/1059155316.db2.gz UBVPQZSZOAXQIL-JQHSSLGASA-N 2 1 318.530 4.322 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1 ZINC001246889634 1059155445 /nfs/dbraw/zinc/15/54/45/1059155445.db2.gz RJEGRFJFJZFKKR-IVSAIRAKSA-N 2 1 304.503 4.074 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246890229 1059156533 /nfs/dbraw/zinc/15/65/33/1059156533.db2.gz SOQXPUGPXDTBJI-WBVHZDCISA-N 2 1 316.514 4.220 20 0 DIADMP Fc1cccc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246900507 1059158204 /nfs/dbraw/zinc/15/82/04/1059158204.db2.gz RYWNWEGPHVZHCC-PCCBWWKXSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246900507 1059158212 /nfs/dbraw/zinc/15/82/12/1059158212.db2.gz RYWNWEGPHVZHCC-PCCBWWKXSA-N 2 1 324.443 4.456 20 0 DIADMP CCC[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001246894056 1059158584 /nfs/dbraw/zinc/15/85/84/1059158584.db2.gz MYPOGBXDSSEEST-UYAOXDASSA-N 2 1 300.490 4.177 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2c[nH]c3ccccc32)CC[NH2+]1 ZINC001246899001 1059158640 /nfs/dbraw/zinc/15/86/40/1059158640.db2.gz BUNSYOPGKFYJTI-XPGWFJOJSA-N 2 1 311.473 4.081 20 0 DIADMP C[N@@H+]([C@H]1CC[NH2+]C2(CCCCC2)C1)C(C)(C)Cc1ccccc1 ZINC001246894291 1059158724 /nfs/dbraw/zinc/15/87/24/1059158724.db2.gz SUDNGZGHJARYOY-IBGZPJMESA-N 2 1 314.517 4.394 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2c[nH]c3ccccc32)CC[NH2+]1 ZINC001246898999 1059159216 /nfs/dbraw/zinc/15/92/16/1059159216.db2.gz BUNSYOPGKFYJTI-UIAACRFSSA-N 2 1 311.473 4.081 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246900383 1059159831 /nfs/dbraw/zinc/15/98/31/1059159831.db2.gz IFALTAXKBUEWOS-ORYQWCPZSA-N 2 1 323.484 4.227 20 0 DIADMP Fc1cccc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246900508 1059164573 /nfs/dbraw/zinc/16/45/73/1059164573.db2.gz RYWNWEGPHVZHCC-PWRODBHTSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC001246900508 1059164578 /nfs/dbraw/zinc/16/45/78/1059164578.db2.gz RYWNWEGPHVZHCC-PWRODBHTSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246900510 1059164725 /nfs/dbraw/zinc/16/47/25/1059164725.db2.gz RYWNWEGPHVZHCC-QHAWAJNXSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246900510 1059164728 /nfs/dbraw/zinc/16/47/28/1059164728.db2.gz RYWNWEGPHVZHCC-QHAWAJNXSA-N 2 1 324.443 4.456 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246907711 1059167209 /nfs/dbraw/zinc/16/72/09/1059167209.db2.gz UMQGKOQBCYNSBW-BWTSREIZSA-N 2 1 322.452 4.194 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246906657 1059167442 /nfs/dbraw/zinc/16/74/42/1059167442.db2.gz FUTJEJDBTCTZDC-IBGZPJMESA-N 2 1 300.490 4.272 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246906977 1059168394 /nfs/dbraw/zinc/16/83/94/1059168394.db2.gz SZBNPIBHEVRIPS-HNNXBMFYSA-N 2 1 314.395 4.058 20 0 DIADMP CC(C)CCC[C@H](C)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246911885 1059171100 /nfs/dbraw/zinc/17/11/00/1059171100.db2.gz CPDUDWHKEIVDKI-SFHVURJKSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246910985 1059172329 /nfs/dbraw/zinc/17/23/29/1059172329.db2.gz OSDDWADHKFHWSY-CMTQZCSUSA-N 2 1 300.490 4.337 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246908755 1059172414 /nfs/dbraw/zinc/17/24/14/1059172414.db2.gz MIRDYSRYBDUMLN-FGZHOGPDSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C[C@@H]1C ZINC001246912106 1059172509 /nfs/dbraw/zinc/17/25/09/1059172509.db2.gz DFNCJBTXGBSGAP-UWVAXJGDSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](CC)Cc2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC001246916405 1059174649 /nfs/dbraw/zinc/17/46/49/1059174649.db2.gz SDDJVOYXVXMGCY-CVEARBPZSA-N 2 1 314.395 4.058 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1 ZINC001246917188 1059175269 /nfs/dbraw/zinc/17/52/69/1059175269.db2.gz WKSIKGGSMWHLNL-YWVIFJGQSA-N 2 1 314.395 4.056 20 0 DIADMP CC(C)=CCC[C@H](C)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246916429 1059175665 /nfs/dbraw/zinc/17/56/65/1059175665.db2.gz SWDXAIOGOFSUAN-SFHVURJKSA-N 2 1 300.490 4.376 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+](C)[C@H]1CCCC[C@@H]1[NH3+] ZINC001246916459 1059176073 /nfs/dbraw/zinc/17/60/73/1059176073.db2.gz HYXFHMPPGPXWFP-KCXAZCMYSA-N 2 1 312.910 4.022 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)[C@H]1CCCC[C@@H]1[NH3+] ZINC001246916459 1059176079 /nfs/dbraw/zinc/17/60/79/1059176079.db2.gz HYXFHMPPGPXWFP-KCXAZCMYSA-N 2 1 312.910 4.022 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246934938 1059182791 /nfs/dbraw/zinc/18/27/91/1059182791.db2.gz DCXXALPSLYGNLR-HZPDHXFCSA-N 2 1 312.567 4.151 20 0 DIADMP CCCCC[C@H](C)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246934036 1059184220 /nfs/dbraw/zinc/18/42/20/1059184220.db2.gz NCIUUBNIRVUWQP-INIZCTEOSA-N 2 1 306.469 4.349 20 0 DIADMP CC[N@@H+](C[C@H]1CC[NH2+]C1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246933682 1059184319 /nfs/dbraw/zinc/18/43/19/1059184319.db2.gz AQQUYMRNBGSOAK-DMKPSLHHSA-N 2 1 320.908 4.298 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+]1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246941105 1059188010 /nfs/dbraw/zinc/18/80/10/1059188010.db2.gz YPMWKXHLMIYIJU-VMWRSERWSA-N 2 1 306.881 4.050 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246941893 1059188148 /nfs/dbraw/zinc/18/81/48/1059188148.db2.gz IWOVEMWOWNNFKH-OXQOHEQNSA-N 2 1 318.480 4.206 20 0 DIADMP CC(C)(C)C[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001246945637 1059188835 /nfs/dbraw/zinc/18/88/35/1059188835.db2.gz HLKPKAKUMNRGFU-UKRRQHHQSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246942758 1059189350 /nfs/dbraw/zinc/18/93/50/1059189350.db2.gz IGBPRXFYBFEPGR-HKBOAZHASA-N 2 1 312.501 4.363 20 0 DIADMP CC(C)(C)C[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC001246945632 1059189771 /nfs/dbraw/zinc/18/97/71/1059189771.db2.gz HLKPKAKUMNRGFU-DZGCQCFKSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246942775 1059189847 /nfs/dbraw/zinc/18/98/47/1059189847.db2.gz IGBPRXFYBFEPGR-PCCBWWKXSA-N 2 1 312.501 4.363 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246943691 1059190338 /nfs/dbraw/zinc/19/03/38/1059190338.db2.gz RXGBNJGZJDLKMV-UHFFFAOYSA-N 2 1 306.469 4.349 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@@H](C(C)C)C2)c1 ZINC001246943552 1059191140 /nfs/dbraw/zinc/19/11/40/1059191140.db2.gz LSKFRQZDTOAXEP-ZCNNSNEGSA-N 2 1 300.490 4.217 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246946415 1059194834 /nfs/dbraw/zinc/19/48/34/1059194834.db2.gz MEHSDSMAYYMZLY-HNNXBMFYSA-N 2 1 322.924 4.371 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246949583 1059196691 /nfs/dbraw/zinc/19/66/91/1059196691.db2.gz AOJWFGLFFUVRHY-PBHICJAKSA-N 2 1 306.881 4.083 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CC[NH2+]CC2)C2CCCCCC2)c1 ZINC001246952813 1059197942 /nfs/dbraw/zinc/19/79/42/1059197942.db2.gz WTXFAYCXHQSVMA-UHFFFAOYSA-N 2 1 318.480 4.411 20 0 DIADMP CC(C)CC[C@H](C)[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954897 1059198002 /nfs/dbraw/zinc/19/80/02/1059198002.db2.gz JNYNFTQTNUTZBF-HNNXBMFYSA-N 2 1 324.459 4.344 20 0 DIADMP CC(C)CC[C@H](C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954897 1059198011 /nfs/dbraw/zinc/19/80/11/1059198011.db2.gz JNYNFTQTNUTZBF-HNNXBMFYSA-N 2 1 324.459 4.344 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246953475 1059198687 /nfs/dbraw/zinc/19/86/87/1059198687.db2.gz CQGFERHWFFCARU-UHFFFAOYSA-N 2 1 324.459 4.488 20 0 DIADMP Cc1ccc(C[N@@H+](C2CC[NH2+]CC2)[C@@H]2CCC[C@H](C)C2)c(F)c1 ZINC001246955645 1059198889 /nfs/dbraw/zinc/19/88/89/1059198889.db2.gz MRBDNVNJAATLRC-HNAYVOBHSA-N 2 1 318.480 4.267 20 0 DIADMP CC[C@@H](CC(C)C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246956015 1059201123 /nfs/dbraw/zinc/20/11/23/1059201123.db2.gz PJSYZLJOQHXAAX-KRWDZBQOSA-N 2 1 324.459 4.344 20 0 DIADMP CCCC[C@H](C)[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954957 1059202405 /nfs/dbraw/zinc/20/24/05/1059202405.db2.gz JZGIKNRPOUCGLA-AWEZNQCLSA-N 2 1 310.432 4.098 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954957 1059202415 /nfs/dbraw/zinc/20/24/15/1059202415.db2.gz JZGIKNRPOUCGLA-AWEZNQCLSA-N 2 1 310.432 4.098 20 0 DIADMP CC(C)CC(CC(C)C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246955760 1059202694 /nfs/dbraw/zinc/20/26/94/1059202694.db2.gz SWZMQLVXCGJZJL-UHFFFAOYSA-N 2 1 317.521 4.096 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2cc(F)ccc2C)C2CC[NH2+]CC2)C1 ZINC001246961466 1059205443 /nfs/dbraw/zinc/20/54/43/1059205443.db2.gz FOCICISDCREXBI-OXQOHEQNSA-N 2 1 318.480 4.267 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2cc(F)ccc2C)C2CC[NH2+]CC2)C1 ZINC001246961467 1059207093 /nfs/dbraw/zinc/20/70/93/1059207093.db2.gz FOCICISDCREXBI-UZLBHIALSA-N 2 1 318.480 4.267 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@@H](C)C1 ZINC001246961254 1059207158 /nfs/dbraw/zinc/20/71/58/1059207158.db2.gz PLJQZTXICMDUFM-FOIQADDNSA-N 2 1 318.480 4.267 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246962591 1059208315 /nfs/dbraw/zinc/20/83/15/1059208315.db2.gz KEHSIPCXVFBFNP-RTBURBONSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@@H](C)C1 ZINC001246961257 1059208680 /nfs/dbraw/zinc/20/86/80/1059208680.db2.gz PLJQZTXICMDUFM-QRWLVFNGSA-N 2 1 318.480 4.267 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1ccc(OC)cc1)C1CC[NH2+]CC1 ZINC001246964540 1059211272 /nfs/dbraw/zinc/21/12/72/1059211272.db2.gz NNEYUIBMMDYQLV-SFHVURJKSA-N 2 1 318.505 4.218 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C1CCCCC1)C1CC[NH2+]CC1 ZINC001246967008 1059211503 /nfs/dbraw/zinc/21/15/03/1059211503.db2.gz ZLHIBBFMXYYCKJ-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP Cc1cccc(C[N@H+]([C@@H]2CC[C@@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001246974847 1059215269 /nfs/dbraw/zinc/21/52/69/1059215269.db2.gz SGOQUQNNLWTQDP-VBSBHUPXSA-N 2 1 300.490 4.256 20 0 DIADMP CCC(CC)[N@@H+]([C@H](C)c1ccccc1)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246972185 1059215353 /nfs/dbraw/zinc/21/53/53/1059215353.db2.gz AKXOMMGWGUZZEJ-VQIMIIECSA-N 2 1 300.490 4.380 20 0 DIADMP CCC(CC)[N@@H+]([C@H](C)c1ccccc1)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246972184 1059216962 /nfs/dbraw/zinc/21/69/62/1059216962.db2.gz AKXOMMGWGUZZEJ-APWZRJJASA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cccc(C[N@H+]([C@@H]2CC[C@H](C)C2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001246974842 1059216993 /nfs/dbraw/zinc/21/69/93/1059216993.db2.gz SGOQUQNNLWTQDP-FRYIKTPZSA-N 2 1 300.490 4.256 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246974429 1059217088 /nfs/dbraw/zinc/21/70/88/1059217088.db2.gz ALLVMAXWPFJUAQ-WOJBJXKFSA-N 2 1 314.517 4.252 20 0 DIADMP CCCCCC[C@H](CCCC)[N@H+]1CC[C@H](N2CCC([NH3+])CC2)C1 ZINC001246974908 1059219197 /nfs/dbraw/zinc/21/91/97/1059219197.db2.gz KSADHNCMCMOXIA-PMACEKPBSA-N 2 1 323.569 4.013 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CCC[NH2+]CC1 ZINC001246975880 1059219596 /nfs/dbraw/zinc/21/95/96/1059219596.db2.gz CVUXFSCMFAZGCA-WOJBJXKFSA-N 2 1 302.506 4.252 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)C1C[C@@H]2C=C[C@H](C1)[NH2+]2 ZINC001246980054 1059220547 /nfs/dbraw/zinc/22/05/47/1059220547.db2.gz QNYZTYCTRNFJDI-HWPVKAJDSA-N 2 1 312.501 4.169 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246979219 1059221342 /nfs/dbraw/zinc/22/13/42/1059221342.db2.gz XOMMTVFCKUYTDD-NRFANRHFSA-N 2 1 314.517 4.250 20 0 DIADMP c1ccc(CC[C@@H]2CCC[N@H+]([C@H]3CC[NH2+]C4(CCC4)C3)C2)cc1 ZINC001246980205 1059223346 /nfs/dbraw/zinc/22/33/46/1059223346.db2.gz QFVVEIHJJBNYOW-PMACEKPBSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc(CC[C@H]2CCC[N@H+]([C@@H]3CC[NH2+]C4(CCC4)C3)C2)cc1 ZINC001246980208 1059224349 /nfs/dbraw/zinc/22/43/49/1059224349.db2.gz QFVVEIHJJBNYOW-WOJBJXKFSA-N 2 1 312.501 4.006 20 0 DIADMP C[C@H]1c2ccccc2CC[N@@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246988866 1059228270 /nfs/dbraw/zinc/22/82/70/1059228270.db2.gz ZOLGGBYPYHCFBW-LRQRDZAKSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1c2ccccc2CC[N@H+]1[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246988866 1059228288 /nfs/dbraw/zinc/22/82/88/1059228288.db2.gz ZOLGGBYPYHCFBW-LRQRDZAKSA-N 2 1 306.453 4.099 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001246999298 1059228323 /nfs/dbraw/zinc/22/83/23/1059228323.db2.gz ASXBYEZVECENTR-IEBWSBKVSA-N 2 1 314.517 4.338 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246983579 1059230343 /nfs/dbraw/zinc/23/03/43/1059230343.db2.gz CAIUCLZEQMAZRG-MUJYYYPQSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246983579 1059230358 /nfs/dbraw/zinc/23/03/58/1059230358.db2.gz CAIUCLZEQMAZRG-MUJYYYPQSA-N 2 1 313.272 4.098 20 0 DIADMP Fc1cc(F)cc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]C3)CC2)c1 ZINC001247006862 1059232048 /nfs/dbraw/zinc/23/20/48/1059232048.db2.gz YAGUMEXHAFWPLQ-JLAWEPINSA-N 2 1 320.427 4.024 20 0 DIADMP CCC1CCC([NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)CC1 ZINC001247001562 1059232514 /nfs/dbraw/zinc/23/25/14/1059232514.db2.gz JOLJITQICOYHMH-UHFFFAOYSA-N 2 1 312.501 4.092 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004575 1059233548 /nfs/dbraw/zinc/23/35/48/1059233548.db2.gz RWHDLLSHABLOMY-KZNAEPCWSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001247004575 1059233565 /nfs/dbraw/zinc/23/35/65/1059233565.db2.gz RWHDLLSHABLOMY-KZNAEPCWSA-N 2 1 322.443 4.268 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)CC[NH2+]1 ZINC001247006239 1059234580 /nfs/dbraw/zinc/23/45/80/1059234580.db2.gz UTIDLTSYUKHMNV-VAMGGRTRSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@@](C)(C[NH3+])C1 ZINC001247001815 1059234691 /nfs/dbraw/zinc/23/46/91/1059234691.db2.gz LLQNPJHRTVRNGP-YJBOKZPZSA-N 2 1 324.534 4.131 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2Cc3ccccc3C23CC[NH2+]CC3)CC(C)(C)C1 ZINC001247013547 1059242678 /nfs/dbraw/zinc/24/26/78/1059242678.db2.gz ZUOWRJWDUXOQRA-FUHWJXTLSA-N 2 1 312.501 4.296 20 0 DIADMP Cc1cc(F)ccc1C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001559509570 1059299572 /nfs/dbraw/zinc/29/95/72/1059299572.db2.gz ZLJIZRDGLRRZNE-GOSISDBHSA-N 2 1 318.480 4.078 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001559509570 1059299590 /nfs/dbraw/zinc/29/95/90/1059299590.db2.gz ZLJIZRDGLRRZNE-GOSISDBHSA-N 2 1 318.480 4.078 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cs1 ZINC001559509043 1059300314 /nfs/dbraw/zinc/30/03/14/1059300314.db2.gz OAUXZTUCQJIHHX-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cs1 ZINC001559509043 1059300334 /nfs/dbraw/zinc/30/03/34/1059300334.db2.gz OAUXZTUCQJIHHX-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1C ZINC001559508760 1059303565 /nfs/dbraw/zinc/30/35/65/1059303565.db2.gz KJCRVSSTDHCGFE-OAQYLSRUSA-N 2 1 314.517 4.247 20 0 DIADMP Cc1ccc(C[C@H]2CCC[N@@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC001559510992 1059306723 /nfs/dbraw/zinc/30/67/23/1059306723.db2.gz BOOZDXDKJVTIGY-OAQYLSRUSA-N 2 1 314.517 4.126 20 0 DIADMP C[N@H+](CCc1ccc2ccccc2c1)CC[C@@H]1CCCC[NH+]1C ZINC001559567565 1059392977 /nfs/dbraw/zinc/39/29/77/1059392977.db2.gz FRVWYACUWGLMHL-NRFANRHFSA-N 2 1 310.485 4.189 20 0 DIADMP C[NH+](CCc1ccc2ccccc2c1)CC[C@@H]1CCCC[N@@H+]1C ZINC001559567565 1059393002 /nfs/dbraw/zinc/39/30/02/1059393002.db2.gz FRVWYACUWGLMHL-NRFANRHFSA-N 2 1 310.485 4.189 20 0 DIADMP C[NH+](CCc1ccc2ccccc2c1)CC[C@@H]1CCCC[N@H+]1C ZINC001559567565 1059393028 /nfs/dbraw/zinc/39/30/28/1059393028.db2.gz FRVWYACUWGLMHL-NRFANRHFSA-N 2 1 310.485 4.189 20 0 DIADMP CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568203 1059397950 /nfs/dbraw/zinc/39/79/50/1059397950.db2.gz RXRCPWMVKVFXCN-PKOBYXMFSA-N 2 1 318.505 4.491 20 0 DIADMP CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568203 1059397932 /nfs/dbraw/zinc/39/79/32/1059397932.db2.gz RXRCPWMVKVFXCN-PKOBYXMFSA-N 2 1 318.505 4.491 20 0 DIADMP CC(C)Cc1ccccc1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001559586416 1059417562 /nfs/dbraw/zinc/41/75/62/1059417562.db2.gz CWTQZCPCRBOPTR-IBGZPJMESA-N 2 1 314.517 4.049 20 0 DIADMP CC(C)Cc1ccccc1C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC001559586416 1059417572 /nfs/dbraw/zinc/41/75/72/1059417572.db2.gz CWTQZCPCRBOPTR-IBGZPJMESA-N 2 1 314.517 4.049 20 0 DIADMP CC(C)Cc1ccccc1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC001559586416 1059417583 /nfs/dbraw/zinc/41/75/83/1059417583.db2.gz CWTQZCPCRBOPTR-IBGZPJMESA-N 2 1 314.517 4.049 20 0 DIADMP CC(C)Cc1ccccc1C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001559586417 1059419844 /nfs/dbraw/zinc/41/98/44/1059419844.db2.gz CWTQZCPCRBOPTR-LJQANCHMSA-N 2 1 314.517 4.049 20 0 DIADMP CC(C)Cc1ccccc1C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC001559586417 1059419851 /nfs/dbraw/zinc/41/98/51/1059419851.db2.gz CWTQZCPCRBOPTR-LJQANCHMSA-N 2 1 314.517 4.049 20 0 DIADMP CC(C)Cc1ccccc1C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC001559586417 1059419860 /nfs/dbraw/zinc/41/98/60/1059419860.db2.gz CWTQZCPCRBOPTR-LJQANCHMSA-N 2 1 314.517 4.049 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001559660559 1059490752 /nfs/dbraw/zinc/49/07/52/1059490752.db2.gz XDYBMZRCOJKMFY-RXVVDRJESA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001559660559 1059490766 /nfs/dbraw/zinc/49/07/66/1059490766.db2.gz XDYBMZRCOJKMFY-RXVVDRJESA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001559660559 1059490778 /nfs/dbraw/zinc/49/07/78/1059490778.db2.gz XDYBMZRCOJKMFY-RXVVDRJESA-N 2 1 312.501 4.259 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(Cl)c1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737043 1059570689 /nfs/dbraw/zinc/57/06/89/1059570689.db2.gz FRQIOQCTVLKQBL-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cccc(Cl)c1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737043 1059570705 /nfs/dbraw/zinc/57/07/05/1059570705.db2.gz FRQIOQCTVLKQBL-DZGCQCFKSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@]1(c2ccccc2)CCC[N@@H+](CCC[NH+]2CCCCC2)CC1 ZINC001559831476 1059665449 /nfs/dbraw/zinc/66/54/49/1059665449.db2.gz UIEQLFROPCWXFI-NRFANRHFSA-N 2 1 314.517 4.306 20 0 DIADMP Cc1ccc(C[N@H+](CC[C@@H]2CCC[NH+]2C)CC(C)C)c(C)c1 ZINC001559935105 1059748966 /nfs/dbraw/zinc/74/89/66/1059748966.db2.gz AHOYTCOOWAZHTR-FQEVSTJZSA-N 2 1 302.506 4.246 20 0 DIADMP Cc1ccc(C[NH+](CC[C@@H]2CCC[N@@H+]2C)CC(C)C)c(C)c1 ZINC001559935105 1059748986 /nfs/dbraw/zinc/74/89/86/1059748986.db2.gz AHOYTCOOWAZHTR-FQEVSTJZSA-N 2 1 302.506 4.246 20 0 DIADMP Cc1ccc(C[NH+](CC[C@@H]2CCC[N@H+]2C)CC(C)C)c(C)c1 ZINC001559935105 1059749005 /nfs/dbraw/zinc/74/90/05/1059749005.db2.gz AHOYTCOOWAZHTR-FQEVSTJZSA-N 2 1 302.506 4.246 20 0 DIADMP CC(C)C[N@H+](CCCc1c[nH+]cn1C)Cc1cccc(Cl)c1 ZINC001560025980 1059839155 /nfs/dbraw/zinc/83/91/55/1059839155.db2.gz MITOPTRIGUVTQV-UHFFFAOYSA-N 2 1 319.880 4.164 20 0 DIADMP CC(C)C[N@@H+](CCCc1c[nH+]cn1C)Cc1cccc(Cl)c1 ZINC001560025980 1059839182 /nfs/dbraw/zinc/83/91/82/1059839182.db2.gz MITOPTRIGUVTQV-UHFFFAOYSA-N 2 1 319.880 4.164 20 0 DIADMP CCC1([NH+](C)C)CC[NH+]([C@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001560048159 1059863541 /nfs/dbraw/zinc/86/35/41/1059863541.db2.gz GMJIPUVSTAWLGD-MRXNPFEDSA-N 2 1 300.490 4.043 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1[C@H](C)C[C@H](c2ccccc2)C1(C)C ZINC001560095869 1059905575 /nfs/dbraw/zinc/90/55/75/1059905575.db2.gz GBYIVNSQXHACIB-VQIMIIECSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1[C@H](C)C[C@H](c2ccccc2)C1(C)C ZINC001560095869 1059905592 /nfs/dbraw/zinc/90/55/92/1059905592.db2.gz GBYIVNSQXHACIB-VQIMIIECSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1C ZINC001560269643 1060042159 /nfs/dbraw/zinc/04/21/59/1060042159.db2.gz LDRWCDDIQBKSTJ-CALCHBBNSA-N 2 1 302.506 4.151 20 0 DIADMP Cc1oc2ccccc2c1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC001560270979 1060047500 /nfs/dbraw/zinc/04/75/00/1060047500.db2.gz QCCUHRGIKDEKPP-INIZCTEOSA-N 2 1 314.473 4.343 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC001560314597 1060102731 /nfs/dbraw/zinc/10/27/31/1060102731.db2.gz FRUSOJWBTRGXAX-XBFCOCLRSA-N 2 1 313.272 4.271 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C[C@@H]2CCCC(C)(C)C2)c1 ZINC001560320059 1060106146 /nfs/dbraw/zinc/10/61/46/1060106146.db2.gz KBLIOVCEIAGSMK-LJQANCHMSA-N 2 1 302.506 4.444 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+]C[C@@H](CC)c1ccccc1 ZINC001560320748 1060107077 /nfs/dbraw/zinc/10/70/77/1060107077.db2.gz NAYIDYXDJUFQHJ-UYAOXDASSA-N 2 1 302.506 4.424 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+]C[C@@H](CC)c1ccccc1 ZINC001560320748 1060107088 /nfs/dbraw/zinc/10/70/88/1060107088.db2.gz NAYIDYXDJUFQHJ-UYAOXDASSA-N 2 1 302.506 4.424 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1cc(F)cc(Cl)c1)C(C)C ZINC001560367761 1060153288 /nfs/dbraw/zinc/15/32/88/1060153288.db2.gz UXKJCVBDSXMILX-UHFFFAOYSA-N 2 1 300.849 4.078 20 0 DIADMP Cc1ccc(C[NH2+][C@@]23CC[C@@]([NH2+]C4CCCC4)(C2)CCC3)o1 ZINC001278514256 1060201013 /nfs/dbraw/zinc/20/10/13/1060201013.db2.gz IVCJDMFAASKBMV-RBUKOAKNSA-N 2 1 302.462 4.055 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001560444028 1060234827 /nfs/dbraw/zinc/23/48/27/1060234827.db2.gz ZVVRNKUGXCGQRK-LJQANCHMSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001560444028 1060234843 /nfs/dbraw/zinc/23/48/43/1060234843.db2.gz ZVVRNKUGXCGQRK-LJQANCHMSA-N 2 1 312.501 4.209 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC001560463678 1060254900 /nfs/dbraw/zinc/25/49/00/1060254900.db2.gz AAAYZNBWWDJXLF-ONCXSQPRSA-N 2 1 302.506 4.277 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC001560463678 1060254918 /nfs/dbraw/zinc/25/49/18/1060254918.db2.gz AAAYZNBWWDJXLF-ONCXSQPRSA-N 2 1 302.506 4.277 20 0 DIADMP CCC[N@@H+](Cc1ccc(-c2ccccc2)s1)C1CC[NH2+]CC1 ZINC000469993990 1060259619 /nfs/dbraw/zinc/25/96/19/1060259619.db2.gz SBEXKJYRRPIPHX-UHFFFAOYSA-N 2 1 314.498 4.379 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479712 1060261344 /nfs/dbraw/zinc/26/13/44/1060261344.db2.gz OGWBGZIZGNEDQV-RBUKOAKNSA-N 2 1 317.521 4.151 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479712 1060261362 /nfs/dbraw/zinc/26/13/62/1060261362.db2.gz OGWBGZIZGNEDQV-RBUKOAKNSA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479712 1060261383 /nfs/dbraw/zinc/26/13/83/1060261383.db2.gz OGWBGZIZGNEDQV-RBUKOAKNSA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cc(C(C)(C)C)c[nH]1 ZINC001249479712 1060261406 /nfs/dbraw/zinc/26/14/06/1060261406.db2.gz OGWBGZIZGNEDQV-RBUKOAKNSA-N 2 1 317.521 4.151 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccc(-c3ccc(C)cc3)c2)C1 ZINC000470021646 1060262298 /nfs/dbraw/zinc/26/22/98/1060262298.db2.gz ZPFPOTKQUQSEHV-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP Clc1ccccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC000469877994 1060263292 /nfs/dbraw/zinc/26/32/92/1060263292.db2.gz JHFGWUJCFLLCLW-OAHLLOKOSA-N 2 1 306.881 4.084 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cc(-c3ccccc3)cs2)C1 ZINC001560500090 1060294198 /nfs/dbraw/zinc/29/41/98/1060294198.db2.gz CWKPIWPHCHHXOP-MRXNPFEDSA-N 2 1 314.498 4.237 20 0 DIADMP CCCc1ccc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1 ZINC001560514125 1060313273 /nfs/dbraw/zinc/31/32/73/1060313273.db2.gz JTUCCNVNHYVLCR-YADHBBJMSA-N 2 1 322.496 4.074 20 0 DIADMP CCCCC/C(=C/c1ccccc1)C[NH2+]CCc1c[nH+]cn1C ZINC001560546850 1060356475 /nfs/dbraw/zinc/35/64/75/1060356475.db2.gz LDDPZHMQWGKUFQ-RGEXLXHISA-N 2 1 311.473 4.216 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572893 1060385050 /nfs/dbraw/zinc/38/50/50/1060385050.db2.gz HOYZAFSASFWSAJ-AZUAARDMSA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001560572893 1060385067 /nfs/dbraw/zinc/38/50/67/1060385067.db2.gz HOYZAFSASFWSAJ-AZUAARDMSA-N 2 1 312.501 4.209 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCC[C@@H]1C=CCC1 ZINC001560576984 1060392181 /nfs/dbraw/zinc/39/21/81/1060392181.db2.gz VUKMPRXJJHRVLB-LJQANCHMSA-N 2 1 314.517 4.481 20 0 DIADMP Cc1cc(Nc2ccccc2C[N@@H+](C)C2CCCCC2)c[nH+]c1N ZINC001249791048 1060403652 /nfs/dbraw/zinc/40/36/52/1060403652.db2.gz TUDMOKYUOIEKHT-UHFFFAOYSA-N 2 1 324.472 4.480 20 0 DIADMP Cc1cc(Nc2ccccc2C[N@H+](C)C2CCCCC2)c[nH+]c1N ZINC001249791048 1060403669 /nfs/dbraw/zinc/40/36/69/1060403669.db2.gz TUDMOKYUOIEKHT-UHFFFAOYSA-N 2 1 324.472 4.480 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@H]2CCC[C@H]2c2ccc(C)cc2)CC1 ZINC001560632909 1060444069 /nfs/dbraw/zinc/44/40/69/1060444069.db2.gz ZZIXWLFORKFRLF-SFTDATJTSA-N 2 1 314.517 4.295 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)CC1 ZINC001560632908 1060444355 /nfs/dbraw/zinc/44/43/55/1060444355.db2.gz ZZIXWLFORKFRLF-RTWAWAEBSA-N 2 1 314.517 4.295 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)CC1 ZINC001560632906 1060445628 /nfs/dbraw/zinc/44/56/28/1060445628.db2.gz ZZIXWLFORKFRLF-LEWJYISDSA-N 2 1 314.517 4.295 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(F)c3ccccc23)C[C@@H]1C ZINC001560636977 1060450707 /nfs/dbraw/zinc/45/07/07/1060450707.db2.gz REZVSIVURMFBNB-DOTOQJQBSA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(F)c3ccccc23)C[C@@H]1C ZINC001560636977 1060450722 /nfs/dbraw/zinc/45/07/22/1060450722.db2.gz REZVSIVURMFBNB-DOTOQJQBSA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(F)c3ccccc23)C[C@@H]1C ZINC001560636977 1060450730 /nfs/dbraw/zinc/45/07/30/1060450730.db2.gz REZVSIVURMFBNB-DOTOQJQBSA-N 2 1 314.448 4.284 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791548 1060651236 /nfs/dbraw/zinc/65/12/36/1060651236.db2.gz LUZJQUISLZIYPM-UZLBHIALSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791545 1060651638 /nfs/dbraw/zinc/65/16/38/1060651638.db2.gz LUZJQUISLZIYPM-JXFKEZNVSA-N 2 1 318.480 4.143 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001560803871 1060663245 /nfs/dbraw/zinc/66/32/45/1060663245.db2.gz IJZNOPBXZRHLSC-CHWSQXEVSA-N 2 1 302.915 4.043 20 0 DIADMP Cc1ccc([C@H](C)C[NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)cc1 ZINC001560845923 1060702837 /nfs/dbraw/zinc/70/28/37/1060702837.db2.gz UWOUARWEKQPCQE-QUCCMNQESA-N 2 1 302.506 4.199 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560869402 1060730028 /nfs/dbraw/zinc/73/00/28/1060730028.db2.gz GRVOWEKUOVMRFB-SXLOBPIMSA-N 2 1 302.506 4.207 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC001560869402 1060730044 /nfs/dbraw/zinc/73/00/44/1060730044.db2.gz GRVOWEKUOVMRFB-SXLOBPIMSA-N 2 1 302.506 4.207 20 0 DIADMP CC(C)CC(CC(C)C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901055 1060765705 /nfs/dbraw/zinc/76/57/05/1060765705.db2.gz LNLXFQBNJSWJJB-CTNGQTDRSA-N 2 1 316.533 4.382 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]CCC[N@@H+](C)CC(C)C ZINC001560916500 1060775491 /nfs/dbraw/zinc/77/54/91/1060775491.db2.gz OZBPIZOIXTXIFB-GOSISDBHSA-N 2 1 310.913 4.229 20 0 DIADMP CCCc1cccc(C[NH+]2CCC(CC)([NH+]3CCCC3)CC2)c1 ZINC001560961983 1060828190 /nfs/dbraw/zinc/82/81/90/1060828190.db2.gz PXHDAROTAAIGCR-UHFFFAOYSA-N 2 1 314.517 4.480 20 0 DIADMP Cc1cc(C)cc(CC[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001560973575 1060836704 /nfs/dbraw/zinc/83/67/04/1060836704.db2.gz YFQDBHXUJDFOEM-NRFANRHFSA-N 2 1 314.517 4.233 20 0 DIADMP Cc1cc(C)cc(CC[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001560973575 1060836718 /nfs/dbraw/zinc/83/67/18/1060836718.db2.gz YFQDBHXUJDFOEM-NRFANRHFSA-N 2 1 314.517 4.233 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2coc3ccccc23)CC1 ZINC001560998108 1060858074 /nfs/dbraw/zinc/85/80/74/1060858074.db2.gz NPICZCZDLPNIIR-UHFFFAOYSA-N 2 1 312.457 4.273 20 0 DIADMP CC(C)C([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2)C(C)C ZINC001561048810 1060898742 /nfs/dbraw/zinc/89/87/42/1060898742.db2.gz FPFXKSDGUDEPOB-ZCNNSNEGSA-N 2 1 314.517 4.310 20 0 DIADMP C[N@@H+](CC1CC2(CCC2)C1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001473190135 1060944702 /nfs/dbraw/zinc/94/47/02/1060944702.db2.gz LXXMSZJOFJOAQP-LJQANCHMSA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](CC1CC2(CCC2)C1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001473190135 1060944725 /nfs/dbraw/zinc/94/47/25/1060944725.db2.gz LXXMSZJOFJOAQP-LJQANCHMSA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](CC1CC2(CCC2)C1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001473190135 1060944747 /nfs/dbraw/zinc/94/47/47/1060944747.db2.gz LXXMSZJOFJOAQP-LJQANCHMSA-N 2 1 312.501 4.021 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)[C@@H]1CCCc2ccc(F)cc21 ZINC001473191009 1060945574 /nfs/dbraw/zinc/94/55/74/1060945574.db2.gz CYWKTMRBVXNBPW-PKOBYXMFSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)[C@@H]1CCCc2ccc(F)cc21 ZINC001473191009 1060945597 /nfs/dbraw/zinc/94/55/97/1060945597.db2.gz CYWKTMRBVXNBPW-PKOBYXMFSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)[C@@H]1CCCc2ccc(F)cc21 ZINC001473191009 1060945608 /nfs/dbraw/zinc/94/56/08/1060945608.db2.gz CYWKTMRBVXNBPW-PKOBYXMFSA-N 2 1 304.453 4.009 20 0 DIADMP C[N@@H+](C/C=C/c1ccc(Cl)cc1)CC[C@H]1CCCC[NH+]1C ZINC001473191494 1060949323 /nfs/dbraw/zinc/94/93/23/1060949323.db2.gz GULRAUCVGNDIND-DUMMIQTOSA-N 2 1 306.881 4.159 20 0 DIADMP C[N@H+](C/C=C/c1ccc(Cl)cc1)CC[C@H]1CCCC[NH+]1C ZINC001473191494 1060949347 /nfs/dbraw/zinc/94/93/47/1060949347.db2.gz GULRAUCVGNDIND-DUMMIQTOSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C/c1ccc(Cl)cc1)CC[C@H]1CCCC[N@@H+]1C ZINC001473191494 1060949370 /nfs/dbraw/zinc/94/93/70/1060949370.db2.gz GULRAUCVGNDIND-DUMMIQTOSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C/c1ccc(Cl)cc1)CC[C@H]1CCCC[N@H+]1C ZINC001473191494 1060949389 /nfs/dbraw/zinc/94/93/89/1060949389.db2.gz GULRAUCVGNDIND-DUMMIQTOSA-N 2 1 306.881 4.159 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220224 1060997050 /nfs/dbraw/zinc/99/70/50/1060997050.db2.gz SGHGRISCKYMWRR-ACRUOGEOSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220224 1060997065 /nfs/dbraw/zinc/99/70/65/1060997065.db2.gz SGHGRISCKYMWRR-ACRUOGEOSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220224 1060997072 /nfs/dbraw/zinc/99/70/72/1060997072.db2.gz SGHGRISCKYMWRR-ACRUOGEOSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@H+]([C@H]4C=CCCC4)CC[C@@H]32)cc1 ZINC001473220224 1060997083 /nfs/dbraw/zinc/99/70/83/1060997083.db2.gz SGHGRISCKYMWRR-ACRUOGEOSA-N 2 1 310.485 4.082 20 0 DIADMP CC[C@H](C)[C@H](C)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219582 1060997557 /nfs/dbraw/zinc/99/75/57/1060997557.db2.gz KCAMCCIHLRWGNR-FMWKFLBASA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219582 1060997580 /nfs/dbraw/zinc/99/75/80/1060997580.db2.gz KCAMCCIHLRWGNR-FMWKFLBASA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H](C)[C@H](C)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219582 1060997600 /nfs/dbraw/zinc/99/76/00/1060997600.db2.gz KCAMCCIHLRWGNR-FMWKFLBASA-N 2 1 314.517 4.408 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001462186480 1061007924 /nfs/dbraw/zinc/00/79/24/1061007924.db2.gz AQBHEKYNYJBBEH-DNVCBOLYSA-N 2 1 304.453 4.082 20 0 DIADMP CC[C@H]1CCC[C@@H](C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001462192385 1061014184 /nfs/dbraw/zinc/01/41/84/1061014184.db2.gz OAIHPOSWDWEWGA-FXAWDEMLSA-N 2 1 302.506 4.396 20 0 DIADMP CC[C@@H]1CCC[C@H](C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001462192389 1061016188 /nfs/dbraw/zinc/01/61/88/1061016188.db2.gz OAIHPOSWDWEWGA-XLIONFOSSA-N 2 1 302.506 4.396 20 0 DIADMP CCc1cccc2cc(C[N@H+](CC)CCC[NH+]3CCCC3)oc21 ZINC001462198229 1061019667 /nfs/dbraw/zinc/01/96/67/1061019667.db2.gz KDAATIHFMGAYQC-UHFFFAOYSA-N 2 1 314.473 4.303 20 0 DIADMP CCc1cccc2cc(C[N@@H+](CC)CCC[NH+]3CCCC3)oc21 ZINC001462198229 1061019682 /nfs/dbraw/zinc/01/96/82/1061019682.db2.gz KDAATIHFMGAYQC-UHFFFAOYSA-N 2 1 314.473 4.303 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287667 1061059043 /nfs/dbraw/zinc/05/90/43/1061059043.db2.gz VQZKTOAHJKCTDP-KKKDIUQISA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287667 1061059056 /nfs/dbraw/zinc/05/90/56/1061059056.db2.gz VQZKTOAHJKCTDP-KKKDIUQISA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287667 1061059069 /nfs/dbraw/zinc/05/90/69/1061059069.db2.gz VQZKTOAHJKCTDP-KKKDIUQISA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287669 1061059543 /nfs/dbraw/zinc/05/95/43/1061059543.db2.gz VQZKTOAHJKCTDP-WVXKDWSHSA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287669 1061059561 /nfs/dbraw/zinc/05/95/61/1061059561.db2.gz VQZKTOAHJKCTDP-WVXKDWSHSA-N 2 1 318.549 4.398 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C[C@@H](C)C1 ZINC001473287669 1061059573 /nfs/dbraw/zinc/05/95/73/1061059573.db2.gz VQZKTOAHJKCTDP-WVXKDWSHSA-N 2 1 318.549 4.398 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462300105 1061089506 /nfs/dbraw/zinc/08/95/06/1061089506.db2.gz OIMSQWDAYHTORF-MISYRCLQSA-N 2 1 302.506 4.108 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC001462300105 1061089521 /nfs/dbraw/zinc/08/95/21/1061089521.db2.gz OIMSQWDAYHTORF-MISYRCLQSA-N 2 1 302.506 4.108 20 0 DIADMP CC1(C)CCC[N@@H+]1CC[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001462331313 1061108170 /nfs/dbraw/zinc/10/81/70/1061108170.db2.gz ARWQCARKENWPQR-IBGZPJMESA-N 2 1 316.464 4.226 20 0 DIADMP CC1(C)CCC[N@H+]1CC[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001462331313 1061108173 /nfs/dbraw/zinc/10/81/73/1061108173.db2.gz ARWQCARKENWPQR-IBGZPJMESA-N 2 1 316.464 4.226 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(C(C)C)c1 ZINC001473377860 1061123210 /nfs/dbraw/zinc/12/32/10/1061123210.db2.gz LJRWJLMZYOIWJY-UHFFFAOYSA-N 2 1 313.489 4.481 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(C(C)C)c1 ZINC001473377860 1061123221 /nfs/dbraw/zinc/12/32/21/1061123221.db2.gz LJRWJLMZYOIWJY-UHFFFAOYSA-N 2 1 313.489 4.481 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001473427704 1061156204 /nfs/dbraw/zinc/15/62/04/1061156204.db2.gz GAKNCLUKWMTPTO-KRWDZBQOSA-N 2 1 304.478 4.450 20 0 DIADMP C[N@H+]1CCC[C@@]2(CC[NH+](CCCCc3cccc(Cl)c3)C2)C1 ZINC001473502295 1061196851 /nfs/dbraw/zinc/19/68/51/1061196851.db2.gz VCPJIALPVDOYFK-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@H+](CCCCc3cccc(Cl)c3)C2)C1 ZINC001473502295 1061196862 /nfs/dbraw/zinc/19/68/62/1061196862.db2.gz VCPJIALPVDOYFK-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CCCCc3cccc(Cl)c3)C2)C1 ZINC001473502295 1061196873 /nfs/dbraw/zinc/19/68/73/1061196873.db2.gz VCPJIALPVDOYFK-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP c1ccc([C@H]2[N@H+](CCC[NH+]3CCCCC3)CC23CCCC3)cc1 ZINC001473529996 1061226037 /nfs/dbraw/zinc/22/60/37/1061226037.db2.gz ZAPUTNYRJMGSFT-HXUWFJFHSA-N 2 1 312.501 4.480 20 0 DIADMP c1ccc([C@H]2[N@@H+](CCC[NH+]3CCCCC3)CC23CCCC3)cc1 ZINC001473529996 1061226057 /nfs/dbraw/zinc/22/60/57/1061226057.db2.gz ZAPUTNYRJMGSFT-HXUWFJFHSA-N 2 1 312.501 4.480 20 0 DIADMP CC(C)C[N@H+](Cc1coc2ccccc12)CC1CC[NH+](C)CC1 ZINC001462524388 1061231355 /nfs/dbraw/zinc/23/13/55/1061231355.db2.gz YEYALUDABPNYFZ-UHFFFAOYSA-N 2 1 314.473 4.233 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001473624311 1061300118 /nfs/dbraw/zinc/30/01/18/1061300118.db2.gz UCIUPTLJRVZZPN-UHFFFAOYSA-N 2 1 311.473 4.153 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001473624311 1061300138 /nfs/dbraw/zinc/30/01/38/1061300138.db2.gz UCIUPTLJRVZZPN-UHFFFAOYSA-N 2 1 311.473 4.153 20 0 DIADMP CCCCCC[NH+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001473718862 1061368051 /nfs/dbraw/zinc/36/80/51/1061368051.db2.gz QQICHCHLZSDGEI-SFTDATJTSA-N 2 1 314.517 4.411 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](c1ccc(F)cc1)C1CCCCC1 ZINC001473717296 1061368782 /nfs/dbraw/zinc/36/87/82/1061368782.db2.gz UMYFDKTZTGRKGI-LJQANCHMSA-N 2 1 315.436 4.242 20 0 DIADMP C[N@@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724609 1061371068 /nfs/dbraw/zinc/37/10/68/1061371068.db2.gz DLFXBCCMHXVWKA-HNAYVOBHSA-N 2 1 314.860 4.019 20 0 DIADMP C[N@H+]1CC[C@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724609 1061371085 /nfs/dbraw/zinc/37/10/85/1061371085.db2.gz DLFXBCCMHXVWKA-HNAYVOBHSA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@H]2C[N@H+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724609 1061371104 /nfs/dbraw/zinc/37/11/04/1061371104.db2.gz DLFXBCCMHXVWKA-HNAYVOBHSA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@H]2C[N@@H+](Cc3ccc(Cl)c4ccccc34)CC[C@H]21 ZINC001473724609 1061371121 /nfs/dbraw/zinc/37/11/21/1061371121.db2.gz DLFXBCCMHXVWKA-HNAYVOBHSA-N 2 1 314.860 4.019 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@@]1(C)Cc1ccc(F)c(F)c1 ZINC001473730333 1061376788 /nfs/dbraw/zinc/37/67/88/1061376788.db2.gz QVBPPRBVYHOGNA-IBGZPJMESA-N 2 1 324.459 4.094 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@]1(C)Cc1ccc(F)c(F)c1 ZINC001473730333 1061376808 /nfs/dbraw/zinc/37/68/08/1061376808.db2.gz QVBPPRBVYHOGNA-IBGZPJMESA-N 2 1 324.459 4.094 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)[C@H]1CCc2c1cccc2F ZINC001473749930 1061389984 /nfs/dbraw/zinc/38/99/84/1061389984.db2.gz QRQJWRARAZIYGU-IBGZPJMESA-N 2 1 304.453 4.011 20 0 DIADMP CC1(C)C[C@H](c2ccccc2)C[N@H+]1CCC[NH+]1CCCCC1 ZINC001473845879 1061430517 /nfs/dbraw/zinc/43/05/17/1061430517.db2.gz OAIBGFZVHGXJDF-IBGZPJMESA-N 2 1 300.490 4.131 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001473957435 1061499216 /nfs/dbraw/zinc/49/92/16/1061499216.db2.gz PAZPZHQCEXTVAH-XLIONFOSSA-N 2 1 314.517 4.034 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001473957435 1061499223 /nfs/dbraw/zinc/49/92/23/1061499223.db2.gz PAZPZHQCEXTVAH-XLIONFOSSA-N 2 1 314.517 4.034 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001473964617 1061507261 /nfs/dbraw/zinc/50/72/61/1061507261.db2.gz GVZDCWWEJOPUKQ-QGZVFWFLSA-N 2 1 312.501 4.263 20 0 DIADMP CCCc1cccc(C[NH2+]Cc2cccc(C[N@@H+](C)CC)c2)c1 ZINC001473988151 1061532656 /nfs/dbraw/zinc/53/26/56/1061532656.db2.gz DKVSUMFUOSSZQG-UHFFFAOYSA-N 2 1 310.485 4.381 20 0 DIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC001474078327 1061624732 /nfs/dbraw/zinc/62/47/32/1061624732.db2.gz IVDKZGQVGUQJSH-OAHLLOKOSA-N 2 1 318.436 4.030 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC001474078327 1061624744 /nfs/dbraw/zinc/62/47/44/1061624744.db2.gz IVDKZGQVGUQJSH-OAHLLOKOSA-N 2 1 318.436 4.030 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(C(F)F)c(F)c1)[NH+]1CCCCC1 ZINC001474108998 1061659664 /nfs/dbraw/zinc/65/96/64/1061659664.db2.gz MUKTXRHDSWPGCQ-CYBMUJFWSA-N 2 1 314.395 4.117 20 0 DIADMP CC(C)(C[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccccc1 ZINC001474128609 1061674492 /nfs/dbraw/zinc/67/44/92/1061674492.db2.gz YXRWUMGTVOTHMV-FQEVSTJZSA-N 2 1 314.517 4.351 20 0 DIADMP Cc1coc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)c1 ZINC001474137942 1061683805 /nfs/dbraw/zinc/68/38/05/1061683805.db2.gz PFQHDWJDCARXSO-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP CC[C@H](C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC001474190086 1061739899 /nfs/dbraw/zinc/73/98/99/1061739899.db2.gz ZTFAKPWPAMWWFW-QIJUGHKUSA-N 2 1 322.496 4.115 20 0 DIADMP CC[N@@H+](CCC[NH2+]C/C=C\c1ccc(F)cc1)C1CCCCC1 ZINC001474200654 1061751219 /nfs/dbraw/zinc/75/12/19/1061751219.db2.gz HDKRDUWFORSSLW-VURMDHGXSA-N 2 1 318.480 4.473 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)C/C=C/c2c(C)cc(C)cc2C)CC1 ZINC001474364157 1061991050 /nfs/dbraw/zinc/99/10/50/1061991050.db2.gz YYRNJNNJOOVRHD-BQYQJAHWSA-N 2 1 314.517 4.431 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)C/C=C/c2c(C)cc(C)cc2C)CC1 ZINC001474364157 1061991068 /nfs/dbraw/zinc/99/10/68/1061991068.db2.gz YYRNJNNJOOVRHD-BQYQJAHWSA-N 2 1 314.517 4.431 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccccc1 ZINC001474371520 1062012595 /nfs/dbraw/zinc/01/25/95/1062012595.db2.gz UGMRHWRLYXWOPV-WOJBJXKFSA-N 2 1 314.517 4.378 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)c1ccccc1 ZINC001474371519 1062012713 /nfs/dbraw/zinc/01/27/13/1062012713.db2.gz UGMRHWRLYXWOPV-VQTJNVASSA-N 2 1 314.517 4.378 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccccc1 ZINC001474371517 1062013313 /nfs/dbraw/zinc/01/33/13/1062013313.db2.gz UGMRHWRLYXWOPV-UXHICEINSA-N 2 1 314.517 4.378 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCCC[C@@H]2c2ccc(C)cc2)CC1 ZINC001474385438 1062036210 /nfs/dbraw/zinc/03/62/10/1062036210.db2.gz FEBBGENUJZUTJE-HXUWFJFHSA-N 2 1 300.490 4.254 20 0 DIADMP CC1([NH2+]C2CCC(F)(F)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC001254215118 1062051832 /nfs/dbraw/zinc/05/18/32/1062051832.db2.gz GIBOJBZCQDBKBW-UHFFFAOYSA-N 2 1 322.443 4.209 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC001254225333 1062055646 /nfs/dbraw/zinc/05/56/46/1062055646.db2.gz RRPSHDSWYBQIOH-QGZVFWFLSA-N 2 1 322.443 4.018 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC001254225333 1062055669 /nfs/dbraw/zinc/05/56/69/1062055669.db2.gz RRPSHDSWYBQIOH-QGZVFWFLSA-N 2 1 322.443 4.018 20 0 DIADMP C[N@@H+](C1CC[NH+](C2CCCCC2)CC1)C1CCC(F)(F)CC1 ZINC001254229121 1062059841 /nfs/dbraw/zinc/05/98/41/1062059841.db2.gz GUDCNQZREVTJHZ-UHFFFAOYSA-N 2 1 314.464 4.293 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c(C)c1 ZINC001474412899 1062075779 /nfs/dbraw/zinc/07/57/79/1062075779.db2.gz LOTIMTYEAPPKEB-FPLPWBNLSA-N 2 1 314.517 4.430 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+](C)C2CC[NH+](C(C)C)CC2)c(C)c1 ZINC001474412899 1062075790 /nfs/dbraw/zinc/07/57/90/1062075790.db2.gz LOTIMTYEAPPKEB-FPLPWBNLSA-N 2 1 314.517 4.430 20 0 DIADMP CC(C)[C@H]1CCc2ccccc2[C@H]1[NH2+]C1CC[NH+](C2CC2)CC1 ZINC001474418388 1062086874 /nfs/dbraw/zinc/08/68/74/1062086874.db2.gz DHXJEMNIYZUOCP-CTNGQTDRSA-N 2 1 312.501 4.163 20 0 DIADMP CC[N@@H+](CC[C@@H]1CCC[NH+]1C)[C@H](C)c1cc2ccccc2o1 ZINC001459348567 1062104356 /nfs/dbraw/zinc/10/43/56/1062104356.db2.gz YVSZSJGQVZPNKQ-WBVHZDCISA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@@H+]1C)[C@H](C)c1cc2ccccc2o1 ZINC001459348567 1062104364 /nfs/dbraw/zinc/10/43/64/1062104364.db2.gz YVSZSJGQVZPNKQ-WBVHZDCISA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@@H]1CCC[N@H+]1C)[C@H](C)c1cc2ccccc2o1 ZINC001459348567 1062104371 /nfs/dbraw/zinc/10/43/71/1062104371.db2.gz YVSZSJGQVZPNKQ-WBVHZDCISA-N 2 1 300.446 4.300 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+](C2CCC3(CC3)CC2)CC1 ZINC001254448321 1062107815 /nfs/dbraw/zinc/10/78/15/1062107815.db2.gz SIWSFOLXSFYJKT-UHFFFAOYSA-N 2 1 312.501 4.306 20 0 DIADMP CC[C@H](C[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC001474436102 1062112643 /nfs/dbraw/zinc/11/26/43/1062112643.db2.gz WCCKPJKMGVDPNZ-GGPKGHCWSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442454 1062120263 /nfs/dbraw/zinc/12/02/63/1062120263.db2.gz NDCBSTVXBWJBCG-GUTXKFCHSA-N 2 1 310.532 4.090 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCC[C@@H]([NH+](C)C)CC2)c2ccsc2S1 ZINC001474442454 1062120276 /nfs/dbraw/zinc/12/02/76/1062120276.db2.gz NDCBSTVXBWJBCG-GUTXKFCHSA-N 2 1 310.532 4.090 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+](CCC)CCn1cc[nH+]c1C ZINC001459423017 1062137463 /nfs/dbraw/zinc/13/74/63/1062137463.db2.gz CGQPQWQOHSNJCT-HXUWFJFHSA-N 2 1 313.489 4.315 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)CCn1cc[nH+]c1C ZINC001459423017 1062137476 /nfs/dbraw/zinc/13/74/76/1062137476.db2.gz CGQPQWQOHSNJCT-HXUWFJFHSA-N 2 1 313.489 4.315 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CC2(C)CCC2)CC1 ZINC001459429699 1062141271 /nfs/dbraw/zinc/14/12/71/1062141271.db2.gz ZLFIEOLNVKDGCS-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC1 ZINC001254498377 1062143022 /nfs/dbraw/zinc/14/30/22/1062143022.db2.gz YFTDXPAFUCJCPI-NHCUHLMSSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@@H+]1CCC[C@@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC1 ZINC001254506232 1062148822 /nfs/dbraw/zinc/14/88/22/1062148822.db2.gz PSTDFTYTEVEBKX-CYBMUJFWSA-N 2 1 315.288 4.302 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C(C)(C)c2ccc(Cl)cc2Cl)CC1 ZINC001254506232 1062148837 /nfs/dbraw/zinc/14/88/37/1062148837.db2.gz PSTDFTYTEVEBKX-CYBMUJFWSA-N 2 1 315.288 4.302 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2CCC[N@@H+](C)CC2)CCC(F)(F)CC1 ZINC001254510887 1062150914 /nfs/dbraw/zinc/15/09/14/1062150914.db2.gz QYORQLODZPYVLB-OAHLLOKOSA-N 2 1 302.453 4.055 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001254510818 1062150990 /nfs/dbraw/zinc/15/09/90/1062150990.db2.gz QSYFGXSIXFTKBF-RTBURBONSA-N 2 1 304.453 4.131 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C2(CC3CCC3)CCC(F)(F)CC2)CC1 ZINC001254511910 1062153680 /nfs/dbraw/zinc/15/36/80/1062153680.db2.gz HALVADAYAGPKIT-MRXNPFEDSA-N 2 1 314.464 4.199 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001254521749 1062157226 /nfs/dbraw/zinc/15/72/26/1062157226.db2.gz WVMUEEJLXUDICQ-HXUWFJFHSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@@H]([N@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001254521749 1062157232 /nfs/dbraw/zinc/15/72/32/1062157232.db2.gz WVMUEEJLXUDICQ-HXUWFJFHSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC1 ZINC001254521749 1062157238 /nfs/dbraw/zinc/15/72/38/1062157238.db2.gz WVMUEEJLXUDICQ-HXUWFJFHSA-N 2 1 300.490 4.306 20 0 DIADMP C[N@H+]1CCC[C@H]([NH+]2CCC(Cc3cccc(Cl)c3)CC2)CC1 ZINC001254517598 1062157541 /nfs/dbraw/zinc/15/75/41/1062157541.db2.gz WSEKCVFRXCZDJX-IBGZPJMESA-N 2 1 320.908 4.079 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CCC[NH+](C)CC1 ZINC001254530971 1062165023 /nfs/dbraw/zinc/16/50/23/1062165023.db2.gz IPUOQCHIKYLQDY-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CCC[N@H+](C)CC1 ZINC001254530971 1062165044 /nfs/dbraw/zinc/16/50/44/1062165044.db2.gz IPUOQCHIKYLQDY-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CCC[N@@H+](C)CC1 ZINC001254530971 1062165059 /nfs/dbraw/zinc/16/50/59/1062165059.db2.gz IPUOQCHIKYLQDY-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP Cc1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1Cl ZINC001474500907 1062181173 /nfs/dbraw/zinc/18/11/73/1062181173.db2.gz QYJFRIOKRQISOW-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(SC(F)F)cc1 ZINC001474502906 1062185106 /nfs/dbraw/zinc/18/51/06/1062185106.db2.gz DRBGMKCQXXBCMB-UHFFFAOYSA-N 2 1 316.461 4.165 20 0 DIADMP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506045 1062187743 /nfs/dbraw/zinc/18/77/43/1062187743.db2.gz ZPBRPNKUARFRNG-RTWAWAEBSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506045 1062187749 /nfs/dbraw/zinc/18/77/49/1062187749.db2.gz ZPBRPNKUARFRNG-RTWAWAEBSA-N 2 1 312.501 4.260 20 0 DIADMP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccc(C3CCCC3)cc2)C1 ZINC001474506045 1062187756 /nfs/dbraw/zinc/18/77/56/1062187756.db2.gz ZPBRPNKUARFRNG-RTWAWAEBSA-N 2 1 312.501 4.260 20 0 DIADMP CC[N@@H+](CC[C@H]1CCC[NH+]1C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001459557227 1062206848 /nfs/dbraw/zinc/20/68/48/1062206848.db2.gz GBSHCMCSZGUPFB-UXHICEINSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@@H+]1C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001459557227 1062206862 /nfs/dbraw/zinc/20/68/62/1062206862.db2.gz GBSHCMCSZGUPFB-UXHICEINSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@H+]1C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001459557227 1062206879 /nfs/dbraw/zinc/20/68/79/1062206879.db2.gz GBSHCMCSZGUPFB-UXHICEINSA-N 2 1 320.496 4.199 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CCC[NH+](CC)CC)o1 ZINC001459567018 1062218820 /nfs/dbraw/zinc/21/88/20/1062218820.db2.gz AODWFLPFMQQHNJ-WMZOPIPTSA-N 2 1 306.494 4.347 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CCC[NH+](CC)CC)o1 ZINC001459567018 1062218839 /nfs/dbraw/zinc/21/88/39/1062218839.db2.gz AODWFLPFMQQHNJ-WMZOPIPTSA-N 2 1 306.494 4.347 20 0 DIADMP C[NH+](C[C@@H](C[N@H+](C)Cc1ccccc1)c1ccccc1)C1CCC1 ZINC001459581616 1062226374 /nfs/dbraw/zinc/22/63/74/1062226374.db2.gz UGWGCIPEEPWAMP-OAQYLSRUSA-N 2 1 322.496 4.387 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@H](C[N@H+](C)C1CCC1)c1ccccc1 ZINC001459581616 1062226388 /nfs/dbraw/zinc/22/63/88/1062226388.db2.gz UGWGCIPEEPWAMP-OAQYLSRUSA-N 2 1 322.496 4.387 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@H](C[N@@H+](C)C1CCC1)c1ccccc1 ZINC001459581616 1062226410 /nfs/dbraw/zinc/22/64/10/1062226410.db2.gz UGWGCIPEEPWAMP-OAQYLSRUSA-N 2 1 322.496 4.387 20 0 DIADMP CC(C)Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1 ZINC001459617970 1062251818 /nfs/dbraw/zinc/25/18/18/1062251818.db2.gz AKEFAWVPQRAJSG-OAQYLSRUSA-N 2 1 314.517 4.049 20 0 DIADMP C[C@H]1C[C@H](CC[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)C[C@@H](C)C1 ZINC001459625535 1062262915 /nfs/dbraw/zinc/26/29/15/1062262915.db2.gz TVWVEUZDBHMPHB-CUDHKJQZSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)C[C@@H](C)C1 ZINC001459625535 1062262937 /nfs/dbraw/zinc/26/29/37/1062262937.db2.gz TVWVEUZDBHMPHB-CUDHKJQZSA-N 2 1 306.538 4.113 20 0 DIADMP C[C@H]1C[C@H](CC[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)C[C@@H](C)C1 ZINC001459625535 1062262954 /nfs/dbraw/zinc/26/29/54/1062262954.db2.gz TVWVEUZDBHMPHB-CUDHKJQZSA-N 2 1 306.538 4.113 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCC[C@H]2C2CCCCC2)C1 ZINC001474573473 1062283675 /nfs/dbraw/zinc/28/36/75/1062283675.db2.gz ZPXLVVPHCDSWBC-YZGWKJHDSA-N 2 1 306.538 4.447 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146329 1062337152 /nfs/dbraw/zinc/33/71/52/1062337152.db2.gz FRJWUJQDIUQWSO-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146329 1062337174 /nfs/dbraw/zinc/33/71/74/1062337174.db2.gz FRJWUJQDIUQWSO-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146329 1062337193 /nfs/dbraw/zinc/33/71/93/1062337193.db2.gz FRJWUJQDIUQWSO-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146329 1062337212 /nfs/dbraw/zinc/33/72/12/1062337212.db2.gz FRJWUJQDIUQWSO-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC4(CCC4)CC2)C3)cc1 ZINC001255142021 1062338838 /nfs/dbraw/zinc/33/88/38/1062338838.db2.gz PGNXBTUDCTUUIY-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255146056 1062340083 /nfs/dbraw/zinc/34/00/83/1062340083.db2.gz BRKKPKJLIRUSAT-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255146056 1062340103 /nfs/dbraw/zinc/34/01/03/1062340103.db2.gz BRKKPKJLIRUSAT-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146056 1062340124 /nfs/dbraw/zinc/34/01/24/1062340124.db2.gz BRKKPKJLIRUSAT-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCCCCCC2)C3)cc1 ZINC001255145941 1062341709 /nfs/dbraw/zinc/34/17/09/1062341709.db2.gz XVXWUYHZEXJIOW-AERCQKQUSA-N 2 1 312.501 4.448 20 0 DIADMP CC1(C)CC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255145984 1062341915 /nfs/dbraw/zinc/34/19/15/1062341915.db2.gz YHJVRCYOCMEZRR-ACDBMABISA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146335 1062342147 /nfs/dbraw/zinc/34/21/47/1062342147.db2.gz FRJWUJQDIUQWSO-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255146335 1062342173 /nfs/dbraw/zinc/34/21/73/1062342173.db2.gz FRJWUJQDIUQWSO-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255146335 1062342200 /nfs/dbraw/zinc/34/22/00/1062342200.db2.gz FRJWUJQDIUQWSO-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255146335 1062342227 /nfs/dbraw/zinc/34/22/27/1062342227.db2.gz FRJWUJQDIUQWSO-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H]1C ZINC001255143024 1062342425 /nfs/dbraw/zinc/34/24/25/1062342425.db2.gz IVUFSZGVWDFFQL-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)[C@@H]1C ZINC001255143024 1062342447 /nfs/dbraw/zinc/34/24/47/1062342447.db2.gz IVUFSZGVWDFFQL-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[C@@H]1C ZINC001255143024 1062342475 /nfs/dbraw/zinc/34/24/75/1062342475.db2.gz IVUFSZGVWDFFQL-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[C@@H]1C ZINC001255143024 1062342499 /nfs/dbraw/zinc/34/24/99/1062342499.db2.gz IVUFSZGVWDFFQL-LPOYBJAFSA-N 2 1 312.501 4.302 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC001459761066 1062370551 /nfs/dbraw/zinc/37/05/51/1062370551.db2.gz AABJOBSWTIQJLM-UHFFFAOYSA-N 2 1 320.496 4.345 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C[C@H]1C ZINC001459762680 1062372330 /nfs/dbraw/zinc/37/23/30/1062372330.db2.gz IIXQCWGWEDNJFD-ZWKOTPCHSA-N 2 1 300.490 4.150 20 0 DIADMP CCCC[C@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001255319169 1062394561 /nfs/dbraw/zinc/39/45/61/1062394561.db2.gz HDASPPCEGPOANS-HBFSDRIKSA-N 2 1 302.506 4.313 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001255332368 1062405544 /nfs/dbraw/zinc/40/55/44/1062405544.db2.gz NNOGFZNWTUTWIN-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001255332368 1062405546 /nfs/dbraw/zinc/40/55/46/1062405546.db2.gz NNOGFZNWTUTWIN-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP CCCC[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001255329696 1062406759 /nfs/dbraw/zinc/40/67/59/1062406759.db2.gz UZPAMUSIBQZQJP-KRWDZBQOSA-N 2 1 304.478 4.146 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]([NH2+]CCC3CCCC3)CC2)cc1 ZINC001255383927 1062421549 /nfs/dbraw/zinc/42/15/49/1062421549.db2.gz PZVHPUIBFMDGSF-HXUWFJFHSA-N 2 1 300.490 4.211 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383025 1062422439 /nfs/dbraw/zinc/42/24/39/1062422439.db2.gz YTQFZUOYELWNFD-MISYRCLQSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@H]3CCc4ccccc43)CC2)cc1 ZINC001255383290 1062425507 /nfs/dbraw/zinc/42/55/07/1062425507.db2.gz HAMWHZPAMDRACT-UNMCSNQZSA-N 2 1 320.480 4.318 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255392553 1062427633 /nfs/dbraw/zinc/42/76/33/1062427633.db2.gz GPSGMLAPJDYFMO-BJLQDIEVSA-N 2 1 302.506 4.455 20 0 DIADMP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255394171 1062429241 /nfs/dbraw/zinc/42/92/41/1062429241.db2.gz TUUNTSGERWWIPM-MSOLQXFVSA-N 2 1 322.443 4.209 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)[C@@H]1C ZINC001255401531 1062431961 /nfs/dbraw/zinc/43/19/61/1062431961.db2.gz BASQXRSQLONARE-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@@H]1C ZINC001255401531 1062431971 /nfs/dbraw/zinc/43/19/71/1062431971.db2.gz BASQXRSQLONARE-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@@H]1C ZINC001255401531 1062431982 /nfs/dbraw/zinc/43/19/82/1062431982.db2.gz BASQXRSQLONARE-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255399183 1062433654 /nfs/dbraw/zinc/43/36/54/1062433654.db2.gz OHSGFFKZGUHYKJ-GGPKGHCWSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255399183 1062433662 /nfs/dbraw/zinc/43/36/62/1062433662.db2.gz OHSGFFKZGUHYKJ-GGPKGHCWSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398668 1062434498 /nfs/dbraw/zinc/43/44/98/1062434498.db2.gz LXKFRRBIYLIZPC-WMZOPIPTSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@H]1C[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398668 1062434507 /nfs/dbraw/zinc/43/45/07/1062434507.db2.gz LXKFRRBIYLIZPC-WMZOPIPTSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@H]1C[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398668 1062434518 /nfs/dbraw/zinc/43/45/18/1062434518.db2.gz LXKFRRBIYLIZPC-WMZOPIPTSA-N 2 1 322.443 4.018 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCc4ccccc4C3)CC2)cc1 ZINC001255399499 1062435690 /nfs/dbraw/zinc/43/56/90/1062435690.db2.gz SXISHHXCAMLOLS-JOCHJYFZSA-N 2 1 320.480 4.099 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@@H+]3CCc4ccccc4C3)CC2)cc1 ZINC001255399499 1062435703 /nfs/dbraw/zinc/43/57/03/1062435703.db2.gz SXISHHXCAMLOLS-JOCHJYFZSA-N 2 1 320.480 4.099 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@H+]3CCc4ccccc4C3)CC2)cc1 ZINC001255399499 1062435710 /nfs/dbraw/zinc/43/57/10/1062435710.db2.gz SXISHHXCAMLOLS-JOCHJYFZSA-N 2 1 320.480 4.099 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255405490 1062437445 /nfs/dbraw/zinc/43/74/45/1062437445.db2.gz NOBSAXOFUHNQDW-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255405490 1062437454 /nfs/dbraw/zinc/43/74/54/1062437454.db2.gz NOBSAXOFUHNQDW-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1C[C@H](C)C[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255405490 1062437465 /nfs/dbraw/zinc/43/74/65/1062437465.db2.gz NOBSAXOFUHNQDW-WSTZPKSXSA-N 2 1 300.490 4.019 20 0 DIADMP FC(F)[C@@H]1CCC[N@H+]([C@H]2CCC[NH+](Cc3ccccc3)CC2)C1 ZINC001255406118 1062438625 /nfs/dbraw/zinc/43/86/25/1062438625.db2.gz PCSXIUBRWDOTAV-MSOLQXFVSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@@H]1CCC[NH+]([C@H]2CCC[N@H+](Cc3ccccc3)CC2)C1 ZINC001255406118 1062438634 /nfs/dbraw/zinc/43/86/34/1062438634.db2.gz PCSXIUBRWDOTAV-MSOLQXFVSA-N 2 1 322.443 4.018 20 0 DIADMP FC(F)[C@@H]1CCC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255406118 1062438639 /nfs/dbraw/zinc/43/86/39/1062438639.db2.gz PCSXIUBRWDOTAV-MSOLQXFVSA-N 2 1 322.443 4.018 20 0 DIADMP C[N@@H+](CC1CC(F)(F)C1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255406971 1062439554 /nfs/dbraw/zinc/43/95/54/1062439554.db2.gz VEMVWPJQLIFWSH-GOSISDBHSA-N 2 1 322.443 4.018 20 0 DIADMP C[NH+](CC1CC(F)(F)C1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255406971 1062439560 /nfs/dbraw/zinc/43/95/60/1062439560.db2.gz VEMVWPJQLIFWSH-GOSISDBHSA-N 2 1 322.443 4.018 20 0 DIADMP C[NH+](CC1CC(F)(F)C1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255406971 1062439568 /nfs/dbraw/zinc/43/95/68/1062439568.db2.gz VEMVWPJQLIFWSH-GOSISDBHSA-N 2 1 322.443 4.018 20 0 DIADMP C[N@@H+](C[C@@H]1CC1(C)C)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408385 1062442280 /nfs/dbraw/zinc/44/22/80/1062442280.db2.gz KWQBYIXTLPBUMP-RBUKOAKNSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408385 1062442291 /nfs/dbraw/zinc/44/22/91/1062442291.db2.gz KWQBYIXTLPBUMP-RBUKOAKNSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@@H]1CC1(C)C)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408385 1062442316 /nfs/dbraw/zinc/44/23/16/1062442316.db2.gz KWQBYIXTLPBUMP-RBUKOAKNSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@@H+](C[C@H]1CC1(C)C)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408383 1062442830 /nfs/dbraw/zinc/44/28/30/1062442830.db2.gz KWQBYIXTLPBUMP-MOPGFXCFSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408383 1062442838 /nfs/dbraw/zinc/44/28/38/1062442838.db2.gz KWQBYIXTLPBUMP-MOPGFXCFSA-N 2 1 300.490 4.019 20 0 DIADMP C[NH+](C[C@H]1CC1(C)C)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408383 1062442847 /nfs/dbraw/zinc/44/28/47/1062442847.db2.gz KWQBYIXTLPBUMP-MOPGFXCFSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255402431 1062442980 /nfs/dbraw/zinc/44/29/80/1062442980.db2.gz IQLBAFFHSSBUHH-HXUWFJFHSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255402431 1062442989 /nfs/dbraw/zinc/44/29/89/1062442989.db2.gz IQLBAFFHSSBUHH-HXUWFJFHSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255402431 1062442996 /nfs/dbraw/zinc/44/29/96/1062442996.db2.gz IQLBAFFHSSBUHH-HXUWFJFHSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CC4CCC(CC4)C3)CC2)cc1 ZINC001255409529 1062446574 /nfs/dbraw/zinc/44/65/74/1062446574.db2.gz ZSVONQZJRVUFEI-CBNMVNINSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC4CCC(CC4)C3)CC2)cc1 ZINC001255409529 1062446584 /nfs/dbraw/zinc/44/65/84/1062446584.db2.gz ZSVONQZJRVUFEI-CBNMVNINSA-N 2 1 312.501 4.163 20 0 DIADMP COC1CCC([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001255453791 1062452196 /nfs/dbraw/zinc/45/21/96/1062452196.db2.gz KRMCWIRVVJIBEF-RTWGARKQSA-N 2 1 322.537 4.096 20 0 DIADMP CC1(C)C[C@@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001255533977 1062476341 /nfs/dbraw/zinc/47/63/41/1062476341.db2.gz NUOHYLKSFYRBIN-FHWLQOOXSA-N 2 1 322.537 4.096 20 0 DIADMP CCOc1cccc2cc([C@H](C)[NH2+]CCC[NH+](CC)CC)oc21 ZINC001459902831 1062486284 /nfs/dbraw/zinc/48/62/84/1062486284.db2.gz UNNZKZDNBXWHSV-HNNXBMFYSA-N 2 1 318.461 4.214 20 0 DIADMP CCCC[C@H](CC)COCCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255667534 1062504921 /nfs/dbraw/zinc/50/49/21/1062504921.db2.gz LCTVGHSSRIERHH-UMQXSMKFSA-N 2 1 324.553 4.214 20 0 DIADMP C[C@H](CC(F)(F)F)[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001255662126 1062505285 /nfs/dbraw/zinc/50/52/85/1062505285.db2.gz FUSDVVXZLXUUCB-CYBMUJFWSA-N 2 1 306.416 4.056 20 0 DIADMP C[C@H](CC(F)(F)F)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001255662126 1062505304 /nfs/dbraw/zinc/50/53/04/1062505304.db2.gz FUSDVVXZLXUUCB-CYBMUJFWSA-N 2 1 306.416 4.056 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(Cl)c1F ZINC001255664255 1062507501 /nfs/dbraw/zinc/50/75/01/1062507501.db2.gz ZJGSXKRZQWYIOI-RLAWYHOSSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1F ZINC001255664255 1062507516 /nfs/dbraw/zinc/50/75/16/1062507516.db2.gz ZJGSXKRZQWYIOI-RLAWYHOSSA-N 2 1 310.844 4.145 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1c(F)cccc1F ZINC001255676990 1062510340 /nfs/dbraw/zinc/51/03/40/1062510340.db2.gz QHNMWJHEHVMIFN-PLTIAYLTSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1c(F)cccc1F ZINC001255676990 1062510363 /nfs/dbraw/zinc/51/03/63/1062510363.db2.gz QHNMWJHEHVMIFN-PLTIAYLTSA-N 2 1 308.416 4.021 20 0 DIADMP Cc1ccc(CC(C)(C)C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001255671487 1062510874 /nfs/dbraw/zinc/51/08/74/1062510874.db2.gz LXDDEAKGQJFDTD-IHWFROFDSA-N 2 1 314.517 4.169 20 0 DIADMP CC[C@@H]1CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@H]1C ZINC001459985639 1062546273 /nfs/dbraw/zinc/54/62/73/1062546273.db2.gz NSAYRDHHEZNYON-FXAWDEMLSA-N 2 1 300.490 4.293 20 0 DIADMP Cc1ccc(SC[C@@H](C)[N@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255756187 1062575056 /nfs/dbraw/zinc/57/50/56/1062575056.db2.gz DWOUTSLWRZHKJC-KZNAEPCWSA-N 2 1 320.546 4.456 20 0 DIADMP Cc1ccc(C[C@H](C)[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001255784736 1062606578 /nfs/dbraw/zinc/60/65/78/1062606578.db2.gz VVWJNEQEJRJUFP-QRFRQXIXSA-N 2 1 300.490 4.050 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@@H](C)CC(C)C)C2)s1 ZINC001460073700 1062616855 /nfs/dbraw/zinc/61/68/55/1062616855.db2.gz PILGGVAEXCRNPB-FUHWJXTLSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@@H](C)CC(C)C)C2)s1 ZINC001460073700 1062616867 /nfs/dbraw/zinc/61/68/67/1062616867.db2.gz PILGGVAEXCRNPB-FUHWJXTLSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C[C@@H](C)CC(C)C)C2)s1 ZINC001460073700 1062616879 /nfs/dbraw/zinc/61/68/79/1062616879.db2.gz PILGGVAEXCRNPB-FUHWJXTLSA-N 2 1 322.562 4.492 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001255851465 1062630428 /nfs/dbraw/zinc/63/04/28/1062630428.db2.gz OYLMPLXLZZREKL-IEBWSBKVSA-N 2 1 318.480 4.097 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@H+](CCC4CCCC4)C3)C2)cc1 ZINC001460100356 1062637914 /nfs/dbraw/zinc/63/79/14/1062637914.db2.gz OVGKTVMRAYETHF-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(CC[NH+](CCC4CCCC4)C3)C2)cc1 ZINC001460100356 1062637921 /nfs/dbraw/zinc/63/79/21/1062637921.db2.gz OVGKTVMRAYETHF-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](CCC4CCCC4)C3)C2)cc1 ZINC001460100356 1062637938 /nfs/dbraw/zinc/63/79/38/1062637938.db2.gz OVGKTVMRAYETHF-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC001460110999 1062642220 /nfs/dbraw/zinc/64/22/20/1062642220.db2.gz JMBIBXBHGQUBTC-KRWDZBQOSA-N 2 1 312.860 4.252 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001255872369 1062646846 /nfs/dbraw/zinc/64/68/46/1062646846.db2.gz IIQJPGWVBFTBGY-XLIONFOSSA-N 2 1 318.480 4.097 20 0 DIADMP [NH3+]C1(c2ccccc2Cl)CC[NH+](C2CCCCCC2)CC1 ZINC001255885954 1062655994 /nfs/dbraw/zinc/65/59/94/1062655994.db2.gz RPTALBICGAKLFF-UHFFFAOYSA-N 2 1 306.881 4.313 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](C2CCCCCC2)CC1 ZINC001255893622 1062657658 /nfs/dbraw/zinc/65/76/58/1062657658.db2.gz MUSZBMZMABIMKS-UHFFFAOYSA-N 2 1 318.480 4.445 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](C2CCCCCC2)CC1 ZINC001255893622 1062657665 /nfs/dbraw/zinc/65/76/65/1062657665.db2.gz MUSZBMZMABIMKS-UHFFFAOYSA-N 2 1 318.480 4.445 20 0 DIADMP c1ccc2c(c1)CC[N@@H+](C1CC[NH+](C3CCCCCC3)CC1)C2 ZINC001255892688 1062658811 /nfs/dbraw/zinc/65/88/11/1062658811.db2.gz RVJZSEKVNBTUQV-UHFFFAOYSA-N 2 1 312.501 4.232 20 0 DIADMP c1ccc2c(c1)CC[N@H+](C1CC[NH+](C3CCCCCC3)CC1)C2 ZINC001255892688 1062658823 /nfs/dbraw/zinc/65/88/23/1062658823.db2.gz RVJZSEKVNBTUQV-UHFFFAOYSA-N 2 1 312.501 4.232 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+](C4CCCCCC4)C3)C2)cc1 ZINC001255892102 1062659698 /nfs/dbraw/zinc/65/96/98/1062659698.db2.gz CTLLOVSUEUYDOE-NRFANRHFSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](C4CCCCCC4)C3)C2)cc1 ZINC001255892102 1062659705 /nfs/dbraw/zinc/65/97/05/1062659705.db2.gz CTLLOVSUEUYDOE-NRFANRHFSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+](C4CCCCCC4)C3)C2)cc1 ZINC001255892102 1062659713 /nfs/dbraw/zinc/65/97/13/1062659713.db2.gz CTLLOVSUEUYDOE-NRFANRHFSA-N 2 1 312.501 4.307 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001255942450 1062665809 /nfs/dbraw/zinc/66/58/09/1062665809.db2.gz GRWSDGHXAYGJEU-LBPRGKRZSA-N 2 1 303.277 4.203 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(F)cc(C(F)(F)F)c1 ZINC001255944767 1062665868 /nfs/dbraw/zinc/66/58/68/1062665868.db2.gz ZGBVLPZDDXGHHN-GFCCVEGCSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(C)c(C(F)(F)F)c1 ZINC001255946861 1062666498 /nfs/dbraw/zinc/66/64/98/1062666498.db2.gz KCPDRKWCFCSOFM-AWEZNQCLSA-N 2 1 316.411 4.224 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC001255942449 1062666535 /nfs/dbraw/zinc/66/65/35/1062666535.db2.gz GRWSDGHXAYGJEU-GFCCVEGCSA-N 2 1 303.277 4.203 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC001255946394 1062666763 /nfs/dbraw/zinc/66/67/63/1062666763.db2.gz ULBVAEQJLGFFLK-MRXNPFEDSA-N 2 1 308.469 4.466 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cccc(OC2CCCC2)c1 ZINC001255949700 1062669293 /nfs/dbraw/zinc/66/92/93/1062669293.db2.gz AMFCKDWYEZFABZ-QGZVFWFLSA-N 2 1 318.505 4.218 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H]1CCCc2c(F)cc(F)cc21 ZINC001255954907 1062669413 /nfs/dbraw/zinc/66/94/13/1062669413.db2.gz KLSPWAXORDGGSL-FZKQIMNGSA-N 2 1 310.432 4.052 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@H](C)c1cc(F)cc(Cl)c1 ZINC001255955202 1062671321 /nfs/dbraw/zinc/67/13/21/1062671321.db2.gz QDHXSVMXIAGFKF-CHWSQXEVSA-N 2 1 300.849 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CCCC[C@@H]1c1cccc(OC)c1 ZINC001255964761 1062674359 /nfs/dbraw/zinc/67/43/59/1062674359.db2.gz SOLQCBPAVDGASC-YLJYHZDGSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CCCC[C@@H]1c1cccc(OC)c1 ZINC001255964761 1062674365 /nfs/dbraw/zinc/67/43/65/1062674365.db2.gz SOLQCBPAVDGASC-YLJYHZDGSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[NH+]1CCC(c2ccc(F)cc2C)CC1 ZINC001460172644 1062679137 /nfs/dbraw/zinc/67/91/37/1062679137.db2.gz GQRDVAYATXITOJ-UHFFFAOYSA-N 2 1 306.469 4.045 20 0 DIADMP Fc1cccc([C@@H](CC2CCC2)[NH2+]C2CC[NH+](C3CC3)CC2)c1 ZINC001256071909 1062696019 /nfs/dbraw/zinc/69/60/19/1062696019.db2.gz STCYGOBHDSKACO-HXUWFJFHSA-N 2 1 316.464 4.273 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+]([C@@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001256121327 1062720908 /nfs/dbraw/zinc/72/09/08/1062720908.db2.gz PPZPQOZJMDWHFA-GHTZIAJQSA-N 2 1 312.501 4.271 20 0 DIADMP CC(C)CC[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001256367696 1062790564 /nfs/dbraw/zinc/79/05/64/1062790564.db2.gz IDLUPNFEKUDTTL-SFHVURJKSA-N 2 1 318.505 4.392 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001256523728 1062848069 /nfs/dbraw/zinc/84/80/69/1062848069.db2.gz RSUASWGEEWRONX-UCNVEGJOSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC001256523728 1062848093 /nfs/dbraw/zinc/84/80/93/1062848093.db2.gz RSUASWGEEWRONX-UCNVEGJOSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256525365 1062848581 /nfs/dbraw/zinc/84/85/81/1062848581.db2.gz BZKCHQGGRLDMAV-GFRNBQLOSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256525365 1062848601 /nfs/dbraw/zinc/84/86/01/1062848601.db2.gz BZKCHQGGRLDMAV-GFRNBQLOSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2[C@H](C)CCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256535764 1062851523 /nfs/dbraw/zinc/85/15/23/1062851523.db2.gz CWHAGEIYKLKWSM-RMJJICAUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2[C@H](C)CCC[C@@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256535764 1062851538 /nfs/dbraw/zinc/85/15/38/1062851538.db2.gz CWHAGEIYKLKWSM-RMJJICAUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256535764 1062851562 /nfs/dbraw/zinc/85/15/62/1062851562.db2.gz CWHAGEIYKLKWSM-RMJJICAUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256535764 1062851585 /nfs/dbraw/zinc/85/15/85/1062851585.db2.gz CWHAGEIYKLKWSM-RMJJICAUSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256533360 1062852692 /nfs/dbraw/zinc/85/26/92/1062852692.db2.gz NEWSUKRZJHMKOW-APWZRJJASA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001256533360 1062852714 /nfs/dbraw/zinc/85/27/14/1062852714.db2.gz NEWSUKRZJHMKOW-APWZRJJASA-N 2 1 300.490 4.208 20 0 DIADMP CCCC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC001256535199 1062853881 /nfs/dbraw/zinc/85/38/81/1062853881.db2.gz XOHFSUCQOSRBSS-MJGOQNOKSA-N 2 1 300.490 4.352 20 0 DIADMP CCCC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC001256535199 1062853898 /nfs/dbraw/zinc/85/38/98/1062853898.db2.gz XOHFSUCQOSRBSS-MJGOQNOKSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536859 1062854753 /nfs/dbraw/zinc/85/47/53/1062854753.db2.gz JARYTXHSRNNQKD-YLJYHZDGSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)C2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256536859 1062854772 /nfs/dbraw/zinc/85/47/72/1062854772.db2.gz JARYTXHSRNNQKD-YLJYHZDGSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536859 1062854795 /nfs/dbraw/zinc/85/47/95/1062854795.db2.gz JARYTXHSRNNQKD-YLJYHZDGSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536859 1062854816 /nfs/dbraw/zinc/85/48/16/1062854816.db2.gz JARYTXHSRNNQKD-YLJYHZDGSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)C2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536856 1062855659 /nfs/dbraw/zinc/85/56/59/1062855659.db2.gz JARYTXHSRNNQKD-PXNSSMCTSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)C2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256536856 1062855684 /nfs/dbraw/zinc/85/56/84/1062855684.db2.gz JARYTXHSRNNQKD-PXNSSMCTSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536856 1062855707 /nfs/dbraw/zinc/85/57/07/1062855707.db2.gz JARYTXHSRNNQKD-PXNSSMCTSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536856 1062855730 /nfs/dbraw/zinc/85/57/30/1062855730.db2.gz JARYTXHSRNNQKD-PXNSSMCTSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540551 1062860907 /nfs/dbraw/zinc/86/09/07/1062860907.db2.gz IVQSMSCRENJNHO-PBASOCQRSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256540551 1062860928 /nfs/dbraw/zinc/86/09/28/1062860928.db2.gz IVQSMSCRENJNHO-PBASOCQRSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256540551 1062860951 /nfs/dbraw/zinc/86/09/51/1062860951.db2.gz IVQSMSCRENJNHO-PBASOCQRSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256540551 1062860973 /nfs/dbraw/zinc/86/09/73/1062860973.db2.gz IVQSMSCRENJNHO-PBASOCQRSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256551505 1062871064 /nfs/dbraw/zinc/87/10/64/1062871064.db2.gz SMANHHYRUXJBDA-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256551505 1062871084 /nfs/dbraw/zinc/87/10/84/1062871084.db2.gz SMANHHYRUXJBDA-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[N@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256551687 1062872877 /nfs/dbraw/zinc/87/28/77/1062872877.db2.gz UHHXAKYTOLAJHZ-YLJYHZDGSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[N@@H+](CC1CC1)[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256551687 1062872903 /nfs/dbraw/zinc/87/29/03/1062872903.db2.gz UHHXAKYTOLAJHZ-YLJYHZDGSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256551687 1062872921 /nfs/dbraw/zinc/87/29/21/1062872921.db2.gz UHHXAKYTOLAJHZ-YLJYHZDGSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[NH+](CC1CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256551687 1062872939 /nfs/dbraw/zinc/87/29/39/1062872939.db2.gz UHHXAKYTOLAJHZ-YLJYHZDGSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256553835 1062874759 /nfs/dbraw/zinc/87/47/59/1062874759.db2.gz LALJGDQKNHFJPR-QUCCMNQESA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256553835 1062874781 /nfs/dbraw/zinc/87/47/81/1062874781.db2.gz LALJGDQKNHFJPR-QUCCMNQESA-N 2 1 300.490 4.306 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256552486 1062878377 /nfs/dbraw/zinc/87/83/77/1062878377.db2.gz BECPXIWIMKIQMP-HOJAQTOUSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256552486 1062878387 /nfs/dbraw/zinc/87/83/87/1062878387.db2.gz BECPXIWIMKIQMP-HOJAQTOUSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256552486 1062878412 /nfs/dbraw/zinc/87/84/12/1062878412.db2.gz BECPXIWIMKIQMP-HOJAQTOUSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256552486 1062878432 /nfs/dbraw/zinc/87/84/32/1062878432.db2.gz BECPXIWIMKIQMP-HOJAQTOUSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256555726 1062885015 /nfs/dbraw/zinc/88/50/15/1062885015.db2.gz WACMRBGVTQTDNZ-QIJUGHKUSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CC[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256555726 1062885027 /nfs/dbraw/zinc/88/50/27/1062885027.db2.gz WACMRBGVTQTDNZ-QIJUGHKUSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CC[C@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555726 1062885041 /nfs/dbraw/zinc/88/50/41/1062885041.db2.gz WACMRBGVTQTDNZ-QIJUGHKUSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CC[C@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555726 1062885056 /nfs/dbraw/zinc/88/50/56/1062885056.db2.gz WACMRBGVTQTDNZ-QIJUGHKUSA-N 2 1 320.480 4.487 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)CC1 ZINC001256566554 1062888796 /nfs/dbraw/zinc/88/87/96/1062888796.db2.gz IXDIMMAYXZPABZ-QGZVFWFLSA-N 2 1 321.896 4.039 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H](c2cncc(Cl)c2)C2CC2)CC1 ZINC001256566552 1062890109 /nfs/dbraw/zinc/89/01/09/1062890109.db2.gz IXDIMMAYXZPABZ-KRWDZBQOSA-N 2 1 321.896 4.039 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(-c3ccccn3)cc2)CC1 ZINC001256563798 1062890717 /nfs/dbraw/zinc/89/07/17/1062890717.db2.gz HPBBTHHJWGWOQV-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+]2Cc3ccccc3C(C)(C)C2)CC1 ZINC001256574456 1062899064 /nfs/dbraw/zinc/89/90/64/1062899064.db2.gz ADZCTDIMJGEDSK-UHFFFAOYSA-N 2 1 300.490 4.043 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2Cc3ccccc3C(C)(C)C2)CC1 ZINC001256574456 1062899077 /nfs/dbraw/zinc/89/90/77/1062899077.db2.gz ADZCTDIMJGEDSK-UHFFFAOYSA-N 2 1 300.490 4.043 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001256575944 1062901096 /nfs/dbraw/zinc/90/10/96/1062901096.db2.gz YSYVLVACEHZHBS-INIZCTEOSA-N 2 1 320.908 4.392 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC001256575944 1062901110 /nfs/dbraw/zinc/90/11/10/1062901110.db2.gz YSYVLVACEHZHBS-INIZCTEOSA-N 2 1 320.908 4.392 20 0 DIADMP c1cc2ccc(C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)cc2o1 ZINC001256601075 1062908346 /nfs/dbraw/zinc/90/83/46/1062908346.db2.gz MCTBGZOKFCSTAM-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP CC(C)(C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)CC1CCC1 ZINC001256600776 1062908972 /nfs/dbraw/zinc/90/89/72/1062908972.db2.gz KYFHLALAMBZQSW-UHFFFAOYSA-N 2 1 314.517 4.457 20 0 DIADMP CCC1([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CCCCC1 ZINC001256599179 1062910903 /nfs/dbraw/zinc/91/09/03/1062910903.db2.gz KKZAWVUPLLCLKQ-UHFFFAOYSA-N 2 1 300.490 4.354 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CC[C@H](c4ccccc4)C3)CC2)cc1 ZINC001256604037 1062912496 /nfs/dbraw/zinc/91/24/96/1062912496.db2.gz MCMFLFSVULGEGH-NRFANRHFSA-N 2 1 320.480 4.141 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CC[C@H](c4ccccc4)C3)CC2)cc1 ZINC001256604037 1062912520 /nfs/dbraw/zinc/91/25/20/1062912520.db2.gz MCMFLFSVULGEGH-NRFANRHFSA-N 2 1 320.480 4.141 20 0 DIADMP C[C@@H]1C[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)Cc2ccccc21 ZINC001256604689 1062913919 /nfs/dbraw/zinc/91/39/19/1062913919.db2.gz VFOXMPYLTAKTHF-GOSISDBHSA-N 2 1 320.480 4.270 20 0 DIADMP C[C@@H]1C[N@H+](C2CC[NH+](Cc3ccccc3)CC2)Cc2ccccc21 ZINC001256604689 1062913941 /nfs/dbraw/zinc/91/39/41/1062913941.db2.gz VFOXMPYLTAKTHF-GOSISDBHSA-N 2 1 320.480 4.270 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2)CCN1c1cc[nH+]cc1 ZINC001460704633 1063000983 /nfs/dbraw/zinc/00/09/83/1063000983.db2.gz FESPOWDXEVCTGD-QGZVFWFLSA-N 2 1 323.484 4.090 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722138 1063012392 /nfs/dbraw/zinc/01/23/92/1063012392.db2.gz VPGDPIGWLHDBIS-HZPDHXFCSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722138 1063012413 /nfs/dbraw/zinc/01/24/13/1063012413.db2.gz VPGDPIGWLHDBIS-HZPDHXFCSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722138 1063012437 /nfs/dbraw/zinc/01/24/37/1063012437.db2.gz VPGDPIGWLHDBIS-HZPDHXFCSA-N 2 1 322.443 4.017 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722142 1063014120 /nfs/dbraw/zinc/01/41/20/1063014120.db2.gz VPGDPIGWLHDBIS-JKSUJKDBSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722142 1063014140 /nfs/dbraw/zinc/01/41/40/1063014140.db2.gz VPGDPIGWLHDBIS-JKSUJKDBSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722142 1063014163 /nfs/dbraw/zinc/01/41/63/1063014163.db2.gz VPGDPIGWLHDBIS-JKSUJKDBSA-N 2 1 322.443 4.017 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC[C@@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722135 1063015764 /nfs/dbraw/zinc/01/57/64/1063015764.db2.gz VPGDPIGWLHDBIS-HOTGVXAUSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CC[C@@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722135 1063015782 /nfs/dbraw/zinc/01/57/82/1063015782.db2.gz VPGDPIGWLHDBIS-HOTGVXAUSA-N 2 1 322.443 4.017 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CC[C@@H](c2ccc(F)c(F)c2)C1(C)C ZINC001460722135 1063015803 /nfs/dbraw/zinc/01/58/03/1063015803.db2.gz VPGDPIGWLHDBIS-HOTGVXAUSA-N 2 1 322.443 4.017 20 0 DIADMP c1cc(N2CCC([N@@H+]3CCC[C@@H]3C3CCCCC3)CC2)cc[nH+]1 ZINC001256862569 1063019105 /nfs/dbraw/zinc/01/91/05/1063019105.db2.gz OKRQVOOORJYYHM-HXUWFJFHSA-N 2 1 313.489 4.095 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)C1CCN(c2cc[nH+]cc2)CC1 ZINC001256861049 1063019899 /nfs/dbraw/zinc/01/98/99/1063019899.db2.gz MWCRVQSCOSJBKS-UHFFFAOYSA-N 2 1 323.484 4.353 20 0 DIADMP CCC1CCC([N@@H+](Cc2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001256870141 1063023325 /nfs/dbraw/zinc/02/33/25/1063023325.db2.gz MNKBWUKIBRRLEX-SUVNUQANSA-N 2 1 315.505 4.122 20 0 DIADMP OCCCCCCCCCC[NH2+][C@@H]1CCC[N@@H+](C2CCCC2)C1 ZINC001256904095 1063035529 /nfs/dbraw/zinc/03/55/29/1063035529.db2.gz HGADMAAJWIPZPY-LJQANCHMSA-N 2 1 324.553 4.096 20 0 DIADMP OCCCCCCCCCC[NH2+][C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC001256904095 1063035550 /nfs/dbraw/zinc/03/55/50/1063035550.db2.gz HGADMAAJWIPZPY-LJQANCHMSA-N 2 1 324.553 4.096 20 0 DIADMP CCC1([NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904521 1063039753 /nfs/dbraw/zinc/03/97/53/1063039753.db2.gz IKAGYEVZTCUUBO-OAHLLOKOSA-N 2 1 314.464 4.341 20 0 DIADMP CCC1([NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)CCC(F)(F)CC1 ZINC001256904521 1063039776 /nfs/dbraw/zinc/03/97/76/1063039776.db2.gz IKAGYEVZTCUUBO-OAHLLOKOSA-N 2 1 314.464 4.341 20 0 DIADMP c1ccc(CCCC[NH2+][C@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC001256908112 1063041328 /nfs/dbraw/zinc/04/13/28/1063041328.db2.gz LFMGTTOQKMSTEG-IBGZPJMESA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(CCCC[NH2+][C@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC001256908112 1063041346 /nfs/dbraw/zinc/04/13/46/1063041346.db2.gz LFMGTTOQKMSTEG-IBGZPJMESA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC001256909256 1063049111 /nfs/dbraw/zinc/04/91/11/1063049111.db2.gz SDNCYKLGBRTEQL-HLAWJBBLSA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC001256909256 1063049129 /nfs/dbraw/zinc/04/91/29/1063049129.db2.gz SDNCYKLGBRTEQL-HLAWJBBLSA-N 2 1 312.501 4.319 20 0 DIADMP CCCCc1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)s1 ZINC001278988876 1063096497 /nfs/dbraw/zinc/09/64/97/1063096497.db2.gz ICCBDORTGGLKRK-SFHVURJKSA-N 2 1 306.519 4.008 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)s1 ZINC001278988876 1063096522 /nfs/dbraw/zinc/09/65/22/1063096522.db2.gz ICCBDORTGGLKRK-SFHVURJKSA-N 2 1 306.519 4.008 20 0 DIADMP CCCCc1ccc(C[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)s1 ZINC001278988876 1063096549 /nfs/dbraw/zinc/09/65/49/1063096549.db2.gz ICCBDORTGGLKRK-SFHVURJKSA-N 2 1 306.519 4.008 20 0 DIADMP CCCCc1ccc(C[NH+]2CCC[C@@]3(CC[N@@H+](C)C3)C2)s1 ZINC001278988876 1063096570 /nfs/dbraw/zinc/09/65/70/1063096570.db2.gz ICCBDORTGGLKRK-SFHVURJKSA-N 2 1 306.519 4.008 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001257217310 1063143559 /nfs/dbraw/zinc/14/35/59/1063143559.db2.gz LSYQKXHEKMXGRM-OAHLLOKOSA-N 2 1 306.881 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001257217310 1063143573 /nfs/dbraw/zinc/14/35/73/1063143573.db2.gz LSYQKXHEKMXGRM-OAHLLOKOSA-N 2 1 306.881 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001257223853 1063148116 /nfs/dbraw/zinc/14/81/16/1063148116.db2.gz FTUXIFGBNPCSAY-GOSISDBHSA-N 2 1 306.881 4.350 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001257223853 1063148135 /nfs/dbraw/zinc/14/81/35/1063148135.db2.gz FTUXIFGBNPCSAY-GOSISDBHSA-N 2 1 306.881 4.350 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257253885 1063160288 /nfs/dbraw/zinc/16/02/88/1063160288.db2.gz XNXCBTOIFJIVBK-GUDVDZBRSA-N 2 1 318.505 4.346 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCCc2ccccc2C1)C1CCCCC1 ZINC001460988473 1063169906 /nfs/dbraw/zinc/16/99/06/1063169906.db2.gz IPLYSTGEMHUDMN-HXUWFJFHSA-N 2 1 314.517 4.178 20 0 DIADMP CCC(CC)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001257290088 1063184329 /nfs/dbraw/zinc/18/43/29/1063184329.db2.gz LVPIRILZDBRKCE-DXBWTPJFSA-N 2 1 300.490 4.303 20 0 DIADMP CCC[C@@H](C)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001257308940 1063195648 /nfs/dbraw/zinc/19/56/48/1063195648.db2.gz LZHBDZVCOHZYLZ-RTNLJHFFSA-N 2 1 300.490 4.303 20 0 DIADMP CCC[C@H](C)[NH+]1CCC([NH3+])(c2ccccc2C(F)(F)F)CC1 ZINC001257310975 1063197334 /nfs/dbraw/zinc/19/73/34/1063197334.db2.gz HFKPHQKKVSJAOW-ZDUSSCGKSA-N 2 1 314.395 4.144 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@@H](C(C)C)[NH+]1CCCC1 ZINC001461030040 1063198782 /nfs/dbraw/zinc/19/87/82/1063198782.db2.gz LHUKXPQERYIHQD-UIRWJGRMSA-N 2 1 320.908 4.453 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(C(F)(F)F)c2)CC1 ZINC001257313119 1063199968 /nfs/dbraw/zinc/19/99/68/1063199968.db2.gz LFLZXMXGGQCBLQ-CYBMUJFWSA-N 2 1 314.395 4.144 20 0 DIADMP CCC[C@H](C)[NH+]1C[C@H]2c3ccccc3[C@H]([N@@H+](C)C(C)C)[C@H]2C1 ZINC001257321850 1063204046 /nfs/dbraw/zinc/20/40/46/1063204046.db2.gz YFAJMKJCMMVFGA-KNTRFNDTSA-N 2 1 300.490 4.286 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001461047388 1063215598 /nfs/dbraw/zinc/21/55/98/1063215598.db2.gz WIMUMPAYJOTFAX-HZPDHXFCSA-N 2 1 320.521 4.343 20 0 DIADMP CCCC(CCC)[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257340009 1063220994 /nfs/dbraw/zinc/22/09/94/1063220994.db2.gz BDHOHPYBAXXEOJ-IBGZPJMESA-N 2 1 302.506 4.409 20 0 DIADMP CCCC(CCC)[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257340009 1063221012 /nfs/dbraw/zinc/22/10/12/1063221012.db2.gz BDHOHPYBAXXEOJ-IBGZPJMESA-N 2 1 302.506 4.409 20 0 DIADMP CCCC(CCC)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257340009 1063221035 /nfs/dbraw/zinc/22/10/35/1063221035.db2.gz BDHOHPYBAXXEOJ-IBGZPJMESA-N 2 1 302.506 4.409 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](C3CCCC3)C[C@@H]21 ZINC001257350541 1063224829 /nfs/dbraw/zinc/22/48/29/1063224829.db2.gz FBKGHWBSWLLGGT-ZYSHUDEJSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@@H+](C3CCCC3)C[C@@H]21 ZINC001257350541 1063224849 /nfs/dbraw/zinc/22/48/49/1063224849.db2.gz FBKGHWBSWLLGGT-ZYSHUDEJSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@H]2C[N@H+](C3CCCC3)C[C@@H]21 ZINC001257350541 1063224869 /nfs/dbraw/zinc/22/48/69/1063224869.db2.gz FBKGHWBSWLLGGT-ZYSHUDEJSA-N 2 1 318.530 4.223 20 0 DIADMP CCCCCC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001257357404 1063227745 /nfs/dbraw/zinc/22/77/45/1063227745.db2.gz NENWAKFDILBBGN-MRXNPFEDSA-N 2 1 306.469 4.434 20 0 DIADMP CCCCCC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001257357398 1063228161 /nfs/dbraw/zinc/22/81/61/1063228161.db2.gz NENWAKFDILBBGN-INIZCTEOSA-N 2 1 306.469 4.434 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257416194 1063266644 /nfs/dbraw/zinc/26/66/44/1063266644.db2.gz FEYGCAGHMSSMME-BHIYHBOVSA-N 2 1 303.494 4.122 20 0 DIADMP CC[C@H](C)[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001257438687 1063277205 /nfs/dbraw/zinc/27/72/05/1063277205.db2.gz BDMKTFWMCPBZQY-UOVPBQLFSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001257438687 1063277226 /nfs/dbraw/zinc/27/72/26/1063277226.db2.gz BDMKTFWMCPBZQY-UOVPBQLFSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001257438687 1063277246 /nfs/dbraw/zinc/27/72/46/1063277246.db2.gz BDMKTFWMCPBZQY-UOVPBQLFSA-N 2 1 306.519 4.079 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]3C[NH+](C4CCCCC4)CC[C@@H]3C2)cc1 ZINC001257466748 1063290859 /nfs/dbraw/zinc/29/08/59/1063290859.db2.gz PAQWTKUKAKOCJV-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](C4CCCCC4)CC[C@@H]3C2)cc1 ZINC001257466748 1063290878 /nfs/dbraw/zinc/29/08/78/1063290878.db2.gz PAQWTKUKAKOCJV-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@H+](C4CCCCC4)CC[C@@H]3C2)cc1 ZINC001257466748 1063290891 /nfs/dbraw/zinc/29/08/91/1063290891.db2.gz PAQWTKUKAKOCJV-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP CCC[C@@H](C)CC[C@H](C)[NH2+]C(C)(C)CC[NH2+]CCC(C)(C)[NH3+] ZINC001257471401 1063292641 /nfs/dbraw/zinc/29/26/41/1063292641.db2.gz NOZSHMXTKOBQKF-SJORKVTESA-N 3 1 313.574 4.067 20 0 DIADMP CCC[C@H](C)CC[C@@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257476162 1063295415 /nfs/dbraw/zinc/29/54/15/1063295415.db2.gz OFYROPWURCUNOP-RDGPPVDQSA-N 2 1 324.553 4.342 20 0 DIADMP CCC[C@H](C)CC[C@H](C)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001257480291 1063301378 /nfs/dbraw/zinc/30/13/78/1063301378.db2.gz CZGZCGKCVCQPAV-BJLQDIEVSA-N 2 1 324.553 4.167 20 0 DIADMP CCC[C@@H](C)CC[C@H](C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001257481331 1063303141 /nfs/dbraw/zinc/30/31/41/1063303141.db2.gz JXBHBONQGFZTQL-MSOLQXFVSA-N 2 1 324.553 4.167 20 0 DIADMP CCCCC[C@@H](C)N[C@H](C[NH3+])c1ccc(Br)cc1 ZINC001257501533 1063310795 /nfs/dbraw/zinc/31/07/95/1063310795.db2.gz BKIVENPUXMTACZ-IUODEOHRSA-N 2 1 313.283 4.007 20 0 DIADMP CCCCC[C@H](C)[N@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257512927 1063323253 /nfs/dbraw/zinc/32/32/53/1063323253.db2.gz QMJSQWOWBKQWKC-YESZJQIVSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[C@H](C)[N@@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257512927 1063323268 /nfs/dbraw/zinc/32/32/68/1063323268.db2.gz QMJSQWOWBKQWKC-YESZJQIVSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[C@H](C)[NH+]1C[C@H]2C[N@@H+](Cc3cccs3)C[C@H]2C1 ZINC001257512927 1063323289 /nfs/dbraw/zinc/32/32/89/1063323289.db2.gz QMJSQWOWBKQWKC-YESZJQIVSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[C@H](C)[NH+]1C[C@H]2C[N@H+](Cc3cccs3)C[C@H]2C1 ZINC001257512927 1063323310 /nfs/dbraw/zinc/32/33/10/1063323310.db2.gz QMJSQWOWBKQWKC-YESZJQIVSA-N 2 1 306.519 4.081 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)[C@@H]1c1cccs1 ZINC001461229075 1063349330 /nfs/dbraw/zinc/34/93/30/1063349330.db2.gz GGNABBKXVDPJRL-FSNPWBFUSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)[C@@H]1c1cccs1 ZINC001461229075 1063349353 /nfs/dbraw/zinc/34/93/53/1063349353.db2.gz GGNABBKXVDPJRL-FSNPWBFUSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)[C@H]1c1cccs1 ZINC001461229087 1063349718 /nfs/dbraw/zinc/34/97/18/1063349718.db2.gz GGNABBKXVDPJRL-MUDKKEKZSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)[C@H]1c1cccs1 ZINC001461229087 1063349730 /nfs/dbraw/zinc/34/97/30/1063349730.db2.gz GGNABBKXVDPJRL-MUDKKEKZSA-N 2 1 318.530 4.299 20 0 DIADMP CC(C)CCC[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC001473143778 1063450172 /nfs/dbraw/zinc/45/01/72/1063450172.db2.gz FTJZHGYHXATNAF-UHFFFAOYSA-N 2 1 302.506 4.267 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]C2CCC(c3ccccc3)CC2)C1 ZINC001257990018 1063453309 /nfs/dbraw/zinc/45/33/09/1063453309.db2.gz YUBGJZLPMKEMQK-QHGAOEGBSA-N 2 1 300.490 4.034 20 0 DIADMP CCCc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC001461373867 1063454605 /nfs/dbraw/zinc/45/46/05/1063454605.db2.gz VJQCLYSTIJVYDX-INIZCTEOSA-N 2 1 308.535 4.158 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H]2CCCc3c(F)cc(F)cc32)CC1 ZINC001258008875 1063460871 /nfs/dbraw/zinc/46/08/71/1063460871.db2.gz IQJJYEQNGHEGAH-IBGZPJMESA-N 2 1 322.443 4.052 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)CC1 ZINC001258008876 1063462336 /nfs/dbraw/zinc/46/23/36/1063462336.db2.gz IQJJYEQNGHEGAH-LJQANCHMSA-N 2 1 322.443 4.052 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccccc2F)CC1 ZINC001258014721 1063466186 /nfs/dbraw/zinc/46/61/86/1063466186.db2.gz RONFIMCMLIXIMC-IBGZPJMESA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@H]2c2ccccc2F)CC1 ZINC001258014721 1063466193 /nfs/dbraw/zinc/46/61/93/1063466193.db2.gz RONFIMCMLIXIMC-IBGZPJMESA-N 2 1 304.453 4.083 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC001258017728 1063466648 /nfs/dbraw/zinc/46/66/48/1063466648.db2.gz NEFKRSQRMMBZOI-HXUWFJFHSA-N 2 1 314.517 4.377 20 0 DIADMP Cc1cccc([C@@H]2CCCCC[N@H+]2CCCc2c[nH+]cn2C)c1 ZINC001473178775 1063486202 /nfs/dbraw/zinc/48/62/02/1063486202.db2.gz LBWVEXZWFSCKPG-FQEVSTJZSA-N 2 1 311.473 4.278 20 0 DIADMP Cc1cccc([C@@H]2CCCCC[N@@H+]2CCCc2c[nH+]cn2C)c1 ZINC001473178775 1063486214 /nfs/dbraw/zinc/48/62/14/1063486214.db2.gz LBWVEXZWFSCKPG-FQEVSTJZSA-N 2 1 311.473 4.278 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@@H](C)C[C@@H](C)CC(C)C)CC1 ZINC001258055793 1063488393 /nfs/dbraw/zinc/48/83/93/1063488393.db2.gz MUICWHSLSUGEID-WMZOPIPTSA-N 2 1 317.521 4.409 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H](C)C[C@@H](C)CC(C)C)CC1 ZINC001258061914 1063489766 /nfs/dbraw/zinc/48/97/66/1063489766.db2.gz AMIWCHMQNUEWFG-DLBZAZTESA-N 2 1 317.521 4.390 20 0 DIADMP C[C@H]([NH2+]C/C=C\c1cccc(F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001461426266 1063494251 /nfs/dbraw/zinc/49/42/51/1063494251.db2.gz NKEBIPHZMNPXKQ-BFVRRIQPSA-N 2 1 316.464 4.082 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC001461425896 1063494875 /nfs/dbraw/zinc/49/48/75/1063494875.db2.gz KTVUGFWYHIBWKT-HUUCEWRRSA-N 2 1 321.534 4.009 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC001461425896 1063494888 /nfs/dbraw/zinc/49/48/88/1063494888.db2.gz KTVUGFWYHIBWKT-HUUCEWRRSA-N 2 1 321.534 4.009 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)CC1 ZINC001461427259 1063495021 /nfs/dbraw/zinc/49/50/21/1063495021.db2.gz AVEXHICOUNZYNW-VIQWUECVSA-N 2 1 324.553 4.072 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)CC1 ZINC001461427259 1063495036 /nfs/dbraw/zinc/49/50/36/1063495036.db2.gz AVEXHICOUNZYNW-VIQWUECVSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1ccc([C@H]2CCC[C@@H]2[N@@H+](C)CCC[NH+]2CCCCC2)cc1 ZINC001473186910 1063497251 /nfs/dbraw/zinc/49/72/51/1063497251.db2.gz NLYBVJJROCUDDT-RTWAWAEBSA-N 2 1 314.517 4.439 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258081176 1063506680 /nfs/dbraw/zinc/50/66/80/1063506680.db2.gz PDMIOXVGALMUMO-QGZVFWFLSA-N 2 1 301.478 4.083 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258086147 1063511789 /nfs/dbraw/zinc/51/17/89/1063511789.db2.gz SQSJVWPLHFEHHR-MISYRCLQSA-N 2 1 315.505 4.288 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC001461485282 1063531838 /nfs/dbraw/zinc/53/18/38/1063531838.db2.gz NJPQRQFMTADDOG-KCLUMXDGSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC001461485282 1063531853 /nfs/dbraw/zinc/53/18/53/1063531853.db2.gz NJPQRQFMTADDOG-KCLUMXDGSA-N 2 1 314.517 4.423 20 0 DIADMP CSCC[C@@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258209816 1063564261 /nfs/dbraw/zinc/56/42/61/1063564261.db2.gz UUQJPVOQTAATQU-ZTFGCOKTSA-N 2 1 324.509 4.039 20 0 DIADMP COc1ccccc1C1([NH3+])CC[NH+](C2CCCCCCC2)CC1 ZINC001258237766 1063575678 /nfs/dbraw/zinc/57/56/78/1063575678.db2.gz SXQAEFJNCSJLDF-UHFFFAOYSA-N 2 1 316.489 4.058 20 0 DIADMP c1csc(C[N@H+]2C[C@@H]3C[NH+](C4CCCCCCC4)C[C@@H]3C2)c1 ZINC001258237411 1063576946 /nfs/dbraw/zinc/57/69/46/1063576946.db2.gz JTAZFUQBSAOVJA-CALCHBBNSA-N 2 1 318.530 4.225 20 0 DIADMP c1csc(C[N@@H+]2C[C@@H]3C[NH+](C4CCCCCCC4)C[C@@H]3C2)c1 ZINC001258237411 1063576962 /nfs/dbraw/zinc/57/69/62/1063576962.db2.gz JTAZFUQBSAOVJA-CALCHBBNSA-N 2 1 318.530 4.225 20 0 DIADMP c1csc(C[NH+]2C[C@@H]3C[N@H+](C4CCCCCCC4)C[C@@H]3C2)c1 ZINC001258237411 1063576973 /nfs/dbraw/zinc/57/69/73/1063576973.db2.gz JTAZFUQBSAOVJA-CALCHBBNSA-N 2 1 318.530 4.225 20 0 DIADMP c1csc(C[NH+]2C[C@@H]3C[N@@H+](C4CCCCCCC4)C[C@@H]3C2)c1 ZINC001258237411 1063576988 /nfs/dbraw/zinc/57/69/88/1063576988.db2.gz JTAZFUQBSAOVJA-CALCHBBNSA-N 2 1 318.530 4.225 20 0 DIADMP CC1(C)CCC[C@H]([N@@H+](Cc2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258281631 1063583547 /nfs/dbraw/zinc/58/35/47/1063583547.db2.gz NDANIQOWNFFBJE-WDSOQIARSA-N 2 1 315.505 4.122 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+][C@H]1CCC[N@@H+](C)CC1 ZINC001258296404 1063592781 /nfs/dbraw/zinc/59/27/81/1063592781.db2.gz WPKHSFKBOXIMQS-CVEARBPZSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+][C@@H](C)C[NH+]1CCCC1 ZINC001258295842 1063592830 /nfs/dbraw/zinc/59/28/30/1063592830.db2.gz QYIZBRBZBBDKEI-CVEARBPZSA-N 2 1 324.534 4.144 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001461616052 1063615551 /nfs/dbraw/zinc/61/55/51/1063615551.db2.gz FVDQMGBILDEPSU-UHFFFAOYSA-N 2 1 303.277 4.061 20 0 DIADMP CC[C@H]1CCC[C@@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)CC1 ZINC001461591223 1063599686 /nfs/dbraw/zinc/59/96/86/1063599686.db2.gz YCEFSEZZWHWPFG-KCLUMXDGSA-N 2 1 314.517 4.280 20 0 DIADMP CC(C)C[N@H+](C)CCC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC001461616052 1063615544 /nfs/dbraw/zinc/61/55/44/1063615544.db2.gz FVDQMGBILDEPSU-UHFFFAOYSA-N 2 1 303.277 4.061 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+](Cc1ccccc1)C[C@H](C)C[NH3+] ZINC001258333984 1063617422 /nfs/dbraw/zinc/61/74/22/1063617422.db2.gz QQASSIUUEZSNES-CVEARBPZSA-N 2 1 308.535 4.004 20 0 DIADMP CCCCC[C@H](CC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258441054 1063654507 /nfs/dbraw/zinc/65/45/07/1063654507.db2.gz CMXPOAIOXXIZDE-KRWDZBQOSA-N 2 1 303.494 4.288 20 0 DIADMP CCCCC[C@H](CC)N(c1cc(C)[nH+]c(C)n1)C1CC[NH2+]CC1 ZINC001258448238 1063658127 /nfs/dbraw/zinc/65/81/27/1063658127.db2.gz SLDCSUQRNRVXEK-KRWDZBQOSA-N 2 1 318.509 4.011 20 0 DIADMP CCc1ccc2ccccc2c1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001461752779 1063697880 /nfs/dbraw/zinc/69/78/80/1063697880.db2.gz HXKRAUMVNARHEX-RBUKOAKNSA-N 2 1 308.469 4.119 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258598644 1063702494 /nfs/dbraw/zinc/70/24/94/1063702494.db2.gz VYZIEEYRVKQRPU-BZSNNMDCSA-N 2 1 318.480 4.476 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2CCC(C)(C)C2)CC1 ZINC001258608639 1063708432 /nfs/dbraw/zinc/70/84/32/1063708432.db2.gz MGPNEXKYYTUXBY-LJQANCHMSA-N 2 1 318.480 4.301 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+]([C@@H]2CCC(C)(C)C2)CC1 ZINC001258608639 1063708447 /nfs/dbraw/zinc/70/84/47/1063708447.db2.gz MGPNEXKYYTUXBY-LJQANCHMSA-N 2 1 318.480 4.301 20 0 DIADMP CCCCC[C@@H](CCC)[NH+]1CCC([N@@H+](CC)[C@@H]2CCOC2)CC1 ZINC001258671260 1063737339 /nfs/dbraw/zinc/73/73/39/1063737339.db2.gz MLUGBYIDJAVOGV-UYAOXDASSA-N 2 1 324.553 4.311 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258708013 1063766667 /nfs/dbraw/zinc/76/66/67/1063766667.db2.gz QGIQMIYEVLBPFP-XSDIEEQYSA-N 2 1 314.517 4.393 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258708013 1063766679 /nfs/dbraw/zinc/76/66/79/1063766679.db2.gz QGIQMIYEVLBPFP-XSDIEEQYSA-N 2 1 314.517 4.393 20 0 DIADMP C[C@@H](Cc1cccc(Cl)c1)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001258741898 1063790088 /nfs/dbraw/zinc/79/00/88/1063790088.db2.gz PYEOYLQIMNIFBA-HNNXBMFYSA-N 2 1 320.908 4.255 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001258745020 1063794620 /nfs/dbraw/zinc/79/46/20/1063794620.db2.gz XJAUCHXRZWFRQS-CVEARBPZSA-N 2 1 308.897 4.112 20 0 DIADMP CCCC[C@@H](CCC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258759639 1063804307 /nfs/dbraw/zinc/80/43/07/1063804307.db2.gz WRCBMWKRDKZOKJ-KZNAEPCWSA-N 2 1 310.526 4.096 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC001461922095 1063804391 /nfs/dbraw/zinc/80/43/91/1063804391.db2.gz SISOILSELOGWOL-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC001461922095 1063804403 /nfs/dbraw/zinc/80/44/03/1063804403.db2.gz SISOILSELOGWOL-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922095 1063804416 /nfs/dbraw/zinc/80/44/16/1063804416.db2.gz SISOILSELOGWOL-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922095 1063804429 /nfs/dbraw/zinc/80/44/29/1063804429.db2.gz SISOILSELOGWOL-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2c(F)cc(C)cc2F)CC1 ZINC001461924575 1063808976 /nfs/dbraw/zinc/80/89/76/1063808976.db2.gz DPLIIGUDAHHJQK-UHFFFAOYSA-N 2 1 324.459 4.217 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(F)cc(C)cc2F)CC1 ZINC001461924575 1063808995 /nfs/dbraw/zinc/80/89/95/1063808995.db2.gz DPLIIGUDAHHJQK-UHFFFAOYSA-N 2 1 324.459 4.217 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258785870 1063822833 /nfs/dbraw/zinc/82/28/33/1063822833.db2.gz JNSTXIVMDFMNGE-RSPOEFSDSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258791540 1063828965 /nfs/dbraw/zinc/82/89/65/1063828965.db2.gz BYHWMGWXDGRRMW-DOTOQJQBSA-N 2 1 303.494 4.144 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258799433 1063833462 /nfs/dbraw/zinc/83/34/62/1063833462.db2.gz FDJYVLDBEBIBDZ-NVXWUHKLSA-N 2 1 303.494 4.163 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001258812856 1063843837 /nfs/dbraw/zinc/84/38/37/1063843837.db2.gz NAKYAJGEMQTZJG-LSDHHAIUSA-N 2 1 306.881 4.169 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258813277 1063844040 /nfs/dbraw/zinc/84/40/40/1063844040.db2.gz JRENUTPMHGXWRW-DSLXNQLJSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](C[C@@]2(C)CCCS2)CC1 ZINC001461966295 1063845466 /nfs/dbraw/zinc/84/54/66/1063845466.db2.gz QBJFUJULRMKQCW-IEBWSBKVSA-N 2 1 324.578 4.249 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814423 1063846252 /nfs/dbraw/zinc/84/62/52/1063846252.db2.gz OUTWLISENFFLHT-MVJPYGJCSA-N 2 1 318.480 4.476 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258825452 1063850005 /nfs/dbraw/zinc/85/00/05/1063850005.db2.gz CUXKEZDWYUWFQL-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825452 1063850020 /nfs/dbraw/zinc/85/00/20/1063850020.db2.gz CUXKEZDWYUWFQL-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825452 1063850033 /nfs/dbraw/zinc/85/00/33/1063850033.db2.gz CUXKEZDWYUWFQL-HMXCVIKNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258825451 1063850632 /nfs/dbraw/zinc/85/06/32/1063850632.db2.gz CUXKEZDWYUWFQL-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825451 1063850646 /nfs/dbraw/zinc/85/06/46/1063850646.db2.gz CUXKEZDWYUWFQL-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258825451 1063850658 /nfs/dbraw/zinc/85/06/58/1063850658.db2.gz CUXKEZDWYUWFQL-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([N@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828598 1063852741 /nfs/dbraw/zinc/85/27/41/1063852741.db2.gz OJGHNYHYQMYZJR-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)C1 ZINC001258828598 1063852760 /nfs/dbraw/zinc/85/27/60/1063852760.db2.gz OJGHNYHYQMYZJR-JXFKEZNVSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001258842477 1063862109 /nfs/dbraw/zinc/86/21/09/1063862109.db2.gz KWVUVPCYXNEXGL-RBUKOAKNSA-N 2 1 300.490 4.004 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001258842477 1063862121 /nfs/dbraw/zinc/86/21/21/1063862121.db2.gz KWVUVPCYXNEXGL-RBUKOAKNSA-N 2 1 300.490 4.004 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H](CC)Cc2ccccc2)CC1 ZINC001258852351 1063866237 /nfs/dbraw/zinc/86/62/37/1063866237.db2.gz LESJXKVKGRIDTP-IBGZPJMESA-N 2 1 302.506 4.204 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001258849990 1063868167 /nfs/dbraw/zinc/86/81/67/1063868167.db2.gz YIABLJKPXOGEPG-HXUWFJFHSA-N 2 1 302.506 4.060 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001258907287 1063878467 /nfs/dbraw/zinc/87/84/67/1063878467.db2.gz HMGVCDHWHRIBTJ-LPHOPBHVSA-N 2 1 306.469 4.473 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001462079481 1063919064 /nfs/dbraw/zinc/91/90/64/1063919064.db2.gz JKCFAMXTCNIPBM-AZUAARDMSA-N 2 1 314.517 4.089 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2ccc(F)c3ccccc23)CC1 ZINC001462093777 1063926491 /nfs/dbraw/zinc/92/64/91/1063926491.db2.gz JOMUCSVMOPAWJG-UHFFFAOYSA-N 2 1 312.432 4.039 20 0 DIADMP CCCCCC[C@@H]1CCC[C@H]1[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC001462099562 1063929204 /nfs/dbraw/zinc/92/92/04/1063929204.db2.gz QAOLNSMOCNXWTM-XUVXKRRUSA-N 2 1 324.553 4.216 20 0 DIADMP CCCCCC[C@@H]1CCC[C@H]1[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC001462099562 1063929216 /nfs/dbraw/zinc/92/92/16/1063929216.db2.gz QAOLNSMOCNXWTM-XUVXKRRUSA-N 2 1 324.553 4.216 20 0 DIADMP Cc1ccc(C)c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379635012 1063983974 /nfs/dbraw/zinc/98/39/74/1063983974.db2.gz PZTGDESPVQJSQC-UGKGYDQZSA-N 2 1 322.496 4.446 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC000379632756 1063984300 /nfs/dbraw/zinc/98/43/00/1063984300.db2.gz SSGNZPKEECAQPT-IAVZTARUSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)[C@H](C)C1 ZINC000379632756 1063984304 /nfs/dbraw/zinc/98/43/04/1063984304.db2.gz SSGNZPKEECAQPT-IAVZTARUSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H](CC[NH2+]Cc1cc(Cl)cs1)[N@H+](C)Cc1ccccc1 ZINC000379630253 1063984698 /nfs/dbraw/zinc/98/46/98/1063984698.db2.gz PHHAUJJOERKOHO-CQSZACIVSA-N 2 1 322.905 4.402 20 0 DIADMP C[C@H](CC[NH2+]Cc1cc(Cl)cs1)[N@@H+](C)Cc1ccccc1 ZINC000379630253 1063984708 /nfs/dbraw/zinc/98/47/08/1063984708.db2.gz PHHAUJJOERKOHO-CQSZACIVSA-N 2 1 322.905 4.402 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H](C)C1 ZINC000379632396 1063985380 /nfs/dbraw/zinc/98/53/80/1063985380.db2.gz NQKVKYIFRKAUTL-WRJHFWDFSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C[C@@H](C)C1 ZINC000379632396 1063985389 /nfs/dbraw/zinc/98/53/89/1063985389.db2.gz NQKVKYIFRKAUTL-WRJHFWDFSA-N 2 1 314.517 4.454 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379633479 1063985569 /nfs/dbraw/zinc/98/55/69/1063985569.db2.gz OUBQSUQFVMAFIQ-BJLQDIEVSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379633479 1063985575 /nfs/dbraw/zinc/98/55/75/1063985575.db2.gz OUBQSUQFVMAFIQ-BJLQDIEVSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379656431 1063986699 /nfs/dbraw/zinc/98/66/99/1063986699.db2.gz OZUFXCNRZOBBDH-HNJRGHQBSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379656431 1063986704 /nfs/dbraw/zinc/98/67/04/1063986704.db2.gz OZUFXCNRZOBBDH-HNJRGHQBSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H](CC[NH2+]C1CCC(C)(C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000379659029 1063987667 /nfs/dbraw/zinc/98/76/67/1063987667.db2.gz YDHFSXWTPBNYMS-KRWDZBQOSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658816 1063987820 /nfs/dbraw/zinc/98/78/20/1063987820.db2.gz XLIPMQFQJNZBOI-LMMKCTJWSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379658816 1063987829 /nfs/dbraw/zinc/98/78/29/1063987829.db2.gz XLIPMQFQJNZBOI-LMMKCTJWSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H](CC[NH2+]C1CCC(C)(C)CC1)[N@@H+](C)Cc1ccccc1 ZINC000379659030 1063988117 /nfs/dbraw/zinc/98/81/17/1063988117.db2.gz YDHFSXWTPBNYMS-QGZVFWFLSA-N 2 1 302.506 4.455 20 0 DIADMP CC1(C)CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380945860 1063988761 /nfs/dbraw/zinc/98/87/61/1063988761.db2.gz OTJMELRVBAKCPP-OALUTQOASA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000380930150 1063989091 /nfs/dbraw/zinc/98/90/91/1063989091.db2.gz FUWCCRBDMMDBOK-OAQYLSRUSA-N 2 1 308.469 4.392 20 0 DIADMP CCC[C@H](CC)[NH2+][C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000381310642 1063992955 /nfs/dbraw/zinc/99/29/55/1063992955.db2.gz NROZXSNYZUWQOG-LWYYNNOASA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612887 1064164968 /nfs/dbraw/zinc/16/49/68/1064164968.db2.gz XHXBBPNNGUUHLY-RBUKOAKNSA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612887 1064164971 /nfs/dbraw/zinc/16/49/71/1064164971.db2.gz XHXBBPNNGUUHLY-RBUKOAKNSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)C1 ZINC000390811817 1064170344 /nfs/dbraw/zinc/17/03/44/1064170344.db2.gz WHNMPOJXTWOHBH-QNDFHXLGSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]1CC([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C[C@H](C)C1 ZINC000393624578 1064290629 /nfs/dbraw/zinc/29/06/29/1064290629.db2.gz HRUXRZDJNDXZDY-OPYAIIAOSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C[C@@H](C)C1 ZINC000393624582 1064291153 /nfs/dbraw/zinc/29/11/53/1064291153.db2.gz HRUXRZDJNDXZDY-ZSXPUABSSA-N 2 1 314.517 4.313 20 0 DIADMP CCc1ccc(C[NH+]2CCC3(CC[N@H+](C4CCCC4)C3)CC2)o1 ZINC001279329916 1064344534 /nfs/dbraw/zinc/34/45/34/1064344534.db2.gz JIEAKCUUAAPOBV-UHFFFAOYSA-N 2 1 316.489 4.073 20 0 DIADMP Clc1ccc(C[N@@H+]2C[C@@H]3CC[NH+](C4CCCC4)CC[C@@H]3C2)o1 ZINC001279483800 1064351180 /nfs/dbraw/zinc/35/11/80/1064351180.db2.gz WHHLBBJLWCQKJG-GASCZTMLSA-N 2 1 322.880 4.019 20 0 DIADMP Clc1ccc(C[NH+]2C[C@@H]3CC[N@H+](C4CCCC4)CC[C@@H]3C2)o1 ZINC001279483800 1064351188 /nfs/dbraw/zinc/35/11/88/1064351188.db2.gz WHHLBBJLWCQKJG-GASCZTMLSA-N 2 1 322.880 4.019 20 0 DIADMP Clc1ccc(C[NH+]2C[C@@H]3CC[N@@H+](C4CCCC4)CC[C@@H]3C2)o1 ZINC001279483800 1064351194 /nfs/dbraw/zinc/35/11/94/1064351194.db2.gz WHHLBBJLWCQKJG-GASCZTMLSA-N 2 1 322.880 4.019 20 0 DIADMP Cc1cccc(N2CCC[C@@]3(CCC[N@@H+](C4CCCC4)C3)C2)[nH+]1 ZINC001279752226 1064367437 /nfs/dbraw/zinc/36/74/37/1064367437.db2.gz KPFAQQNYYOUWHT-HXUWFJFHSA-N 2 1 313.489 4.015 20 0 DIADMP Cc1cccc(N2CCC[C@@]3(CCC[N@H+](C4CCCC4)C3)C2)[nH+]1 ZINC001279752226 1064367456 /nfs/dbraw/zinc/36/74/56/1064367456.db2.gz KPFAQQNYYOUWHT-HXUWFJFHSA-N 2 1 313.489 4.015 20 0 DIADMP FC(F)(F)CCC[N@@H+]1CC[C@@]2(C1)CCC[NH+](C1CCCC1)C2 ZINC001280179332 1064384366 /nfs/dbraw/zinc/38/43/66/1064384366.db2.gz HRRAVURMULCPBW-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[N@H+]1CC[C@@]2(C1)CCC[NH+](C1CCCC1)C2 ZINC001280179332 1064384379 /nfs/dbraw/zinc/38/43/79/1064384379.db2.gz HRRAVURMULCPBW-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CC[C@@]2(C1)CCC[N@@H+](C1CCCC1)C2 ZINC001280179332 1064384390 /nfs/dbraw/zinc/38/43/90/1064384390.db2.gz HRRAVURMULCPBW-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP FC(F)(F)CCC[NH+]1CC[C@@]2(C1)CCC[N@H+](C1CCCC1)C2 ZINC001280179332 1064384403 /nfs/dbraw/zinc/38/44/03/1064384403.db2.gz HRRAVURMULCPBW-MRXNPFEDSA-N 2 1 318.427 4.059 20 0 DIADMP c1ccc(CCCC[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000643458366 1064411980 /nfs/dbraw/zinc/41/19/80/1064411980.db2.gz QVVAOWFAMZOOPO-RTWAWAEBSA-N 2 1 308.469 4.092 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@H]1Cc1ccccc1Cl ZINC001307431214 1065391986 /nfs/dbraw/zinc/39/19/86/1065391986.db2.gz GOPTUMQGZCTTIJ-KRWDZBQOSA-N 2 1 308.897 4.079 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@H]1Cc1ccccc1Cl ZINC001307431214 1065391991 /nfs/dbraw/zinc/39/19/91/1065391991.db2.gz GOPTUMQGZCTTIJ-KRWDZBQOSA-N 2 1 308.897 4.079 20 0 DIADMP CC[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC001307434700 1065394937 /nfs/dbraw/zinc/39/49/37/1065394937.db2.gz XTCKEDGJUNZOCR-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC001307434700 1065394946 /nfs/dbraw/zinc/39/49/46/1065394946.db2.gz XTCKEDGJUNZOCR-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC001307434700 1065394956 /nfs/dbraw/zinc/39/49/56/1065394956.db2.gz XTCKEDGJUNZOCR-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP c1ccc2c(c1)CC[C@H]2[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001307455203 1065411448 /nfs/dbraw/zinc/41/14/48/1065411448.db2.gz HNWIWFYJPBJTQB-WIYYLYMNSA-N 2 1 312.501 4.262 20 0 DIADMP C[N@@H+](CCCC1CCCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001307495820 1065439040 /nfs/dbraw/zinc/43/90/40/1065439040.db2.gz GWEWAAISAYXGNW-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCCC1CCCC1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001307495820 1065439051 /nfs/dbraw/zinc/43/90/51/1065439051.db2.gz GWEWAAISAYXGNW-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](CCCC1CCCC1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001307495820 1065439058 /nfs/dbraw/zinc/43/90/58/1065439058.db2.gz GWEWAAISAYXGNW-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CC(C)C[C@@H](C)C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001307496415 1065440351 /nfs/dbraw/zinc/44/03/51/1065440351.db2.gz LMQVIDDPLUUGSA-UYAOXDASSA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001307496415 1065440360 /nfs/dbraw/zinc/44/03/60/1065440360.db2.gz LMQVIDDPLUUGSA-UYAOXDASSA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001307496415 1065440367 /nfs/dbraw/zinc/44/03/67/1065440367.db2.gz LMQVIDDPLUUGSA-UYAOXDASSA-N 2 1 302.506 4.123 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)CC1 ZINC001307514298 1065453261 /nfs/dbraw/zinc/45/32/61/1065453261.db2.gz BFYLVXNKBVXOLO-IBGZPJMESA-N 2 1 322.537 4.065 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC001307516617 1065455380 /nfs/dbraw/zinc/45/53/80/1065455380.db2.gz KGBGRFNLTMDQRE-PKOBYXMFSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC001307516617 1065455386 /nfs/dbraw/zinc/45/53/86/1065455386.db2.gz KGBGRFNLTMDQRE-PKOBYXMFSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)c1 ZINC001307516617 1065455391 /nfs/dbraw/zinc/45/53/91/1065455391.db2.gz KGBGRFNLTMDQRE-PKOBYXMFSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@H+](C)[C@@H]2CC[NH+](C)[C@@H](C)C2)c1 ZINC001307516617 1065455395 /nfs/dbraw/zinc/45/53/95/1065455395.db2.gz KGBGRFNLTMDQRE-PKOBYXMFSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC001307516615 1065456040 /nfs/dbraw/zinc/45/60/40/1065456040.db2.gz KGBGRFNLTMDQRE-IEBWSBKVSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC001307516615 1065456046 /nfs/dbraw/zinc/45/60/46/1065456046.db2.gz KGBGRFNLTMDQRE-IEBWSBKVSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c1 ZINC001307516615 1065456053 /nfs/dbraw/zinc/45/60/53/1065456053.db2.gz KGBGRFNLTMDQRE-IEBWSBKVSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c1 ZINC001307516615 1065456064 /nfs/dbraw/zinc/45/60/64/1065456064.db2.gz KGBGRFNLTMDQRE-IEBWSBKVSA-N 2 1 310.485 4.371 20 0 DIADMP CC(C)=CCC[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001307514930 1065456186 /nfs/dbraw/zinc/45/61/86/1065456186.db2.gz QLYJNQBEEPXSHO-NRFANRHFSA-N 2 1 312.501 4.331 20 0 DIADMP CC1CC(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC001307523671 1065463077 /nfs/dbraw/zinc/46/30/77/1065463077.db2.gz BCPNKJFTSNWWQY-NLDTVIPQSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3Cc3ccccc3)C2)C1 ZINC001307523671 1065463089 /nfs/dbraw/zinc/46/30/89/1065463089.db2.gz BCPNKJFTSNWWQY-NLDTVIPQSA-N 2 1 312.501 4.019 20 0 DIADMP CC1CC(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)C1 ZINC001307523671 1065463101 /nfs/dbraw/zinc/46/31/01/1065463101.db2.gz BCPNKJFTSNWWQY-NLDTVIPQSA-N 2 1 312.501 4.019 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@H]1CCCc1ccccc1 ZINC001307601774 1065510000 /nfs/dbraw/zinc/51/00/00/1065510000.db2.gz ABVWBSZXSVSNOI-RTWAWAEBSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@H]1CCCc1ccccc1 ZINC001307601774 1065510018 /nfs/dbraw/zinc/51/00/18/1065510018.db2.gz ABVWBSZXSVSNOI-RTWAWAEBSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@H]1CCCc1ccccc1 ZINC001307601774 1065510032 /nfs/dbraw/zinc/51/00/32/1065510032.db2.gz ABVWBSZXSVSNOI-RTWAWAEBSA-N 2 1 314.517 4.348 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC001307628308 1065527285 /nfs/dbraw/zinc/52/72/85/1065527285.db2.gz HERCSQBENOXXCE-ZWKOTPCHSA-N 2 1 306.881 4.255 20 0 DIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCC[C@H](C3CC3)C2)c1 ZINC001307812109 1065634156 /nfs/dbraw/zinc/63/41/56/1065634156.db2.gz FRURDFKSWVISFQ-NRFANRHFSA-N 2 1 312.501 4.295 20 0 DIADMP CC(C)(C[NH+]1CCCC1)[NH2+]CCCCc1cccc(Cl)c1 ZINC001307848507 1065650469 /nfs/dbraw/zinc/65/04/69/1065650469.db2.gz FQQOPLMJVBLBIZ-UHFFFAOYSA-N 2 1 308.897 4.127 20 0 DIADMP C[N@@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)C(C)(C)C ZINC001307867916 1065660367 /nfs/dbraw/zinc/66/03/67/1065660367.db2.gz IIAXPBWRJWWOHB-UHFFFAOYSA-N 2 1 302.506 4.062 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H]([C@@H]2CCCC2(C)C)C1 ZINC001307867092 1065660501 /nfs/dbraw/zinc/66/05/01/1065660501.db2.gz FAJJUNWNJWTEKZ-ROUUACIJSA-N 2 1 303.494 4.120 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H]([C@@H]2CCCC2(C)C)C1 ZINC001307867092 1065660508 /nfs/dbraw/zinc/66/05/08/1065660508.db2.gz FAJJUNWNJWTEKZ-ROUUACIJSA-N 2 1 303.494 4.120 20 0 DIADMP Cc1ccc(C[N@@H+](CCCc2c[nH+]cn2C)CC(C)C)c(C)c1 ZINC001307869793 1065662921 /nfs/dbraw/zinc/66/29/21/1065662921.db2.gz IEBFHIRYPGBQCQ-UHFFFAOYSA-N 2 1 313.489 4.128 20 0 DIADMP Cc1ccc(C[N@H+](CCCc2c[nH+]cn2C)CC(C)C)c(C)c1 ZINC001307869793 1065662929 /nfs/dbraw/zinc/66/29/29/1065662929.db2.gz IEBFHIRYPGBQCQ-UHFFFAOYSA-N 2 1 313.489 4.128 20 0 DIADMP CCCC[N@H+](Cc1ccncc1F)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001307968220 1065704280 /nfs/dbraw/zinc/70/42/80/1065704280.db2.gz UVFFYOGCAIAMTD-UHFFFAOYSA-N 2 1 321.484 4.132 20 0 DIADMP CCCC[N@@H+](Cc1ccncc1F)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001307968220 1065704290 /nfs/dbraw/zinc/70/42/90/1065704290.db2.gz UVFFYOGCAIAMTD-UHFFFAOYSA-N 2 1 321.484 4.132 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001308041290 1065738495 /nfs/dbraw/zinc/73/84/95/1065738495.db2.gz YVICOZTXSVLKGD-IBGZPJMESA-N 2 1 306.469 4.475 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CC[C@H](c2ccc(Cl)cc2)C1(C)C ZINC001308098787 1065761989 /nfs/dbraw/zinc/76/19/89/1065761989.db2.gz RNPDGXGMCUJVAL-ZWKOTPCHSA-N 2 1 320.908 4.392 20 0 DIADMP CC1=CCC[C@@H](C)[C@H]1C[NH2+]CCC[N@@H+](C)Cc1ccccc1 ZINC001308187091 1065797579 /nfs/dbraw/zinc/79/75/79/1065797579.db2.gz QNJWAZCZQVYTAN-QUCCMNQESA-N 2 1 300.490 4.091 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC001308198796 1065805980 /nfs/dbraw/zinc/80/59/80/1065805980.db2.gz CMICIKVXHSYGPS-HLIPFELVSA-N 2 1 300.490 4.197 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC001308199279 1065806980 /nfs/dbraw/zinc/80/69/80/1065806980.db2.gz JEJVUWRYSYQMEL-HLIPFELVSA-N 2 1 300.490 4.339 20 0 DIADMP Cc1ccc(C)c(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001308204378 1065811712 /nfs/dbraw/zinc/81/17/12/1065811712.db2.gz SBSVTHZTFLSUTN-HDICACEKSA-N 2 1 302.506 4.151 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)CC1 ZINC001308206400 1065815021 /nfs/dbraw/zinc/81/50/21/1065815021.db2.gz XYXNUFLIQSNGFR-YRISNDGFSA-N 2 1 314.517 4.374 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+]C[C@@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001308208948 1065816641 /nfs/dbraw/zinc/81/66/41/1065816641.db2.gz JLZJUXTXHUHLMA-PKOBYXMFSA-N 2 1 316.533 4.094 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)C1 ZINC001308225216 1065830797 /nfs/dbraw/zinc/83/07/97/1065830797.db2.gz OHOVEAMLBNWPSN-IZZBFERCSA-N 2 1 314.517 4.280 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2C[C@H](C)C[C@H](c3ccccc3)C2)C1 ZINC001308225219 1065831435 /nfs/dbraw/zinc/83/14/35/1065831435.db2.gz OHOVEAMLBNWPSN-RMVXJAJNSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CC[N@H+](C)C1CCCCC1 ZINC001308229230 1065835982 /nfs/dbraw/zinc/83/59/82/1065835982.db2.gz XKASGIXZVNIKFC-GOSISDBHSA-N 2 1 302.506 4.109 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]CC[N@@H+](C)C1CCCCC1 ZINC001308229230 1065835991 /nfs/dbraw/zinc/83/59/91/1065835991.db2.gz XKASGIXZVNIKFC-GOSISDBHSA-N 2 1 302.506 4.109 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)c2cccc(Cl)c2)CC1(C)C ZINC001308231222 1065839599 /nfs/dbraw/zinc/83/95/99/1065839599.db2.gz IHSGYSIXFLBZEO-MRXNPFEDSA-N 2 1 308.897 4.080 20 0 DIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H]2CCC[C@H]2C)CCCC1)c1ccccc1 ZINC001308278587 1065878783 /nfs/dbraw/zinc/87/87/83/1065878783.db2.gz DOCNEVGLKIIFDQ-ZIFCJYIRSA-N 2 1 300.490 4.428 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc1 ZINC001308283015 1065880808 /nfs/dbraw/zinc/88/08/08/1065880808.db2.gz QVXCVPLRIFOERQ-PKOBYXMFSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc1 ZINC001308283015 1065880818 /nfs/dbraw/zinc/88/08/18/1065880818.db2.gz QVXCVPLRIFOERQ-PKOBYXMFSA-N 2 1 314.498 4.229 20 0 DIADMP CC(C)CCC[NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001308333374 1065920154 /nfs/dbraw/zinc/92/01/54/1065920154.db2.gz LJPQCQBXJLWGRZ-QUCCMNQESA-N 2 1 302.506 4.313 20 0 DIADMP Cc1scc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1C ZINC001308367312 1065945076 /nfs/dbraw/zinc/94/50/76/1065945076.db2.gz DVSPLPMBMHZURO-GOEBONIOSA-N 2 1 306.519 4.108 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382705 1065953482 /nfs/dbraw/zinc/95/34/82/1065953482.db2.gz RCOBNTKCXCMGJW-RLLQIKCJSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382705 1065953492 /nfs/dbraw/zinc/95/34/92/1065953492.db2.gz RCOBNTKCXCMGJW-RLLQIKCJSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382704 1065954064 /nfs/dbraw/zinc/95/40/64/1065954064.db2.gz RCOBNTKCXCMGJW-MISYRCLQSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308382704 1065954068 /nfs/dbraw/zinc/95/40/68/1065954068.db2.gz RCOBNTKCXCMGJW-MISYRCLQSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]CC[C@H]3CCC[N@H+](C)C3)o2)cc1 ZINC001308433304 1065984489 /nfs/dbraw/zinc/98/44/89/1065984489.db2.gz USKXLKQAYRZTKW-QGZVFWFLSA-N 2 1 312.457 4.077 20 0 DIADMP CC(C)C1CCC([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)CC1 ZINC001308444238 1065992438 /nfs/dbraw/zinc/99/24/38/1065992438.db2.gz IMRIPUXQRDUMTP-WDQDQHCCSA-N 2 1 314.517 4.136 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1(CC2CC2)CC1 ZINC001308504864 1066033817 /nfs/dbraw/zinc/03/38/17/1066033817.db2.gz PIJRJSLAHNOFPE-UHFFFAOYSA-N 2 1 314.517 4.315 20 0 DIADMP CCCCC1([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001308546655 1066060478 /nfs/dbraw/zinc/06/04/78/1066060478.db2.gz UGLNNXIPLNMCFL-MJGOQNOKSA-N 2 1 300.490 4.352 20 0 DIADMP CCCCC1([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001308546655 1066060491 /nfs/dbraw/zinc/06/04/91/1066060491.db2.gz UGLNNXIPLNMCFL-MJGOQNOKSA-N 2 1 300.490 4.352 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)CC1CC[NH+](CC)CC1 ZINC001308565634 1066076331 /nfs/dbraw/zinc/07/63/31/1066076331.db2.gz TVIIBUVPXWNMAI-NRFANRHFSA-N 2 1 316.533 4.370 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)s1 ZINC001308576058 1066089970 /nfs/dbraw/zinc/08/99/70/1066089970.db2.gz YJKMXAOOFVWKDU-BEFAXECRSA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC001308576058 1066089977 /nfs/dbraw/zinc/08/99/77/1066089977.db2.gz YJKMXAOOFVWKDU-BEFAXECRSA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)s1 ZINC001308576058 1066089984 /nfs/dbraw/zinc/08/99/84/1066089984.db2.gz YJKMXAOOFVWKDU-BEFAXECRSA-N 2 1 318.530 4.149 20 0 DIADMP CC(C)[C@H](C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1)c1ccccc1 ZINC001308597511 1066109005 /nfs/dbraw/zinc/10/90/05/1066109005.db2.gz CHGHOZBUFBGCKH-CTNGQTDRSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@H](C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597511 1066109008 /nfs/dbraw/zinc/10/90/08/1066109008.db2.gz CHGHOZBUFBGCKH-CTNGQTDRSA-N 2 1 314.517 4.090 20 0 DIADMP CC(C)[C@H](C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1)c1ccccc1 ZINC001308597511 1066109012 /nfs/dbraw/zinc/10/90/12/1066109012.db2.gz CHGHOZBUFBGCKH-CTNGQTDRSA-N 2 1 314.517 4.090 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc(C)c2F)CC1 ZINC001308605114 1066113425 /nfs/dbraw/zinc/11/34/25/1066113425.db2.gz FIXVDAMPQSYSHO-UHFFFAOYSA-N 2 1 306.469 4.078 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001308610233 1066116256 /nfs/dbraw/zinc/11/62/56/1066116256.db2.gz IPGPXLRGHSTLRQ-GOSISDBHSA-N 2 1 320.908 4.407 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001308610233 1066116262 /nfs/dbraw/zinc/11/62/62/1066116262.db2.gz IPGPXLRGHSTLRQ-GOSISDBHSA-N 2 1 320.908 4.407 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](Cc2ccco2)Cc2cccs2)CC1 ZINC001308658809 1066140454 /nfs/dbraw/zinc/14/04/54/1066140454.db2.gz DIZLCJPDJYSYJH-UHFFFAOYSA-N 2 1 318.486 4.075 20 0 DIADMP C[C@H]([NH2+]Cc1coc2ccccc12)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001308681811 1066154113 /nfs/dbraw/zinc/15/41/13/1066154113.db2.gz XFAAPSGKQOIGQB-HOTGVXAUSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@H]([NH2+]Cc1coc2ccccc12)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001308681813 1066154246 /nfs/dbraw/zinc/15/42/46/1066154246.db2.gz XFAAPSGKQOIGQB-JKSUJKDBSA-N 2 1 312.457 4.175 20 0 DIADMP c1ccc([C@@H]2C[C@@H]2C[NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001308720960 1066199083 /nfs/dbraw/zinc/19/90/83/1066199083.db2.gz AGOMLVGBWCPNFO-NRSPTQNISA-N 2 1 312.501 4.177 20 0 DIADMP CCCC[C@H](C)[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308730574 1066206548 /nfs/dbraw/zinc/20/65/48/1066206548.db2.gz UTOSVACEXKKQRK-CMKODMSKSA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1 ZINC001308744806 1066217740 /nfs/dbraw/zinc/21/77/40/1066217740.db2.gz YOYVNKAMGHGYQZ-OAQYLSRUSA-N 2 1 314.517 4.016 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1cc2c(cccc2C)[nH]1 ZINC001308744963 1066217818 /nfs/dbraw/zinc/21/78/18/1066217818.db2.gz MFRLWFHQIPVNJD-UHFFFAOYSA-N 2 1 301.478 4.030 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1cc2c(cccc2C)[nH]1 ZINC001308744963 1066217835 /nfs/dbraw/zinc/21/78/35/1066217835.db2.gz MFRLWFHQIPVNJD-UHFFFAOYSA-N 2 1 301.478 4.030 20 0 DIADMP CCC1C[NH+](C[C@]2(C(C)(C)C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001308804815 1066281657 /nfs/dbraw/zinc/28/16/57/1066281657.db2.gz WKPIBZKXOOLZAJ-NRFANRHFSA-N 2 1 314.517 4.267 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CCC[N@H+](C)CC(C)C)cc1 ZINC001308847613 1066322232 /nfs/dbraw/zinc/32/22/32/1066322232.db2.gz LLMOYEBKMVXULX-VQTJNVASSA-N 2 1 302.506 4.199 20 0 DIADMP Cc1ccc([C@H]2CCC[C@H]2[NH2+]CCC[N@H+](C)CC(C)C)cc1 ZINC001308847614 1066323464 /nfs/dbraw/zinc/32/34/64/1066323464.db2.gz LLMOYEBKMVXULX-WOJBJXKFSA-N 2 1 302.506 4.199 20 0 DIADMP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1C[C@@H](C)c1cc(F)cc(F)c1 ZINC001308882871 1066362986 /nfs/dbraw/zinc/36/29/86/1066362986.db2.gz SGRJSRMUBUEBSD-SPYBWZPUSA-N 2 1 324.459 4.121 20 0 DIADMP C([NH2+][C@H]1CCCCC12CCCC2)[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308884345 1066364769 /nfs/dbraw/zinc/36/47/69/1066364769.db2.gz PZFJEUJSKGZOGC-OALUTQOASA-N 2 1 304.522 4.201 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1CCN(c2cc[nH+]cc2)[C@@H](C)C1 ZINC001308920104 1066398970 /nfs/dbraw/zinc/39/89/70/1066398970.db2.gz ZJXDFJGOBGTCMB-MSOLQXFVSA-N 2 1 315.505 4.199 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]C3CCC=CCC3)CC[N@H+]2C2CC2)cc1 ZINC001308944230 1066410922 /nfs/dbraw/zinc/41/09/22/1066410922.db2.gz RETGQVOMVPOJMO-CTNGQTDRSA-N 2 1 310.485 4.443 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]C3CCC=CCC3)CC[N@@H+]2C2CC2)cc1 ZINC001308944230 1066410932 /nfs/dbraw/zinc/41/09/32/1066410932.db2.gz RETGQVOMVPOJMO-CTNGQTDRSA-N 2 1 310.485 4.443 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCC[C@H]3C3CCCCC3)[C@@H]2C1 ZINC001308985101 1066432915 /nfs/dbraw/zinc/43/29/15/1066432915.db2.gz SDBJXUGGPFZARB-OMZCGLGVSA-N 2 1 304.522 4.055 20 0 DIADMP CC[NH+]1CCC(CNc2cc[nH+]c3cc(Cl)ccc23)CC1 ZINC000003622079 181042228 /nfs/dbraw/zinc/04/22/28/181042228.db2.gz KDBQSRLUZVCNAS-UHFFFAOYSA-N 2 1 303.837 4.032 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000005096987 181203250 /nfs/dbraw/zinc/20/32/50/181203250.db2.gz BJAKZXSZGVRNPU-CYBMUJFWSA-N 2 1 315.288 4.348 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000005096987 181203251 /nfs/dbraw/zinc/20/32/51/181203251.db2.gz BJAKZXSZGVRNPU-CYBMUJFWSA-N 2 1 315.288 4.348 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000274927695 130275340 /nfs/dbraw/zinc/27/53/40/130275340.db2.gz QDXRQFYLVCTKKQ-WMQCIHAUSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)cn1 ZINC000274930783 130275561 /nfs/dbraw/zinc/27/55/61/130275561.db2.gz QTPNQWXFZNFNHX-HUUCEWRRSA-N 2 1 309.885 4.040 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1Cl ZINC000284550907 131091810 /nfs/dbraw/zinc/09/18/10/131091810.db2.gz XXLYVTVNOQATRH-AWEZNQCLSA-N 2 1 322.880 4.040 20 0 DIADMP Cc1ccnc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000286011528 131214926 /nfs/dbraw/zinc/21/49/26/131214926.db2.gz JGNWCQFPTRJSQR-QGZVFWFLSA-N 2 1 311.473 4.081 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000289222919 131366825 /nfs/dbraw/zinc/36/68/25/131366825.db2.gz LJGKTEYQRRUKEQ-LJQANCHMSA-N 2 1 322.456 4.120 20 0 DIADMP FC1(F)CCCC[C@@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000294352221 131826403 /nfs/dbraw/zinc/82/64/03/131826403.db2.gz ZGGYGHDBFHYOER-QGZVFWFLSA-N 2 1 322.443 4.066 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCCC(C)(F)F)CC1 ZINC000297206188 132003983 /nfs/dbraw/zinc/00/39/83/132003983.db2.gz GIASNPZFOZSARM-UHFFFAOYSA-N 2 1 324.459 4.455 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)c2ccccc21 ZINC000298324173 132056687 /nfs/dbraw/zinc/05/66/87/132056687.db2.gz IMHSMPNUEXVTGP-ZDUSSCGKSA-N 2 1 313.832 4.120 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1nccc2ccccc21 ZINC000558506364 331914510 /nfs/dbraw/zinc/91/45/10/331914510.db2.gz ZIGYWOYIHJNAAG-DLBZAZTESA-N 2 1 311.473 4.150 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000559273242 332011904 /nfs/dbraw/zinc/01/19/04/332011904.db2.gz KVTLCIRRUPWJOF-DOTOQJQBSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1sccc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000559273242 332011905 /nfs/dbraw/zinc/01/19/05/332011905.db2.gz KVTLCIRRUPWJOF-DOTOQJQBSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000559295253 332018459 /nfs/dbraw/zinc/01/84/59/332018459.db2.gz VAGWXJZOHCSHBG-NVXWUHKLSA-N 2 1 320.908 4.391 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2ccccc2F)CC1 ZINC000520044086 332032092 /nfs/dbraw/zinc/03/20/92/332032092.db2.gz OGBVZAVIIURGHZ-MRXNPFEDSA-N 2 1 306.469 4.331 20 0 DIADMP CCc1ccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C(C)C)cc1 ZINC000409447392 332032838 /nfs/dbraw/zinc/03/28/38/332032838.db2.gz GYXWQMUNNHDWMY-HXUWFJFHSA-N 2 1 300.490 4.163 20 0 DIADMP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770622 332142163 /nfs/dbraw/zinc/14/21/63/332142163.db2.gz MKKUAAYLEOPROP-MRXNPFEDSA-N 2 1 314.498 4.189 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770622 332142165 /nfs/dbraw/zinc/14/21/65/332142165.db2.gz MKKUAAYLEOPROP-MRXNPFEDSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770622 332142167 /nfs/dbraw/zinc/14/21/67/332142167.db2.gz MKKUAAYLEOPROP-MRXNPFEDSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000093770622 332142169 /nfs/dbraw/zinc/14/21/69/332142169.db2.gz MKKUAAYLEOPROP-MRXNPFEDSA-N 2 1 314.498 4.189 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc21 ZINC000448028897 332201307 /nfs/dbraw/zinc/20/13/07/332201307.db2.gz PIDMDSPQWFXCSJ-NTLWEQJWSA-N 2 1 312.501 4.130 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc21 ZINC000448028898 332201499 /nfs/dbraw/zinc/20/14/99/332201499.db2.gz PIDMDSPQWFXCSJ-NYUBLWNDSA-N 2 1 312.501 4.130 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000536476433 332250820 /nfs/dbraw/zinc/25/08/20/332250820.db2.gz QGQYZLMLYXKNSH-KRWDZBQOSA-N 2 1 303.425 4.098 20 0 DIADMP Cc1nccn1CCC[N@H+]1CCCC[C@H]1CCc1ccccc1 ZINC000536484710 332251535 /nfs/dbraw/zinc/25/15/35/332251535.db2.gz HEMDGFOFYQQYGZ-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@H]1CCc1ccccc1 ZINC000536484710 332251536 /nfs/dbraw/zinc/25/15/36/332251536.db2.gz HEMDGFOFYQQYGZ-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@H]1CCc1ccccc1 ZINC000536484710 332251537 /nfs/dbraw/zinc/25/15/37/332251537.db2.gz HEMDGFOFYQQYGZ-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000559741917 332278260 /nfs/dbraw/zinc/27/82/60/332278260.db2.gz XFGWEKVAYVWWEO-LDQXTDLNSA-N 2 1 324.468 4.181 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000559741917 332278262 /nfs/dbraw/zinc/27/82/62/332278262.db2.gz XFGWEKVAYVWWEO-LDQXTDLNSA-N 2 1 324.468 4.181 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000559741920 332278290 /nfs/dbraw/zinc/27/82/90/332278290.db2.gz XFGWEKVAYVWWEO-SCWSEQNSSA-N 2 1 324.468 4.181 20 0 DIADMP COc1cccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000559741920 332278292 /nfs/dbraw/zinc/27/82/92/332278292.db2.gz XFGWEKVAYVWWEO-SCWSEQNSSA-N 2 1 324.468 4.181 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(F)c2ccccc21 ZINC000559740342 332278344 /nfs/dbraw/zinc/27/83/44/332278344.db2.gz OJEBHKTWBDNSEI-HUUCEWRRSA-N 2 1 312.432 4.114 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000559744072 332278560 /nfs/dbraw/zinc/27/85/60/332278560.db2.gz VCIMETOGZABZPT-ILWGZMRPSA-N 2 1 320.480 4.407 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000559744072 332278562 /nfs/dbraw/zinc/27/85/62/332278562.db2.gz VCIMETOGZABZPT-ILWGZMRPSA-N 2 1 320.480 4.407 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000559767083 332280213 /nfs/dbraw/zinc/28/02/13/332280213.db2.gz PBECISNODSINGW-MANSERQUSA-N 2 1 318.530 4.086 20 0 DIADMP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C1 ZINC000559767083 332280214 /nfs/dbraw/zinc/28/02/14/332280214.db2.gz PBECISNODSINGW-MANSERQUSA-N 2 1 318.530 4.086 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2(C)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000559794460 332282251 /nfs/dbraw/zinc/28/22/51/332282251.db2.gz XLSCFJUSXULQAR-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2(C)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000559794460 332282252 /nfs/dbraw/zinc/28/22/52/332282252.db2.gz XLSCFJUSXULQAR-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794460 332282254 /nfs/dbraw/zinc/28/22/54/332282254.db2.gz XLSCFJUSXULQAR-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794460 332282256 /nfs/dbraw/zinc/28/22/56/332282256.db2.gz XLSCFJUSXULQAR-IEBWSBKVSA-N 2 1 300.490 4.162 20 0 DIADMP c1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000564959099 332296543 /nfs/dbraw/zinc/29/65/43/332296543.db2.gz NPALIUCIPDYWEX-GOSISDBHSA-N 2 1 312.482 4.035 20 0 DIADMP c1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cs1 ZINC000564959099 332296545 /nfs/dbraw/zinc/29/65/45/332296545.db2.gz NPALIUCIPDYWEX-GOSISDBHSA-N 2 1 312.482 4.035 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000442775992 335101039 /nfs/dbraw/zinc/10/10/39/335101039.db2.gz HBXORUMEOWQWRN-AWEZNQCLSA-N 2 1 304.503 4.076 20 0 DIADMP CSCCCC[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000560525875 332351127 /nfs/dbraw/zinc/35/11/27/332351127.db2.gz BOJLJFCDWFKRKZ-UHFFFAOYSA-N 2 1 320.546 4.162 20 0 DIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000560579486 332364114 /nfs/dbraw/zinc/36/41/14/332364114.db2.gz ABHYXGQQHGZHFU-WBAXXEDZSA-N 2 1 308.897 4.152 20 0 DIADMP C[C@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000574581010 332394916 /nfs/dbraw/zinc/39/49/16/332394916.db2.gz LYEXJGNYPZAVOB-STQMWFEESA-N 2 1 320.889 4.380 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526055577 333051822 /nfs/dbraw/zinc/05/18/22/333051822.db2.gz HIDDYIOIVGRRQI-OSJSJHBBSA-N 2 1 306.881 4.017 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526055577 333051823 /nfs/dbraw/zinc/05/18/23/333051823.db2.gz HIDDYIOIVGRRQI-OSJSJHBBSA-N 2 1 306.881 4.017 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000378902532 333061858 /nfs/dbraw/zinc/06/18/58/333061858.db2.gz XPWMONWWBJSRPU-ZCNNSNEGSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c(F)cccc2F)c1 ZINC000065976630 335119981 /nfs/dbraw/zinc/11/99/81/335119981.db2.gz HFUBULLSAQVHGK-UHFFFAOYSA-N 2 1 318.411 4.095 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2c(F)cccc2F)c1 ZINC000065976630 335119983 /nfs/dbraw/zinc/11/99/83/335119983.db2.gz HFUBULLSAQVHGK-UHFFFAOYSA-N 2 1 318.411 4.095 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000314082534 333086205 /nfs/dbraw/zinc/08/62/05/333086205.db2.gz DQYKLGXPFXITEV-SFHVURJKSA-N 2 1 306.881 4.254 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CCN(c2cc(C)c3ccc(C)cc3[nH+]2)C1 ZINC000460958002 333105890 /nfs/dbraw/zinc/10/58/90/333105890.db2.gz OBYWVCBRPQWDQF-KRWDZBQOSA-N 2 1 311.473 4.020 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CCN(c2cc(C)c3ccc(C)cc3[nH+]2)C1 ZINC000460958002 333105892 /nfs/dbraw/zinc/10/58/92/333105892.db2.gz OBYWVCBRPQWDQF-KRWDZBQOSA-N 2 1 311.473 4.020 20 0 DIADMP CC1(C)CCC([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000462776155 333110869 /nfs/dbraw/zinc/11/08/69/333110869.db2.gz REURBSCDLMDQAQ-IBGZPJMESA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000582130298 333132373 /nfs/dbraw/zinc/13/23/73/333132373.db2.gz YWPBBSSQMKZMJR-CQSZACIVSA-N 2 1 317.864 4.232 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](CCCc1c[nH+]cn1C)C1CC1 ZINC000582130298 333132374 /nfs/dbraw/zinc/13/23/74/333132374.db2.gz YWPBBSSQMKZMJR-CQSZACIVSA-N 2 1 317.864 4.232 20 0 DIADMP CC(C)c1ccc(C[C@H]2CC[NH+](CC[C@@H]3CCC[N@H+]3C)C2)cc1 ZINC000460985999 333177975 /nfs/dbraw/zinc/17/79/75/333177975.db2.gz YZOBISKPSQUIGN-CTNGQTDRSA-N 2 1 314.517 4.159 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCC3)[C@H]1c1cccs1 ZINC000502465325 333298161 /nfs/dbraw/zinc/29/81/61/333298161.db2.gz VBICHGKDLHZANO-PVAVHDDUSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCC3)[C@H]1c1cccs1 ZINC000502465325 333298162 /nfs/dbraw/zinc/29/81/62/333298162.db2.gz VBICHGKDLHZANO-PVAVHDDUSA-N 2 1 304.503 4.053 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497834948 333298626 /nfs/dbraw/zinc/29/86/26/333298626.db2.gz AZLQIFFBDUNNMR-OXJNMPFZSA-N 2 1 316.464 4.083 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cn1 ZINC000497851907 333301652 /nfs/dbraw/zinc/30/16/52/333301652.db2.gz HPSLGVMAFIIPRM-VQIMIIECSA-N 2 1 321.484 4.020 20 0 DIADMP CC(C)[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(F)cn1 ZINC000497853653 333301910 /nfs/dbraw/zinc/30/19/10/333301910.db2.gz QRKNICYFSJQMHD-IBGZPJMESA-N 2 1 321.484 4.162 20 0 DIADMP CC(C)[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(F)cn1 ZINC000497853653 333301911 /nfs/dbraw/zinc/30/19/11/333301911.db2.gz QRKNICYFSJQMHD-IBGZPJMESA-N 2 1 321.484 4.162 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594280 333305100 /nfs/dbraw/zinc/30/51/00/333305100.db2.gz GYHBWWKNHHTOSM-NEWSRXKRSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390594280 333305101 /nfs/dbraw/zinc/30/51/01/333305101.db2.gz GYHBWWKNHHTOSM-NEWSRXKRSA-N 2 1 300.490 4.065 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCCCC1 ZINC000390625117 333307684 /nfs/dbraw/zinc/30/76/84/333307684.db2.gz HVSWPVOUQMLILS-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCCCC1 ZINC000390625117 333307686 /nfs/dbraw/zinc/30/76/86/333307686.db2.gz HVSWPVOUQMLILS-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP Cc1cc(C)c(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1C ZINC000390638343 333308652 /nfs/dbraw/zinc/30/86/52/333308652.db2.gz HOFJICYNWIXHCE-UHFFFAOYSA-N 2 1 322.496 4.366 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744238 333322777 /nfs/dbraw/zinc/32/27/77/333322777.db2.gz OPZOMDAFODOUSB-QUCCMNQESA-N 2 1 308.469 4.168 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000020556178 333323175 /nfs/dbraw/zinc/32/31/75/333323175.db2.gz XYWQFSOCWFFUQH-ZDUSSCGKSA-N 2 1 302.384 4.088 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000390756995 333324313 /nfs/dbraw/zinc/32/43/13/333324313.db2.gz WXEQOQRNQNMWFQ-ICSRJNTNSA-N 2 1 308.469 4.168 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccc(Cl)cc2)C[C@H]1C ZINC000531378786 333347370 /nfs/dbraw/zinc/34/73/70/333347370.db2.gz YTDKGTMGQQEUSL-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccc(Cl)cc2)C[C@H]1C ZINC000531378786 333347372 /nfs/dbraw/zinc/34/73/72/333347372.db2.gz YTDKGTMGQQEUSL-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccc(Cl)cc2)C[C@H]1C ZINC000531378786 333347374 /nfs/dbraw/zinc/34/73/74/333347374.db2.gz YTDKGTMGQQEUSL-QAPCUYQASA-N 2 1 308.897 4.077 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390788144 333393411 /nfs/dbraw/zinc/39/34/11/333393411.db2.gz ACNPIMCSRAGFMW-RNQOJCNYSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)[C@@H]1C[C@H]1C ZINC000414067281 333890466 /nfs/dbraw/zinc/89/04/66/333890466.db2.gz AGTXMJBMLXQJKA-SMOSDQRPSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414672782 334065599 /nfs/dbraw/zinc/06/55/99/334065599.db2.gz HXZTXCDPNZJAPI-HZSPNIEDSA-N 2 1 314.395 4.086 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000280344732 334116679 /nfs/dbraw/zinc/11/66/79/334116679.db2.gz RRKGYHRKXAKOOH-FXAWDEMLSA-N 2 1 315.505 4.167 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000280344872 334116715 /nfs/dbraw/zinc/11/67/15/334116715.db2.gz RVIMYVIOJUWDTJ-FXAWDEMLSA-N 2 1 315.505 4.025 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000280344737 334116737 /nfs/dbraw/zinc/11/67/37/334116737.db2.gz RRKGYHRKXAKOOH-XLIONFOSSA-N 2 1 315.505 4.167 20 0 DIADMP c1c2ccccc2oc1CC[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000415084291 334272643 /nfs/dbraw/zinc/27/26/43/334272643.db2.gz GSRYDECFBGKONR-ICSRJNTNSA-N 2 1 320.436 4.058 20 0 DIADMP Clc1ccc(CC[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC000415088088 334276576 /nfs/dbraw/zinc/27/65/76/334276576.db2.gz UQWNSOHJASOFAL-GDBMZVCRSA-N 2 1 320.889 4.027 20 0 DIADMP Clc1ccc(CC[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC000415088092 334276580 /nfs/dbraw/zinc/27/65/80/334276580.db2.gz UQWNSOHJASOFAL-GOEBONIOSA-N 2 1 320.889 4.027 20 0 DIADMP CC[C@H]1CCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2C)CC1 ZINC000531955082 334306521 /nfs/dbraw/zinc/30/65/21/334306521.db2.gz CXQNLCBQRLPEER-PXNSSMCTSA-N 2 1 300.490 4.128 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972455 334336956 /nfs/dbraw/zinc/33/69/56/334336956.db2.gz YYSCOLBQWBYDOV-PXNSSMCTSA-N 2 1 318.505 4.104 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+](C)CCCn1cc[nH+]c1C ZINC000535051677 334360464 /nfs/dbraw/zinc/36/04/64/334360464.db2.gz WNWBQZHXRJIVBR-QGZVFWFLSA-N 2 1 305.853 4.318 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCCn1cc[nH+]c1C ZINC000535051677 334360465 /nfs/dbraw/zinc/36/04/65/334360465.db2.gz WNWBQZHXRJIVBR-QGZVFWFLSA-N 2 1 305.853 4.318 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000531988795 334364303 /nfs/dbraw/zinc/36/43/03/334364303.db2.gz SBKARNGXJPKJEH-MMOPVJDHSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000531988795 334364304 /nfs/dbraw/zinc/36/43/04/334364304.db2.gz SBKARNGXJPKJEH-MMOPVJDHSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000531988795 334364305 /nfs/dbraw/zinc/36/43/05/334364305.db2.gz SBKARNGXJPKJEH-MMOPVJDHSA-N 2 1 308.469 4.317 20 0 DIADMP CCCC[C@H]([NH2+]CCCn1cc[nH+]c1C)c1ccc(OC)cc1 ZINC000341793756 334479592 /nfs/dbraw/zinc/47/95/92/334479592.db2.gz WYLCLSDGCVBHRU-IBGZPJMESA-N 2 1 315.461 4.111 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1c2cccc(F)c2CC[C@@H]1C ZINC000164593113 334614235 /nfs/dbraw/zinc/61/42/35/334614235.db2.gz FPDWNWNUFIYUEC-LIRRHRJNSA-N 2 1 315.436 4.024 20 0 DIADMP Clc1ccc([C@@H](CC2CC2)[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000345682957 335341288 /nfs/dbraw/zinc/34/12/88/335341288.db2.gz NYAGBTZIDFBSLZ-DNVCBOLYSA-N 2 1 318.892 4.255 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000345693319 335342311 /nfs/dbraw/zinc/34/23/11/335342311.db2.gz QLQZSKSHZKTZBC-GOSISDBHSA-N 2 1 306.881 4.255 20 0 DIADMP CC[N@@H+](CCc1cccs1)Cc1cc(-n2ccnc2)cs1 ZINC000346142359 335380796 /nfs/dbraw/zinc/38/07/96/335380796.db2.gz AMMFEDGUNWNQRE-UHFFFAOYSA-N 2 1 317.483 4.060 20 0 DIADMP FC(F)(F)c1ccccc1[C@@H]1CCCC[N@H+]1CCn1ccnc1 ZINC000346300871 335396361 /nfs/dbraw/zinc/39/63/61/335396361.db2.gz DDRQGESTTIYBLB-INIZCTEOSA-N 2 1 323.362 4.129 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000347738548 335521123 /nfs/dbraw/zinc/52/11/23/335521123.db2.gz JOIBPXGDOVKXIN-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP Clc1ccc2c(NCC3CC[NH+](C4CC4)CC3)cc[nH+]c2c1 ZINC000444878681 338491220 /nfs/dbraw/zinc/49/12/20/338491220.db2.gz VJFOFTCSXFEODK-UHFFFAOYSA-N 2 1 315.848 4.175 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCCc2c(Cl)cccc21 ZINC000349463210 335673841 /nfs/dbraw/zinc/67/38/41/335673841.db2.gz SLZYUCDZGRQZFI-FZKQIMNGSA-N 2 1 317.864 4.148 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCC2 ZINC000535622834 335694891 /nfs/dbraw/zinc/69/48/91/335694891.db2.gz JLZLIDNSZOSQJZ-NRFANRHFSA-N 2 1 312.501 4.404 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@](C)(c2ccccc2)CC1 ZINC000352210325 336203085 /nfs/dbraw/zinc/20/30/85/336203085.db2.gz FZSCOYBGQKNIKF-HXUWFJFHSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@](C)(c2ccccc2)CC1 ZINC000352210325 336203086 /nfs/dbraw/zinc/20/30/86/336203086.db2.gz FZSCOYBGQKNIKF-HXUWFJFHSA-N 2 1 311.473 4.025 20 0 DIADMP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1cnc(C(C)C)s1 ZINC000532328868 336240625 /nfs/dbraw/zinc/24/06/25/336240625.db2.gz BJBREXVSCALJHV-WBVHZDCISA-N 2 1 323.550 4.257 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000532504735 336252523 /nfs/dbraw/zinc/25/25/23/336252523.db2.gz MDNBKLNZMVLKJL-UUIXGBLFSA-N 2 1 314.517 4.279 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CCc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000532525372 336254244 /nfs/dbraw/zinc/25/42/44/336254244.db2.gz UWYIAOOHBSFJRQ-BVYCBKJFSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](CCc2ccccc2)c2ccccc2)CC[N@H+]1C ZINC000532525372 336254245 /nfs/dbraw/zinc/25/42/45/336254245.db2.gz UWYIAOOHBSFJRQ-BVYCBKJFSA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000192705845 336258943 /nfs/dbraw/zinc/25/89/43/336258943.db2.gz UTIRAUQWGIVIKY-XVFGAMNESA-N 2 1 300.490 4.031 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526974394 336277100 /nfs/dbraw/zinc/27/71/00/336277100.db2.gz KIEOISRRUBUKBN-OAHLLOKOSA-N 2 1 310.432 4.226 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+][C@H](C)c1cnc2ccsc2c1 ZINC000482231104 336284329 /nfs/dbraw/zinc/28/43/29/336284329.db2.gz LWEYBWWVZPGPFX-OAHLLOKOSA-N 2 1 319.518 4.459 20 0 DIADMP C[N@@H+]1CCC[C@H](CNc2cc[nH+]cc2Cl)[C@H]1c1cccs1 ZINC000301554279 336314608 /nfs/dbraw/zinc/31/46/08/336314608.db2.gz MYJIZTRPDBDOFM-WBMJQRKESA-N 2 1 321.877 4.292 20 0 DIADMP C[N@H+]1CCC[C@H](CNc2cc[nH+]cc2Cl)[C@H]1c1cccs1 ZINC000301554279 336314609 /nfs/dbraw/zinc/31/46/09/336314609.db2.gz MYJIZTRPDBDOFM-WBMJQRKESA-N 2 1 321.877 4.292 20 0 DIADMP C[N@@H+]1CCC[C@@H](CNc2cc[nH+]cc2Cl)[C@@H]1c1cccs1 ZINC000301554276 336314614 /nfs/dbraw/zinc/31/46/14/336314614.db2.gz MYJIZTRPDBDOFM-BLLLJJGKSA-N 2 1 321.877 4.292 20 0 DIADMP C[N@H+]1CCC[C@@H](CNc2cc[nH+]cc2Cl)[C@@H]1c1cccs1 ZINC000301554276 336314615 /nfs/dbraw/zinc/31/46/15/336314615.db2.gz MYJIZTRPDBDOFM-BLLLJJGKSA-N 2 1 321.877 4.292 20 0 DIADMP c1cc2[nH+]ccc(NC3CC[NH+](C4CCCC4)CC3)c2s1 ZINC000301558815 336314762 /nfs/dbraw/zinc/31/47/62/336314762.db2.gz SZURSIOSQRLOFH-UHFFFAOYSA-N 2 1 301.459 4.115 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1 ZINC000514100250 336332195 /nfs/dbraw/zinc/33/21/95/336332195.db2.gz URYANVYHCKICLF-DBVUQKKJSA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+](CC)Cc1ccccc1CNc1[nH]c2ccccc2[nH+]1 ZINC000301901245 336337316 /nfs/dbraw/zinc/33/73/16/336337316.db2.gz ZYZDUPRXNNKWSY-UHFFFAOYSA-N 2 1 308.429 4.017 20 0 DIADMP CCC[N@@H+]1CC[C@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000302002191 336342413 /nfs/dbraw/zinc/34/24/13/336342413.db2.gz XBEXGOUWDNZZBT-CYBMUJFWSA-N 2 1 303.837 4.032 20 0 DIADMP CCC[N@H+]1CC[C@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000302002191 336342414 /nfs/dbraw/zinc/34/24/14/336342414.db2.gz XBEXGOUWDNZZBT-CYBMUJFWSA-N 2 1 303.837 4.032 20 0 DIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000302056402 336345901 /nfs/dbraw/zinc/34/59/01/336345901.db2.gz QRZXBLPBGIVMSP-HNNXBMFYSA-N 2 1 320.440 4.213 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccccc1 ZINC000353033846 336384356 /nfs/dbraw/zinc/38/43/56/336384356.db2.gz OJRBRFSMQMBUMB-OAQYLSRUSA-N 2 1 308.469 4.176 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccccc1 ZINC000353033846 336384357 /nfs/dbraw/zinc/38/43/57/336384357.db2.gz OJRBRFSMQMBUMB-OAQYLSRUSA-N 2 1 308.469 4.176 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c1 ZINC000105449357 336387734 /nfs/dbraw/zinc/38/77/34/336387734.db2.gz QZJRGLXPGRWOII-HNAYVOBHSA-N 2 1 312.457 4.145 20 0 DIADMP CC(C)(C[NH2+][C@H]1CCSc2ccc(F)cc21)C[NH+]1CCCC1 ZINC000357848442 336601354 /nfs/dbraw/zinc/60/13/54/336601354.db2.gz KEZOEPXDXOCWEU-INIZCTEOSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3occc32)CC1 ZINC000359101107 336657834 /nfs/dbraw/zinc/65/78/34/336657834.db2.gz CQYTYCFLTYKVJS-MNEFBYGVSA-N 2 1 316.489 4.290 20 0 DIADMP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC000360849145 336724506 /nfs/dbraw/zinc/72/45/06/336724506.db2.gz XOJAKMWMWOFIJV-HUUCEWRRSA-N 2 1 318.436 4.030 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCCc2c3ccccc3sc21 ZINC000360941420 336728507 /nfs/dbraw/zinc/72/85/07/336728507.db2.gz KQCJDRWDXNNAEH-MRXNPFEDSA-N 2 1 311.454 4.073 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2CC(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584365347 337102204 /nfs/dbraw/zinc/10/22/04/337102204.db2.gz QPPMUJLHEGMSGW-XLCOUGHXSA-N 2 1 320.480 4.358 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2CC(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584365347 337102205 /nfs/dbraw/zinc/10/22/05/337102205.db2.gz QPPMUJLHEGMSGW-XLCOUGHXSA-N 2 1 320.480 4.358 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ccsc2)cc1 ZINC000177727372 337157038 /nfs/dbraw/zinc/15/70/38/337157038.db2.gz GBDLEQKLJXDGJM-CQSZACIVSA-N 2 1 311.454 4.136 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccsc2)cc1F ZINC000178625753 337165570 /nfs/dbraw/zinc/16/55/70/337165570.db2.gz TWQKICFOPYMZPW-LBPRGKRZSA-N 2 1 315.417 4.232 20 0 DIADMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000178707219 337166291 /nfs/dbraw/zinc/16/62/91/337166291.db2.gz LFLSZRPTIIPMGE-GUYCJALGSA-N 2 1 305.853 4.222 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]CC(c2ccccc2)c2ccccc2)C1 ZINC000392193145 337179144 /nfs/dbraw/zinc/17/91/44/337179144.db2.gz IJSJHZGTOZPAKY-LJQANCHMSA-N 2 1 322.496 4.138 20 0 DIADMP Cc1nc(C)c([C@@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000183190861 337190241 /nfs/dbraw/zinc/19/02/41/337190241.db2.gz LIQDORYVKOIOSF-WOSRLPQWSA-N 2 1 321.534 4.064 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024174 337226400 /nfs/dbraw/zinc/22/64/00/337226400.db2.gz MBZMHSZMGZOVOL-MOPGFXCFSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@H]3CC34CCCC4)CC23CC3)cc1 ZINC000583024174 337226401 /nfs/dbraw/zinc/22/64/01/337226401.db2.gz MBZMHSZMGZOVOL-MOPGFXCFSA-N 2 1 310.485 4.106 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1cc2ccccc2s1 ZINC000525952587 337309033 /nfs/dbraw/zinc/30/90/33/337309033.db2.gz YXBJCKZQDATNMC-GOEBONIOSA-N 2 1 302.487 4.426 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC(C2CC2)C2CC2)C3)cc1 ZINC000584429080 337324775 /nfs/dbraw/zinc/32/47/75/337324775.db2.gz HFRRIVSTIGTPTN-MZADTFQBSA-N 2 1 324.512 4.208 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000583901531 337384842 /nfs/dbraw/zinc/38/48/42/337384842.db2.gz GXQKKLZJEJKSBV-NFOMZHRRSA-N 2 1 308.432 4.065 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000583901531 337384843 /nfs/dbraw/zinc/38/48/43/337384843.db2.gz GXQKKLZJEJKSBV-NFOMZHRRSA-N 2 1 308.432 4.065 20 0 DIADMP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)c1C ZINC000422734059 337684583 /nfs/dbraw/zinc/68/45/83/337684583.db2.gz CCAUROIRNSCWQF-VQTJNVASSA-N 2 1 319.452 4.328 20 0 DIADMP c1csc([C@@H]([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)C2CC2)c1 ZINC000422798623 337687104 /nfs/dbraw/zinc/68/71/04/337687104.db2.gz SBYCBXQLSWJZFP-AOIWGVFYSA-N 2 1 312.482 4.282 20 0 DIADMP CCOc1ccccc1[C@@H](CC(C)C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422816338 337687786 /nfs/dbraw/zinc/68/77/86/337687786.db2.gz ZOTQWTIUILLPDI-SUTQANCOSA-N 2 1 316.489 4.045 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+]C[C@@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423063008 337697843 /nfs/dbraw/zinc/69/78/43/337697843.db2.gz OEDHYEXLQJJXTH-GVDBMIGSSA-N 2 1 320.358 4.067 20 0 DIADMP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc2ccccc2c1 ZINC000423182484 337702662 /nfs/dbraw/zinc/70/26/62/337702662.db2.gz DYTQCIGYGDUNDO-KRWDZBQOSA-N 2 1 319.452 4.065 20 0 DIADMP Cc1cc([C@H]([NH2+]CCC[NH3+])c2cccc(Cl)c2)c(C)s1 ZINC000423190092 337703060 /nfs/dbraw/zinc/70/30/60/337703060.db2.gz NLSJNYQJVPXOSB-MRXNPFEDSA-N 2 1 308.878 4.046 20 0 DIADMP CC(C)c1ccc([C@@H](C)[NH2+]CCC[NH2+]Cc2cccnc2)cc1 ZINC000423189319 337703075 /nfs/dbraw/zinc/70/30/75/337703075.db2.gz PCPGPOVHOBMVAT-QGZVFWFLSA-N 2 1 311.473 4.036 20 0 DIADMP CCCC[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000423298792 337710857 /nfs/dbraw/zinc/71/08/57/337710857.db2.gz ANJQNIQDUBAUOY-OAHLLOKOSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc(Cl)c1Cl ZINC000423329559 337712300 /nfs/dbraw/zinc/71/23/00/337712300.db2.gz MVQRAPAMOVSRBW-XHDPSFHLSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc2cc(Cl)ccc2o1 ZINC000423339579 337712853 /nfs/dbraw/zinc/71/28/53/337712853.db2.gz LIYJIVNMGLGZIA-YVEFUNNKSA-N 2 1 306.837 4.127 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000423325854 337715356 /nfs/dbraw/zinc/71/53/56/337715356.db2.gz JWIWLIANJPDBFL-ABAIWWIYSA-N 2 1 301.261 4.034 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cc2c(ccc3ccccc23)o1 ZINC000423389311 337718277 /nfs/dbraw/zinc/71/82/77/337718277.db2.gz JHZBNDGKUDVFIJ-DEYYWGMASA-N 2 1 308.425 4.235 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)o1 ZINC000123086037 337943356 /nfs/dbraw/zinc/94/33/56/337943356.db2.gz DCNDUUMKWBLURJ-MRXNPFEDSA-N 2 1 312.457 4.289 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)[C@H]2CCC[C@@H]21 ZINC000426312709 338026323 /nfs/dbraw/zinc/02/63/23/338026323.db2.gz KFXAGATVGZTMNN-RZFFKMDDSA-N 2 1 324.921 4.241 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000448523457 338152455 /nfs/dbraw/zinc/15/24/55/338152455.db2.gz ZIYIVLUSPSCYHX-QZTJIDSGSA-N 2 1 316.832 4.339 20 0 DIADMP Clc1scc(CN2CCC[C@H](c3[nH]cc[nH+]3)C2)c1Cl ZINC000432743468 338165581 /nfs/dbraw/zinc/16/55/81/338165581.db2.gz VNCJKGBVRNSXRM-VIFPVBQESA-N 2 1 316.257 4.158 20 0 DIADMP C[C@@H](C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1)c1ccccc1 ZINC000434687759 338223563 /nfs/dbraw/zinc/22/35/63/338223563.db2.gz FVBBDNGAVBOHLX-KRWDZBQOSA-N 2 1 323.484 4.203 20 0 DIADMP Cc1cccc([C@@H](C)[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000434686811 338223575 /nfs/dbraw/zinc/22/35/75/338223575.db2.gz VLJFSWFGOHJDFD-QGZVFWFLSA-N 2 1 323.484 4.468 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000434752292 338224884 /nfs/dbraw/zinc/22/48/84/338224884.db2.gz AUEPRKMYTAFBCA-YLJYHZDGSA-N 2 1 314.517 4.108 20 0 DIADMP Cc1cccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1C ZINC000435056544 338231382 /nfs/dbraw/zinc/23/13/82/338231382.db2.gz HFCMMLQVRSUAOQ-UHFFFAOYSA-N 2 1 323.484 4.216 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436232942 338262635 /nfs/dbraw/zinc/26/26/35/338262635.db2.gz QLPYIFJPWRNFGN-MISYRCLQSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436283619 338265814 /nfs/dbraw/zinc/26/58/14/338265814.db2.gz LWDDXPYXFMPIKV-UKRRQHHQSA-N 2 1 306.416 4.104 20 0 DIADMP C[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438216546 338336995 /nfs/dbraw/zinc/33/69/95/338336995.db2.gz PHNLUEVJFPEYFX-RBSFLKMASA-N 2 1 320.443 4.208 20 0 DIADMP C[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438216546 338336996 /nfs/dbraw/zinc/33/69/96/338336996.db2.gz PHNLUEVJFPEYFX-RBSFLKMASA-N 2 1 320.443 4.208 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccs2)CC1 ZINC000438825120 338352591 /nfs/dbraw/zinc/35/25/91/338352591.db2.gz BDBKKXCBYAIMIQ-UHFFFAOYSA-N 2 1 314.498 4.281 20 0 DIADMP C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC000439311639 338366794 /nfs/dbraw/zinc/36/67/94/338366794.db2.gz CDBGFMFYWIEMSF-QUCCMNQESA-N 2 1 300.490 4.131 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1C[C@H](C(C)C)c2ccccc21 ZINC000447527820 338554083 /nfs/dbraw/zinc/55/40/83/338554083.db2.gz GAQKBRRSFNCYAX-UXHICEINSA-N 2 1 311.473 4.446 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000449068810 338590252 /nfs/dbraw/zinc/59/02/52/338590252.db2.gz CWBOXWVALOOJNK-UHFFFAOYSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccncc1C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449522741 338634238 /nfs/dbraw/zinc/63/42/38/338634238.db2.gz KDGNBLHCMSEFTJ-UHFFFAOYSA-N 2 1 317.521 4.159 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC000449791592 338653389 /nfs/dbraw/zinc/65/33/89/338653389.db2.gz PNWUUDOPSVCLCB-QAPCUYQASA-N 2 1 306.881 4.050 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000451353811 338730783 /nfs/dbraw/zinc/73/07/83/338730783.db2.gz LJNRLLAIMJVWMV-KRWDZBQOSA-N 2 1 321.827 4.115 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cs1 ZINC000453110596 338794978 /nfs/dbraw/zinc/79/49/78/338794978.db2.gz CNRPQUHGVBLTMR-OAHLLOKOSA-N 2 1 315.486 4.080 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000195615396 338910445 /nfs/dbraw/zinc/91/04/45/338910445.db2.gz LBVHOMKVJBGDCR-GOSISDBHSA-N 2 1 308.469 4.310 20 0 DIADMP Cc1cccc(N2CCC([NH2+]Cc3ccc(C4CC4)cc3)CC2)[nH+]1 ZINC000459405934 339027394 /nfs/dbraw/zinc/02/73/94/339027394.db2.gz FROIKRGGIIAXRR-UHFFFAOYSA-N 2 1 321.468 4.026 20 0 DIADMP Fc1cccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)c1 ZINC000459427165 339028547 /nfs/dbraw/zinc/02/85/47/339028547.db2.gz AJDDLXTWJSDSBE-FQEVSTJZSA-N 2 1 316.464 4.273 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000459475572 339031481 /nfs/dbraw/zinc/03/14/81/339031481.db2.gz YVNKARUWPISPKG-SAJDGTNDSA-N 2 1 312.501 4.033 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1ccccc1C(F)(F)F ZINC000459736632 339045278 /nfs/dbraw/zinc/04/52/78/339045278.db2.gz QCDWSLJCGQSORF-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP FCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000462821688 339092102 /nfs/dbraw/zinc/09/21/02/339092102.db2.gz MKXPYFUNEXLZTO-HSALFYBXSA-N 2 1 318.480 4.017 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC000463023174 339101042 /nfs/dbraw/zinc/10/10/42/339101042.db2.gz GYPZXIVDTQGACQ-IAGOWNOFSA-N 2 1 318.505 4.246 20 0 DIADMP Cc1nc2ccccc2n1CCCCC[N@H+](CC(F)F)C(C)C ZINC000463097620 339105596 /nfs/dbraw/zinc/10/55/96/339105596.db2.gz HJEXKOZMNPTLDN-UHFFFAOYSA-N 2 1 323.431 4.491 20 0 DIADMP Cc1nc2ccccc2n1CCCCC[N@@H+](CC(F)F)C(C)C ZINC000463097620 339105597 /nfs/dbraw/zinc/10/55/97/339105597.db2.gz HJEXKOZMNPTLDN-UHFFFAOYSA-N 2 1 323.431 4.491 20 0 DIADMP C[C@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463138263 339106858 /nfs/dbraw/zinc/10/68/58/339106858.db2.gz CJULGSASRRCINL-JXFKEZNVSA-N 2 1 318.480 4.001 20 0 DIADMP Fc1ccc(CC[NH+]2CCC([NH2+]CC3CCCCC3)CC2)cc1 ZINC000463140200 339107023 /nfs/dbraw/zinc/10/70/23/339107023.db2.gz VNLAYUCVTQUMBI-UHFFFAOYSA-N 2 1 318.480 4.003 20 0 DIADMP CC[C@H](C)C[C@@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463193131 339108769 /nfs/dbraw/zinc/10/87/69/339108769.db2.gz URXPLVMRJJGXPD-DLBZAZTESA-N 2 1 320.496 4.247 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463193133 339108792 /nfs/dbraw/zinc/10/87/92/339108792.db2.gz URXPLVMRJJGXPD-IRXDYDNUSA-N 2 1 320.496 4.247 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463206956 339109449 /nfs/dbraw/zinc/10/94/49/339109449.db2.gz RIJWAKHAXHOXLW-XLIONFOSSA-N 2 1 318.480 4.001 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207750 339109497 /nfs/dbraw/zinc/10/94/97/339109497.db2.gz UHDJJAQYKFYJSQ-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000463207750 339109498 /nfs/dbraw/zinc/10/94/98/339109498.db2.gz UHDJJAQYKFYJSQ-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC23CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000463235049 339110930 /nfs/dbraw/zinc/11/09/30/339110930.db2.gz FHSYNXMSPHSTCD-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC000463235049 339110931 /nfs/dbraw/zinc/11/09/31/339110931.db2.gz FHSYNXMSPHSTCD-MISYRCLQSA-N 2 1 312.501 4.352 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463278915 339112897 /nfs/dbraw/zinc/11/28/97/339112897.db2.gz DYSAXAFWPKBTTO-PKOBYXMFSA-N 2 1 320.546 4.162 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463278915 339112898 /nfs/dbraw/zinc/11/28/98/339112898.db2.gz DYSAXAFWPKBTTO-PKOBYXMFSA-N 2 1 320.546 4.162 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463278912 339112985 /nfs/dbraw/zinc/11/29/85/339112985.db2.gz DYSAXAFWPKBTTO-HKUYNNGSSA-N 2 1 320.546 4.162 20 0 DIADMP CSCCCCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463278912 339112986 /nfs/dbraw/zinc/11/29/86/339112986.db2.gz DYSAXAFWPKBTTO-HKUYNNGSSA-N 2 1 320.546 4.162 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463279851 339113042 /nfs/dbraw/zinc/11/30/42/339113042.db2.gz GLRCGGMBYCXDFH-FUHIMQAGSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463279851 339113043 /nfs/dbraw/zinc/11/30/43/339113043.db2.gz GLRCGGMBYCXDFH-FUHIMQAGSA-N 2 1 300.490 4.208 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2)C1 ZINC000464776988 339152741 /nfs/dbraw/zinc/15/27/41/339152741.db2.gz LQFMRUWMBRRJKL-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2)C1 ZINC000464776988 339152742 /nfs/dbraw/zinc/15/27/42/339152742.db2.gz LQFMRUWMBRRJKL-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2)C1 ZINC000464776991 339152918 /nfs/dbraw/zinc/15/29/18/339152918.db2.gz LQFMRUWMBRRJKL-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)cc2)C1 ZINC000464776991 339152919 /nfs/dbraw/zinc/15/29/19/339152919.db2.gz LQFMRUWMBRRJKL-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP C[C@@H](C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841339 339156606 /nfs/dbraw/zinc/15/66/06/339156606.db2.gz YBVKYQIZMNFPTC-FPOVZHCZSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@@H](C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841339 339156607 /nfs/dbraw/zinc/15/66/07/339156607.db2.gz YBVKYQIZMNFPTC-FPOVZHCZSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@@H](C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841339 339156608 /nfs/dbraw/zinc/15/66/08/339156608.db2.gz YBVKYQIZMNFPTC-FPOVZHCZSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCC[C@H](C)C1 ZINC000466459480 339205892 /nfs/dbraw/zinc/20/58/92/339205892.db2.gz YRFUQDIWOFTXNY-FXQLRMTLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000466459480 339205893 /nfs/dbraw/zinc/20/58/93/339205893.db2.gz YRFUQDIWOFTXNY-FXQLRMTLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000466464010 339206219 /nfs/dbraw/zinc/20/62/19/339206219.db2.gz PUXZAQXNFQDZEQ-QQFBHYJXSA-N 2 1 320.443 4.209 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C1CCC2(CCCCC2)CC1 ZINC000466741564 339215356 /nfs/dbraw/zinc/21/53/56/339215356.db2.gz ADRILHQMRNBBME-INIZCTEOSA-N 2 1 303.494 4.310 20 0 DIADMP C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1cccc2nccn21 ZINC000467550616 339242055 /nfs/dbraw/zinc/24/20/55/339242055.db2.gz LXARIXHXCHMAQJ-FUHWJXTLSA-N 2 1 305.425 4.102 20 0 DIADMP CCCCOc1ccccc1C[N@H+](C)[C@H]1CC[NH+](CC)C[C@H]1C ZINC000468392424 339261526 /nfs/dbraw/zinc/26/15/26/339261526.db2.gz LGWMMFDTJFIKTJ-MJGOQNOKSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[N@@H+](C)[C@H]1CC[NH+](CC)C[C@H]1C ZINC000468392424 339261527 /nfs/dbraw/zinc/26/15/27/339261527.db2.gz LGWMMFDTJFIKTJ-MJGOQNOKSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@H]1CC[N@H+](CC)C[C@H]1C ZINC000468392424 339261528 /nfs/dbraw/zinc/26/15/28/339261528.db2.gz LGWMMFDTJFIKTJ-MJGOQNOKSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@H]1CC[N@@H+](CC)C[C@H]1C ZINC000468392424 339261529 /nfs/dbraw/zinc/26/15/29/339261529.db2.gz LGWMMFDTJFIKTJ-MJGOQNOKSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[N@H+](C)[C@H]1CC[NH+](CC)C[C@@H]1C ZINC000468392422 339261638 /nfs/dbraw/zinc/26/16/38/339261638.db2.gz LGWMMFDTJFIKTJ-HKUYNNGSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[N@@H+](C)[C@H]1CC[NH+](CC)C[C@@H]1C ZINC000468392422 339261639 /nfs/dbraw/zinc/26/16/39/339261639.db2.gz LGWMMFDTJFIKTJ-HKUYNNGSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000468392422 339261640 /nfs/dbraw/zinc/26/16/40/339261640.db2.gz LGWMMFDTJFIKTJ-HKUYNNGSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[NH+](C)[C@H]1CC[N@@H+](CC)C[C@@H]1C ZINC000468392422 339261641 /nfs/dbraw/zinc/26/16/41/339261641.db2.gz LGWMMFDTJFIKTJ-HKUYNNGSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccccc1C[N@@H+]1CC[C@@H](C[NH+](C)CCC)C1 ZINC000468402611 339262060 /nfs/dbraw/zinc/26/20/60/339262060.db2.gz QLFJUFNPSOVOKS-SFHVURJKSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccccc1C[N@H+]1CC[C@@H](C[NH+](C)CCC)C1 ZINC000468402611 339262061 /nfs/dbraw/zinc/26/20/61/339262061.db2.gz QLFJUFNPSOVOKS-SFHVURJKSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccccc1C[NH+]1CC[C@@H](C[N@H+](C)CCC)C1 ZINC000468402611 339262062 /nfs/dbraw/zinc/26/20/62/339262062.db2.gz QLFJUFNPSOVOKS-SFHVURJKSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCOc1ccccc1C[NH+]1CC[C@@H](C[N@@H+](C)CCC)C1 ZINC000468402611 339262063 /nfs/dbraw/zinc/26/20/63/339262063.db2.gz QLFJUFNPSOVOKS-SFHVURJKSA-N 2 1 318.505 4.029 20 0 DIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000469004968 339277175 /nfs/dbraw/zinc/27/71/75/339277175.db2.gz QPGDAGSPBKFGQF-UONOGXRCSA-N 2 1 314.926 4.420 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000469004968 339277176 /nfs/dbraw/zinc/27/71/76/339277176.db2.gz QPGDAGSPBKFGQF-UONOGXRCSA-N 2 1 314.926 4.420 20 0 DIADMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000469005086 339277398 /nfs/dbraw/zinc/27/73/98/339277398.db2.gz QPGDAGSPBKFGQF-ZIAGYGMSSA-N 2 1 314.926 4.420 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000469005086 339277399 /nfs/dbraw/zinc/27/73/99/339277399.db2.gz QPGDAGSPBKFGQF-ZIAGYGMSSA-N 2 1 314.926 4.420 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)C1 ZINC000469126545 339280898 /nfs/dbraw/zinc/28/08/98/339280898.db2.gz XYGXWFNNZFLEFU-QAPCUYQASA-N 2 1 306.881 4.113 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CCCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC000469158950 339281721 /nfs/dbraw/zinc/28/17/21/339281721.db2.gz WOEVIAQHCDSIAH-XLIONFOSSA-N 2 1 302.506 4.063 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000469789522 339300246 /nfs/dbraw/zinc/30/02/46/339300246.db2.gz YRSLHODBPSEVGN-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CCC1CC1)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000469789522 339300247 /nfs/dbraw/zinc/30/02/47/339300247.db2.gz YRSLHODBPSEVGN-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000469847656 339302487 /nfs/dbraw/zinc/30/24/87/339302487.db2.gz ZKQDMQOCISUIDP-STQMWFEESA-N 2 1 320.889 4.238 20 0 DIADMP FC(F)c1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764492 339326950 /nfs/dbraw/zinc/32/69/50/339326950.db2.gz JKQHUYYYAMZHMM-WMZOPIPTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000470764492 339326951 /nfs/dbraw/zinc/32/69/51/339326951.db2.gz JKQHUYYYAMZHMM-WMZOPIPTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000470764492 339326952 /nfs/dbraw/zinc/32/69/52/339326952.db2.gz JKQHUYYYAMZHMM-WMZOPIPTSA-N 2 1 320.427 4.073 20 0 DIADMP FC(F)c1cccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000470764492 339326953 /nfs/dbraw/zinc/32/69/53/339326953.db2.gz JKQHUYYYAMZHMM-WMZOPIPTSA-N 2 1 320.427 4.073 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](CCc2ccc3ccccc3c2)C1 ZINC000470957666 339332955 /nfs/dbraw/zinc/33/29/55/339332955.db2.gz FNLFKKHYVPFFLB-HXUWFJFHSA-N 2 1 322.496 4.046 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](CCc2ccc3ccccc3c2)C1 ZINC000470957666 339332956 /nfs/dbraw/zinc/33/29/56/339332956.db2.gz FNLFKKHYVPFFLB-HXUWFJFHSA-N 2 1 322.496 4.046 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](CCc2ccc3ccccc3c2)C1 ZINC000470957666 339332957 /nfs/dbraw/zinc/33/29/57/339332957.db2.gz FNLFKKHYVPFFLB-HXUWFJFHSA-N 2 1 322.496 4.046 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(Cc3ccccc3)CCCCC2)CC[N@H+]1C ZINC000471591814 339348490 /nfs/dbraw/zinc/34/84/90/339348490.db2.gz AIVGKDIHQHKZOO-QUCCMNQESA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH2+]CC1(Cc2ccccc2)CCCCC1 ZINC000471593997 339348696 /nfs/dbraw/zinc/34/86/96/339348696.db2.gz NVOADCOBCGLGIO-AZUAARDMSA-N 2 1 314.517 4.109 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CCCC12CC[NH+](C)CC2 ZINC000472602249 339375073 /nfs/dbraw/zinc/37/50/73/339375073.db2.gz PLTPUGXSIDPONT-UHFFFAOYSA-N 2 1 306.881 4.017 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CCN1CCC(=Cc2ccccc2F)CC1 ZINC000473019807 339380183 /nfs/dbraw/zinc/38/01/83/339380183.db2.gz DOAQXUUZUACDIX-LJQANCHMSA-N 2 1 316.464 4.179 20 0 DIADMP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC000473019807 339380184 /nfs/dbraw/zinc/38/01/84/339380184.db2.gz DOAQXUUZUACDIX-LJQANCHMSA-N 2 1 316.464 4.179 20 0 DIADMP C[N@H+]1CCCC[C@@H]1CC[NH+]1CCC(=Cc2ccccc2F)CC1 ZINC000473019807 339380185 /nfs/dbraw/zinc/38/01/85/339380185.db2.gz DOAQXUUZUACDIX-LJQANCHMSA-N 2 1 316.464 4.179 20 0 DIADMP CCSc1cccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000473139833 339382379 /nfs/dbraw/zinc/38/23/79/339382379.db2.gz OFUYANPKDCWADF-UHFFFAOYSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c1 ZINC000473139833 339382380 /nfs/dbraw/zinc/38/23/80/339382380.db2.gz OFUYANPKDCWADF-UHFFFAOYSA-N 2 1 306.519 4.103 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H]1CCC12CCCC2 ZINC000474040102 339398395 /nfs/dbraw/zinc/39/83/95/339398395.db2.gz UIYJKHLZWWAVFI-IBGZPJMESA-N 2 1 300.490 4.339 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2cccc(F)c2o1 ZINC000474101611 339402677 /nfs/dbraw/zinc/40/26/77/339402677.db2.gz WEIJFJMUPIRSSA-ZDUSSCGKSA-N 2 1 318.436 4.485 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474483397 339417193 /nfs/dbraw/zinc/41/71/93/339417193.db2.gz WFPXSQMHVUUUTP-KGLIPLIRSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@@H]3CCC[C@H](C(C)C)C3)CC2)[nH+]1 ZINC000474725305 339424215 /nfs/dbraw/zinc/42/42/15/339424215.db2.gz LYTYCJIRXITKJC-PKOBYXMFSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000474727662 339424339 /nfs/dbraw/zinc/42/43/39/339424339.db2.gz KXLHGGYODOVFCS-IAGOWNOFSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1csc(Cl)c1 ZINC000477920152 339504520 /nfs/dbraw/zinc/50/45/20/339504520.db2.gz SZQCJDJDWVWOQG-GFCCVEGCSA-N 2 1 300.899 4.174 20 0 DIADMP CCC[C@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1 ZINC000484172677 339682364 /nfs/dbraw/zinc/68/23/64/339682364.db2.gz GBPUILAPVLLDDE-FQEVSTJZSA-N 2 1 323.484 4.490 20 0 DIADMP COc1cccc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000484495711 339688040 /nfs/dbraw/zinc/68/80/40/339688040.db2.gz QMSDFVVFPRMWBM-INIZCTEOSA-N 2 1 316.489 4.143 20 0 DIADMP CC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCCC1 ZINC000499223540 340032693 /nfs/dbraw/zinc/03/26/93/340032693.db2.gz RSBJVNFDZWPMSK-OWZKRDHZSA-N 2 1 312.501 4.352 20 0 DIADMP CCC[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccccn1 ZINC000500651303 340064493 /nfs/dbraw/zinc/06/44/93/340064493.db2.gz MYVMAZZHXTXNSV-QZTJIDSGSA-N 2 1 303.494 4.167 20 0 DIADMP C[C@H]([NH2+]CCSC1CCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000501064296 340073518 /nfs/dbraw/zinc/07/35/18/340073518.db2.gz PXASMRXUMFUONP-DLBZAZTESA-N 2 1 324.578 4.295 20 0 DIADMP Cc1ccccc1[C@H](C)[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501067567 340073694 /nfs/dbraw/zinc/07/36/94/340073694.db2.gz JALRFYDFCZCUFJ-SFHVURJKSA-N 2 1 323.484 4.299 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCC23CCC3)C[N@H+]1Cc1ccccc1 ZINC000502411999 340102357 /nfs/dbraw/zinc/10/23/57/340102357.db2.gz BFEDHWZFUBQHLH-RLLQIKCJSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CC[C@H]1CCC[NH+]1C ZINC000502703032 340111407 /nfs/dbraw/zinc/11/14/07/340111407.db2.gz UPTXRQXOIJPLEG-XJKSGUPXSA-N 2 1 314.395 4.183 20 0 DIADMP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1cnn(C2CCCC2)c1 ZINC000502728159 340112556 /nfs/dbraw/zinc/11/25/56/340112556.db2.gz QZJYNJNMCJCUOQ-YJBOKZPZSA-N 2 1 320.525 4.015 20 0 DIADMP Cc1ccc2c(C3=CC[NH+](CC[C@H]4CCC[N@@H+]4C)CC3)c[nH]c2c1 ZINC000503052757 340119795 /nfs/dbraw/zinc/11/97/95/340119795.db2.gz MBOUDJLREUJSRJ-GOSISDBHSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1ccc2c(C3=CC[N@H+](CC[C@H]4CCC[NH+]4C)CC3)c[nH]c2c1 ZINC000503052757 340119796 /nfs/dbraw/zinc/11/97/96/340119796.db2.gz MBOUDJLREUJSRJ-GOSISDBHSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1ccc2c(C3=CC[N@@H+](CC[C@H]4CCC[NH+]4C)CC3)c[nH]c2c1 ZINC000503052757 340119797 /nfs/dbraw/zinc/11/97/97/340119797.db2.gz MBOUDJLREUJSRJ-GOSISDBHSA-N 2 1 323.484 4.050 20 0 DIADMP C[C@H]1CC[N@H+](Cc2ccc(Cl)c(Cl)c2)C[C@H]1n1ccnc1 ZINC000503063486 340120053 /nfs/dbraw/zinc/12/00/53/340120053.db2.gz MVUHJHPGPQHIGX-BLLLJJGKSA-N 2 1 324.255 4.273 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C[C@H]1n1ccnc1 ZINC000503063486 340120054 /nfs/dbraw/zinc/12/00/54/340120054.db2.gz MVUHJHPGPQHIGX-BLLLJJGKSA-N 2 1 324.255 4.273 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2Cl)C[C@H]1n1ccnc1 ZINC000503077571 340120222 /nfs/dbraw/zinc/12/02/22/340120222.db2.gz ZZNDXPLUFDWNDT-MLGOLLRUSA-N 2 1 324.255 4.273 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(C(C)(C)C)s2)CC1 ZINC000506357209 340193253 /nfs/dbraw/zinc/19/32/53/340193253.db2.gz RMABWNWWKHZDSR-UHFFFAOYSA-N 2 1 308.535 4.350 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(C(C)(C)C)s2)CC1 ZINC000506357209 340193254 /nfs/dbraw/zinc/19/32/54/340193254.db2.gz RMABWNWWKHZDSR-UHFFFAOYSA-N 2 1 308.535 4.350 20 0 DIADMP CC[NH+]1CCC([N@H+](C)CC(c2ccccc2)c2ccccc2)CC1 ZINC000507092358 340207037 /nfs/dbraw/zinc/20/70/37/340207037.db2.gz BQTSUPSFJTXWFF-UHFFFAOYSA-N 2 1 322.496 4.235 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)CC(c2ccccc2)c2ccccc2)CC1 ZINC000507092358 340207038 /nfs/dbraw/zinc/20/70/38/340207038.db2.gz BQTSUPSFJTXWFF-UHFFFAOYSA-N 2 1 322.496 4.235 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000508720381 340251525 /nfs/dbraw/zinc/25/15/25/340251525.db2.gz RIWADGFUYNTLAC-UHOSZYNNSA-N 2 1 302.506 4.311 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC000509956829 340283906 /nfs/dbraw/zinc/28/39/06/340283906.db2.gz JBALPZRVGJHPQI-PWIZWCRZSA-N 2 1 311.473 4.144 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1 ZINC000509972286 340284341 /nfs/dbraw/zinc/28/43/41/340284341.db2.gz NZCJFXKEGNEDMX-PMACEKPBSA-N 2 1 311.473 4.288 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]Cc2ncc(C[NH+](C)C)s2)CC1 ZINC000510177407 340291728 /nfs/dbraw/zinc/29/17/28/340291728.db2.gz UKVPYPIDUPEZPS-UHFFFAOYSA-N 2 1 323.550 4.289 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@H+](C/C=C/c3ccccc3)C2)CC1 ZINC000302989898 340292539 /nfs/dbraw/zinc/29/25/39/340292539.db2.gz FTNCTLHNGYUNIA-OWLMGLOSSA-N 2 1 312.501 4.144 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](C/C=C/c3ccccc3)C2)CC1 ZINC000302989898 340292540 /nfs/dbraw/zinc/29/25/40/340292540.db2.gz FTNCTLHNGYUNIA-OWLMGLOSSA-N 2 1 312.501 4.144 20 0 DIADMP Fc1ccc2c(c1)[C@@H]([N@H+]1CCC[C@H]([NH+]3CCCC3)CC1)CCC2 ZINC000510582486 340303313 /nfs/dbraw/zinc/30/33/13/340303313.db2.gz DXRZWSWARLROOY-ICSRJNTNSA-N 2 1 316.464 4.153 20 0 DIADMP Fc1ccc2c(c1)[C@@H]([N@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)CCC2 ZINC000510582487 340303435 /nfs/dbraw/zinc/30/34/35/340303435.db2.gz DXRZWSWARLROOY-QUCCMNQESA-N 2 1 316.464 4.153 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@H]2CCC[C@@H]2CCCF)C1 ZINC000510694890 340307094 /nfs/dbraw/zinc/30/70/94/340307094.db2.gz LTGPMOPUMYRITH-HCXYKTFWSA-N 2 1 312.517 4.253 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+][C@@H]2CCC[C@@H]2CCCF)C1 ZINC000510694889 340307104 /nfs/dbraw/zinc/30/71/04/340307104.db2.gz LTGPMOPUMYRITH-FCGDIQPGSA-N 2 1 312.517 4.253 20 0 DIADMP FCCC[C@H]1CCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000510715994 340307904 /nfs/dbraw/zinc/30/79/04/340307904.db2.gz DRTPUUHGTHESMS-QUCCMNQESA-N 2 1 318.480 4.159 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CCC2)[C@H]1c1cccs1 ZINC000510739045 340308928 /nfs/dbraw/zinc/30/89/28/340308928.db2.gz SIYNZJBQNNKGIU-MTNOOBJLSA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H]2C2CCC2)[C@H]1c1cccs1 ZINC000510739045 340308929 /nfs/dbraw/zinc/30/89/29/340308929.db2.gz SIYNZJBQNNKGIU-MTNOOBJLSA-N 2 1 318.530 4.299 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CC[C@@H]2C2CCC2)CC1 ZINC000510753978 340309710 /nfs/dbraw/zinc/30/97/10/340309710.db2.gz MVLHLFTYNIKODG-RTWAWAEBSA-N 2 1 312.501 4.128 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000510992806 340317465 /nfs/dbraw/zinc/31/74/65/340317465.db2.gz CSWZFKMTBVITIQ-OAQYLSRUSA-N 2 1 319.452 4.155 20 0 DIADMP CC(C)Sc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000511100625 340320733 /nfs/dbraw/zinc/32/07/33/340320733.db2.gz JDZJXUNWDFTUOE-UHFFFAOYSA-N 2 1 320.546 4.492 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000511100625 340320734 /nfs/dbraw/zinc/32/07/34/340320734.db2.gz JDZJXUNWDFTUOE-UHFFFAOYSA-N 2 1 320.546 4.492 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511110187 340321207 /nfs/dbraw/zinc/32/12/07/340321207.db2.gz LVMKNZXIGWUUBQ-GOSISDBHSA-N 2 1 320.546 4.351 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(SC(C)C)cc2)C1 ZINC000511110187 340321208 /nfs/dbraw/zinc/32/12/08/340321208.db2.gz LVMKNZXIGWUUBQ-GOSISDBHSA-N 2 1 320.546 4.351 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1 ZINC000511162698 340322976 /nfs/dbraw/zinc/32/29/76/340322976.db2.gz SFGRUQBKILBDQW-MJGOQNOKSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1 ZINC000511162698 340322977 /nfs/dbraw/zinc/32/29/77/340322977.db2.gz SFGRUQBKILBDQW-MJGOQNOKSA-N 2 1 318.530 4.103 20 0 DIADMP CC(C)Sc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC000511162698 340322978 /nfs/dbraw/zinc/32/29/78/340322978.db2.gz SFGRUQBKILBDQW-MJGOQNOKSA-N 2 1 318.530 4.103 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2ncc(C[NH+](C)C)s2)CC(C)(C)C1 ZINC000511772610 340337742 /nfs/dbraw/zinc/33/77/42/340337742.db2.gz MTPMPWKDFUZQMV-LSDHHAIUSA-N 2 1 323.550 4.147 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ccc2occc2c1 ZINC000512145765 340349810 /nfs/dbraw/zinc/34/98/10/340349810.db2.gz NKHKWRDREIXLQR-INIZCTEOSA-N 2 1 300.446 4.177 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cc(F)ccc2F)C1 ZINC000512196197 340351920 /nfs/dbraw/zinc/35/19/20/340351920.db2.gz NMQNKPOMYSLSOV-CVEARBPZSA-N 2 1 322.443 4.051 20 0 DIADMP Cc1ccsc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000512212670 340352483 /nfs/dbraw/zinc/35/24/83/340352483.db2.gz OBMYVIUSZGJFMR-IRXDYDNUSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000512212670 340352484 /nfs/dbraw/zinc/35/24/84/340352484.db2.gz OBMYVIUSZGJFMR-IRXDYDNUSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccsc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000512212670 340352485 /nfs/dbraw/zinc/35/24/85/340352485.db2.gz OBMYVIUSZGJFMR-IRXDYDNUSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512316491 340356675 /nfs/dbraw/zinc/35/66/75/340356675.db2.gz ZKKPTLDHDPZVAK-LZJOCLMNSA-N 2 1 312.501 4.225 20 0 DIADMP CCCOc1cccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000512826326 340379596 /nfs/dbraw/zinc/37/95/96/340379596.db2.gz GQCWFFQISPBJLH-SFHVURJKSA-N 2 1 318.505 4.220 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccccc1 ZINC000174158390 340383239 /nfs/dbraw/zinc/38/32/39/340383239.db2.gz AREWONJBHYDDJX-WDYCEAGBSA-N 2 1 314.498 4.482 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccccc1 ZINC000174158390 340383240 /nfs/dbraw/zinc/38/32/40/340383240.db2.gz AREWONJBHYDDJX-WDYCEAGBSA-N 2 1 314.498 4.482 20 0 DIADMP Fc1cccc2c1CC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000513081770 340392439 /nfs/dbraw/zinc/39/24/39/340392439.db2.gz KAIAUMFVHJWFPF-HXUWFJFHSA-N 2 1 316.464 4.200 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513145087 340395019 /nfs/dbraw/zinc/39/50/19/340395019.db2.gz PYUOBTQAJOMWAT-CBQGHPETSA-N 2 1 320.480 4.411 20 0 DIADMP C[NH+](Cc1ccc(-c2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000513145087 340395020 /nfs/dbraw/zinc/39/50/20/340395020.db2.gz PYUOBTQAJOMWAT-CBQGHPETSA-N 2 1 320.480 4.411 20 0 DIADMP C[NH+](Cc1ccc(-c2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000513145087 340395021 /nfs/dbraw/zinc/39/50/21/340395021.db2.gz PYUOBTQAJOMWAT-CBQGHPETSA-N 2 1 320.480 4.411 20 0 DIADMP Clc1ccsc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000192994140 340571489 /nfs/dbraw/zinc/57/14/89/340571489.db2.gz ABDRGPGVSQVNDX-UHFFFAOYSA-N 2 1 320.889 4.287 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000237580410 340672318 /nfs/dbraw/zinc/67/23/18/340672318.db2.gz YIWIIOZTIRJCGO-QGZVFWFLSA-N 2 1 319.452 4.284 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)([NH+](C)C)C1 ZINC000316209918 340678683 /nfs/dbraw/zinc/67/86/83/340678683.db2.gz VSXUTMNZRIZJKE-QXSJWSMHSA-N 2 1 320.443 4.208 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCCc2ccc(Cl)cc21 ZINC000537967808 340714455 /nfs/dbraw/zinc/71/44/55/340714455.db2.gz AYHDLEZPFYCCDB-FZKQIMNGSA-N 2 1 317.864 4.148 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)C(c1ccccc1)c1ccccc1 ZINC000326430113 340714641 /nfs/dbraw/zinc/71/46/41/340714641.db2.gz RMPCEKQSIJHVCD-QGZVFWFLSA-N 2 1 319.452 4.002 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1ccc(F)cc1)C(C)(C)C ZINC000126210247 340825095 /nfs/dbraw/zinc/82/50/95/340825095.db2.gz BYINHVUVOUPTIZ-GOSISDBHSA-N 2 1 317.452 4.488 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000539216519 340876768 /nfs/dbraw/zinc/87/67/68/340876768.db2.gz FBTNRUXFZQGLLT-KSSFIOAISA-N 2 1 319.880 4.468 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@@H+](C)C2)c2ccccc2)cc1 ZINC000542774078 341019976 /nfs/dbraw/zinc/01/99/76/341019976.db2.gz WXWDNTJHZNCJFV-RXVVDRJESA-N 2 1 308.469 4.016 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000542774078 341019977 /nfs/dbraw/zinc/01/99/77/341019977.db2.gz WXWDNTJHZNCJFV-RXVVDRJESA-N 2 1 308.469 4.016 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CCC3(CCC[N@@H+]3C)CC2)cc1 ZINC000543192695 341036251 /nfs/dbraw/zinc/03/62/51/341036251.db2.gz SJMSFCBLTSNLOV-KRWDZBQOSA-N 2 1 300.490 4.431 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CCC3(CCC[N@H+]3C)CC2)cc1 ZINC000543192695 341036252 /nfs/dbraw/zinc/03/62/52/341036252.db2.gz SJMSFCBLTSNLOV-KRWDZBQOSA-N 2 1 300.490 4.431 20 0 DIADMP CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000543207286 341036687 /nfs/dbraw/zinc/03/66/87/341036687.db2.gz CITABJVYQUMLNS-MSOLQXFVSA-N 2 1 300.490 4.289 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc(Cl)s1 ZINC000543417418 341043474 /nfs/dbraw/zinc/04/34/74/341043474.db2.gz KMSLGQFTJRSLAJ-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)CC[N@@H+]1C ZINC000543591386 341049661 /nfs/dbraw/zinc/04/96/61/341049661.db2.gz HLDOSFPUJPCMIW-AHEZYBDSSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)CC[N@H+]1C ZINC000543591386 341049662 /nfs/dbraw/zinc/04/96/62/341049662.db2.gz HLDOSFPUJPCMIW-AHEZYBDSSA-N 2 1 306.881 4.048 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCCc2ccccc2Cl)C[C@@H]1C ZINC000544146025 341072207 /nfs/dbraw/zinc/07/22/07/341072207.db2.gz PMADLIBYLDJKPW-RDJZCZTQSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCCc2ccccc2Cl)C[C@@H]1C ZINC000544146025 341072208 /nfs/dbraw/zinc/07/22/08/341072208.db2.gz PMADLIBYLDJKPW-RDJZCZTQSA-N 2 1 308.897 4.077 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCCc2ccccc2Cl)C[C@@H]1C ZINC000544146025 341072209 /nfs/dbraw/zinc/07/22/09/341072209.db2.gz PMADLIBYLDJKPW-RDJZCZTQSA-N 2 1 308.897 4.077 20 0 DIADMP CCC(CC)(C[NH2+][C@H](C)[C@H]1CCCO1)[NH2+][C@H](C)c1ccccc1 ZINC000544355444 341077838 /nfs/dbraw/zinc/07/78/38/341077838.db2.gz GHRGNFZZQDCFDG-ZHALLVOQSA-N 2 1 318.505 4.053 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1cc2ccccc2o1)[NH+]1CCCCC1 ZINC000544374192 341078918 /nfs/dbraw/zinc/07/89/18/341078918.db2.gz BQRQDNQOVRTATC-CVEARBPZSA-N 2 1 300.446 4.348 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000544375225 341078980 /nfs/dbraw/zinc/07/89/80/341078980.db2.gz POHAFXGDTSRXJT-SJORKVTESA-N 2 1 304.478 4.000 20 0 DIADMP CCOc1ccccc1[C@@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000544375220 341079053 /nfs/dbraw/zinc/07/90/53/341079053.db2.gz POHAFXGDTSRXJT-DLBZAZTESA-N 2 1 304.478 4.000 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000545952775 341148169 /nfs/dbraw/zinc/14/81/69/341148169.db2.gz BWCYMUNBHISNJM-VDGAXYAQSA-N 2 1 311.473 4.062 20 0 DIADMP Cc1cc(Cl)ccc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000547361157 341208805 /nfs/dbraw/zinc/20/88/05/341208805.db2.gz NLOFEGZEDSEQOO-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548154532 341249899 /nfs/dbraw/zinc/24/98/99/341249899.db2.gz ABLJTDIIFPXQCF-XEYPJELSSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481933 341263132 /nfs/dbraw/zinc/26/31/32/341263132.db2.gz VPYZXKJICQIKDI-CGTJXYLNSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548483642 341263237 /nfs/dbraw/zinc/26/32/37/341263237.db2.gz CCQJDEWSZOLZER-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@@H+]1C ZINC000548721905 341270575 /nfs/dbraw/zinc/27/05/75/341270575.db2.gz DAFCTDJJPAMHOK-AXIYNFMDSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CC2CCC(c3ccccc3)CC2)CC[N@H+]1C ZINC000548721905 341270576 /nfs/dbraw/zinc/27/05/76/341270576.db2.gz DAFCTDJJPAMHOK-AXIYNFMDSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721905 341270577 /nfs/dbraw/zinc/27/05/77/341270577.db2.gz DAFCTDJJPAMHOK-AXIYNFMDSA-N 2 1 314.517 4.375 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CC2CCC(c3ccccc3)CC2)CC[NH+]1C ZINC000548721905 341270578 /nfs/dbraw/zinc/27/05/78/341270578.db2.gz DAFCTDJJPAMHOK-AXIYNFMDSA-N 2 1 314.517 4.375 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCSC2CCCCC2)CC1 ZINC000548783800 341275544 /nfs/dbraw/zinc/27/55/44/341275544.db2.gz LARSIIXRBPEXKJ-UHFFFAOYSA-N 2 1 312.567 4.105 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000245455507 341295099 /nfs/dbraw/zinc/29/50/99/341295099.db2.gz IESXJZHEBZRHFF-HZPDHXFCSA-N 2 1 306.519 4.180 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000549613282 341298962 /nfs/dbraw/zinc/29/89/62/341298962.db2.gz CXINAQDYMHWCOL-QCFAMHMHSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1sccc1C[NH2+]C1CC[NH+](Cc2ccccc2C)CC1 ZINC000549709789 341301128 /nfs/dbraw/zinc/30/11/28/341301128.db2.gz RDWNSCAGLYCVRQ-UHFFFAOYSA-N 2 1 314.498 4.119 20 0 DIADMP Cc1sccc1C[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000550139534 341310971 /nfs/dbraw/zinc/31/09/71/341310971.db2.gz NBYSEBAEYPXRCB-HNNXBMFYSA-N 2 1 314.498 4.372 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550610062 341319451 /nfs/dbraw/zinc/31/94/51/341319451.db2.gz LTPBXTXVLNNCFM-SZVBFZGTSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550610062 341319452 /nfs/dbraw/zinc/31/94/52/341319452.db2.gz LTPBXTXVLNNCFM-SZVBFZGTSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)c1ccc(F)c2ccccc21 ZINC000550623169 341319796 /nfs/dbraw/zinc/31/97/96/341319796.db2.gz SYLOWDLCJAOCPX-VHKYSDTDSA-N 2 1 312.432 4.256 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(F)c2ccccc21 ZINC000550623169 341319797 /nfs/dbraw/zinc/31/97/97/341319797.db2.gz SYLOWDLCJAOCPX-VHKYSDTDSA-N 2 1 312.432 4.256 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550662009 341320900 /nfs/dbraw/zinc/32/09/00/341320900.db2.gz NBRWTKYWAZEIIN-VXKWHMMOSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550662009 341320901 /nfs/dbraw/zinc/32/09/01/341320901.db2.gz NBRWTKYWAZEIIN-VXKWHMMOSA-N 2 1 322.496 4.271 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000550679879 341321288 /nfs/dbraw/zinc/32/12/88/341321288.db2.gz ARAYANNDYIVCJV-OTWHNJEPSA-N 2 1 300.490 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCCCC2(C)C)C[C@@H]1c1ccccc1 ZINC000550679879 341321289 /nfs/dbraw/zinc/32/12/89/341321289.db2.gz ARAYANNDYIVCJV-OTWHNJEPSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700285 341321656 /nfs/dbraw/zinc/32/16/56/341321656.db2.gz CUQSOSKJPHUAGK-BVYCBKJFSA-N 2 1 320.480 4.407 20 0 DIADMP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550700285 341321657 /nfs/dbraw/zinc/32/16/57/341321657.db2.gz CUQSOSKJPHUAGK-BVYCBKJFSA-N 2 1 320.480 4.407 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000550847887 341324391 /nfs/dbraw/zinc/32/43/91/341324391.db2.gz PCKKVUWVFLNEGH-ZWKOTPCHSA-N 2 1 302.506 4.484 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)C(C)(C)C)C[C@@H]1c1ccccc1 ZINC000550847887 341324392 /nfs/dbraw/zinc/32/43/92/341324392.db2.gz PCKKVUWVFLNEGH-ZWKOTPCHSA-N 2 1 302.506 4.484 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000551052202 341330335 /nfs/dbraw/zinc/33/03/35/341330335.db2.gz WWAZVDCIHFJIEL-GSEOLPGOSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000551052202 341330336 /nfs/dbraw/zinc/33/03/36/341330336.db2.gz WWAZVDCIHFJIEL-GSEOLPGOSA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000551052201 341330401 /nfs/dbraw/zinc/33/04/01/341330401.db2.gz WWAZVDCIHFJIEL-BTHPGYMESA-N 2 1 300.490 4.380 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)C1 ZINC000551052201 341330402 /nfs/dbraw/zinc/33/04/02/341330402.db2.gz WWAZVDCIHFJIEL-BTHPGYMESA-N 2 1 300.490 4.380 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000551083650 341331135 /nfs/dbraw/zinc/33/11/35/341331135.db2.gz KIJLJIPUOOOWKP-NBHGPNQESA-N 2 1 323.484 4.130 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000551083650 341331136 /nfs/dbraw/zinc/33/11/36/341331136.db2.gz KIJLJIPUOOOWKP-NBHGPNQESA-N 2 1 323.484 4.130 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C2CCCCC2)C[C@H]1c1ccccc1 ZINC000551086014 341331206 /nfs/dbraw/zinc/33/12/06/341331206.db2.gz LOIINUSQXGIERH-BQJUDKOJSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H]2C2CCCCC2)C[C@H]1c1ccccc1 ZINC000551086014 341331207 /nfs/dbraw/zinc/33/12/07/341331207.db2.gz LOIINUSQXGIERH-BQJUDKOJSA-N 2 1 312.501 4.380 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000551086197 341331268 /nfs/dbraw/zinc/33/12/68/341331268.db2.gz NDVGKVCWDKAETA-RTBURBONSA-N 2 1 300.490 4.382 20 0 DIADMP CCCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000551086197 341331269 /nfs/dbraw/zinc/33/12/69/341331269.db2.gz NDVGKVCWDKAETA-RTBURBONSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2C2CCCCC2)C[C@@H]1c1ccccc1 ZINC000551086017 341331282 /nfs/dbraw/zinc/33/12/82/341331282.db2.gz LOIINUSQXGIERH-UWHLTILDSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2C[C@H]2C2CCCCC2)C[C@@H]1c1ccccc1 ZINC000551086017 341331283 /nfs/dbraw/zinc/33/12/83/341331283.db2.gz LOIINUSQXGIERH-UWHLTILDSA-N 2 1 312.501 4.380 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000551086196 341331294 /nfs/dbraw/zinc/33/12/94/341331294.db2.gz NDVGKVCWDKAETA-RBUKOAKNSA-N 2 1 300.490 4.382 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCC1 ZINC000551086196 341331295 /nfs/dbraw/zinc/33/12/95/341331295.db2.gz NDVGKVCWDKAETA-RBUKOAKNSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CCCc2cccs2)C[C@H]1c1ccccc1 ZINC000551087624 341331378 /nfs/dbraw/zinc/33/13/78/341331378.db2.gz VEJCYHARWUXNAF-MJGOQNOKSA-N 2 1 314.498 4.106 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CCCc2cccs2)C[C@H]1c1ccccc1 ZINC000551087624 341331379 /nfs/dbraw/zinc/33/13/79/341331379.db2.gz VEJCYHARWUXNAF-MJGOQNOKSA-N 2 1 314.498 4.106 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)[C@@H]2CCC[C@@H]21 ZINC000551308026 341338024 /nfs/dbraw/zinc/33/80/24/341338024.db2.gz IUCWJIUJABJHLD-NCTLDZBQSA-N 2 1 318.892 4.048 20 0 DIADMP Cc1ccccc1C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)C1CC1 ZINC000551530960 341344185 /nfs/dbraw/zinc/34/41/85/341344185.db2.gz ZNNFGKAWXFVOSO-GHTZIAJQSA-N 2 1 314.517 4.026 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246747597 341356760 /nfs/dbraw/zinc/35/67/60/341356760.db2.gz FRQWAPDAIXZARS-KBPBESRZSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246747597 341356761 /nfs/dbraw/zinc/35/67/61/341356761.db2.gz FRQWAPDAIXZARS-KBPBESRZSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000246747597 341356762 /nfs/dbraw/zinc/35/67/62/341356762.db2.gz FRQWAPDAIXZARS-KBPBESRZSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246747597 341356763 /nfs/dbraw/zinc/35/67/63/341356763.db2.gz FRQWAPDAIXZARS-KBPBESRZSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccco1 ZINC000246816791 341357288 /nfs/dbraw/zinc/35/72/88/341357288.db2.gz AXSFWADWUHJDNE-IAGOWNOFSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccco1 ZINC000246816791 341357289 /nfs/dbraw/zinc/35/72/89/341357289.db2.gz AXSFWADWUHJDNE-IAGOWNOFSA-N 2 1 312.457 4.362 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2cccc(F)c2)C2CCCC2)CC[N@@H+]1C ZINC000246959448 341359208 /nfs/dbraw/zinc/35/92/08/341359208.db2.gz HSPTWSPAYLJTCC-CCKFTAQKSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H](c2cccc(F)c2)C2CCCC2)CC[N@H+]1C ZINC000246959448 341359209 /nfs/dbraw/zinc/35/92/09/341359209.db2.gz HSPTWSPAYLJTCC-CCKFTAQKSA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)s2)C1 ZINC000246989506 341359648 /nfs/dbraw/zinc/35/96/48/341359648.db2.gz KNXDNVZRMQPHIP-OLZOCXBDSA-N 2 1 300.899 4.173 20 0 DIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccoc1 ZINC000247049010 341360314 /nfs/dbraw/zinc/36/03/14/341360314.db2.gz MCDXQJCUKWWSNN-YZLZLFLDSA-N 2 1 312.457 4.087 20 0 DIADMP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccoc1 ZINC000247049010 341360315 /nfs/dbraw/zinc/36/03/15/341360315.db2.gz MCDXQJCUKWWSNN-YZLZLFLDSA-N 2 1 312.457 4.087 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)o1 ZINC000248392443 341376289 /nfs/dbraw/zinc/37/62/89/341376289.db2.gz DBAFEGDFLDAWQY-JYJNAYRXSA-N 2 1 304.478 4.146 20 0 DIADMP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)o1 ZINC000248392443 341376290 /nfs/dbraw/zinc/37/62/90/341376290.db2.gz DBAFEGDFLDAWQY-JYJNAYRXSA-N 2 1 304.478 4.146 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248404298 341376641 /nfs/dbraw/zinc/37/66/41/341376641.db2.gz PYHXALBEYGXWMO-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248404298 341376642 /nfs/dbraw/zinc/37/66/42/341376642.db2.gz PYHXALBEYGXWMO-ILXRZTDVSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248400482 341376684 /nfs/dbraw/zinc/37/66/84/341376684.db2.gz KXZSJJQURGJYMZ-HBFSDRIKSA-N 2 1 314.517 4.250 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248408537 341377013 /nfs/dbraw/zinc/37/70/13/341377013.db2.gz VPHBYAIICHPPAD-LNLFQRSKSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248412019 341377149 /nfs/dbraw/zinc/37/71/49/341377149.db2.gz ZXBRGVGSQSKPOU-DRMAHVMPSA-N 2 1 316.489 4.146 20 0 DIADMP C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248412019 341377150 /nfs/dbraw/zinc/37/71/50/341377150.db2.gz ZXBRGVGSQSKPOU-DRMAHVMPSA-N 2 1 316.489 4.146 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1 ZINC000248542539 341379596 /nfs/dbraw/zinc/37/95/96/341379596.db2.gz BZZDHYGIZVKXJY-AOIWGVFYSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@H](c1cccc(Cl)c1F)N1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000248551238 341379769 /nfs/dbraw/zinc/37/97/69/341379769.db2.gz INJANAXEMLKNSI-XJKCOSOUSA-N 2 1 321.827 4.320 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CC=CCC2)CC1 ZINC000552250932 341381379 /nfs/dbraw/zinc/38/13/79/341381379.db2.gz FZYTUHBLZHMEPO-PELRDEGISA-N 2 1 312.501 4.376 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000552251058 341381399 /nfs/dbraw/zinc/38/13/99/341381399.db2.gz JMIIKAXCOYODHA-CVYDXHPNSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)[C@@H]1CC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000552251058 341381400 /nfs/dbraw/zinc/38/14/00/341381400.db2.gz JMIIKAXCOYODHA-CVYDXHPNSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000248682689 341384127 /nfs/dbraw/zinc/38/41/27/341384127.db2.gz DZMNORDPZFGKBQ-CHWSQXEVSA-N 2 1 300.899 4.173 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2csc(Cl)c2)C1 ZINC000248682689 341384128 /nfs/dbraw/zinc/38/41/28/341384128.db2.gz DZMNORDPZFGKBQ-CHWSQXEVSA-N 2 1 300.899 4.173 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000248754157 341385865 /nfs/dbraw/zinc/38/58/65/341385865.db2.gz UTVWYLRNAFKCNM-LBDPXKHJSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000248754157 341385866 /nfs/dbraw/zinc/38/58/66/341385866.db2.gz UTVWYLRNAFKCNM-LBDPXKHJSA-N 2 1 320.443 4.017 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CC2CCC(C(F)(F)F)CC2)[C@@H](C)C1 ZINC000248754157 341385867 /nfs/dbraw/zinc/38/58/67/341385867.db2.gz UTVWYLRNAFKCNM-LBDPXKHJSA-N 2 1 320.443 4.017 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000249434339 341397611 /nfs/dbraw/zinc/39/76/11/341397611.db2.gz FAZCYIVPVDRPSC-CVEARBPZSA-N 2 1 306.519 4.180 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1Cl ZINC000552549896 341398394 /nfs/dbraw/zinc/39/83/94/341398394.db2.gz CDGJLCJUPZGLTD-ZDUSSCGKSA-N 2 1 324.896 4.262 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](c1ccc(F)cc1)C1CCCC1 ZINC000566415377 341557182 /nfs/dbraw/zinc/55/71/82/341557182.db2.gz CZUKIZGWUSLQEL-IBGZPJMESA-N 2 1 315.436 4.013 20 0 DIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2csc(C)n2)cc1 ZINC000269431535 341609749 /nfs/dbraw/zinc/60/97/49/341609749.db2.gz PTERHJHMGKLBLV-AWEZNQCLSA-N 2 1 317.502 4.144 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(C)cc1)C1CCC1 ZINC000427703502 518193415 /nfs/dbraw/zinc/19/34/15/518193415.db2.gz FRUXLQDSENELRJ-UZLBHIALSA-N 2 1 311.473 4.267 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1cccc2[nH]ccc21 ZINC000236659283 519630302 /nfs/dbraw/zinc/63/03/02/519630302.db2.gz NOQZBPJHDZHBDB-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)Sc3sccc32)CC1 ZINC000336825672 519672661 /nfs/dbraw/zinc/67/26/61/519672661.db2.gz AUDWYJRCYVOLQU-IUODEOHRSA-N 2 1 310.532 4.136 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)s1 ZINC000157909063 522231134 /nfs/dbraw/zinc/23/11/34/522231134.db2.gz CGJINFXFHJNPDR-GJZGRUSLSA-N 2 1 323.550 4.177 20 0 DIADMP Cc1cccc(NCc2ccccc2C[N@H+](C)Cc2ccco2)[nH+]1 ZINC000157702625 524687145 /nfs/dbraw/zinc/68/71/45/524687145.db2.gz CLHXUBMOFPTNCY-UHFFFAOYSA-N 2 1 321.424 4.227 20 0 DIADMP Cc1cccc(NCc2ccccc2C[N@@H+](C)Cc2ccco2)[nH+]1 ZINC000157702625 524687155 /nfs/dbraw/zinc/68/71/55/524687155.db2.gz CLHXUBMOFPTNCY-UHFFFAOYSA-N 2 1 321.424 4.227 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cccnc1Cl ZINC000157861774 525334601 /nfs/dbraw/zinc/33/46/01/525334601.db2.gz QGVLGGDYSXJOKG-CABCVRRESA-N 2 1 309.885 4.040 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccccn1 ZINC000158888424 525533014 /nfs/dbraw/zinc/53/30/14/525533014.db2.gz IOLXQRVQHCWZHZ-GOSISDBHSA-N 2 1 323.484 4.308 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCS2 ZINC000129110814 526967511 /nfs/dbraw/zinc/96/75/11/526967511.db2.gz MYTLDITXSXLPCK-IIAWOOMASA-N 2 1 322.905 4.093 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCS2 ZINC000129110814 526967515 /nfs/dbraw/zinc/96/75/15/526967515.db2.gz MYTLDITXSXLPCK-IIAWOOMASA-N 2 1 322.905 4.093 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCS2 ZINC000129111228 526967538 /nfs/dbraw/zinc/96/75/38/526967538.db2.gz MYTLDITXSXLPCK-SQWLQELKSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCS2 ZINC000129111228 526967539 /nfs/dbraw/zinc/96/75/39/526967539.db2.gz MYTLDITXSXLPCK-SQWLQELKSA-N 2 1 322.905 4.093 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000338008731 527422325 /nfs/dbraw/zinc/42/23/25/527422325.db2.gz TYEJZRSEUCFJBV-HNNXBMFYSA-N 2 1 311.429 4.295 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1cc2ccccc2o1)C(C)C ZINC000338012025 527422347 /nfs/dbraw/zinc/42/23/47/527422347.db2.gz KSARVIRSTCXWDB-LJQANCHMSA-N 2 1 311.429 4.315 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000338016714 527422892 /nfs/dbraw/zinc/42/28/92/527422892.db2.gz WXIAKBDFZSQSTQ-HXUWFJFHSA-N 2 1 323.415 4.100 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl ZINC000338009268 527423111 /nfs/dbraw/zinc/42/31/11/527423111.db2.gz TXMHWSQGTKECEU-AEFFLSMTSA-N 2 1 317.864 4.161 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(Cl)cs1 ZINC000486949623 1049494262 /nfs/dbraw/zinc/49/42/62/1049494262.db2.gz ISAHONUKQWXPBU-CYBMUJFWSA-N 2 1 300.899 4.146 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Cl)c1Cl ZINC000643546261 1035591741 /nfs/dbraw/zinc/59/17/41/1035591741.db2.gz LKKMVHCAXZAVKW-VXGBXAGGSA-N 2 1 313.272 4.319 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(-c2ccccc2)o1 ZINC000643546379 1035591788 /nfs/dbraw/zinc/59/17/88/1035591788.db2.gz NWARALHZFRESMD-NVXWUHKLSA-N 2 1 310.441 4.272 20 0 DIADMP CC/C=C\CC[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001208734309 1035838352 /nfs/dbraw/zinc/83/83/52/1035838352.db2.gz VXDFBSVWRKMBKL-VLAJDJSHSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001208734309 1035838374 /nfs/dbraw/zinc/83/83/74/1035838374.db2.gz VXDFBSVWRKMBKL-VLAJDJSHSA-N 2 1 312.501 4.187 20 0 DIADMP CC/C=C\CC[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001208734309 1035838391 /nfs/dbraw/zinc/83/83/91/1035838391.db2.gz VXDFBSVWRKMBKL-VLAJDJSHSA-N 2 1 312.501 4.187 20 0 DIADMP C[C@@H](N[C@@H](C)c1cccc(F)c1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183191988 1035892625 /nfs/dbraw/zinc/89/26/25/1035892625.db2.gz PYHXALBEYGXWMO-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183191988 1035892647 /nfs/dbraw/zinc/89/26/47/1035892647.db2.gz PYHXALBEYGXWMO-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183191988 1035892667 /nfs/dbraw/zinc/89/26/67/1035892667.db2.gz PYHXALBEYGXWMO-QLFBSQMISA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1F ZINC000183194406 1035908407 /nfs/dbraw/zinc/90/84/07/1035908407.db2.gz CHSPSCLBRIKFCS-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1F ZINC000183194406 1035908414 /nfs/dbraw/zinc/90/84/14/1035908414.db2.gz CHSPSCLBRIKFCS-SOUVJXGZSA-N 2 1 322.443 4.268 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C[C@H](C)Cn2cc[nH+]c2C)cc1 ZINC000339682887 1035913988 /nfs/dbraw/zinc/91/39/88/1035913988.db2.gz MSEQVWOXHCIPBU-GJZGRUSLSA-N 2 1 317.502 4.290 20 0 DIADMP C[C@H](NCc1cccc(F)c1F)c1ccc(-n2ccnc2)cc1 ZINC000073617874 1035916582 /nfs/dbraw/zinc/91/65/82/1035916582.db2.gz KEVSIEBGPFKGLJ-ZDUSSCGKSA-N 2 1 313.351 4.001 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583994262 1035922285 /nfs/dbraw/zinc/92/22/85/1035922285.db2.gz UHMVJNJNXAHIMW-KRWDZBQOSA-N 2 1 322.443 4.209 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000583994262 1035922298 /nfs/dbraw/zinc/92/22/98/1035922298.db2.gz UHMVJNJNXAHIMW-KRWDZBQOSA-N 2 1 322.443 4.209 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C[C@H]2CC=CCC2)C1 ZINC001648792536 1036081345 /nfs/dbraw/zinc/08/13/45/1036081345.db2.gz PTKDOYJVJYPDDU-OALUTQOASA-N 2 1 312.501 4.364 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001209453171 1036198477 /nfs/dbraw/zinc/19/84/77/1036198477.db2.gz ZLHHACKPBSQIPP-SFHVURJKSA-N 2 1 318.530 4.421 20 0 DIADMP c1c2ccccc2oc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000236631163 1036299888 /nfs/dbraw/zinc/29/98/88/1036299888.db2.gz COJGGRIUNQQINS-UHFFFAOYSA-N 2 1 312.457 4.320 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]C2CCC(C)CC2)CC1 ZINC000236825385 1036317697 /nfs/dbraw/zinc/31/76/97/1036317697.db2.gz SNIHNIKSZHWMAU-HFCFLWKCSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001648811683 1036493858 /nfs/dbraw/zinc/49/38/58/1036493858.db2.gz VBKVSEAWMOWSJM-TWFHAPMSSA-N 2 1 314.517 4.443 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CC[C@@H](C)SC2)CC1 ZINC000655715598 1036498517 /nfs/dbraw/zinc/49/85/17/1036498517.db2.gz MHNAUUORDCBPHQ-MDZRGWNJSA-N 2 1 318.530 4.086 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@H]2CCCC[C@H]2C)CC1 ZINC001648826619 1036604408 /nfs/dbraw/zinc/60/44/08/1036604408.db2.gz LVLJRLYAJOVLEJ-IEBWSBKVSA-N 2 1 314.517 4.375 20 0 DIADMP c1sc(C[NH2+]C2CC[NH+](C3CC3)CC2)cc1-c1ccccc1 ZINC000077290335 1036709998 /nfs/dbraw/zinc/70/99/98/1036709998.db2.gz MEWFDGXMUAQWOC-UHFFFAOYSA-N 2 1 312.482 4.132 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(C)c1 ZINC001167325430 1036731086 /nfs/dbraw/zinc/73/10/86/1036731086.db2.gz AWSDGCPVKCTVLN-FQEVSTJZSA-N 2 1 314.517 4.391 20 0 DIADMP FCc1ccccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001167326326 1036739100 /nfs/dbraw/zinc/73/91/00/1036739100.db2.gz KQDLQYIWXNFIFS-SFHVURJKSA-N 2 1 318.480 4.244 20 0 DIADMP FCc1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001167326326 1036739117 /nfs/dbraw/zinc/73/91/17/1036739117.db2.gz KQDLQYIWXNFIFS-SFHVURJKSA-N 2 1 318.480 4.244 20 0 DIADMP CCc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000398023175 1037082890 /nfs/dbraw/zinc/08/28/90/1037082890.db2.gz KWHYCSMFSXAMGL-AVRDEDQJSA-N 2 1 322.496 4.249 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398041105 1037109040 /nfs/dbraw/zinc/10/90/40/1037109040.db2.gz RWVJKFRAKGYXJQ-CMKODMSKSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398041105 1037109046 /nfs/dbraw/zinc/10/90/46/1037109046.db2.gz RWVJKFRAKGYXJQ-CMKODMSKSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+]([C@H]2CCc3ccccc32)C1 ZINC001167424473 1037227193 /nfs/dbraw/zinc/22/71/93/1037227193.db2.gz KABUXRTVSLDPNJ-OPYAIIAOSA-N 2 1 312.501 4.260 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001167424473 1037227195 /nfs/dbraw/zinc/22/71/95/1037227195.db2.gz KABUXRTVSLDPNJ-OPYAIIAOSA-N 2 1 312.501 4.260 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+]([C@H]2CCc3ccccc32)C1 ZINC001167424471 1037228006 /nfs/dbraw/zinc/22/80/06/1037228006.db2.gz KABUXRTVSLDPNJ-LQWHRVPQSA-N 2 1 312.501 4.260 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc32)C1 ZINC001167424471 1037228021 /nfs/dbraw/zinc/22/80/21/1037228021.db2.gz KABUXRTVSLDPNJ-LQWHRVPQSA-N 2 1 312.501 4.260 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C=CCCCCC1 ZINC000398179717 1037269811 /nfs/dbraw/zinc/26/98/11/1037269811.db2.gz WSZZBPSWUOMEDB-GIVPXCGWSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C=CCCCCC1 ZINC000398179717 1037269830 /nfs/dbraw/zinc/26/98/30/1037269830.db2.gz WSZZBPSWUOMEDB-GIVPXCGWSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCC(C)(C)C1 ZINC000398189035 1037278753 /nfs/dbraw/zinc/27/87/53/1037278753.db2.gz MEPAYFOFOSLYPJ-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCC(C)(C)C1 ZINC000398189035 1037278765 /nfs/dbraw/zinc/27/87/65/1037278765.db2.gz MEPAYFOFOSLYPJ-HOJAQTOUSA-N 2 1 314.517 4.455 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[N@@H+]2CC2CCCC2)cc1 ZINC000656401158 1037443521 /nfs/dbraw/zinc/44/35/21/1037443521.db2.gz AJYIUYCMKSMVPX-LRSLUSHPSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@@H+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[NH+]2CC2CCCC2)cc1 ZINC000656401158 1037443526 /nfs/dbraw/zinc/44/35/26/1037443526.db2.gz AJYIUYCMKSMVPX-LRSLUSHPSA-N 2 1 324.512 4.019 20 0 DIADMP c1ccc(C[N@H+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[NH+]2CC2CCCC2)cc1 ZINC000656401158 1037443530 /nfs/dbraw/zinc/44/35/30/1037443530.db2.gz AJYIUYCMKSMVPX-LRSLUSHPSA-N 2 1 324.512 4.019 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@H+]2CCC[NH+](CC)CC)o1 ZINC001167452999 1037515352 /nfs/dbraw/zinc/51/53/52/1037515352.db2.gz HGJFKQKGMPTONU-SFHVURJKSA-N 2 1 306.494 4.491 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@@H+]2CCC[NH+](CC)CC)o1 ZINC001167452999 1037515361 /nfs/dbraw/zinc/51/53/61/1037515361.db2.gz HGJFKQKGMPTONU-SFHVURJKSA-N 2 1 306.494 4.491 20 0 DIADMP c1ccc(-c2ccc(CC[NH2+]C3CC[NH+](C4CC4)CC3)cc2)cc1 ZINC000656507803 1037574491 /nfs/dbraw/zinc/57/44/91/1037574491.db2.gz GNOHFLOYQKDBGA-UHFFFAOYSA-N 2 1 320.480 4.113 20 0 DIADMP Clc1csc(CNC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000093093159 1037621805 /nfs/dbraw/zinc/62/18/05/1037621805.db2.gz FNCGVKXMIQNMRK-UHFFFAOYSA-N 2 1 320.889 4.156 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000581554132 1037733384 /nfs/dbraw/zinc/73/33/84/1037733384.db2.gz UOUJRTBWGUCPNW-LRQRDZAKSA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000581554132 1037733400 /nfs/dbraw/zinc/73/34/00/1037733400.db2.gz UOUJRTBWGUCPNW-LRQRDZAKSA-N 2 1 324.468 4.181 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1C(C)=CCC[C@H]1C ZINC000581694065 1037921299 /nfs/dbraw/zinc/92/12/99/1037921299.db2.gz BLBSHURJJLHISS-MSOLQXFVSA-N 2 1 303.494 4.150 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1C(C)=CCC[C@H]1C ZINC000581694065 1037921309 /nfs/dbraw/zinc/92/13/09/1037921309.db2.gz BLBSHURJJLHISS-MSOLQXFVSA-N 2 1 303.494 4.150 20 0 DIADMP CC(C)(C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000684410399 1037956089 /nfs/dbraw/zinc/95/60/89/1037956089.db2.gz WUOKDIJFRIEGDF-FQEVSTJZSA-N 2 1 322.496 4.076 20 0 DIADMP Cc1ncc([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)s1 ZINC000090418588 1038113674 /nfs/dbraw/zinc/11/36/74/1038113674.db2.gz YODARWXGXNPQJE-HUUCEWRRSA-N 2 1 317.502 4.013 20 0 DIADMP Cc1ncc([C@@H](C)[NH2+]CC[C@@H](C)[N@@H+](C)Cc2ccccc2)s1 ZINC000090418588 1038113696 /nfs/dbraw/zinc/11/36/96/1038113696.db2.gz YODARWXGXNPQJE-HUUCEWRRSA-N 2 1 317.502 4.013 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@H]1c1cccc(C)c1C ZINC000535668624 1038312613 /nfs/dbraw/zinc/31/26/13/1038312613.db2.gz UONOGUFBOXXUSQ-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@H]1c1cccc(C)c1C ZINC000535668624 1038312631 /nfs/dbraw/zinc/31/26/31/1038312631.db2.gz UONOGUFBOXXUSQ-FQEVSTJZSA-N 2 1 311.473 4.426 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](CCc1ccccc1)C1CCCC1 ZINC000535668780 1038313537 /nfs/dbraw/zinc/31/35/37/1038313537.db2.gz BKEQPAVIYGCLAO-UHFFFAOYSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](CCc1ccccc1)C1CCCC1 ZINC000535668780 1038313552 /nfs/dbraw/zinc/31/35/52/1038313552.db2.gz BKEQPAVIYGCLAO-UHFFFAOYSA-N 2 1 311.473 4.069 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001167499254 1038452760 /nfs/dbraw/zinc/45/27/60/1038452760.db2.gz FGPYBRPJZIKENK-HLAWJBBLSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001167499254 1038452765 /nfs/dbraw/zinc/45/27/65/1038452765.db2.gz FGPYBRPJZIKENK-HLAWJBBLSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001167499254 1038452769 /nfs/dbraw/zinc/45/27/69/1038452769.db2.gz FGPYBRPJZIKENK-HLAWJBBLSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)c1ccccc1 ZINC000604902873 1038459684 /nfs/dbraw/zinc/45/96/84/1038459684.db2.gz GKLKTWFFZFZKGC-PMACEKPBSA-N 2 1 314.517 4.234 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102086 1038514628 /nfs/dbraw/zinc/51/46/28/1038514628.db2.gz CJDJYUZVCZAQCO-GXTWGEPZSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102086 1038514640 /nfs/dbraw/zinc/51/46/40/1038514640.db2.gz CJDJYUZVCZAQCO-GXTWGEPZSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102086 1038514649 /nfs/dbraw/zinc/51/46/49/1038514649.db2.gz CJDJYUZVCZAQCO-GXTWGEPZSA-N 2 1 314.395 4.068 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(C(F)F)c(F)c2)C[C@@H]1C ZINC000892102086 1038514658 /nfs/dbraw/zinc/51/46/58/1038514658.db2.gz CJDJYUZVCZAQCO-GXTWGEPZSA-N 2 1 314.395 4.068 20 0 DIADMP Cc1cccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000072097768 1038590657 /nfs/dbraw/zinc/59/06/57/1038590657.db2.gz WSOAUWMXPJVQNR-UHFFFAOYSA-N 2 1 322.496 4.339 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000684773102 1038597052 /nfs/dbraw/zinc/59/70/52/1038597052.db2.gz CDMOWBWMBIWLAA-WBVHZDCISA-N 2 1 306.519 4.066 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557929 1038618245 /nfs/dbraw/zinc/61/82/45/1038618245.db2.gz AGTJPDHLOFJFKH-SFHVURJKSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557929 1038618248 /nfs/dbraw/zinc/61/82/48/1038618248.db2.gz AGTJPDHLOFJFKH-SFHVURJKSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557929 1038618252 /nfs/dbraw/zinc/61/82/52/1038618252.db2.gz AGTJPDHLOFJFKH-SFHVURJKSA-N 2 1 318.505 4.028 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001167557929 1038618254 /nfs/dbraw/zinc/61/82/54/1038618254.db2.gz AGTJPDHLOFJFKH-SFHVURJKSA-N 2 1 318.505 4.028 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cccc(F)c2Cl)CC1 ZINC001140563405 1038650148 /nfs/dbraw/zinc/65/01/48/1038650148.db2.gz VKESXVNAAGIBMD-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@H]([NH3+])C[C@@H]3C)s2)cc1 ZINC000563350715 1038661515 /nfs/dbraw/zinc/66/15/15/1038661515.db2.gz QDUJNWQVGXSQON-HOCLYGCPSA-N 2 1 300.471 4.035 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC001167599812 1038760314 /nfs/dbraw/zinc/76/03/14/1038760314.db2.gz ZSCLTQRZXWFYOP-IBGZPJMESA-N 2 1 322.496 4.312 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001167599812 1038760319 /nfs/dbraw/zinc/76/03/19/1038760319.db2.gz ZSCLTQRZXWFYOP-IBGZPJMESA-N 2 1 322.496 4.312 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001167599812 1038760327 /nfs/dbraw/zinc/76/03/27/1038760327.db2.gz ZSCLTQRZXWFYOP-IBGZPJMESA-N 2 1 322.496 4.312 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000608061594 1038761616 /nfs/dbraw/zinc/76/16/16/1038761616.db2.gz ZJUQMEOIDQSMIR-XJKSGUPXSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000608061594 1038761619 /nfs/dbraw/zinc/76/16/19/1038761619.db2.gz ZJUQMEOIDQSMIR-XJKSGUPXSA-N 2 1 318.461 4.127 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000342859606 1038924038 /nfs/dbraw/zinc/92/40/38/1038924038.db2.gz JRXCMULWTCTYGR-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000342859606 1038924048 /nfs/dbraw/zinc/92/40/48/1038924048.db2.gz JRXCMULWTCTYGR-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCCCc1cccc(Cl)c1 ZINC001167635488 1039021017 /nfs/dbraw/zinc/02/10/17/1039021017.db2.gz LWQFQVDHTKYKTE-MOPGFXCFSA-N 2 1 320.908 4.221 20 0 DIADMP CC1(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCC1 ZINC001167648700 1039083669 /nfs/dbraw/zinc/08/36/69/1039083669.db2.gz WYLALHYAZGUXBY-WOJBJXKFSA-N 2 1 312.501 4.163 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1CC1CCC(F)(F)CC1 ZINC001207346752 1039085043 /nfs/dbraw/zinc/08/50/43/1039085043.db2.gz AAROEWSSZFVYRL-DLBZAZTESA-N 2 1 314.464 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CC1CCC(F)(F)CC1 ZINC001207346752 1039085062 /nfs/dbraw/zinc/08/50/62/1039085062.db2.gz AAROEWSSZFVYRL-DLBZAZTESA-N 2 1 314.464 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1CC1CCC(F)(F)CC1 ZINC001207346752 1039085082 /nfs/dbraw/zinc/08/50/82/1039085082.db2.gz AAROEWSSZFVYRL-DLBZAZTESA-N 2 1 314.464 4.151 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000052120154 1039151191 /nfs/dbraw/zinc/15/11/91/1039151191.db2.gz FWBJEWMYODJQIK-UHFFFAOYSA-N 2 1 315.420 4.288 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2F)c1 ZINC000123872611 1039177799 /nfs/dbraw/zinc/17/77/99/1039177799.db2.gz LKFALAKAVLNVAT-HNNXBMFYSA-N 2 1 300.421 4.128 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000539499525 1039274276 /nfs/dbraw/zinc/27/42/76/1039274276.db2.gz GVAXIUWQDQAHJV-CRAIPNDOSA-N 2 1 306.469 4.234 20 0 DIADMP CCOc1cccc2cc([C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)oc21 ZINC000539498025 1039275731 /nfs/dbraw/zinc/27/57/31/1039275731.db2.gz CNYRFZKYEXRUAK-AWEZNQCLSA-N 2 1 318.461 4.070 20 0 DIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C)oc21 ZINC000539498028 1039275807 /nfs/dbraw/zinc/27/58/07/1039275807.db2.gz CNYRFZKYEXRUAK-CQSZACIVSA-N 2 1 318.461 4.070 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000539547084 1039286821 /nfs/dbraw/zinc/28/68/21/1039286821.db2.gz NTHFUBGDHFFWMU-HNAYVOBHSA-N 2 1 300.446 4.061 20 0 DIADMP CC(C)(C)C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000539825339 1039345185 /nfs/dbraw/zinc/34/51/85/1039345185.db2.gz RTZSOOOQTAUBFT-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2csc3ccccc23)C[C@H]1C ZINC000539818120 1039348889 /nfs/dbraw/zinc/34/88/89/1039348889.db2.gz QPQFOZQPUIGGIP-ZBFHGGJFSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2csc3ccccc23)C[C@H]1C ZINC000539818120 1039348895 /nfs/dbraw/zinc/34/88/95/1039348895.db2.gz QPQFOZQPUIGGIP-ZBFHGGJFSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2csc3ccccc23)C[C@H]1C ZINC000539818120 1039348897 /nfs/dbraw/zinc/34/88/97/1039348897.db2.gz QPQFOZQPUIGGIP-ZBFHGGJFSA-N 2 1 302.487 4.206 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2csc3ccccc23)C[C@H]1C ZINC000539818116 1039349684 /nfs/dbraw/zinc/34/96/84/1039349684.db2.gz QPQFOZQPUIGGIP-GDBMZVCRSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2csc3ccccc23)C[C@H]1C ZINC000539818116 1039349697 /nfs/dbraw/zinc/34/96/97/1039349697.db2.gz QPQFOZQPUIGGIP-GDBMZVCRSA-N 2 1 302.487 4.206 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2csc3ccccc23)C[C@H]1C ZINC000539818116 1039349713 /nfs/dbraw/zinc/34/97/13/1039349713.db2.gz QPQFOZQPUIGGIP-GDBMZVCRSA-N 2 1 302.487 4.206 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccsc1 ZINC000669850675 1039382610 /nfs/dbraw/zinc/38/26/10/1039382610.db2.gz FFTNHVPFHZOVIY-RKVPGOIHSA-N 2 1 306.519 4.442 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc2c(c1)CCCC2 ZINC000540168876 1039436673 /nfs/dbraw/zinc/43/66/73/1039436673.db2.gz NXSRXVRGZYVRME-JKSUJKDBSA-N 2 1 311.473 4.057 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(Cl)s2)C1 ZINC000151136565 1039451902 /nfs/dbraw/zinc/45/19/02/1039451902.db2.gz WMDGNJDRYXUOJU-STQMWFEESA-N 2 1 300.899 4.174 20 0 DIADMP CC(C)[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(F)ccc1F ZINC000650754907 1039460696 /nfs/dbraw/zinc/46/06/96/1039460696.db2.gz USNHETVNUBQALB-SFHVURJKSA-N 2 1 322.374 4.050 20 0 DIADMP C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccnc3ccsc32)C1 ZINC000540286772 1039467434 /nfs/dbraw/zinc/46/74/34/1039467434.db2.gz NJBHFADDWURZGI-QLFBSQMISA-N 2 1 315.486 4.138 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1cccc(F)c1)C1CCCC1 ZINC000540432567 1039496777 /nfs/dbraw/zinc/49/67/77/1039496777.db2.gz AGYXFYUOXAEKQC-LJQANCHMSA-N 2 1 315.436 4.242 20 0 DIADMP CCOc1cccc2cc([C@H](C)[NH2+]CCC[N@H+](C)C(C)C)oc21 ZINC000540596484 1039522565 /nfs/dbraw/zinc/52/25/65/1039522565.db2.gz DQSMBVXPGGJHJF-HNNXBMFYSA-N 2 1 318.461 4.212 20 0 DIADMP CCOc1cccc2cc([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)oc21 ZINC000540596484 1039522573 /nfs/dbraw/zinc/52/25/73/1039522573.db2.gz DQSMBVXPGGJHJF-HNNXBMFYSA-N 2 1 318.461 4.212 20 0 DIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)oc21 ZINC000540596486 1039523502 /nfs/dbraw/zinc/52/35/02/1039523502.db2.gz DQSMBVXPGGJHJF-OAHLLOKOSA-N 2 1 318.461 4.212 20 0 DIADMP CCOc1cccc2cc([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)oc21 ZINC000540596486 1039523509 /nfs/dbraw/zinc/52/35/09/1039523509.db2.gz DQSMBVXPGGJHJF-OAHLLOKOSA-N 2 1 318.461 4.212 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C[C@H]2CCc3ccccc32)C[C@H]1c1ccccc1 ZINC000584060194 1039585089 /nfs/dbraw/zinc/58/50/89/1039585089.db2.gz PICHGEWJPWVZGB-URVUXULASA-N 2 1 320.480 4.142 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCc3ccccc32)C[C@H]1c1ccccc1 ZINC000584060194 1039585101 /nfs/dbraw/zinc/58/51/01/1039585101.db2.gz PICHGEWJPWVZGB-URVUXULASA-N 2 1 320.480 4.142 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)C1 ZINC000540989830 1039605787 /nfs/dbraw/zinc/60/57/87/1039605787.db2.gz XJFRINQGYYFQRI-CXAGYDPISA-N 2 1 312.860 4.108 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCCCC(F)(F)F)C2)CC1 ZINC000151637742 1039612448 /nfs/dbraw/zinc/61/24/48/1039612448.db2.gz UXKLQCDIORUMJX-MRXNPFEDSA-N 2 1 320.443 4.163 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCCCC(F)(F)F)C2)CC1 ZINC000151637742 1039612457 /nfs/dbraw/zinc/61/24/57/1039612457.db2.gz UXKLQCDIORUMJX-MRXNPFEDSA-N 2 1 320.443 4.163 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+]1CCCCC[C@H]1/C=C/c1cccs1 ZINC000541203183 1039632525 /nfs/dbraw/zinc/63/25/25/1039632525.db2.gz VHTQDTUPKKDHEQ-IJDCCNJMSA-N 2 1 315.486 4.211 20 0 DIADMP Cc1[nH+]ccn1CC[N@H+]1CCCCC[C@H]1/C=C/c1cccs1 ZINC000541203183 1039632534 /nfs/dbraw/zinc/63/25/34/1039632534.db2.gz VHTQDTUPKKDHEQ-IJDCCNJMSA-N 2 1 315.486 4.211 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)C(C)(C)C(F)F)CC1 ZINC000657840234 1039685533 /nfs/dbraw/zinc/68/55/33/1039685533.db2.gz NXKWSVAUFNQQEX-HNNXBMFYSA-N 2 1 324.459 4.229 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(C)oc2C)c1 ZINC000278765125 1039758944 /nfs/dbraw/zinc/75/89/44/1039758944.db2.gz OUOUGWHHDPUKLP-OAHLLOKOSA-N 2 1 300.446 4.199 20 0 DIADMP C[C@H](Cc1ccsc1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542151112 1039802089 /nfs/dbraw/zinc/80/20/89/1039802089.db2.gz ADXYQOWMKXKHJF-ZHALLVOQSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@H](Cc1ccsc1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542151112 1039802099 /nfs/dbraw/zinc/80/20/99/1039802099.db2.gz ADXYQOWMKXKHJF-ZHALLVOQSA-N 2 1 320.546 4.266 20 0 DIADMP C[C@H](Cc1ccsc1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542151112 1039802105 /nfs/dbraw/zinc/80/21/05/1039802105.db2.gz ADXYQOWMKXKHJF-ZHALLVOQSA-N 2 1 320.546 4.266 20 0 DIADMP Cc1cc2cc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)oc2cc1C ZINC000092072994 1039866301 /nfs/dbraw/zinc/86/63/01/1039866301.db2.gz OWJRVCFUIHQBNX-HNNXBMFYSA-N 2 1 309.413 4.152 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccncc3s2)C1 ZINC000657872561 1039953379 /nfs/dbraw/zinc/95/33/79/1039953379.db2.gz OBWZEGIGBVORQM-GJZGRUSLSA-N 2 1 317.502 4.067 20 0 DIADMP CC[N@@H+](Cc1cc2ccccc2[nH]1)Cc1ccc(C[NH+](C)C)cc1 ZINC000685456722 1040056333 /nfs/dbraw/zinc/05/63/33/1040056333.db2.gz ODRPGOIGKDIOMK-UHFFFAOYSA-N 2 1 321.468 4.252 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@H]2C)cc1 ZINC000685470088 1040065535 /nfs/dbraw/zinc/06/55/35/1040065535.db2.gz SDIBWTFAERCZFE-XLIONFOSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000685470088 1040065548 /nfs/dbraw/zinc/06/55/48/1040065548.db2.gz SDIBWTFAERCZFE-XLIONFOSSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000685470088 1040065557 /nfs/dbraw/zinc/06/55/57/1040065557.db2.gz SDIBWTFAERCZFE-XLIONFOSSA-N 2 1 318.505 4.028 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC000309689075 1040089678 /nfs/dbraw/zinc/08/96/78/1040089678.db2.gz CITBNXRSTJCGNY-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccsc1C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309763118 1040095651 /nfs/dbraw/zinc/09/56/51/1040095651.db2.gz FHVIPDVUWZCXHC-SJLPKXTDSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@H]1CC(C)(C)C[C@H]1[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000708575044 1040096067 /nfs/dbraw/zinc/09/60/67/1040096067.db2.gz PQGJXKHVYYYMTN-KVPLUYHFSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901116 1040097801 /nfs/dbraw/zinc/09/78/01/1040097801.db2.gz NTMSVGBZAMDXAS-INMHGKMJSA-N 2 1 324.459 4.309 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901116 1040097816 /nfs/dbraw/zinc/09/78/16/1040097816.db2.gz NTMSVGBZAMDXAS-INMHGKMJSA-N 2 1 324.459 4.309 20 0 DIADMP C[C@H]([NH2+]CC1(C)CCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309900148 1040099546 /nfs/dbraw/zinc/09/95/46/1040099546.db2.gz HYCIJTPLKZTPQK-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000708582328 1040132364 /nfs/dbraw/zinc/13/23/64/1040132364.db2.gz UGABDNRKWUASAI-QBVCYTKMSA-N 2 1 314.517 4.169 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)CC(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000694031518 1040244351 /nfs/dbraw/zinc/24/43/51/1040244351.db2.gz VILYBHIFGRRMER-NVXWUHKLSA-N 2 1 324.459 4.311 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC(C)(C)CC(F)F)CC[N@H+]1Cc1ccccc1 ZINC000694031518 1040244359 /nfs/dbraw/zinc/24/43/59/1040244359.db2.gz VILYBHIFGRRMER-NVXWUHKLSA-N 2 1 324.459 4.311 20 0 DIADMP Cc1ccc(C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309751387 1040249980 /nfs/dbraw/zinc/24/99/80/1040249980.db2.gz VXKAOSXLVZQNPM-LJQANCHMSA-N 2 1 314.498 4.058 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1)C(C)(C)C(F)F ZINC000658001985 1040263437 /nfs/dbraw/zinc/26/34/37/1040263437.db2.gz DXXLICPPFRVXBH-ZFWWWQNUSA-N 2 1 302.453 4.053 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1 ZINC000658280499 1040400429 /nfs/dbraw/zinc/40/04/29/1040400429.db2.gz IYESEMULTXPDHQ-WBMJQRKESA-N 2 1 319.399 4.123 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000658321189 1040418270 /nfs/dbraw/zinc/41/82/70/1040418270.db2.gz NJWTZTPRPIZCFV-OWZKRDHZSA-N 2 1 312.501 4.350 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(CC(C)C)cc2)[C@H](C)C1 ZINC001167686821 1040459035 /nfs/dbraw/zinc/45/90/35/1040459035.db2.gz ZGRAMIPWWIFFLM-YLJYHZDGSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(CC(C)C)cc2)[C@H](C)C1 ZINC001167686821 1040459045 /nfs/dbraw/zinc/45/90/45/1040459045.db2.gz ZGRAMIPWWIFFLM-YLJYHZDGSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(CC(C)C)cc2)[C@H](C)C1 ZINC001167686821 1040459052 /nfs/dbraw/zinc/45/90/52/1040459052.db2.gz ZGRAMIPWWIFFLM-YLJYHZDGSA-N 2 1 302.506 4.047 20 0 DIADMP C[N@H+](CCc1ccc(C(C)(C)C)cc1)CC[C@H]1CCCC[NH+]1C ZINC001204616100 1040474787 /nfs/dbraw/zinc/47/47/87/1040474787.db2.gz OGNXFRDEFBJAID-HXUWFJFHSA-N 2 1 316.533 4.333 20 0 DIADMP C[NH+](CCc1ccc(C(C)(C)C)cc1)CC[C@H]1CCCC[N@@H+]1C ZINC001204616100 1040474800 /nfs/dbraw/zinc/47/48/00/1040474800.db2.gz OGNXFRDEFBJAID-HXUWFJFHSA-N 2 1 316.533 4.333 20 0 DIADMP C[NH+](CCc1ccc(C(C)(C)C)cc1)CC[C@H]1CCCC[N@H+]1C ZINC001204616100 1040474807 /nfs/dbraw/zinc/47/48/07/1040474807.db2.gz OGNXFRDEFBJAID-HXUWFJFHSA-N 2 1 316.533 4.333 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C1 ZINC000323308524 1040520343 /nfs/dbraw/zinc/52/03/43/1040520343.db2.gz FBCADAHGPGBHRP-CUDHKJQZSA-N 2 1 312.501 4.033 20 0 DIADMP C[C@@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1Cl ZINC000161590482 1040723999 /nfs/dbraw/zinc/72/39/99/1040723999.db2.gz MUSNMWADQZDBRX-FRRDWIJNSA-N 2 1 313.272 4.271 20 0 DIADMP c1cc2c(o1)CCC[C@@H]2[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310078674 1040751501 /nfs/dbraw/zinc/75/15/01/1040751501.db2.gz HPSMSGIKMHUURX-QUCCMNQESA-N 2 1 324.468 4.159 20 0 DIADMP Clc1cccc([C@@H]2CC[C@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)C2)c1 ZINC000414075119 1040821237 /nfs/dbraw/zinc/82/12/37/1040821237.db2.gz XJRGTGDPFYCDJO-KYJSFNMBSA-N 2 1 318.892 4.050 20 0 DIADMP Clc1cccc([C@@H]2CC[C@@H]([NH2+]C[C@H]3CC[N@H+](C4CC4)C3)C2)c1 ZINC000414075126 1040823064 /nfs/dbraw/zinc/82/30/64/1040823064.db2.gz XJRGTGDPFYCDJO-QGPMSJSTSA-N 2 1 318.892 4.050 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@@H]1C ZINC000414131126 1040904760 /nfs/dbraw/zinc/90/47/60/1040904760.db2.gz XLEJQDDQNFESNO-RPUYLAQPSA-N 2 1 306.519 4.155 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@@H]1C[C@@H]1C ZINC000414131126 1040904775 /nfs/dbraw/zinc/90/47/75/1040904775.db2.gz XLEJQDDQNFESNO-RPUYLAQPSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC(C)(C)C1 ZINC000708833466 1040916364 /nfs/dbraw/zinc/91/63/64/1040916364.db2.gz CHPCXGWZMZVMAQ-YSIASYRMSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000414179681 1040966222 /nfs/dbraw/zinc/96/62/22/1040966222.db2.gz LMTQDPXXWVFKCF-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCO[C@@H]2CCCC[C@@H]2C)CC1 ZINC000613491440 1041002137 /nfs/dbraw/zinc/00/21/37/1041002137.db2.gz RTHBCEWYJMLLIK-AZUAARDMSA-N 2 1 324.553 4.026 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCOc3c(Cl)cccc32)CC1 ZINC000161602641 1041113046 /nfs/dbraw/zinc/11/30/46/1041113046.db2.gz CKYMRRKDWIZDKX-QGZVFWFLSA-N 2 1 322.880 4.018 20 0 DIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000193206575 1041171629 /nfs/dbraw/zinc/17/16/29/1041171629.db2.gz SNOSBJQQHLHXSP-STQMWFEESA-N 2 1 312.910 4.144 20 0 DIADMP C[C@H]([NH2+]Cc1sccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000193206575 1041171642 /nfs/dbraw/zinc/17/16/42/1041171642.db2.gz SNOSBJQQHLHXSP-STQMWFEESA-N 2 1 312.910 4.144 20 0 DIADMP CC(C)CC[NH+](CCC(C)C)Cc1ncc(C[NH+](C)C)s1 ZINC000809537468 1041184739 /nfs/dbraw/zinc/18/47/39/1041184739.db2.gz KLHQPNJAOKPMSV-UHFFFAOYSA-N 2 1 311.539 4.099 20 0 DIADMP C[C@H]1C[C@H](Nc2cc[nH+]cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000301567218 1041246316 /nfs/dbraw/zinc/24/63/16/1041246316.db2.gz WQOTXYWSLCYTAK-GOEBONIOSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@H]1C[C@H](Nc2cc[nH+]cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301567218 1041246333 /nfs/dbraw/zinc/24/63/33/1041246333.db2.gz WQOTXYWSLCYTAK-GOEBONIOSA-N 2 1 315.848 4.200 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C[C@@H](c2ccccc2)C1 ZINC000323351683 1041269709 /nfs/dbraw/zinc/26/97/09/1041269709.db2.gz SVFHVVWXOWUMJU-QRFRQXIXSA-N 2 1 312.501 4.175 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331151 1041273239 /nfs/dbraw/zinc/27/32/39/1041273239.db2.gz RKNBBPCJSVXWNK-ICSRJNTNSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000377331151 1041273258 /nfs/dbraw/zinc/27/32/58/1041273258.db2.gz RKNBBPCJSVXWNK-ICSRJNTNSA-N 2 1 323.484 4.035 20 0 DIADMP CCCCCC[C@@H](CC)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170590117 1041277083 /nfs/dbraw/zinc/27/70/83/1041277083.db2.gz GDXNUHAKJNVHGU-GUDVDZBRSA-N 2 1 324.553 4.486 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC001170594664 1041297252 /nfs/dbraw/zinc/29/72/52/1041297252.db2.gz WCJIAXWCTDWZKQ-PXNSSMCTSA-N 2 1 300.490 4.289 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1 ZINC001170594664 1041297261 /nfs/dbraw/zinc/29/72/61/1041297261.db2.gz WCJIAXWCTDWZKQ-PXNSSMCTSA-N 2 1 300.490 4.289 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC001170594664 1041297269 /nfs/dbraw/zinc/29/72/69/1041297269.db2.gz WCJIAXWCTDWZKQ-PXNSSMCTSA-N 2 1 300.490 4.289 20 0 DIADMP CCCCCC[C@@H](CC)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001170602270 1041359085 /nfs/dbraw/zinc/35/90/85/1041359085.db2.gz YLYHJZHAZXPZAU-GOSISDBHSA-N 2 1 324.553 4.311 20 0 DIADMP C[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccc(C4CCCC4)cc3)C2)C1 ZINC001170604341 1041376508 /nfs/dbraw/zinc/37/65/08/1041376508.db2.gz KGVJPBLVXFERCL-OAQYLSRUSA-N 2 1 312.501 4.262 20 0 DIADMP CC[C@@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccncc1 ZINC000163714837 1041413676 /nfs/dbraw/zinc/41/36/76/1041413676.db2.gz LXKNWMBAQRCBSD-MGPUTAFESA-N 2 1 320.440 4.378 20 0 DIADMP CSc1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)o1 ZINC000641706923 1041619048 /nfs/dbraw/zinc/61/90/48/1041619048.db2.gz HUKVOZXHNYSXFP-UHFFFAOYSA-N 2 1 318.486 4.132 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307868 1041709356 /nfs/dbraw/zinc/70/93/56/1041709356.db2.gz WWRYUABKGJLJGJ-KVJIRVJXSA-N 2 1 320.480 4.043 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]1c1ccccc1 ZINC000660307868 1041709359 /nfs/dbraw/zinc/70/93/59/1041709359.db2.gz WWRYUABKGJLJGJ-KVJIRVJXSA-N 2 1 320.480 4.043 20 0 DIADMP Cc1cc[nH+]c(NC2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000813625054 1041722406 /nfs/dbraw/zinc/72/24/06/1041722406.db2.gz MBUIPEMJULKCSQ-IHWFROFDSA-N 2 1 321.468 4.388 20 0 DIADMP Cc1cc[nH+]c(NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000813625054 1041722412 /nfs/dbraw/zinc/72/24/12/1041722412.db2.gz MBUIPEMJULKCSQ-IHWFROFDSA-N 2 1 321.468 4.388 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC000709355258 1041733974 /nfs/dbraw/zinc/73/39/74/1041733974.db2.gz QTASZMHBGPDHIY-JQWIXIFHSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC000709355260 1041734427 /nfs/dbraw/zinc/73/44/27/1041734427.db2.gz QTASZMHBGPDHIY-ZYHUDNBSSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1(C)CC1 ZINC000813881328 1041742324 /nfs/dbraw/zinc/74/23/24/1041742324.db2.gz OCUAYBSJTNXWIT-VOBGVNJCSA-N 2 1 312.501 4.350 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]C3CC4(CCC4)C3)CC23CC3)cc1 ZINC000652042268 1041764331 /nfs/dbraw/zinc/76/43/31/1041764331.db2.gz VAJLTOIXDZMOPW-GOSISDBHSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]C3CC4(CCC4)C3)CC23CC3)cc1 ZINC000652042268 1041764335 /nfs/dbraw/zinc/76/43/35/1041764335.db2.gz VAJLTOIXDZMOPW-GOSISDBHSA-N 2 1 310.485 4.106 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398159109 1041772683 /nfs/dbraw/zinc/77/26/83/1041772683.db2.gz FLELBWBAXSOULH-XLIONFOSSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398159109 1041772691 /nfs/dbraw/zinc/77/26/91/1041772691.db2.gz FLELBWBAXSOULH-XLIONFOSSA-N 2 1 314.517 4.455 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1C ZINC000194900480 1041796027 /nfs/dbraw/zinc/79/60/27/1041796027.db2.gz LFIVGJWUYCOKRZ-AWEZNQCLSA-N 2 1 303.475 4.044 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(-c2ccccc2)cn1 ZINC000651827815 1041926652 /nfs/dbraw/zinc/92/66/52/1041926652.db2.gz OCGVRGMZWBAEHT-QGZVFWFLSA-N 2 1 323.484 4.274 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2CC4(CCC4)C2)C3)cc1 ZINC000652328107 1042007303 /nfs/dbraw/zinc/00/73/03/1042007303.db2.gz VGEKFICKFJYVNP-VJDPLVQDSA-N 2 1 310.485 4.104 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(OC(C)C)cc1 ZINC000164672119 1042032840 /nfs/dbraw/zinc/03/28/40/1042032840.db2.gz UOEIOSANVUYZQP-INIZCTEOSA-N 2 1 315.461 4.110 20 0 DIADMP CCCC[N@H+](Cc1ncc(C[NH+](C)C)s1)[C@H]1CCC[C@H](C)C1 ZINC000816658431 1042076415 /nfs/dbraw/zinc/07/64/15/1042076415.db2.gz MPOGHJRFFURYOL-HOTGVXAUSA-N 2 1 323.550 4.386 20 0 DIADMP CCCC[N@@H+](Cc1ncc(C[NH+](C)C)s1)[C@H]1CCC[C@H](C)C1 ZINC000816658431 1042076422 /nfs/dbraw/zinc/07/64/22/1042076422.db2.gz MPOGHJRFFURYOL-HOTGVXAUSA-N 2 1 323.550 4.386 20 0 DIADMP CCC(CC)(C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(F)cc1 ZINC000663353852 1042130911 /nfs/dbraw/zinc/13/09/11/1042130911.db2.gz DMWSYDMQDLIOJJ-OALUTQOASA-N 2 1 318.480 4.100 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](CCCC(C)(F)F)CC1 ZINC000931686561 1042157689 /nfs/dbraw/zinc/15/76/89/1042157689.db2.gz NXTDKSIZQQYAQQ-UHFFFAOYSA-N 2 1 302.453 4.152 20 0 DIADMP C[C@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466609 1042179500 /nfs/dbraw/zinc/17/95/00/1042179500.db2.gz VZFMKESVEGOGCE-JSGCOSHPSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466609 1042179504 /nfs/dbraw/zinc/17/95/04/1042179504.db2.gz VZFMKESVEGOGCE-JSGCOSHPSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466609 1042179508 /nfs/dbraw/zinc/17/95/08/1042179508.db2.gz VZFMKESVEGOGCE-JSGCOSHPSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466610 1042179541 /nfs/dbraw/zinc/17/95/41/1042179541.db2.gz VZFMKESVEGOGCE-OCCSQVGLSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466610 1042179547 /nfs/dbraw/zinc/17/95/47/1042179547.db2.gz VZFMKESVEGOGCE-OCCSQVGLSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1csc(Cl)c1 ZINC000663466610 1042179551 /nfs/dbraw/zinc/17/95/51/1042179551.db2.gz VZFMKESVEGOGCE-OCCSQVGLSA-N 2 1 312.910 4.174 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472211 1042183568 /nfs/dbraw/zinc/18/35/68/1042183568.db2.gz ZSQVJPKNOWOHQV-WMZOPIPTSA-N 2 1 323.484 4.007 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc2ccccc2n1 ZINC000663472211 1042183571 /nfs/dbraw/zinc/18/35/71/1042183571.db2.gz ZSQVJPKNOWOHQV-WMZOPIPTSA-N 2 1 323.484 4.007 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC000663471805 1042184502 /nfs/dbraw/zinc/18/45/02/1042184502.db2.gz YKQUEFLJEFNRTA-HOCLYGCPSA-N 2 1 306.519 4.083 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@H]1CCc2[nH+]ccn2C1 ZINC000278923918 1042215901 /nfs/dbraw/zinc/21/59/01/1042215901.db2.gz IEJUQEVJYDIELG-LSDHHAIUSA-N 2 1 323.440 4.105 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000643521340 1042220307 /nfs/dbraw/zinc/22/03/07/1042220307.db2.gz ADWPXAYODWZPTC-SWLSCSKDSA-N 2 1 301.261 4.176 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001167833461 1042235335 /nfs/dbraw/zinc/23/53/35/1042235335.db2.gz BLPPODMCZCDVJD-HNNXBMFYSA-N 2 1 308.897 4.209 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cc(Cl)cc(Cl)c1 ZINC000278969917 1042254978 /nfs/dbraw/zinc/25/49/78/1042254978.db2.gz NKBFMTBCZRJIIH-VXGBXAGGSA-N 2 1 324.255 4.103 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@@H]3CCc4[nH+]ccn4C3)oc2cc1C ZINC000278971427 1042255141 /nfs/dbraw/zinc/25/51/41/1042255141.db2.gz NPDYIXULVQNENR-CVEARBPZSA-N 2 1 323.440 4.159 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]CC2(C)CCC2)C[N@H+]1Cc1ccccc1 ZINC000434774544 1042305650 /nfs/dbraw/zinc/30/56/50/1042305650.db2.gz HQOKAONRKBWJFY-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CCSc2ccc(Cl)cc21)C[NH+]1CCCC1 ZINC000062078754 1042314111 /nfs/dbraw/zinc/31/41/11/1042314111.db2.gz IMCFVPRNFWDTLL-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2c(Cl)cccc2C1 ZINC001171018636 1042328769 /nfs/dbraw/zinc/32/87/69/1042328769.db2.gz UYVIPQYYCGZMEV-NVXWUHKLSA-N 2 1 320.908 4.051 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000337949220 1042343237 /nfs/dbraw/zinc/34/32/37/1042343237.db2.gz NLDQOXRVBHSHIB-UHFFFAOYSA-N 2 1 319.452 4.003 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccccc2C(F)F)CC1 ZINC001139801954 1042356508 /nfs/dbraw/zinc/35/65/08/1042356508.db2.gz HNEFAQKBKQMNBD-UHFFFAOYSA-N 2 1 310.432 4.321 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccccc2C(F)F)CC1 ZINC001139801954 1042356512 /nfs/dbraw/zinc/35/65/12/1042356512.db2.gz HNEFAQKBKQMNBD-UHFFFAOYSA-N 2 1 310.432 4.321 20 0 DIADMP CC(C)[N@@H+]1CC[C@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000040624103 1042388992 /nfs/dbraw/zinc/38/89/92/1042388992.db2.gz HNQATEVKNQQTQB-CYBMUJFWSA-N 2 1 303.837 4.030 20 0 DIADMP CC(C)[N@H+]1CC[C@H](CNc2cc[nH+]c3cc(Cl)ccc23)C1 ZINC000040624103 1042388994 /nfs/dbraw/zinc/38/89/94/1042388994.db2.gz HNQATEVKNQQTQB-CYBMUJFWSA-N 2 1 303.837 4.030 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)C1 ZINC000540989838 1042396458 /nfs/dbraw/zinc/39/64/58/1042396458.db2.gz XJFRINQGYYFQRI-GUYCJALGSA-N 2 1 312.860 4.108 20 0 DIADMP c1[nH+]c(C2CC[NH+](CCCC3CCCC3)CC2)n2c1CCCC2 ZINC000434681970 1042460761 /nfs/dbraw/zinc/46/07/61/1042460761.db2.gz AAIZJOCKRXOWCL-UHFFFAOYSA-N 2 1 315.505 4.369 20 0 DIADMP CCCC[N@H+](C)CC1CC[NH+](Cc2csc(C(C)C)n2)CC1 ZINC000052209901 1042484161 /nfs/dbraw/zinc/48/41/61/1042484161.db2.gz PDQACNDBHYKOQI-UHFFFAOYSA-N 2 1 323.550 4.210 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2csc(C(C)C)n2)CC1 ZINC000052209901 1042484163 /nfs/dbraw/zinc/48/41/63/1042484163.db2.gz PDQACNDBHYKOQI-UHFFFAOYSA-N 2 1 323.550 4.210 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000513488491 1042546555 /nfs/dbraw/zinc/54/65/55/1042546555.db2.gz VYNDFPIOXLDCIJ-QIPHDZALSA-N 2 1 320.908 4.453 20 0 DIADMP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000513501427 1042548957 /nfs/dbraw/zinc/54/89/57/1042548957.db2.gz SXJYPNLSBGNBCG-IPJDOKCGSA-N 2 1 317.864 4.174 20 0 DIADMP Cc1cccc(C[N@H+](C)C2CCN(Cc3ccccc3)CC2)c1 ZINC000513503770 1042549254 /nfs/dbraw/zinc/54/92/54/1042549254.db2.gz XYGJHTCNUBMDDA-UHFFFAOYSA-N 2 1 308.469 4.091 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2c1c(F)ccc2F ZINC000513524458 1042550024 /nfs/dbraw/zinc/55/00/24/1042550024.db2.gz GWQOYJWTLPDNLD-RDTXWAMCSA-N 2 1 322.443 4.196 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CC2(C)C)CC1 ZINC000513713621 1042593578 /nfs/dbraw/zinc/59/35/78/1042593578.db2.gz QUKLINWNTCNICD-LMDPOFIKSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CCC4(CC[NH2+]4)CC3)s2)cc1 ZINC000422561497 1042686578 /nfs/dbraw/zinc/68/65/78/1042686578.db2.gz LNBOUPOQLZNYIR-UHFFFAOYSA-N 2 1 312.482 4.051 20 0 DIADMP Cc1[nH]c2ccc(C[NH2+][C@@H]3C[C@H]([NH3+])c4ccccc43)cc2c1C ZINC000422724030 1042689238 /nfs/dbraw/zinc/68/92/38/1042689238.db2.gz UDWWRDKMEFFDBI-AZUAARDMSA-N 2 1 305.425 4.019 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422836186 1042690590 /nfs/dbraw/zinc/69/05/90/1042690590.db2.gz JMIOUYMYZLHCOA-AJSUPXSGSA-N 2 1 310.416 4.184 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000422968491 1042694848 /nfs/dbraw/zinc/69/48/48/1042694848.db2.gz RGHYHOIBAWXKFW-KJJMTIBFSA-N 2 1 320.480 4.406 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1F ZINC000423034961 1042695949 /nfs/dbraw/zinc/69/59/49/1042695949.db2.gz QXOYXMBPFCTVOM-CKQIIDDLSA-N 2 1 310.844 4.049 20 0 DIADMP Cc1cccc(C)c1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC000423040371 1042696082 /nfs/dbraw/zinc/69/60/82/1042696082.db2.gz UANVYENSFTWFCR-SXLOBPIMSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CC1([NH3+])CCCCC1 ZINC000423180013 1042699414 /nfs/dbraw/zinc/69/94/14/1042699414.db2.gz NDVKPPIPTBMFHB-LBPRGKRZSA-N 2 1 309.523 4.061 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@@H](C[NH3+])C1CCCCC1 ZINC000423270880 1042704878 /nfs/dbraw/zinc/70/48/78/1042704878.db2.gz XDZICBYBHSPLTL-DOMZBBRYSA-N 2 1 309.523 4.133 20 0 DIADMP c1cncc([C@H]2CCC[C@H]([NH2+]CC[NH2+]C3CCCCCC3)C2)c1 ZINC000423266770 1042704891 /nfs/dbraw/zinc/70/48/91/1042704891.db2.gz CIOOSMSTGPKKGC-PXNSSMCTSA-N 2 1 315.505 4.010 20 0 DIADMP c1cncc([C@@H]2CCC[C@H]([NH2+]CC[NH2+]C3CCCCCC3)C2)c1 ZINC000423266771 1042704981 /nfs/dbraw/zinc/70/49/81/1042704981.db2.gz CIOOSMSTGPKKGC-XLIONFOSSA-N 2 1 315.505 4.010 20 0 DIADMP c1cncc([C@H]2CCC[C@@H]([NH2+]CC[NH2+]C3CCCCCC3)C2)c1 ZINC000423266769 1042705046 /nfs/dbraw/zinc/70/50/46/1042705046.db2.gz CIOOSMSTGPKKGC-FXAWDEMLSA-N 2 1 315.505 4.010 20 0 DIADMP [NH3+][C@@H](C[NH2+][C@@H](Cc1ccccc1Cl)c1cccs1)C1CC1 ZINC000423319731 1042706313 /nfs/dbraw/zinc/70/63/13/1042706313.db2.gz LXJSLOYTJFWEAF-HOTGVXAUSA-N 2 1 320.889 4.012 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cc2c(ccc3ccccc23)o1 ZINC000423389313 1042709636 /nfs/dbraw/zinc/70/96/36/1042709636.db2.gz JHZBNDGKUDVFIJ-QWQRMKEZSA-N 2 1 308.425 4.235 20 0 DIADMP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000423451013 1042712393 /nfs/dbraw/zinc/71/23/93/1042712393.db2.gz UIGLCWZQNYGACI-AXFHLTTASA-N 2 1 323.893 4.158 20 0 DIADMP CC[C@H]([NH3+])C[NH2+][C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000423457500 1042714191 /nfs/dbraw/zinc/71/41/91/1042714191.db2.gz FZARMTGFXPILAF-HZMBPMFUSA-N 2 1 323.893 4.160 20 0 DIADMP C[C@@H]([NH3+])[C@@H](C)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423453062 1042714775 /nfs/dbraw/zinc/71/47/75/1042714775.db2.gz XCWPEQVDQFCWOJ-MCIONIFRSA-N 2 1 302.393 4.004 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000513902126 1042762367 /nfs/dbraw/zinc/76/23/67/1042762367.db2.gz ICPPWHZROFBJQA-QGZVFWFLSA-N 2 1 316.480 4.256 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167956398 1042780215 /nfs/dbraw/zinc/78/02/15/1042780215.db2.gz PLKZYBYRLZUYSP-HGKCTWBKSA-N 2 1 318.892 4.035 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+]([C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167956398 1042780221 /nfs/dbraw/zinc/78/02/21/1042780221.db2.gz PLKZYBYRLZUYSP-HGKCTWBKSA-N 2 1 318.892 4.035 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436295613 1042833914 /nfs/dbraw/zinc/83/39/14/1042833914.db2.gz PUXWIQRLMHLMDI-ZBFHGGJFSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@@]1(C[NH2+][C@H]2C[C@@H]3CCCC[C@@H]32)CC[N@@H+](Cc2ccccc2)C1 ZINC000712458634 1042852056 /nfs/dbraw/zinc/85/20/56/1042852056.db2.gz VUTASKLGHOINHS-TUFLPTIASA-N 2 1 312.501 4.067 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC2(SC)CCC2)CC1)CC1CC1 ZINC000517062835 1042865426 /nfs/dbraw/zinc/86/54/26/1042865426.db2.gz WHDGXHOBYFMKOP-UHFFFAOYSA-N 2 1 324.578 4.106 20 0 DIADMP CS[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C(C)(C)C ZINC000517187493 1042870676 /nfs/dbraw/zinc/87/06/76/1042870676.db2.gz KJHLQDYKAVGZGW-KZNAEPCWSA-N 2 1 320.546 4.189 20 0 DIADMP CS[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C(C)(C)C ZINC000517187493 1042870683 /nfs/dbraw/zinc/87/06/83/1042870683.db2.gz KJHLQDYKAVGZGW-KZNAEPCWSA-N 2 1 320.546 4.189 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000517205135 1042871219 /nfs/dbraw/zinc/87/12/19/1042871219.db2.gz NMBYQIYSGCKCKL-DNVCBOLYSA-N 2 1 304.453 4.080 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000517205135 1042871225 /nfs/dbraw/zinc/87/12/25/1042871225.db2.gz NMBYQIYSGCKCKL-DNVCBOLYSA-N 2 1 304.453 4.080 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)c1nccc2ccccc21)C[NH+]1CCCCC1 ZINC000517441820 1042879899 /nfs/dbraw/zinc/87/98/99/1042879899.db2.gz GLOMLKKXNDZLMQ-IRXDYDNUSA-N 2 1 311.473 4.007 20 0 DIADMP c1ccc2cc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)ccc2c1 ZINC001167964063 1042916021 /nfs/dbraw/zinc/91/60/21/1042916021.db2.gz MONVHWJQVZWIMM-FRIKZZABSA-N 2 1 320.480 4.335 20 0 DIADMP c1ccc(C2CC2)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167964383 1042917897 /nfs/dbraw/zinc/91/78/97/1042917897.db2.gz QCIPVJHREJUKKK-IHWFROFDSA-N 2 1 310.485 4.059 20 0 DIADMP CC(C)c1cc(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)ccc1Cl ZINC001204741805 1042938200 /nfs/dbraw/zinc/93/82/00/1042938200.db2.gz BVAIINBAZKVKFF-UHFFFAOYSA-N 2 1 320.908 4.429 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC(C)(C)C1 ZINC001167967601 1042954569 /nfs/dbraw/zinc/95/45/69/1042954569.db2.gz IKLVASCBNYFUAU-SBXRHNTMSA-N 2 1 304.522 4.196 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1cccc(Cl)c1 ZINC001167971529 1042964007 /nfs/dbraw/zinc/96/40/07/1042964007.db2.gz XJJSZBWWDLQIHM-NZKYFMOASA-N 2 1 318.892 4.396 20 0 DIADMP C[C@H]1c2ccccc2CC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167982816 1042975590 /nfs/dbraw/zinc/97/55/90/1042975590.db2.gz BEKPONACCMQLOY-LATSOQNDSA-N 2 1 310.485 4.011 20 0 DIADMP C[C@H]1c2ccccc2CC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167982816 1042975592 /nfs/dbraw/zinc/97/55/92/1042975592.db2.gz BEKPONACCMQLOY-LATSOQNDSA-N 2 1 310.485 4.011 20 0 DIADMP C[C@H]1c2ccccc2CC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167982816 1042975595 /nfs/dbraw/zinc/97/55/95/1042975595.db2.gz BEKPONACCMQLOY-LATSOQNDSA-N 2 1 310.485 4.011 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167982815 1042975846 /nfs/dbraw/zinc/97/58/46/1042975846.db2.gz BEKPONACCMQLOY-AZCLRUCKSA-N 2 1 310.485 4.011 20 0 DIADMP C[C@@H]1c2ccccc2CC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167982815 1042975848 /nfs/dbraw/zinc/97/58/48/1042975848.db2.gz BEKPONACCMQLOY-AZCLRUCKSA-N 2 1 310.485 4.011 20 0 DIADMP C[C@@H]1c2ccccc2CC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167982815 1042975851 /nfs/dbraw/zinc/97/58/51/1042975851.db2.gz BEKPONACCMQLOY-AZCLRUCKSA-N 2 1 310.485 4.011 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000638762129 1042980558 /nfs/dbraw/zinc/98/05/58/1042980558.db2.gz BEAIDWWRKPPPFJ-XYJFISCASA-N 2 1 320.427 4.132 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000638762129 1042980562 /nfs/dbraw/zinc/98/05/62/1042980562.db2.gz BEAIDWWRKPPPFJ-XYJFISCASA-N 2 1 320.427 4.132 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H]2CCSc3ccc(F)cc32)CC1 ZINC000164439108 1042985775 /nfs/dbraw/zinc/98/57/75/1042985775.db2.gz WLEOUOOIWCOCGY-QGZVFWFLSA-N 2 1 322.493 4.217 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@@H]1C1CCCCC1)C2 ZINC001167995019 1043067079 /nfs/dbraw/zinc/06/70/79/1043067079.db2.gz UEJJHMKTKZYNGE-JGUMPVPUSA-N 2 1 316.533 4.437 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC[C@H]1C1CCCCC1)C2 ZINC001167995020 1043067897 /nfs/dbraw/zinc/06/78/97/1043067897.db2.gz UEJJHMKTKZYNGE-JKWVGCSGSA-N 2 1 316.533 4.437 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167994469 1043070090 /nfs/dbraw/zinc/07/00/90/1043070090.db2.gz FXIIADHLFCBCNL-YOFSQIOKSA-N 2 1 316.464 4.053 20 0 DIADMP CC[NH+](Cc1cccc(F)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167994469 1043070099 /nfs/dbraw/zinc/07/00/99/1043070099.db2.gz FXIIADHLFCBCNL-YOFSQIOKSA-N 2 1 316.464 4.053 20 0 DIADMP CC[NH+](Cc1cccc(F)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167994469 1043070109 /nfs/dbraw/zinc/07/01/09/1043070109.db2.gz FXIIADHLFCBCNL-YOFSQIOKSA-N 2 1 316.464 4.053 20 0 DIADMP c1ccc([C@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167995731 1043078548 /nfs/dbraw/zinc/07/85/48/1043078548.db2.gz PCQOSKQGAWDNHR-JGUMPVPUSA-N 2 1 310.485 4.229 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC[N@@H+]1C ZINC000536303149 1043091933 /nfs/dbraw/zinc/09/19/33/1043091933.db2.gz WESWUJZAJIDHSS-NSODJVPESA-N 2 1 313.272 4.053 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)CC[N@H+]1C ZINC000536303149 1043091946 /nfs/dbraw/zinc/09/19/46/1043091946.db2.gz WESWUJZAJIDHSS-NSODJVPESA-N 2 1 313.272 4.053 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1F ZINC000178254948 1043125543 /nfs/dbraw/zinc/12/55/43/1043125543.db2.gz KTOYNWDHRHTWNI-ZDUSSCGKSA-N 2 1 322.493 4.073 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(O)c2)cc1 ZINC000178756818 1043136200 /nfs/dbraw/zinc/13/62/00/1043136200.db2.gz ILEICEPHKYFVQY-GJZGRUSLSA-N 2 1 321.424 4.298 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000178750965 1043137470 /nfs/dbraw/zinc/13/74/70/1043137470.db2.gz QJRWLBXFZHPECK-IRXDYDNUSA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3n2)C1 ZINC000178750965 1043137478 /nfs/dbraw/zinc/13/74/78/1043137478.db2.gz QJRWLBXFZHPECK-IRXDYDNUSA-N 2 1 311.473 4.006 20 0 DIADMP CC[C@H]([NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1)C(C)C ZINC000179840253 1043154026 /nfs/dbraw/zinc/15/40/26/1043154026.db2.gz RCJCGHIVBXFJMJ-IBGZPJMESA-N 2 1 303.494 4.064 20 0 DIADMP c1cc2cccc3c2c(c1)CC[C@H]3[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000866236810 1043163404 /nfs/dbraw/zinc/16/34/04/1043163404.db2.gz FJBAOKDZGAXUEM-NLWGTHIKSA-N 2 1 306.453 4.044 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cc2c(ccnc2Cl)o1 ZINC000866281543 1043173672 /nfs/dbraw/zinc/17/36/72/1043173672.db2.gz JDSHKYSPIYNSSR-XQQFMLRXSA-N 2 1 321.852 4.005 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)CCCC1CC[NH2+]CC1 ZINC000647989937 1043205872 /nfs/dbraw/zinc/20/58/72/1043205872.db2.gz GIAABDHLRPJWQP-OAHLLOKOSA-N 2 1 323.550 4.348 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccncc1 ZINC001168004996 1043239803 /nfs/dbraw/zinc/23/98/03/1043239803.db2.gz DCHHUIQRDDTLED-NYUBLWNDSA-N 2 1 323.484 4.174 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCSc3cc(C)c(C)cc32)C1 ZINC000427610496 1043243147 /nfs/dbraw/zinc/24/31/47/1043243147.db2.gz VAJIAZLGFABCRU-WMZOPIPTSA-N 2 1 318.530 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC(F)(F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168005473 1043248349 /nfs/dbraw/zinc/24/83/49/1043248349.db2.gz IYTLKZPHGWYDAY-CYGHRXIMSA-N 2 1 322.443 4.205 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C(C)(C)C2CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168006242 1043254072 /nfs/dbraw/zinc/25/40/72/1043254072.db2.gz MPOBDPGKLHLRRJ-HGKCTWBKSA-N 2 1 300.490 4.206 20 0 DIADMP CC1CC(C[NH2+][C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168008706 1043281632 /nfs/dbraw/zinc/28/16/32/1043281632.db2.gz XYHOJLFTBKGIHN-OCJQAAENSA-N 2 1 300.490 4.064 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)COC3)c1 ZINC000268862706 1043338520 /nfs/dbraw/zinc/33/85/20/1043338520.db2.gz JZWNPQSIUNBFEY-INIZCTEOSA-N 2 1 324.468 4.019 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000268883274 1043341049 /nfs/dbraw/zinc/34/10/49/1043341049.db2.gz SGFOOBCOJNQFDD-HNNXBMFYSA-N 2 1 321.877 4.062 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccncc1 ZINC000268936999 1043345496 /nfs/dbraw/zinc/34/54/96/1043345496.db2.gz YYDPBEATZDFNQU-UIFIKXQLSA-N 2 1 323.484 4.175 20 0 DIADMP Cc1nccn1CCCC[N@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC000442374477 1043376703 /nfs/dbraw/zinc/37/67/03/1043376703.db2.gz GUIHJTXDQGBPNF-HXUWFJFHSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC000442374477 1043376712 /nfs/dbraw/zinc/37/67/12/1043376712.db2.gz GUIHJTXDQGBPNF-HXUWFJFHSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC000442374477 1043376722 /nfs/dbraw/zinc/37/67/22/1043376722.db2.gz GUIHJTXDQGBPNF-HXUWFJFHSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1nccn1CCCC[N@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000442374465 1043377256 /nfs/dbraw/zinc/37/72/56/1043377256.db2.gz GUIHJTXDQGBPNF-FQEVSTJZSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000442374465 1043377266 /nfs/dbraw/zinc/37/72/66/1043377266.db2.gz GUIHJTXDQGBPNF-FQEVSTJZSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000442374465 1043377279 /nfs/dbraw/zinc/37/72/79/1043377279.db2.gz GUIHJTXDQGBPNF-FQEVSTJZSA-N 2 1 311.473 4.025 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H](C)c2cnccc2C)CC1 ZINC000271403246 1043414809 /nfs/dbraw/zinc/41/48/09/1043414809.db2.gz LULIWPTXMCGPLK-SFHVURJKSA-N 2 1 323.484 4.014 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000442859417 1043436121 /nfs/dbraw/zinc/43/61/21/1043436121.db2.gz VJERRVKSVUACHO-FZMZJTMJSA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000442859417 1043436128 /nfs/dbraw/zinc/43/61/28/1043436128.db2.gz VJERRVKSVUACHO-FZMZJTMJSA-N 2 1 322.905 4.435 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000558161103 1043447908 /nfs/dbraw/zinc/44/79/08/1043447908.db2.gz WRLFCCCTKJCKKF-WOYCLPQFSA-N 2 1 312.501 4.478 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(C)(C)C)cc2)C1 ZINC000521827433 1043479240 /nfs/dbraw/zinc/47/92/40/1043479240.db2.gz ITTFSYZLNAYHDX-GOSISDBHSA-N 2 1 302.506 4.194 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000349011039 1043485946 /nfs/dbraw/zinc/48/59/46/1043485946.db2.gz RHZNPTCXARNNCT-UHFFFAOYSA-N 2 1 306.837 4.017 20 0 DIADMP CC[N@@H+](Cc1ccsc1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000353503387 1043611590 /nfs/dbraw/zinc/61/15/90/1043611590.db2.gz OUQGMJFUNLEAOS-UHFFFAOYSA-N 2 1 302.487 4.140 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539982 1043615568 /nfs/dbraw/zinc/61/55/68/1043615568.db2.gz NUAUTAWWHWXHAC-OXQOHEQNSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000353539982 1043615575 /nfs/dbraw/zinc/61/55/75/1043615575.db2.gz NUAUTAWWHWXHAC-OXQOHEQNSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@H](Nc1cc(C2CC2)cc[nH+]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000353563536 1043617509 /nfs/dbraw/zinc/61/75/09/1043617509.db2.gz TWFWWEBCVANKDL-JXFKEZNVSA-N 2 1 321.468 4.282 20 0 DIADMP C[C@H](Nc1cc(C2CC2)cc[nH+]1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000353563536 1043617512 /nfs/dbraw/zinc/61/75/12/1043617512.db2.gz TWFWWEBCVANKDL-JXFKEZNVSA-N 2 1 321.468 4.282 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(-c2ccncc2)c1 ZINC000353645543 1043628139 /nfs/dbraw/zinc/62/81/39/1043628139.db2.gz HDJZNLNJQMRVEJ-NRFANRHFSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cccc(-c2ccncc2)c1 ZINC000353645543 1043628145 /nfs/dbraw/zinc/62/81/45/1043628145.db2.gz HDJZNLNJQMRVEJ-NRFANRHFSA-N 2 1 323.484 4.055 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(-c2ccncc2)c1 ZINC000353645543 1043628149 /nfs/dbraw/zinc/62/81/49/1043628149.db2.gz HDJZNLNJQMRVEJ-NRFANRHFSA-N 2 1 323.484 4.055 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)C1 ZINC001648960832 1043633423 /nfs/dbraw/zinc/63/34/23/1043633423.db2.gz WFBLDXXCGFDDHY-HXUWFJFHSA-N 2 1 322.496 4.484 20 0 DIADMP CC(C)(F)CC[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639314950 1043648474 /nfs/dbraw/zinc/64/84/74/1043648474.db2.gz AMVLXZFKAFPLGW-SJLPKXTDSA-N 2 1 304.453 4.082 20 0 DIADMP CC(C)(F)CC[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000639314950 1043648481 /nfs/dbraw/zinc/64/84/81/1043648481.db2.gz AMVLXZFKAFPLGW-SJLPKXTDSA-N 2 1 304.453 4.082 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC2(C(F)(F)F)CC2)cc1 ZINC000353979497 1043669021 /nfs/dbraw/zinc/66/90/21/1043669021.db2.gz RBBCTKLKPPPPFC-GFCCVEGCSA-N 2 1 323.362 4.174 20 0 DIADMP CC(C)C[C@@H](C[N@H+]1CCC[C@H](c2ncc[nH]2)C1)c1ccccc1 ZINC000474157398 1043673898 /nfs/dbraw/zinc/67/38/98/1043673898.db2.gz XGBKUUHIGTWSRF-OALUTQOASA-N 2 1 311.473 4.419 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CCC2(OC)CCC2)CC1)CC(C)C ZINC000559147391 1043703742 /nfs/dbraw/zinc/70/37/42/1043703742.db2.gz WKFKDZVBCCYCAG-UHFFFAOYSA-N 2 1 324.553 4.026 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CCC1 ZINC000354516277 1043705795 /nfs/dbraw/zinc/70/57/95/1043705795.db2.gz VBIXZIPITOBHTH-INIZCTEOSA-N 2 1 312.457 4.190 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](CC(C)C)c2ccccc2)C1 ZINC000474271900 1043718550 /nfs/dbraw/zinc/71/85/50/1043718550.db2.gz PCYKACPVZCFFEU-QUCCMNQESA-N 2 1 302.506 4.090 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474270211 1043719115 /nfs/dbraw/zinc/71/91/15/1043719115.db2.gz UGAHXCLZJNFOLS-QUCCMNQESA-N 2 1 302.506 4.090 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](CC(C)C)c2ccccc2)C1 ZINC000474271901 1043719694 /nfs/dbraw/zinc/71/96/94/1043719694.db2.gz PCYKACPVZCFFEU-UYAOXDASSA-N 2 1 302.506 4.090 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474269709 1043720051 /nfs/dbraw/zinc/72/00/51/1043720051.db2.gz UGAHXCLZJNFOLS-AZUAARDMSA-N 2 1 302.506 4.090 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000354825456 1043722066 /nfs/dbraw/zinc/72/20/66/1043722066.db2.gz CGCFQNWCZDAYDI-CABCVRRESA-N 2 1 315.436 4.119 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000354825456 1043722072 /nfs/dbraw/zinc/72/20/72/1043722072.db2.gz CGCFQNWCZDAYDI-CABCVRRESA-N 2 1 315.436 4.119 20 0 DIADMP CSC(C)(C)C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877064926 1043739884 /nfs/dbraw/zinc/73/98/84/1043739884.db2.gz GFQRWGTUMZPKLB-AEFFLSMTSA-N 2 1 318.530 4.086 20 0 DIADMP CSC(C)(C)C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877064926 1043739901 /nfs/dbraw/zinc/73/99/01/1043739901.db2.gz GFQRWGTUMZPKLB-AEFFLSMTSA-N 2 1 318.530 4.086 20 0 DIADMP CC[C@@H](C)[C@@H](C)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000777692462 1043756521 /nfs/dbraw/zinc/75/65/21/1043756521.db2.gz BZOTWRHXBACIJD-IAGOWNOFSA-N 2 1 317.521 4.311 20 0 DIADMP CC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)C1CCCCC1 ZINC000126497812 1043759656 /nfs/dbraw/zinc/75/96/56/1043759656.db2.gz HFHKWTVDWKPBMV-SFHVURJKSA-N 2 1 312.461 4.024 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000355594295 1043778846 /nfs/dbraw/zinc/77/88/46/1043778846.db2.gz DSWCVGQODCHSAB-AWEZNQCLSA-N 2 1 303.837 4.005 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2ccc3cnccc3c2)CC1 ZINC000877794911 1043799682 /nfs/dbraw/zinc/79/96/82/1043799682.db2.gz VPNFZHZJAUJWJJ-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP CC1CC([N@H+](C)[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039718 1043857288 /nfs/dbraw/zinc/85/72/88/1043857288.db2.gz HQRPAWYGTBRFRC-OCJQAAENSA-N 2 1 300.490 4.158 20 0 DIADMP CC1CC([N@@H+](C)[C@@H]2C[C@@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039718 1043857304 /nfs/dbraw/zinc/85/73/04/1043857304.db2.gz HQRPAWYGTBRFRC-OCJQAAENSA-N 2 1 300.490 4.158 20 0 DIADMP CC1CC([NH+](C)[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039718 1043857324 /nfs/dbraw/zinc/85/73/24/1043857324.db2.gz HQRPAWYGTBRFRC-OCJQAAENSA-N 2 1 300.490 4.158 20 0 DIADMP CC1CC([NH+](C)[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039718 1043857341 /nfs/dbraw/zinc/85/73/41/1043857341.db2.gz HQRPAWYGTBRFRC-OCJQAAENSA-N 2 1 300.490 4.158 20 0 DIADMP C[C@@H]1CC([N@H+]2CCCC[C@@H]2C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039449 1043860076 /nfs/dbraw/zinc/86/00/76/1043860076.db2.gz DXCSZUIHVDYIBG-RCCFBDPRSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCCC[C@@H]2C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039449 1043860097 /nfs/dbraw/zinc/86/00/97/1043860097.db2.gz DXCSZUIHVDYIBG-RCCFBDPRSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCCC[C@H](F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040045 1043872494 /nfs/dbraw/zinc/87/24/94/1043872494.db2.gz JZSQVEFUWNRDTE-LMMKCTJWSA-N 2 1 318.480 4.252 20 0 DIADMP C[C@@H]1CC([N@H+]2CCCC[C@H](F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168040045 1043872506 /nfs/dbraw/zinc/87/25/06/1043872506.db2.gz JZSQVEFUWNRDTE-LMMKCTJWSA-N 2 1 318.480 4.252 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C2CCC2)C[C@@H]1c1ccccc1 ZINC000453303782 1043882585 /nfs/dbraw/zinc/88/25/85/1043882585.db2.gz DCPVEWIVGMRMBV-RBUKOAKNSA-N 2 1 300.490 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)C2CCC2)C[C@@H]1c1ccccc1 ZINC000453303782 1043882602 /nfs/dbraw/zinc/88/26/02/1043882602.db2.gz DCPVEWIVGMRMBV-RBUKOAKNSA-N 2 1 300.490 4.238 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H](C)C2CCSCC2)C1 ZINC000474711668 1043897573 /nfs/dbraw/zinc/89/75/73/1043897573.db2.gz RUOBYHQGAVVHKZ-JKSUJKDBSA-N 2 1 312.567 4.008 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H](C)C2CCSCC2)C1 ZINC000474711668 1043897589 /nfs/dbraw/zinc/89/75/89/1043897589.db2.gz RUOBYHQGAVVHKZ-JKSUJKDBSA-N 2 1 312.567 4.008 20 0 DIADMP CC1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168041290 1043904001 /nfs/dbraw/zinc/90/40/01/1043904001.db2.gz RNBNWHMVMNCJHE-OPVJXMOQSA-N 2 1 300.490 4.160 20 0 DIADMP CC1CC[NH+]([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168041290 1043904006 /nfs/dbraw/zinc/90/40/06/1043904006.db2.gz RNBNWHMVMNCJHE-OPVJXMOQSA-N 2 1 300.490 4.160 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCSc2c(Cl)cccc21)C1CC1 ZINC000453405887 1043913124 /nfs/dbraw/zinc/91/31/24/1043913124.db2.gz QRDUBDCEWIAULV-INIZCTEOSA-N 2 1 324.921 4.341 20 0 DIADMP CC(C)[C@H]1CC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000561315288 1043925358 /nfs/dbraw/zinc/92/53/58/1043925358.db2.gz XQEMMFNEASVSTO-VKQJQLINSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@@H]1CC[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C[C@H]1F ZINC001168041995 1043930616 /nfs/dbraw/zinc/93/06/16/1043930616.db2.gz XKSXTGYXGPZNJF-WOCWXWTJSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@@H]1CC[N@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C[C@H]1F ZINC001168041995 1043930623 /nfs/dbraw/zinc/93/06/23/1043930623.db2.gz XKSXTGYXGPZNJF-WOCWXWTJSA-N 2 1 318.480 4.108 20 0 DIADMP CC[N@@H+](CCCn1ccnc1)C(c1ccccc1)c1ccccc1 ZINC000561361036 1043936985 /nfs/dbraw/zinc/93/69/85/1043936985.db2.gz KOZFFLXGXUGSCM-UHFFFAOYSA-N 2 1 319.452 4.385 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC3(C2)CCCC3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168044848 1044023697 /nfs/dbraw/zinc/02/36/97/1044023697.db2.gz GYPDULANBRVZHG-OPVJXMOQSA-N 2 1 312.501 4.304 20 0 DIADMP Cc1ccsc1C[N@@H+](Cc1ccccc1)C1CCN(C)CC1 ZINC000561975460 1044041134 /nfs/dbraw/zinc/04/11/34/1044041134.db2.gz VLTVBDQRQZLXHQ-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCc2ccccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000358475838 1044074620 /nfs/dbraw/zinc/07/46/20/1044074620.db2.gz WLIQCZZECXTJNC-YRISNDGFSA-N 2 1 312.501 4.307 20 0 DIADMP CC(C)(C)OCCCC[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000475047414 1044076681 /nfs/dbraw/zinc/07/66/81/1044076681.db2.gz ONWWPBXYOAVNPV-LJQANCHMSA-N 2 1 324.553 4.170 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1cc(F)ccc1F)C(C)C ZINC000358745416 1044096183 /nfs/dbraw/zinc/09/61/83/1044096183.db2.gz DXKKRXUKVSRSKV-SFHVURJKSA-N 2 1 321.415 4.237 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCCc4occc43)CC2)C1 ZINC000359113969 1044132256 /nfs/dbraw/zinc/13/22/56/1044132256.db2.gz JLBVPNJZZVAYLO-SZVBFZGTSA-N 2 1 316.489 4.290 20 0 DIADMP CC(C)[C@H](C)[NH+](C)Cc1cncc(C[N@H+](C)[C@@H](C)C(C)C)c1 ZINC000562686977 1044150685 /nfs/dbraw/zinc/15/06/85/1044150685.db2.gz DLOCBNJQZCWMFN-IRXDYDNUSA-N 2 1 305.510 4.034 20 0 DIADMP CC(C)[C@@H](C)[NH+](C)Cc1cncc(C[N@H+](C)[C@H](C)C(C)C)c1 ZINC000562686976 1044150853 /nfs/dbraw/zinc/15/08/53/1044150853.db2.gz DLOCBNJQZCWMFN-IAGOWNOFSA-N 2 1 305.510 4.034 20 0 DIADMP CCC[N@H+](Cc1c(Cl)oc2ccccc21)C1CC[NH2+]CC1 ZINC000347013304 1044182176 /nfs/dbraw/zinc/18/21/76/1044182176.db2.gz VYGMUXVFQPZFGT-UHFFFAOYSA-N 2 1 306.837 4.050 20 0 DIADMP CCC[N@@H+](Cc1c(Cl)oc2ccccc21)C1CC[NH2+]CC1 ZINC000347013304 1044182180 /nfs/dbraw/zinc/18/21/80/1044182180.db2.gz VYGMUXVFQPZFGT-UHFFFAOYSA-N 2 1 306.837 4.050 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@@H]2CCSc3ccc(F)cc32)CC1 ZINC000359621534 1044182628 /nfs/dbraw/zinc/18/26/28/1044182628.db2.gz PNXCMISEHSAAKI-QGZVFWFLSA-N 2 1 322.493 4.074 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@@H+](C)C(C)C)c1ccc(OC(F)F)cc1 ZINC000359637677 1044185015 /nfs/dbraw/zinc/18/50/15/1044185015.db2.gz ISCXLMXJYASNNB-MRXNPFEDSA-N 2 1 314.420 4.059 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCSc2ccccc21 ZINC000359944464 1044219949 /nfs/dbraw/zinc/21/99/49/1044219949.db2.gz UQQJWRGJWCYPLE-FUHWJXTLSA-N 2 1 318.530 4.468 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444187480 1044233350 /nfs/dbraw/zinc/23/33/50/1044233350.db2.gz APFWMLUOKGPRFX-QFBILLFUSA-N 2 1 304.453 4.085 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000444187480 1044233362 /nfs/dbraw/zinc/23/33/62/1044233362.db2.gz APFWMLUOKGPRFX-QFBILLFUSA-N 2 1 304.453 4.085 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CCSc2ccc(F)cc21)C[NH+]1CCCCC1 ZINC000360151990 1044242126 /nfs/dbraw/zinc/24/21/26/1044242126.db2.gz XJKLDYFVUXNXFN-RHSMWYFYSA-N 2 1 322.493 4.074 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC2(C)CC(F)(F)C2)cc1 ZINC000883255336 1044245357 /nfs/dbraw/zinc/24/53/57/1044245357.db2.gz SJSRIFGGSVYGEO-CYBMUJFWSA-N 2 1 319.399 4.267 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168056254 1044274242 /nfs/dbraw/zinc/27/42/42/1044274242.db2.gz DXCSZUIHVDYIBG-SQNIBIBYSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168056254 1044274255 /nfs/dbraw/zinc/27/42/55/1044274255.db2.gz DXCSZUIHVDYIBG-SQNIBIBYSA-N 2 1 300.490 4.302 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2[C@H]2CC[C@](C)(c3ccccc3)C2)CC1 ZINC000475133285 1044282451 /nfs/dbraw/zinc/28/24/51/1044282451.db2.gz ZAOUGMQZBWHCLF-PMACEKPBSA-N 2 1 312.501 4.057 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)C1 ZINC000563570863 1044283476 /nfs/dbraw/zinc/28/34/76/1044283476.db2.gz JUQIIEYZFYKPIY-MNEFBYGVSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCC2CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168058705 1044306720 /nfs/dbraw/zinc/30/67/20/1044306720.db2.gz BVWMORQOXIJYID-XEMDLRDOSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CCC2CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168058705 1044306734 /nfs/dbraw/zinc/30/67/34/1044306734.db2.gz BVWMORQOXIJYID-XEMDLRDOSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCC2CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168058705 1044306750 /nfs/dbraw/zinc/30/67/50/1044306750.db2.gz BVWMORQOXIJYID-XEMDLRDOSA-N 2 1 300.490 4.160 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H](c1cccnc1)C1CCC1)Cc1ccccc1 ZINC000360842497 1044316331 /nfs/dbraw/zinc/31/63/31/1044316331.db2.gz WXCVKJFACIHLBA-NRFANRHFSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC000360849143 1044319398 /nfs/dbraw/zinc/31/93/98/1044319398.db2.gz XOJAKMWMWOFIJV-GASCZTMLSA-N 2 1 318.436 4.030 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC000360849143 1044319409 /nfs/dbraw/zinc/31/94/09/1044319409.db2.gz XOJAKMWMWOFIJV-GASCZTMLSA-N 2 1 318.436 4.030 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+][C@H](C)CC[NH+](C)C)cs2)cs1 ZINC000360862956 1044319761 /nfs/dbraw/zinc/31/97/61/1044319761.db2.gz YBURXOICJNUSFY-VXGBXAGGSA-N 2 1 323.531 4.171 20 0 DIADMP CC(C)C[C@@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000564084564 1044338119 /nfs/dbraw/zinc/33/81/19/1044338119.db2.gz PJWMYPJYBMLSSD-GURQWTFNSA-N 2 1 300.490 4.031 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069955 1044353269 /nfs/dbraw/zinc/35/32/69/1044353269.db2.gz SNQJKWMZHUJLGE-IJEWVQPXSA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@@H](C)Sc3sccc32)C1 ZINC000361069955 1044353278 /nfs/dbraw/zinc/35/32/78/1044353278.db2.gz SNQJKWMZHUJLGE-IJEWVQPXSA-N 2 1 324.559 4.384 20 0 DIADMP c1cc2[nH+]ccc(NCCC[N@@H+]3CCc4ccccc4C3)c2s1 ZINC000361160458 1044367485 /nfs/dbraw/zinc/36/74/85/1044367485.db2.gz YJESRYDQOWUKNZ-UHFFFAOYSA-N 2 1 323.465 4.157 20 0 DIADMP c1cc2[nH+]ccc(NCCC[N@H+]3CCc4ccccc4C3)c2s1 ZINC000361160458 1044367502 /nfs/dbraw/zinc/36/75/02/1044367502.db2.gz YJESRYDQOWUKNZ-UHFFFAOYSA-N 2 1 323.465 4.157 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@@H](CF)C2)C[C@@H](C)N1Cc1ccccc1 ZINC001168062351 1044379943 /nfs/dbraw/zinc/37/99/43/1044379943.db2.gz KDYYYMYLXKBWOT-LMMKCTJWSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC[C@@H](CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168062351 1044379954 /nfs/dbraw/zinc/37/99/54/1044379954.db2.gz KDYYYMYLXKBWOT-LMMKCTJWSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@@H](CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168062351 1044379964 /nfs/dbraw/zinc/37/99/64/1044379964.db2.gz KDYYYMYLXKBWOT-LMMKCTJWSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@H](CF)C2)C[C@@H](C)N1Cc1ccccc1 ZINC001168062355 1044380603 /nfs/dbraw/zinc/38/06/03/1044380603.db2.gz KDYYYMYLXKBWOT-ZHALLVOQSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC([N@@H+]2CCC[C@H](CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168062355 1044380615 /nfs/dbraw/zinc/38/06/15/1044380615.db2.gz KDYYYMYLXKBWOT-ZHALLVOQSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC([N@H+]2CCC[C@H](CF)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168062355 1044380627 /nfs/dbraw/zinc/38/06/27/1044380627.db2.gz KDYYYMYLXKBWOT-ZHALLVOQSA-N 2 1 318.480 4.110 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccc(C)cc1 ZINC000361507331 1044413084 /nfs/dbraw/zinc/41/30/84/1044413084.db2.gz DKJNOKSODUORGQ-HXUWFJFHSA-N 2 1 323.484 4.408 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC3(CCC3)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168065927 1044416829 /nfs/dbraw/zinc/41/68/29/1044416829.db2.gz ZGSHKNQXSHZMLW-OPVJXMOQSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC3(CCC3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168065927 1044416833 /nfs/dbraw/zinc/41/68/33/1044416833.db2.gz ZGSHKNQXSHZMLW-OPVJXMOQSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC3(CCC3)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168065927 1044416836 /nfs/dbraw/zinc/41/68/36/1044416836.db2.gz ZGSHKNQXSHZMLW-OPVJXMOQSA-N 2 1 312.501 4.304 20 0 DIADMP Cc1cscc1C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000565744577 1044455070 /nfs/dbraw/zinc/45/50/70/1044455070.db2.gz WYHLGICAXSCJCJ-SJLPKXTDSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(Cl)nc1 ZINC000179099381 1044518252 /nfs/dbraw/zinc/51/82/52/1044518252.db2.gz AJQBNCVWBCMALT-AWEZNQCLSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccc(Cl)nc1 ZINC000179099381 1044518266 /nfs/dbraw/zinc/51/82/66/1044518266.db2.gz AJQBNCVWBCMALT-AWEZNQCLSA-N 2 1 309.885 4.040 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000567026871 1044538100 /nfs/dbraw/zinc/53/81/00/1044538100.db2.gz XEVAEGWFNUIDAR-AVRDEDQJSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH+](C)[C@H]2CC[N@H+](C)C[C@@H]2C)c1 ZINC000567026871 1044538112 /nfs/dbraw/zinc/53/81/12/1044538112.db2.gz XEVAEGWFNUIDAR-AVRDEDQJSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)c1 ZINC000567026871 1044538122 /nfs/dbraw/zinc/53/81/22/1044538122.db2.gz XEVAEGWFNUIDAR-AVRDEDQJSA-N 2 1 322.496 4.434 20 0 DIADMP Cc1ccccc1-c1cccc(C[N@H+](C)[C@H]2CC[NH+](C)C[C@@H]2C)c1 ZINC000567026871 1044538135 /nfs/dbraw/zinc/53/81/35/1044538135.db2.gz XEVAEGWFNUIDAR-AVRDEDQJSA-N 2 1 322.496 4.434 20 0 DIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000567296126 1044555813 /nfs/dbraw/zinc/55/58/13/1044555813.db2.gz BFLYZQPFSCKTBK-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000567296126 1044555824 /nfs/dbraw/zinc/55/58/24/1044555824.db2.gz BFLYZQPFSCKTBK-PZJWPPBQSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000567296127 1044556007 /nfs/dbraw/zinc/55/60/07/1044556007.db2.gz BFLYZQPFSCKTBK-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000567296127 1044556020 /nfs/dbraw/zinc/55/60/20/1044556020.db2.gz BFLYZQPFSCKTBK-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1ccc(Cl)cc1[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000295846464 1044567728 /nfs/dbraw/zinc/56/77/28/1044567728.db2.gz DQTSTWAJXZFTAN-OHRKKDJYSA-N 2 1 322.880 4.015 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccsc3)cc2)C1 ZINC000444636335 1044576325 /nfs/dbraw/zinc/57/63/25/1044576325.db2.gz GDRPAGCWTUCGJE-KRWDZBQOSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccsc3)cc2)C1 ZINC000444636335 1044576337 /nfs/dbraw/zinc/57/63/37/1044576337.db2.gz GDRPAGCWTUCGJE-KRWDZBQOSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccsc3)cc2)C1 ZINC000444636335 1044576350 /nfs/dbraw/zinc/57/63/50/1044576350.db2.gz GDRPAGCWTUCGJE-KRWDZBQOSA-N 2 1 314.498 4.189 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CCN1C ZINC000444649482 1044581719 /nfs/dbraw/zinc/58/17/19/1044581719.db2.gz KCORXSVDDSNPAR-BEFAXECRSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649482 1044581756 /nfs/dbraw/zinc/58/17/56/1044581756.db2.gz KCORXSVDDSNPAR-BEFAXECRSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CC[NH+]1C ZINC000444649482 1044581765 /nfs/dbraw/zinc/58/17/65/1044581765.db2.gz KCORXSVDDSNPAR-BEFAXECRSA-N 2 1 314.498 4.330 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000444645124 1044582039 /nfs/dbraw/zinc/58/20/39/1044582039.db2.gz XDGUHHOXMJUFIF-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000444645124 1044582053 /nfs/dbraw/zinc/58/20/53/1044582053.db2.gz XDGUHHOXMJUFIF-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]CC(C)(C)c2ccccc2)c1 ZINC001649171235 1044589116 /nfs/dbraw/zinc/58/91/16/1044589116.db2.gz NVQBCVIYIFBHFN-UHFFFAOYSA-N 2 1 310.485 4.206 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000296133891 1044590636 /nfs/dbraw/zinc/59/06/36/1044590636.db2.gz URDJZPBYIMMWNW-DOTOQJQBSA-N 2 1 310.432 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCCC(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000296133891 1044590646 /nfs/dbraw/zinc/59/06/46/1044590646.db2.gz URDJZPBYIMMWNW-DOTOQJQBSA-N 2 1 310.432 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCCC(C)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000296133904 1044591157 /nfs/dbraw/zinc/59/11/57/1044591157.db2.gz URDJZPBYIMMWNW-NVXWUHKLSA-N 2 1 310.432 4.065 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CCCC(C)(F)F)CC[N@H+]1Cc1ccccc1 ZINC000296133904 1044591169 /nfs/dbraw/zinc/59/11/69/1044591169.db2.gz URDJZPBYIMMWNW-NVXWUHKLSA-N 2 1 310.432 4.065 20 0 DIADMP Cc1ccccc1C1CC([N@H+](CCCc2c[nH+]cn2C)C2CC2)C1 ZINC000568165819 1044606413 /nfs/dbraw/zinc/60/64/13/1044606413.db2.gz YEVRPSFOZXKBMM-UHFFFAOYSA-N 2 1 323.484 4.072 20 0 DIADMP Cc1ccccc1C1CC([N@@H+](CCCc2c[nH+]cn2C)C2CC2)C1 ZINC000568165819 1044606421 /nfs/dbraw/zinc/60/64/21/1044606421.db2.gz YEVRPSFOZXKBMM-UHFFFAOYSA-N 2 1 323.484 4.072 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000568329660 1044616390 /nfs/dbraw/zinc/61/63/90/1044616390.db2.gz AVZFMJWJDWWNQH-OXJNMPFZSA-N 2 1 316.464 4.082 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444788768 1044630761 /nfs/dbraw/zinc/63/07/61/1044630761.db2.gz ASVZVTRGIBFZGR-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444788768 1044630767 /nfs/dbraw/zinc/63/07/67/1044630767.db2.gz ASVZVTRGIBFZGR-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C)CCS2 ZINC000296637720 1044638879 /nfs/dbraw/zinc/63/88/79/1044638879.db2.gz XVIQHEHDMZPMBB-YCXXCVGLSA-N 2 1 316.514 4.055 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(C)CCCCC2)C[C@H]1c1ccccc1 ZINC000568776030 1044649156 /nfs/dbraw/zinc/64/91/56/1044649156.db2.gz YXWRIOZZTNVFPC-OALUTQOASA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2(C)CCCCC2)C[C@H]1c1ccccc1 ZINC000568776030 1044649163 /nfs/dbraw/zinc/64/91/63/1044649163.db2.gz YXWRIOZZTNVFPC-OALUTQOASA-N 2 1 300.490 4.382 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(C)CCCCC2)C[C@@H]1c1ccccc1 ZINC000568776031 1044649322 /nfs/dbraw/zinc/64/93/22/1044649322.db2.gz YXWRIOZZTNVFPC-RBUKOAKNSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2(C)CCCCC2)C[C@@H]1c1ccccc1 ZINC000568776031 1044649330 /nfs/dbraw/zinc/64/93/30/1044649330.db2.gz YXWRIOZZTNVFPC-RBUKOAKNSA-N 2 1 300.490 4.382 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3cccc(C(F)F)c3)CC2)[nH+]c1C ZINC000886662980 1044676470 /nfs/dbraw/zinc/67/64/70/1044676470.db2.gz QRJAEEMNTRZFEN-UHFFFAOYSA-N 2 1 319.399 4.344 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@H]3CCc4ccc(F)cc43)CC2)[nH+]c1C ZINC000886666228 1044676787 /nfs/dbraw/zinc/67/67/87/1044676787.db2.gz PEFQPPPYHMJCBQ-SFHVURJKSA-N 2 1 313.420 4.033 20 0 DIADMP Cc1[nH]c(C2CC[NH+](CC[C@@H]3CCCC3(F)F)CC2)[nH+]c1C ZINC000886659324 1044677630 /nfs/dbraw/zinc/67/76/30/1044677630.db2.gz KAZMZTJTHYJGCP-HNNXBMFYSA-N 2 1 311.420 4.031 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000569290982 1044693109 /nfs/dbraw/zinc/69/31/09/1044693109.db2.gz OPXLNYYBFZXXGU-PKOBYXMFSA-N 2 1 309.457 4.021 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000366426639 1044718551 /nfs/dbraw/zinc/71/85/51/1044718551.db2.gz AGHXHKXZPWGBNE-OOHWJJMZSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccn2)cc1 ZINC000367601860 1044746995 /nfs/dbraw/zinc/74/69/95/1044746995.db2.gz QADRMQAZVHQKRW-HZPDHXFCSA-N 2 1 320.440 4.296 20 0 DIADMP CSC1(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CCC1 ZINC000368216730 1044771273 /nfs/dbraw/zinc/77/12/73/1044771273.db2.gz UANLNMCIXGERGQ-GDBMZVCRSA-N 2 1 324.559 4.006 20 0 DIADMP CSC1(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CCC1 ZINC000368216730 1044771285 /nfs/dbraw/zinc/77/12/85/1044771285.db2.gz UANLNMCIXGERGQ-GDBMZVCRSA-N 2 1 324.559 4.006 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)[C@H](C)Cc1ccsc1 ZINC000570760399 1044781806 /nfs/dbraw/zinc/78/18/06/1044781806.db2.gz GUOWSCVSODLQCD-MRXNPFEDSA-N 2 1 316.514 4.263 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCS2 ZINC000368753951 1044788194 /nfs/dbraw/zinc/78/81/94/1044788194.db2.gz NWKXYHUMTWLKST-JFIYKMOQSA-N 2 1 316.514 4.057 20 0 DIADMP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccnc2Cl)c1 ZINC000123924350 1044788764 /nfs/dbraw/zinc/78/87/64/1044788764.db2.gz HPRSFERGEDZCBT-AWEZNQCLSA-N 2 1 317.864 4.038 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccnc2Cl)c1 ZINC000123924350 1044788781 /nfs/dbraw/zinc/78/87/81/1044788781.db2.gz HPRSFERGEDZCBT-AWEZNQCLSA-N 2 1 317.864 4.038 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2sccc2C)c1 ZINC000123936415 1044788949 /nfs/dbraw/zinc/78/89/49/1044788949.db2.gz YVMIVSSQTOHFDO-OAHLLOKOSA-N 2 1 302.487 4.359 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cnc3ccsc3c2)C1 ZINC000125928564 1044808874 /nfs/dbraw/zinc/80/88/74/1044808874.db2.gz WXABMYMWGHVBJY-GJZGRUSLSA-N 2 1 317.502 4.067 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000524593486 1044880976 /nfs/dbraw/zinc/88/09/76/1044880976.db2.gz BRHFIBUDMYJOPP-HXUWFJFHSA-N 2 1 308.469 4.290 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2C[C@H](C)c3ccccc32)c1 ZINC000574073728 1044939808 /nfs/dbraw/zinc/93/98/08/1044939808.db2.gz BWGISOSMDKJWNN-KKSFZXQISA-N 2 1 308.469 4.476 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC2(c3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000574178590 1044942990 /nfs/dbraw/zinc/94/29/90/1044942990.db2.gz LBNHFCZYFRONRK-SFTDATJTSA-N 2 1 320.480 4.143 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2(c3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000574178590 1044943000 /nfs/dbraw/zinc/94/30/00/1044943000.db2.gz LBNHFCZYFRONRK-SFTDATJTSA-N 2 1 320.480 4.143 20 0 DIADMP C[C@H](c1ccc(Cl)cc1Cl)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000524979996 1044958059 /nfs/dbraw/zinc/95/80/59/1044958059.db2.gz ILTVVTIDIVTASO-CHWSQXEVSA-N 2 1 315.288 4.328 20 0 DIADMP C[C@H](c1ccc(Cl)cc1Cl)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000524979997 1044959611 /nfs/dbraw/zinc/95/96/11/1044959611.db2.gz ILTVVTIDIVTASO-OLZOCXBDSA-N 2 1 315.288 4.328 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)cc1 ZINC000446748888 1045029039 /nfs/dbraw/zinc/02/90/39/1045029039.db2.gz VBEXYJOQTGGNMO-NJDAHSKKSA-N 2 1 312.501 4.443 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc3ccccc3s2)C1 ZINC000446745819 1045029450 /nfs/dbraw/zinc/02/94/50/1045029450.db2.gz QODODCCLVLIPED-HUUCEWRRSA-N 2 1 302.487 4.284 20 0 DIADMP FC1(F)CCC(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000374304973 1045046393 /nfs/dbraw/zinc/04/63/93/1045046393.db2.gz FBDCCIKGRYCNNG-UHFFFAOYSA-N 2 1 322.443 4.066 20 0 DIADMP Cc1nccn1CCC[N@H+](C)Cc1ccc(C(C)(C)C)s1 ZINC000576387646 1045055703 /nfs/dbraw/zinc/05/57/03/1045055703.db2.gz YLJKHBUUSQLXJS-UHFFFAOYSA-N 2 1 305.491 4.073 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(C(C)(C)C)s1 ZINC000576387646 1045055713 /nfs/dbraw/zinc/05/57/13/1045055713.db2.gz YLJKHBUUSQLXJS-UHFFFAOYSA-N 2 1 305.491 4.073 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(C(C)(C)C)s1 ZINC000576387646 1045055723 /nfs/dbraw/zinc/05/57/23/1045055723.db2.gz YLJKHBUUSQLXJS-UHFFFAOYSA-N 2 1 305.491 4.073 20 0 DIADMP CC[NH+](CC)[C@@H](CNc1cc[nH+]c2ccsc21)c1ccco1 ZINC000360519471 1045087859 /nfs/dbraw/zinc/08/78/59/1045087859.db2.gz BFALQQIFSSVWOX-HNNXBMFYSA-N 2 1 315.442 4.384 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000525991310 1045151176 /nfs/dbraw/zinc/15/11/76/1045151176.db2.gz KSKDCWDPHNQFPV-ZIFCJYIRSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447594170 1045154985 /nfs/dbraw/zinc/15/49/85/1045154985.db2.gz XIOHIFABYXFNPU-DVWBAYGPSA-N 2 1 312.501 4.350 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000447590877 1045155543 /nfs/dbraw/zinc/15/55/43/1045155543.db2.gz AUNXWCZNMIEMGX-REPLKXPHSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccccn2)C2CCC2)C1 ZINC000924684148 1045188894 /nfs/dbraw/zinc/18/88/94/1045188894.db2.gz CEZIEPGKDQSGEH-XLIONFOSSA-N 2 1 315.505 4.025 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000924684337 1045189553 /nfs/dbraw/zinc/18/95/53/1045189553.db2.gz DYMITFNFAMNGLV-PXNSSMCTSA-N 2 1 315.505 4.167 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000924684339 1045189762 /nfs/dbraw/zinc/18/97/62/1045189762.db2.gz DYMITFNFAMNGLV-XLIONFOSSA-N 2 1 315.505 4.167 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694629 1045191277 /nfs/dbraw/zinc/19/12/77/1045191277.db2.gz FSTHQVYTCSKUOH-CYZMBNFOSA-N 2 1 318.408 4.044 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1csc(C(F)(F)F)c1 ZINC000924694629 1045191280 /nfs/dbraw/zinc/19/12/80/1045191280.db2.gz FSTHQVYTCSKUOH-CYZMBNFOSA-N 2 1 318.408 4.044 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000577984274 1045195113 /nfs/dbraw/zinc/19/51/13/1045195113.db2.gz HVKJHXKRROADQY-JKSUJKDBSA-N 2 1 306.519 4.128 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000577984274 1045195122 /nfs/dbraw/zinc/19/51/22/1045195122.db2.gz HVKJHXKRROADQY-JKSUJKDBSA-N 2 1 306.519 4.128 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)C1 ZINC000577984273 1045196022 /nfs/dbraw/zinc/19/60/22/1045196022.db2.gz HVKJHXKRROADQY-HZPDHXFCSA-N 2 1 306.519 4.128 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)C1 ZINC000577984273 1045196027 /nfs/dbraw/zinc/19/60/27/1045196027.db2.gz HVKJHXKRROADQY-HZPDHXFCSA-N 2 1 306.519 4.128 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Cl)c2)C[C@@H]1C ZINC000527116510 1045197766 /nfs/dbraw/zinc/19/77/66/1045197766.db2.gz VGCQZROEWFMCPI-VKJFTORMSA-N 2 1 308.897 4.248 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Cl)c2)[C@@H](C)C1 ZINC000527115717 1045198360 /nfs/dbraw/zinc/19/83/60/1045198360.db2.gz JSCRULSQIYPSPQ-VKJFTORMSA-N 2 1 308.897 4.106 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527116155 1045198422 /nfs/dbraw/zinc/19/84/22/1045198422.db2.gz DDJDSOGMSHXUSP-HOTGVXAUSA-N 2 1 308.897 4.107 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527116155 1045198425 /nfs/dbraw/zinc/19/84/25/1045198425.db2.gz DDJDSOGMSHXUSP-HOTGVXAUSA-N 2 1 308.897 4.107 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@@H](C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000527115716 1045198585 /nfs/dbraw/zinc/19/85/85/1045198585.db2.gz JSCRULSQIYPSPQ-RKVPGOIHSA-N 2 1 308.897 4.106 20 0 DIADMP c1ccc([C@H]2CCC[C@H]([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000527631944 1045243218 /nfs/dbraw/zinc/24/32/18/1045243218.db2.gz DRKJJJIIGLAFHW-OALUTQOASA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc([C@H]2CCC[C@@H]([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000527631947 1045243262 /nfs/dbraw/zinc/24/32/62/1045243262.db2.gz DRKJJJIIGLAFHW-RBUKOAKNSA-N 2 1 312.501 4.319 20 0 DIADMP Fc1cc2c(cc1Cl)[C@@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CC2 ZINC000527853508 1045268001 /nfs/dbraw/zinc/26/80/01/1045268001.db2.gz PMUIVIJWSADTQN-SFHVURJKSA-N 2 1 322.855 4.073 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768597 1045269726 /nfs/dbraw/zinc/26/97/26/1045269726.db2.gz JLHWUPOZKVHGRL-LNLFQRSKSA-N 2 1 300.490 4.208 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC000578768597 1045269736 /nfs/dbraw/zinc/26/97/36/1045269736.db2.gz JLHWUPOZKVHGRL-LNLFQRSKSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+][C@@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352743 1045309287 /nfs/dbraw/zinc/30/92/87/1045309287.db2.gz JFTYHEIYFKIFMU-NHCUHLMSSA-N 2 1 324.512 4.352 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+][C@@H](C3CC3)C3CCC3)CC23CC3)cc1 ZINC000579352743 1045309294 /nfs/dbraw/zinc/30/92/94/1045309294.db2.gz JFTYHEIYFKIFMU-NHCUHLMSSA-N 2 1 324.512 4.352 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000449072708 1045344222 /nfs/dbraw/zinc/34/42/22/1045344222.db2.gz GGMVMRQIGJAAMX-SFHVURJKSA-N 2 1 320.480 4.236 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCCC34CCC4)C2)c1 ZINC000449106380 1045346258 /nfs/dbraw/zinc/34/62/58/1045346258.db2.gz LQPMWIFFTXINIT-SJLPKXTDSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@@H]3CCCC34CCC4)C2)c1 ZINC000449106380 1045346261 /nfs/dbraw/zinc/34/62/61/1045346261.db2.gz LQPMWIFFTXINIT-SJLPKXTDSA-N 2 1 318.530 4.273 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)cs1 ZINC000449106628 1045347941 /nfs/dbraw/zinc/34/79/41/1045347941.db2.gz MXWGHDKRCPPTCS-HNNXBMFYSA-N 2 1 320.527 4.120 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cs1 ZINC000449106628 1045347949 /nfs/dbraw/zinc/34/79/49/1045347949.db2.gz MXWGHDKRCPPTCS-HNNXBMFYSA-N 2 1 320.527 4.120 20 0 DIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000449092879 1045348921 /nfs/dbraw/zinc/34/89/21/1045348921.db2.gz VNIIVKADQUJLSP-XGXHKWSGSA-N 2 1 318.892 4.193 20 0 DIADMP C[C@H](Cc1ccoc1)[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000449149487 1045352181 /nfs/dbraw/zinc/35/21/81/1045352181.db2.gz NUBSPSJIOCKBHH-SJORKVTESA-N 2 1 312.457 4.026 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@@H+]1C ZINC000449177446 1045354376 /nfs/dbraw/zinc/35/43/76/1045354376.db2.gz VQHWUIFEJMBDGW-MDASCCDHSA-N 2 1 318.892 4.348 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC[N@H+]1C ZINC000449177446 1045354379 /nfs/dbraw/zinc/35/43/79/1045354379.db2.gz VQHWUIFEJMBDGW-MDASCCDHSA-N 2 1 318.892 4.348 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cs1 ZINC000449162679 1045356913 /nfs/dbraw/zinc/35/69/13/1045356913.db2.gz SSEGCNCHLNMIHP-RDJZCZTQSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cs1 ZINC000449162679 1045356921 /nfs/dbraw/zinc/35/69/21/1045356921.db2.gz SSEGCNCHLNMIHP-RDJZCZTQSA-N 2 1 320.527 4.291 20 0 DIADMP Cc1cc(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cs1 ZINC000449193103 1045358131 /nfs/dbraw/zinc/35/81/31/1045358131.db2.gz QJCYVWSYAUFGHW-CQSZACIVSA-N 2 1 311.454 4.401 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000449249246 1045366214 /nfs/dbraw/zinc/36/62/14/1045366214.db2.gz IOVUVUXWROFXIF-UHFFFAOYSA-N 2 1 306.453 4.014 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)C(C)(F)F ZINC000697138461 1045413719 /nfs/dbraw/zinc/41/37/19/1045413719.db2.gz ZXMUSYSNJJIQBR-NVXWUHKLSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](c3ccccc3)C[C@H](C)C2)CC[N@@H+]1C ZINC000389742326 1045426966 /nfs/dbraw/zinc/42/69/66/1045426966.db2.gz SSRRRDPDYPHRTP-MSJBJCGKSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](c3ccccc3)C[C@H](C)C2)CC[N@H+]1C ZINC000389742326 1045426967 /nfs/dbraw/zinc/42/69/67/1045426967.db2.gz SSRRRDPDYPHRTP-MSJBJCGKSA-N 2 1 300.490 4.031 20 0 DIADMP c1ccc([C@@H]2CCCC[C@@H]2C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000449691823 1045427199 /nfs/dbraw/zinc/42/71/99/1045427199.db2.gz YOBYITDHNOWSDY-ANULTFPQSA-N 2 1 312.501 4.177 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000370671290 1045428126 /nfs/dbraw/zinc/42/81/26/1045428126.db2.gz PHQWQELLBVXPEK-JYJNAYRXSA-N 2 1 304.503 4.076 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC1 ZINC000449791588 1045439455 /nfs/dbraw/zinc/43/94/55/1045439455.db2.gz PNWUUDOPSVCLCB-CRAIPNDOSA-N 2 1 306.881 4.050 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)C2CC(F)(F)C2)c1 ZINC000529531151 1045488307 /nfs/dbraw/zinc/48/83/07/1045488307.db2.gz KRBLASUQXWXGSX-AWEZNQCLSA-N 2 1 310.432 4.050 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@@]2(C)CCCS2)[C@@H]1c1cccs1 ZINC000628217968 1045546581 /nfs/dbraw/zinc/54/65/81/1045546581.db2.gz ORSCKOUBEWMHPY-DJIMGWMZSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@@]2(C)CCCS2)[C@@H]1c1cccs1 ZINC000628217968 1045546593 /nfs/dbraw/zinc/54/65/93/1045546593.db2.gz ORSCKOUBEWMHPY-DJIMGWMZSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+]C[C@]2(C)CCCS2)[C@@H]1c1cccs1 ZINC000628217970 1045548043 /nfs/dbraw/zinc/54/80/43/1045548043.db2.gz ORSCKOUBEWMHPY-OIISXLGYSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+]C[C@]2(C)CCCS2)[C@@H]1c1cccs1 ZINC000628217970 1045548059 /nfs/dbraw/zinc/54/80/59/1045548059.db2.gz ORSCKOUBEWMHPY-OIISXLGYSA-N 2 1 324.559 4.006 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380965851 1045555025 /nfs/dbraw/zinc/55/50/25/1045555025.db2.gz CPMMROXMAICYBW-RLLQIKCJSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccccc1 ZINC000390846862 1045585760 /nfs/dbraw/zinc/58/57/60/1045585760.db2.gz FTPZJIDAAFCDFG-NRFANRHFSA-N 2 1 322.496 4.119 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccccc1 ZINC000390846862 1045585771 /nfs/dbraw/zinc/58/57/71/1045585771.db2.gz FTPZJIDAAFCDFG-NRFANRHFSA-N 2 1 322.496 4.119 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]1C ZINC000451146805 1045633320 /nfs/dbraw/zinc/63/33/20/1045633320.db2.gz NCODJRGGPNUIGV-GZBFAFLISA-N 2 1 317.399 4.023 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]1C ZINC000451146805 1045633324 /nfs/dbraw/zinc/63/33/24/1045633324.db2.gz NCODJRGGPNUIGV-GZBFAFLISA-N 2 1 317.399 4.023 20 0 DIADMP Cc1nccn1CCCC[N@H+]1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C ZINC000451191846 1045643920 /nfs/dbraw/zinc/64/39/20/1045643920.db2.gz UWSXLXKOJWDAKQ-MBOZVWFJSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C ZINC000451191846 1045643928 /nfs/dbraw/zinc/64/39/28/1045643928.db2.gz UWSXLXKOJWDAKQ-MBOZVWFJSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C ZINC000451191846 1045643931 /nfs/dbraw/zinc/64/39/31/1045643931.db2.gz UWSXLXKOJWDAKQ-MBOZVWFJSA-N 2 1 311.473 4.238 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335450 1045646457 /nfs/dbraw/zinc/64/64/57/1045646457.db2.gz OSTCUBWJAPFJTR-CHYADLBTSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335450 1045646464 /nfs/dbraw/zinc/64/64/64/1045646464.db2.gz OSTCUBWJAPFJTR-CHYADLBTSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335450 1045646470 /nfs/dbraw/zinc/64/64/70/1045646470.db2.gz OSTCUBWJAPFJTR-CHYADLBTSA-N 2 1 306.881 4.017 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000530335450 1045646476 /nfs/dbraw/zinc/64/64/76/1045646476.db2.gz OSTCUBWJAPFJTR-CHYADLBTSA-N 2 1 306.881 4.017 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccccc2CC(F)(F)F)c2ccccc21 ZINC000629553608 1045678705 /nfs/dbraw/zinc/67/87/05/1045678705.db2.gz BCTOUDOCBGQDPQ-IAGOWNOFSA-N 2 1 320.358 4.026 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cccc(C(F)(F)F)c2)C[C@H]1C ZINC000530905613 1045748568 /nfs/dbraw/zinc/74/85/68/1045748568.db2.gz PXAGAUKGYJKEKP-CZUORRHYSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@H]1C ZINC000530905613 1045748584 /nfs/dbraw/zinc/74/85/84/1045748584.db2.gz PXAGAUKGYJKEKP-CZUORRHYSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@H]1C ZINC000530905613 1045748594 /nfs/dbraw/zinc/74/85/94/1045748594.db2.gz PXAGAUKGYJKEKP-CZUORRHYSA-N 2 1 314.395 4.010 20 0 DIADMP FC1(F)CCC([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000688309638 1045753331 /nfs/dbraw/zinc/75/33/31/1045753331.db2.gz ZCDPOFIKMBWQGF-KRWDZBQOSA-N 2 1 322.443 4.066 20 0 DIADMP C[C@]1(C[NH2+]C2CCC(F)(F)CC2)CC[N@@H+](Cc2ccccc2)C1 ZINC000688309313 1045754110 /nfs/dbraw/zinc/75/41/10/1045754110.db2.gz XSNTUBDFRYXUHO-GOSISDBHSA-N 2 1 322.443 4.066 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)C2CCCCCC2)cn1 ZINC000753626992 1045781274 /nfs/dbraw/zinc/78/12/74/1045781274.db2.gz UBVXQPUDEJGZGI-HNNXBMFYSA-N 2 1 312.461 4.024 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000531340245 1045827313 /nfs/dbraw/zinc/82/73/13/1045827313.db2.gz DSTYKYSQQLTPPX-GOSISDBHSA-N 2 1 308.469 4.004 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCSc3ccc(Cl)cc32)CC1 ZINC000035047349 1045832594 /nfs/dbraw/zinc/83/25/94/1045832594.db2.gz SCZSRBSMPDKMJG-MRXNPFEDSA-N 2 1 324.921 4.339 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC000531687436 1045892250 /nfs/dbraw/zinc/89/22/50/1045892250.db2.gz WKCYBPACXRGKKC-SGZDXZSOSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@@H+]1C ZINC000531683328 1045897538 /nfs/dbraw/zinc/89/75/38/1045897538.db2.gz GPBXWGUUHCDUSN-OLMNPRSZSA-N 2 1 306.469 4.375 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CC[N@H+]1C ZINC000531683328 1045897563 /nfs/dbraw/zinc/89/75/63/1045897563.db2.gz GPBXWGUUHCDUSN-OLMNPRSZSA-N 2 1 306.469 4.375 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000531704750 1045901397 /nfs/dbraw/zinc/90/13/97/1045901397.db2.gz JPMAPLXBOJZZKK-CTNGQTDRSA-N 2 1 314.517 4.276 20 0 DIADMP c1cnc2cccc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c2c1 ZINC001137627911 1045910798 /nfs/dbraw/zinc/91/07/98/1045910798.db2.gz FJEXFZUUWZKUHO-IBGZPJMESA-N 2 1 323.484 4.075 20 0 DIADMP CC(C)C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000531717191 1045911644 /nfs/dbraw/zinc/91/16/44/1045911644.db2.gz GKIDFYJSVBSLHE-YJBOKZPZSA-N 2 1 308.897 4.359 20 0 DIADMP CC[C@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccsc1 ZINC000453104193 1045935424 /nfs/dbraw/zinc/93/54/24/1045935424.db2.gz DVHVUWPGEHWOHF-SFHVURJKSA-N 2 1 302.487 4.441 20 0 DIADMP CC[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)c1ccsc1 ZINC000453104172 1045937478 /nfs/dbraw/zinc/93/74/78/1045937478.db2.gz DVHVUWPGEHWOHF-GOSISDBHSA-N 2 1 302.487 4.441 20 0 DIADMP CCC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)C(C)(C)C ZINC000453129721 1045953517 /nfs/dbraw/zinc/95/35/17/1045953517.db2.gz TZJNXEWHOPIQPI-QGZVFWFLSA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccsc1 ZINC000453129668 1045953718 /nfs/dbraw/zinc/95/37/18/1045953718.db2.gz RPGZCIXDRMFULC-QGZVFWFLSA-N 2 1 315.486 4.161 20 0 DIADMP CC(F)(F)CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000453227803 1045994668 /nfs/dbraw/zinc/99/46/68/1045994668.db2.gz FYHAEJLUOSOMRX-BCDXTJNWSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H](C[NH2+]c1ccc(N(C)C2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000802640784 1046020168 /nfs/dbraw/zinc/02/01/68/1046020168.db2.gz SKSSFBMEWQHDQR-INIZCTEOSA-N 2 1 317.521 4.311 20 0 DIADMP C[C@H](C[NH2+]c1ccc(N(C)C2CC[NH+](C)CC2)cc1)C(C)(C)C ZINC000802640793 1046020302 /nfs/dbraw/zinc/02/03/02/1046020302.db2.gz SKSSFBMEWQHDQR-MRXNPFEDSA-N 2 1 317.521 4.311 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1C(C)(C)C ZINC000453340984 1046044686 /nfs/dbraw/zinc/04/46/86/1046044686.db2.gz HKDKUATXMBJKDX-XYTVBORESA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1F ZINC000453349630 1046049943 /nfs/dbraw/zinc/04/99/43/1046049943.db2.gz LRVXMPDVFMZRRM-KRWWSPQJSA-N 2 1 324.871 4.391 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1F ZINC000453349630 1046049961 /nfs/dbraw/zinc/04/99/61/1046049961.db2.gz LRVXMPDVFMZRRM-KRWWSPQJSA-N 2 1 324.871 4.391 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC000453381482 1046057740 /nfs/dbraw/zinc/05/77/40/1046057740.db2.gz BAIUSEWANWJOHZ-MOIQIXESSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC000453381482 1046057754 /nfs/dbraw/zinc/05/77/54/1046057754.db2.gz BAIUSEWANWJOHZ-MOIQIXESSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453389342 1046065466 /nfs/dbraw/zinc/06/54/66/1046065466.db2.gz CEOBDYZSWOTTKH-ZDUSSCGKSA-N 2 1 323.550 4.274 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1C[C@@H](c2ccccc2)C1(C)C)C1CC1 ZINC000453403398 1046076918 /nfs/dbraw/zinc/07/69/18/1046076918.db2.gz OHUDZPZKJIIVAM-RBUKOAKNSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1cccc(-c2ccncc2)c1 ZINC000453405346 1046077267 /nfs/dbraw/zinc/07/72/67/1046077267.db2.gz QJJHGMNRMOTWGH-QGZVFWFLSA-N 2 1 323.484 4.274 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2ccsc2S1 ZINC000453401369 1046077299 /nfs/dbraw/zinc/07/72/99/1046077299.db2.gz MTNNLMIVSJYDER-WFASDCNBSA-N 2 1 310.532 4.138 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453410114 1046079134 /nfs/dbraw/zinc/07/91/34/1046079134.db2.gz VAATVCYHPOROJF-OAHLLOKOSA-N 2 1 306.519 4.324 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+]CCCC[N@H+](C)C1CC1)CCS2 ZINC000453397796 1046083769 /nfs/dbraw/zinc/08/37/69/1046083769.db2.gz KAJQMDFQZFZQKJ-GOSISDBHSA-N 2 1 318.530 4.304 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc2ncccc2c1 ZINC001138111900 1046098208 /nfs/dbraw/zinc/09/82/08/1046098208.db2.gz WDRURBGFIDDQCG-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc2ncccc2c1 ZINC001138111900 1046098223 /nfs/dbraw/zinc/09/82/23/1046098223.db2.gz WDRURBGFIDDQCG-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc2ncccc2c1 ZINC001138111900 1046098238 /nfs/dbraw/zinc/09/82/38/1046098238.db2.gz WDRURBGFIDDQCG-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CC(c2ccccc2)c2ccccc2)[C@@H](C)C1 ZINC000532203437 1046114235 /nfs/dbraw/zinc/11/42/35/1046114235.db2.gz ZJFMGRUUYDUEDF-AVRDEDQJSA-N 2 1 322.496 4.138 20 0 DIADMP Clc1cccc2c1CC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1 ZINC000903083217 1046159085 /nfs/dbraw/zinc/15/90/85/1046159085.db2.gz BPYCFZIQBXFDRR-QTRNOVCWSA-N 2 1 316.876 4.075 20 0 DIADMP Clc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C3CC3)CC2)cc1 ZINC000903137765 1046172601 /nfs/dbraw/zinc/17/26/01/1046172601.db2.gz PPATWUSHYMIFMV-ZNXRZULTSA-N 2 1 316.876 4.077 20 0 DIADMP Clc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C3CC3)CC2)cc1 ZINC000903137765 1046172605 /nfs/dbraw/zinc/17/26/05/1046172605.db2.gz PPATWUSHYMIFMV-ZNXRZULTSA-N 2 1 316.876 4.077 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1cccc(C2CC2)c1 ZINC000903176912 1046185411 /nfs/dbraw/zinc/18/54/11/1046185411.db2.gz GEAPYPGAJYRUPZ-OBVMDAEUSA-N 2 1 310.485 4.372 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@@H+]3C1CC1)CC2 ZINC000903210316 1046195736 /nfs/dbraw/zinc/19/57/36/1046195736.db2.gz WIIWXNMHTLNMJP-KTWXZFIHSA-N 2 1 316.876 4.075 20 0 DIADMP CCCc1ccc(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3C)C2)s1 ZINC001138528704 1046212702 /nfs/dbraw/zinc/21/27/02/1046212702.db2.gz BJLUYPWLAKFUBA-OAHLLOKOSA-N 2 1 316.470 4.057 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3C)C2)s1 ZINC001138528704 1046212706 /nfs/dbraw/zinc/21/27/06/1046212706.db2.gz BJLUYPWLAKFUBA-OAHLLOKOSA-N 2 1 316.470 4.057 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168163633 1046218570 /nfs/dbraw/zinc/21/85/70/1046218570.db2.gz AWNFIBDOCWYYLZ-FNHZYXHNSA-N 2 1 320.908 4.395 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)cc1 ZINC001138543461 1046219418 /nfs/dbraw/zinc/21/94/18/1046219418.db2.gz PHLLKVUBBSVOSN-INIZCTEOSA-N 2 1 317.436 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)cc1 ZINC001138543461 1046219434 /nfs/dbraw/zinc/21/94/34/1046219434.db2.gz PHLLKVUBBSVOSN-INIZCTEOSA-N 2 1 317.436 4.300 20 0 DIADMP CCc1ccc(C[N@H+](C)Cc2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC001138549042 1046222479 /nfs/dbraw/zinc/22/24/79/1046222479.db2.gz OTZUHBJTDYEZAG-UHFFFAOYSA-N 2 1 319.452 4.375 20 0 DIADMP CCc1ccc(C[N@@H+](C)Cc2ccc(-n3cc[nH+]c3C)cc2)cc1 ZINC001138549042 1046222492 /nfs/dbraw/zinc/22/24/92/1046222492.db2.gz OTZUHBJTDYEZAG-UHFFFAOYSA-N 2 1 319.452 4.375 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)CCCc2ccccc2)cc1 ZINC001138547312 1046223236 /nfs/dbraw/zinc/22/32/36/1046223236.db2.gz JVLPTTVDXBAUEG-UHFFFAOYSA-N 2 1 319.452 4.245 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)CCCc2ccccc2)cc1 ZINC001138547312 1046223250 /nfs/dbraw/zinc/22/32/50/1046223250.db2.gz JVLPTTVDXBAUEG-UHFFFAOYSA-N 2 1 319.452 4.245 20 0 DIADMP CCC[N@H+](C[C@H]([NH3+])CC(F)F)[C@H](C)c1cc2ccccc2o1 ZINC000903885360 1046334301 /nfs/dbraw/zinc/33/43/01/1046334301.db2.gz FTDDJUOWJOGRHB-TZMCWYRMSA-N 2 1 310.388 4.188 20 0 DIADMP CCC[N@@H+](C[C@H]([NH3+])CC(F)F)[C@H](C)c1cc2ccccc2o1 ZINC000903885360 1046334312 /nfs/dbraw/zinc/33/43/12/1046334312.db2.gz FTDDJUOWJOGRHB-TZMCWYRMSA-N 2 1 310.388 4.188 20 0 DIADMP CCC[N@H+](C[C@@H]([NH3+])CC(F)F)[C@H](C)c1cc2ccccc2o1 ZINC000903885359 1046335310 /nfs/dbraw/zinc/33/53/10/1046335310.db2.gz FTDDJUOWJOGRHB-OCCSQVGLSA-N 2 1 310.388 4.188 20 0 DIADMP CCC[N@@H+](C[C@@H]([NH3+])CC(F)F)[C@H](C)c1cc2ccccc2o1 ZINC000903885359 1046335315 /nfs/dbraw/zinc/33/53/15/1046335315.db2.gz FTDDJUOWJOGRHB-OCCSQVGLSA-N 2 1 310.388 4.188 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000638762126 1046339704 /nfs/dbraw/zinc/33/97/04/1046339704.db2.gz BEAIDWWRKPPPFJ-BQFCYCMXSA-N 2 1 320.427 4.132 20 0 DIADMP FC1(F)CC[C@H]([NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000638762126 1046339719 /nfs/dbraw/zinc/33/97/19/1046339719.db2.gz BEAIDWWRKPPPFJ-BQFCYCMXSA-N 2 1 320.427 4.132 20 0 DIADMP FC1(CC[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CCC1 ZINC000639181619 1046366032 /nfs/dbraw/zinc/36/60/32/1046366032.db2.gz VPZPZYPFEGZULD-HKUYNNGSSA-N 2 1 316.464 4.226 20 0 DIADMP FC1(CC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CCC1 ZINC000639181619 1046366044 /nfs/dbraw/zinc/36/60/44/1046366044.db2.gz VPZPZYPFEGZULD-HKUYNNGSSA-N 2 1 316.464 4.226 20 0 DIADMP FC1(CC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CCC1 ZINC000639181623 1046366493 /nfs/dbraw/zinc/36/64/93/1046366493.db2.gz VPZPZYPFEGZULD-IEBWSBKVSA-N 2 1 316.464 4.226 20 0 DIADMP FC1(CC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CCC1 ZINC000639181623 1046366504 /nfs/dbraw/zinc/36/65/04/1046366504.db2.gz VPZPZYPFEGZULD-IEBWSBKVSA-N 2 1 316.464 4.226 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639273781 1046376575 /nfs/dbraw/zinc/37/65/75/1046376575.db2.gz NOWQGEFQMAWYPT-MTFMMBMASA-N 2 1 322.452 4.093 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639273781 1046376590 /nfs/dbraw/zinc/37/65/90/1046376590.db2.gz NOWQGEFQMAWYPT-MTFMMBMASA-N 2 1 322.452 4.093 20 0 DIADMP CC1CCC([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001168205937 1046421094 /nfs/dbraw/zinc/42/10/94/1046421094.db2.gz NMXDRBLQIZPSSJ-FMMXVMRKSA-N 2 1 318.480 4.476 20 0 DIADMP CC1CCC([NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)CC1 ZINC001168217777 1046426982 /nfs/dbraw/zinc/42/69/82/1046426982.db2.gz ONIIOZLMNVZGJV-UHFFFAOYSA-N 2 1 300.490 4.162 20 0 DIADMP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000781428090 1046444218 /nfs/dbraw/zinc/44/42/18/1046444218.db2.gz ZNLIGNIKFJYZRA-BLIXFSHQSA-N 2 1 312.501 4.225 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000124879137 1046459791 /nfs/dbraw/zinc/45/97/91/1046459791.db2.gz CGMBWTGSQMLPKY-HNAYVOBHSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000124879137 1046459802 /nfs/dbraw/zinc/45/98/02/1046459802.db2.gz CGMBWTGSQMLPKY-HNAYVOBHSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124778109 1046460523 /nfs/dbraw/zinc/46/05/23/1046460523.db2.gz STRQEZSKIGLZPJ-YJBOKZPZSA-N 2 1 315.461 4.346 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CCCCn2cc[nH+]c2C)o1 ZINC000124778109 1046460529 /nfs/dbraw/zinc/46/05/29/1046460529.db2.gz STRQEZSKIGLZPJ-YJBOKZPZSA-N 2 1 315.461 4.346 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125809172 1046472121 /nfs/dbraw/zinc/47/21/21/1046472121.db2.gz SNQJKWMZHUJLGE-OFQRWUPVSA-N 2 1 324.559 4.384 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2C[C@H](C)Sc3sccc32)C1 ZINC000125809172 1046472128 /nfs/dbraw/zinc/47/21/28/1046472128.db2.gz SNQJKWMZHUJLGE-OFQRWUPVSA-N 2 1 324.559 4.384 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)Cc1ccccc1-c1ccccc1Cl ZINC001139572936 1046474216 /nfs/dbraw/zinc/47/42/16/1046474216.db2.gz WNYVLHNYJZUZGO-UHFFFAOYSA-N 2 1 316.876 4.391 20 0 DIADMP c1ccc(C2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000677236831 1046475279 /nfs/dbraw/zinc/47/52/79/1046475279.db2.gz VFGBCEMMIVTKIJ-WOJBJXKFSA-N 2 1 312.501 4.105 20 0 DIADMP CCC(CC)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccs1 ZINC000677237881 1046476632 /nfs/dbraw/zinc/47/66/32/1046476632.db2.gz PDSXHBJFSHMUHL-RYRKJORJSA-N 2 1 306.519 4.442 20 0 DIADMP Fc1cccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)c1 ZINC000677241701 1046476668 /nfs/dbraw/zinc/47/66/68/1046476668.db2.gz UCSNPMGPBSPFNN-HSALFYBXSA-N 2 1 316.464 4.273 20 0 DIADMP FC(F)c1ccccc1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001139801505 1046520686 /nfs/dbraw/zinc/52/06/86/1046520686.db2.gz VKANNYJHAAPFSV-KRWDZBQOSA-N 2 1 322.443 4.465 20 0 DIADMP FC(F)c1ccccc1C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001139801505 1046520695 /nfs/dbraw/zinc/52/06/95/1046520695.db2.gz VKANNYJHAAPFSV-KRWDZBQOSA-N 2 1 322.443 4.465 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1cccnc1 ZINC000359864101 1046526085 /nfs/dbraw/zinc/52/60/85/1046526085.db2.gz ABRPJJURSGBZAV-HKBOAZHASA-N 2 1 323.484 4.205 20 0 DIADMP CCCC[N@H+](CCCn1cc[nH+]c1C)[C@H](C)c1ccc(C)o1 ZINC000677818191 1046529700 /nfs/dbraw/zinc/52/97/00/1046529700.db2.gz HBWXQWMXLQXXHL-MRXNPFEDSA-N 2 1 303.450 4.346 20 0 DIADMP CCCC[N@@H+](CCCn1cc[nH+]c1C)[C@H](C)c1ccc(C)o1 ZINC000677818191 1046529711 /nfs/dbraw/zinc/52/97/11/1046529711.db2.gz HBWXQWMXLQXXHL-MRXNPFEDSA-N 2 1 303.450 4.346 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cncc2ccccc21 ZINC001139897076 1046550099 /nfs/dbraw/zinc/55/00/99/1046550099.db2.gz SNJAIGPUSBTOAZ-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cncc2ccccc21 ZINC001139897076 1046550110 /nfs/dbraw/zinc/55/01/10/1046550110.db2.gz SNJAIGPUSBTOAZ-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cncc2ccccc21 ZINC001139897076 1046550119 /nfs/dbraw/zinc/55/01/19/1046550119.db2.gz SNJAIGPUSBTOAZ-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1C[C@H]1C ZINC000322090845 1046583954 /nfs/dbraw/zinc/58/39/54/1046583954.db2.gz WIAHFTPATOIMPZ-QGBNDMGVSA-N 2 1 312.501 4.206 20 0 DIADMP CC(C)CCCNc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000783585129 1046611448 /nfs/dbraw/zinc/61/14/48/1046611448.db2.gz OSUHLVMMAPDAQV-UHFFFAOYSA-N 2 1 317.521 4.313 20 0 DIADMP Cc1ccc2cc[nH+]c(NC3CC[NH+](CC(C)(C)C)CC3)c2c1 ZINC001161207897 1046618962 /nfs/dbraw/zinc/61/89/62/1046618962.db2.gz ZURJLMQBLFMMDD-UHFFFAOYSA-N 2 1 311.473 4.466 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000678425867 1046636786 /nfs/dbraw/zinc/63/67/86/1046636786.db2.gz DACNYBVDSIEUQI-FUHIMQAGSA-N 2 1 315.505 4.084 20 0 DIADMP CC(C)C1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000678596447 1046669081 /nfs/dbraw/zinc/66/90/81/1046669081.db2.gz RPFQLWBNQBPCQK-IHWFROFDSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000643548693 1046672814 /nfs/dbraw/zinc/67/28/14/1046672814.db2.gz TWNGXMNXFWVKTB-SWLSCSKDSA-N 2 1 318.848 4.412 20 0 DIADMP CCc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548791 1046672887 /nfs/dbraw/zinc/67/28/87/1046672887.db2.gz VGKTWBNACSTNEV-HUUCEWRRSA-N 2 1 312.457 4.321 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000643548692 1046672912 /nfs/dbraw/zinc/67/29/12/1046672912.db2.gz TWNGXMNXFWVKTB-IUODEOHRSA-N 2 1 318.848 4.412 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548903 1046673606 /nfs/dbraw/zinc/67/36/06/1046673606.db2.gz XHECNWXBLABHFC-HNNXBMFYSA-N 2 1 304.437 4.021 20 0 DIADMP C[C@@H](NCc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000245960904 1046678115 /nfs/dbraw/zinc/67/81/15/1046678115.db2.gz UVNXEZRGCKAXRX-ZWKOTPCHSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000245960904 1046678127 /nfs/dbraw/zinc/67/81/27/1046678127.db2.gz UVNXEZRGCKAXRX-ZWKOTPCHSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccccn1 ZINC000245960904 1046678131 /nfs/dbraw/zinc/67/81/31/1046678131.db2.gz UVNXEZRGCKAXRX-ZWKOTPCHSA-N 2 1 323.484 4.164 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@H+]3CCC[C@@H]3C1)CCC2 ZINC000678609544 1046679165 /nfs/dbraw/zinc/67/91/65/1046679165.db2.gz PHFABJASGLKEAM-ZVDOUQERSA-N 2 1 312.501 4.404 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394594 1046715014 /nfs/dbraw/zinc/71/50/14/1046715014.db2.gz HILBCVFKVOLXNZ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394594 1046715028 /nfs/dbraw/zinc/71/50/28/1046715028.db2.gz HILBCVFKVOLXNZ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394594 1046715032 /nfs/dbraw/zinc/71/50/32/1046715032.db2.gz HILBCVFKVOLXNZ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)[C@H](C)C1 ZINC000533394594 1046715049 /nfs/dbraw/zinc/71/50/49/1046715049.db2.gz HILBCVFKVOLXNZ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000678892288 1046728895 /nfs/dbraw/zinc/72/88/95/1046728895.db2.gz FNYIYGORPASLSE-ACJLOTCBSA-N 2 1 321.415 4.093 20 0 DIADMP CC[N@H+](CCC[NH2+]Cc1cnc(C(C)C)s1)C1CCCCC1 ZINC001203042681 1046752919 /nfs/dbraw/zinc/75/29/19/1046752919.db2.gz BUVCUZMFCSGNQR-UHFFFAOYSA-N 2 1 323.550 4.401 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1cnc(C(C)C)s1)C1CCCCC1 ZINC001203042681 1046752935 /nfs/dbraw/zinc/75/29/35/1046752935.db2.gz BUVCUZMFCSGNQR-UHFFFAOYSA-N 2 1 323.550 4.401 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cc(F)cc(Cl)c2)CC1 ZINC001140538259 1046770737 /nfs/dbraw/zinc/77/07/37/1046770737.db2.gz LPIOZYUNJYYLRI-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC[NH+](CC)Cc1ccccc1Nc1ccc2c(c1)C[N@H+](C)CC2 ZINC001211997673 1046772850 /nfs/dbraw/zinc/77/28/50/1046772850.db2.gz FPTXPDYKOBUPJN-UHFFFAOYSA-N 2 1 323.484 4.260 20 0 DIADMP C[C@H](NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccoc1 ZINC000248177948 1046835833 /nfs/dbraw/zinc/83/58/33/1046835833.db2.gz VWQNLKMBKLMREJ-JJRVBVJISA-N 2 1 304.459 4.075 20 0 DIADMP Fc1ccc(C2CC[NH+](Cc3c[nH]c4cc[nH+]cc34)CC2)cc1 ZINC001140802854 1046906849 /nfs/dbraw/zinc/90/68/49/1046906849.db2.gz GTWRUBQORPIIES-UHFFFAOYSA-N 2 1 309.388 4.082 20 0 DIADMP Fc1ccc(C[C@@H]2CCC[N@H+](Cc3c[nH]c4cc[nH+]cc34)C2)cc1 ZINC001140805193 1046909504 /nfs/dbraw/zinc/90/95/04/1046909504.db2.gz VVBFBVTWAOLFOL-INIZCTEOSA-N 2 1 323.415 4.157 20 0 DIADMP Fc1ccc(C[C@@H]2CCC[N@@H+](Cc3c[nH]c4cc[nH+]cc34)C2)cc1 ZINC001140805193 1046909509 /nfs/dbraw/zinc/90/95/09/1046909509.db2.gz VVBFBVTWAOLFOL-INIZCTEOSA-N 2 1 323.415 4.157 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C2CCC(F)(F)CC2)CC1 ZINC000647172088 1046950022 /nfs/dbraw/zinc/95/00/22/1046950022.db2.gz HXBLHMWJMQREES-UHFFFAOYSA-N 2 1 322.443 4.127 20 0 DIADMP Cc1ccc2c(C)cc(N3CCCC4(CC[NH+](C)CC4)C3)[nH+]c2c1 ZINC000798405334 1046953101 /nfs/dbraw/zinc/95/31/01/1046953101.db2.gz GCMFATWJHCYPME-UHFFFAOYSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@@H](c1cccs1)[N@H+](Cc1ccccc1)CC1CC[NH2+]CC1 ZINC000262257799 1046961893 /nfs/dbraw/zinc/96/18/93/1046961893.db2.gz QVUZTADGWARDPN-INIZCTEOSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)c1ccco1 ZINC000680351870 1046970408 /nfs/dbraw/zinc/97/04/08/1046970408.db2.gz GZJDTICPJIXKPN-OJAHFUOMSA-N 2 1 324.468 4.231 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccco1 ZINC000680351870 1046970412 /nfs/dbraw/zinc/97/04/12/1046970412.db2.gz GZJDTICPJIXKPN-OJAHFUOMSA-N 2 1 324.468 4.231 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H](C)CC(F)F)cc1 ZINC000647317936 1046974912 /nfs/dbraw/zinc/97/49/12/1046974912.db2.gz AFBJQVDRGDMDKZ-STQMWFEESA-N 2 1 307.388 4.123 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000827438620 1046989716 /nfs/dbraw/zinc/98/97/16/1046989716.db2.gz SOLPINCYVQISNP-OAHLLOKOSA-N 2 1 321.336 4.014 20 0 DIADMP C[C@H]([NH2+]CC1CCC(F)CC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000647350061 1046989807 /nfs/dbraw/zinc/98/98/07/1046989807.db2.gz UCICEMUVCKNFON-AILXTGBUSA-N 2 1 318.480 4.015 20 0 DIADMP C[C@@H]([NH2+]CC1CCC(F)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000647350063 1046989994 /nfs/dbraw/zinc/98/99/94/1046989994.db2.gz UCICEMUVCKNFON-PYXOFJJQSA-N 2 1 318.480 4.015 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SCC)cc2)C1 ZINC000533783172 1047018819 /nfs/dbraw/zinc/01/88/19/1047018819.db2.gz FNKZBCNDHOWFBO-JKSUJKDBSA-N 2 1 306.519 4.181 20 0 DIADMP CCCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000536662654 1047057787 /nfs/dbraw/zinc/05/77/87/1047057787.db2.gz OWRKNMMFTBZTAK-YLJYHZDGSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000536662654 1047057800 /nfs/dbraw/zinc/05/78/00/1047057800.db2.gz OWRKNMMFTBZTAK-YLJYHZDGSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000536662654 1047057816 /nfs/dbraw/zinc/05/78/16/1047057816.db2.gz OWRKNMMFTBZTAK-YLJYHZDGSA-N 2 1 318.505 4.028 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379643924 1047090155 /nfs/dbraw/zinc/09/01/55/1047090155.db2.gz BPAQJPXLWRUNGE-YLJYHZDGSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379643924 1047090165 /nfs/dbraw/zinc/09/01/65/1047090165.db2.gz BPAQJPXLWRUNGE-YLJYHZDGSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]([NH2+]C1(C[NH2+]C2CC(C(F)F)C2)CCCC1)c1ccccc1 ZINC000681091050 1047093770 /nfs/dbraw/zinc/09/37/70/1047093770.db2.gz WUUPGRQXXYIFRN-ODIFPOPNSA-N 2 1 322.443 4.283 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000379653741 1047094508 /nfs/dbraw/zinc/09/45/08/1047094508.db2.gz GNJBRZVVESRXMH-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000379653741 1047094524 /nfs/dbraw/zinc/09/45/24/1047094524.db2.gz GNJBRZVVESRXMH-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379657081 1047095614 /nfs/dbraw/zinc/09/56/14/1047095614.db2.gz RPSSLXHAGOVGMP-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379657081 1047095630 /nfs/dbraw/zinc/09/56/30/1047095630.db2.gz RPSSLXHAGOVGMP-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2cccc(-c3ccsc3)c2)CC1 ZINC001141384376 1047113535 /nfs/dbraw/zinc/11/35/35/1047113535.db2.gz KQVSNQGWHRFQTN-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2cccc(-c3ccsc3)c2)CC1 ZINC001141384376 1047113538 /nfs/dbraw/zinc/11/35/38/1047113538.db2.gz KQVSNQGWHRFQTN-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP c1cc(-c2cccc(C[NH+]3CCC([NH+]4CCC4)CC3)c2)cs1 ZINC001141386477 1047113579 /nfs/dbraw/zinc/11/35/79/1047113579.db2.gz JXGXKFOZBXLWGY-UHFFFAOYSA-N 2 1 312.482 4.085 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc2c(s1)CCCC2 ZINC000536864488 1047115337 /nfs/dbraw/zinc/11/53/37/1047115337.db2.gz NWZVAONBOVQIFK-ZIAGYGMSSA-N 2 1 317.502 4.119 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc2c(s1)CCCC2 ZINC000536864487 1047115556 /nfs/dbraw/zinc/11/55/56/1047115556.db2.gz NWZVAONBOVQIFK-UONOGXRCSA-N 2 1 317.502 4.119 20 0 DIADMP CC[N@H+]1CCC[C@H](CN[C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293159 1047127291 /nfs/dbraw/zinc/12/72/91/1047127291.db2.gz KXMPUAWPOBICFL-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293159 1047127295 /nfs/dbraw/zinc/12/72/95/1047127295.db2.gz KXMPUAWPOBICFL-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC001116293159 1047127298 /nfs/dbraw/zinc/12/72/98/1047127298.db2.gz KXMPUAWPOBICFL-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)C2CC2)C1 ZINC000537014111 1047131400 /nfs/dbraw/zinc/13/14/00/1047131400.db2.gz CBHAQBXVFRMXLD-PXNSSMCTSA-N 2 1 300.490 4.095 20 0 DIADMP CC[NH+](CC)C1CCN(c2cc[nH+]c3ccc(Cl)cc32)CC1 ZINC001116473284 1047146820 /nfs/dbraw/zinc/14/68/20/1047146820.db2.gz LEBYEDWKSSLPDY-UHFFFAOYSA-N 2 1 317.864 4.199 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](CSc2ccccc2)C(C)C)C1 ZINC001116505804 1047149981 /nfs/dbraw/zinc/14/99/81/1047149981.db2.gz SSXYNVDBGUMAAE-MJGOQNOKSA-N 2 1 320.546 4.125 20 0 DIADMP C[NH+](C)[C@@H]1CCCC[C@@H]1[NH2+]C1CC(c2ccc(Cl)cc2)C1 ZINC001116554735 1047157025 /nfs/dbraw/zinc/15/70/25/1047157025.db2.gz CPJJJWLKYVCTKW-DQVOVIAYSA-N 2 1 306.881 4.048 20 0 DIADMP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000537305882 1047163036 /nfs/dbraw/zinc/16/30/36/1047163036.db2.gz BNOMRVMSOHNRAU-IBGZPJMESA-N 2 1 320.908 4.149 20 0 DIADMP CC[NH+](CC)C1CC[NH+](CCc2ccc(C(C)C)cc2)CC1 ZINC001116639489 1047165380 /nfs/dbraw/zinc/16/53/80/1047165380.db2.gz YMBZVNNDVBONPC-UHFFFAOYSA-N 2 1 302.506 4.159 20 0 DIADMP CC[N@@H+](C)Cc1cccc(CNc2cc[nH+]c3c(O)cccc23)c1 ZINC000682238673 1047183437 /nfs/dbraw/zinc/18/34/37/1047183437.db2.gz HFVGWDVUUJXPBO-UHFFFAOYSA-N 2 1 321.424 4.004 20 0 DIADMP Clc1cccc(C2([NH2+]C3CC[NH+](C4CCCC4)CC3)CC2)c1 ZINC000537451357 1047186845 /nfs/dbraw/zinc/18/68/45/1047186845.db2.gz ZBKFGTOLEAIXCP-UHFFFAOYSA-N 2 1 318.892 4.326 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692627 1047321915 /nfs/dbraw/zinc/32/19/15/1047321915.db2.gz MEHAKQVWSXFRNS-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692627 1047321923 /nfs/dbraw/zinc/32/19/23/1047321923.db2.gz MEHAKQVWSXFRNS-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1 ZINC000652140361 1047344879 /nfs/dbraw/zinc/34/48/79/1047344879.db2.gz MDXYDHBONHNRMR-QRVBRYPASA-N 2 1 304.453 4.129 20 0 DIADMP [NH3+]CCC[N@@H+](C1CCCCC1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255691174 1047423122 /nfs/dbraw/zinc/42/31/22/1047423122.db2.gz WWAHWXLPXJXEDG-UKRRQHHQSA-N 2 1 306.416 4.091 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3C[C@H]4CC[N@H+](C)C[C@H]4C3)cc2)cc1 ZINC001142299751 1047423606 /nfs/dbraw/zinc/42/36/06/1047423606.db2.gz CSPZGCXCZXRWEJ-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3C[C@H]4CC[NH+](C)C[C@H]4C3)cc2)cc1 ZINC001142299751 1047423613 /nfs/dbraw/zinc/42/36/13/1047423613.db2.gz CSPZGCXCZXRWEJ-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@H]4CC[NH+](C)C[C@H]4C3)cc2)cc1 ZINC001142299751 1047423617 /nfs/dbraw/zinc/42/36/17/1047423617.db2.gz CSPZGCXCZXRWEJ-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC001168316015 1047427660 /nfs/dbraw/zinc/42/76/60/1047427660.db2.gz SYVVIPZSUVOPPY-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2cccc(F)c2)cc1 ZINC000086279451 1047440337 /nfs/dbraw/zinc/44/03/37/1047440337.db2.gz JVDWLGKFMYIHOP-CQSZACIVSA-N 2 1 309.388 4.171 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001168322746 1047444146 /nfs/dbraw/zinc/44/41/46/1047444146.db2.gz GWCNIVAAWAMEQJ-ABHNRTSZSA-N 2 1 306.881 4.350 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC001168327357 1047455545 /nfs/dbraw/zinc/45/55/45/1047455545.db2.gz KOJCLOWQSQANLW-FAEJEUNOSA-N 2 1 306.881 4.002 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@@H+]1C ZINC000537618160 1047457290 /nfs/dbraw/zinc/45/72/90/1047457290.db2.gz OXBUZESXVQAPGE-UTKZUKDTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)Cc2cccc(-c3ccccc3)c2)CC[N@H+]1C ZINC000537618160 1047457292 /nfs/dbraw/zinc/45/72/92/1047457292.db2.gz OXBUZESXVQAPGE-UTKZUKDTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618160 1047457297 /nfs/dbraw/zinc/45/72/97/1047457297.db2.gz OXBUZESXVQAPGE-UTKZUKDTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc(-c3ccccc3)c2)CC[NH+]1C ZINC000537618160 1047457298 /nfs/dbraw/zinc/45/72/98/1047457298.db2.gz OXBUZESXVQAPGE-UTKZUKDTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(F)c2)C2CCCC2)CC[N@@H+]1C ZINC000119727498 1047465441 /nfs/dbraw/zinc/46/54/41/1047465441.db2.gz HSPTWSPAYLJTCC-NIKGAXFTSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2cccc(F)c2)C2CCCC2)CC[N@H+]1C ZINC000119727498 1047465449 /nfs/dbraw/zinc/46/54/49/1047465449.db2.gz HSPTWSPAYLJTCC-NIKGAXFTSA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000119696080 1047470012 /nfs/dbraw/zinc/47/00/12/1047470012.db2.gz MDAYCOUKNFABAD-HNNXBMFYSA-N 2 1 318.530 4.465 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CCCO2 ZINC000089513097 1047485444 /nfs/dbraw/zinc/48/54/44/1047485444.db2.gz JOOMCACHROOMSU-GOSISDBHSA-N 2 1 316.489 4.061 20 0 DIADMP [NH3+]CCCc1[nH+]ccn1C1CCC(c2ccc(Cl)cc2)CC1 ZINC001168342019 1047511170 /nfs/dbraw/zinc/51/11/70/1047511170.db2.gz YWZOZIBVZRJGBG-UHFFFAOYSA-N 2 1 317.864 4.327 20 0 DIADMP C[N@@H+](Cc1ccc(-c2cccc(F)c2)s1)C1CCC([NH3+])CC1 ZINC000843055509 1047526128 /nfs/dbraw/zinc/52/61/28/1047526128.db2.gz DQHAGNYLZAKAMR-UHFFFAOYSA-N 2 1 318.461 4.256 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc(C(F)F)cc1 ZINC001143252246 1047544548 /nfs/dbraw/zinc/54/45/48/1047544548.db2.gz WRZLQZMDMSZVPK-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc(C(F)F)cc1 ZINC001143252246 1047544552 /nfs/dbraw/zinc/54/45/52/1047544552.db2.gz WRZLQZMDMSZVPK-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC001143252246 1047544560 /nfs/dbraw/zinc/54/45/60/1047544560.db2.gz WRZLQZMDMSZVPK-ZWKOTPCHSA-N 2 1 322.443 4.463 20 0 DIADMP Fc1ccc2oc(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2c1 ZINC000093563661 1047548428 /nfs/dbraw/zinc/54/84/28/1047548428.db2.gz WOBJWIIVDYWGPR-QGZVFWFLSA-N 2 1 316.420 4.022 20 0 DIADMP Fc1ccc2oc(C[N@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)cc2c1 ZINC000093563661 1047548432 /nfs/dbraw/zinc/54/84/32/1047548432.db2.gz WOBJWIIVDYWGPR-QGZVFWFLSA-N 2 1 316.420 4.022 20 0 DIADMP C[C@H](c1cccnc1)[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000476976281 1047587079 /nfs/dbraw/zinc/58/70/79/1047587079.db2.gz WANXZWBVWHCHKX-QZTJIDSGSA-N 2 1 315.505 4.119 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2cc(-c3ccsc3)cs2)C1 ZINC001206640394 1047593986 /nfs/dbraw/zinc/59/39/86/1047593986.db2.gz JJPNJPOVEAHAOI-CYBMUJFWSA-N 2 1 306.500 4.037 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCCC[C@@H](C[NH3+])C3)c2)cc1 ZINC001206640698 1047594733 /nfs/dbraw/zinc/59/47/33/1047594733.db2.gz LFTBCLQEWATKMH-IBGZPJMESA-N 2 1 308.469 4.223 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(F)c(Cl)c1 ZINC001168356019 1047603985 /nfs/dbraw/zinc/60/39/85/1047603985.db2.gz IYPVMKNADGPRQY-GFCCVEGCSA-N 2 1 310.844 4.004 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1cc(C)ccc1OC ZINC000537884985 1047642880 /nfs/dbraw/zinc/64/28/80/1047642880.db2.gz VKXGQZCUWDHTDI-IBGZPJMESA-N 2 1 318.505 4.165 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000537944906 1047645053 /nfs/dbraw/zinc/64/50/53/1047645053.db2.gz SGHRKGHFOXIZNL-AOIWGVFYSA-N 2 1 312.457 4.231 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000537983232 1047650042 /nfs/dbraw/zinc/65/00/42/1047650042.db2.gz DCDXEAZDYTYYOF-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC000537983232 1047650044 /nfs/dbraw/zinc/65/00/44/1047650044.db2.gz DCDXEAZDYTYYOF-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)Cc2ccsc2)c1 ZINC000537971766 1047651465 /nfs/dbraw/zinc/65/14/65/1047651465.db2.gz GMONYVAWIIFWJB-INIZCTEOSA-N 2 1 316.514 4.309 20 0 DIADMP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCc2ccco2)c1 ZINC000537971010 1047651489 /nfs/dbraw/zinc/65/14/89/1047651489.db2.gz VEVYAKYCHDGBLH-KRWDZBQOSA-N 2 1 314.473 4.231 20 0 DIADMP [NH2+]=C(Nc1cc(N2CCCC2)cc[nH+]1)C12CC3CC(CC(C3)C1)C2 ZINC001155960183 1047692903 /nfs/dbraw/zinc/69/29/03/1047692903.db2.gz UIZYGVDXLNDCKU-UHFFFAOYSA-N 2 1 324.472 4.287 20 0 DIADMP CC[C@H](C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000538719206 1047699183 /nfs/dbraw/zinc/69/91/83/1047699183.db2.gz RPVDLEBAZVFMRY-UYAOXDASSA-N 2 1 300.490 4.131 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2cccs2)C2CCCC2)C1 ZINC000538985390 1047723817 /nfs/dbraw/zinc/72/38/17/1047723817.db2.gz RMKJPRCGIHIENN-QAPCUYQASA-N 2 1 306.519 4.301 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000539041664 1047726395 /nfs/dbraw/zinc/72/63/95/1047726395.db2.gz NXXMBUANDCRWDJ-WSTZPKSXSA-N 2 1 323.484 4.033 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)s2)C1 ZINC000539046260 1047731684 /nfs/dbraw/zinc/73/16/84/1047731684.db2.gz IYXSJHQKBMFLQW-KBPBESRZSA-N 2 1 314.926 4.420 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)s2)C1 ZINC000539046268 1047732019 /nfs/dbraw/zinc/73/20/19/1047732019.db2.gz IYXSJHQKBMFLQW-UONOGXRCSA-N 2 1 314.926 4.420 20 0 DIADMP CCc1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C(C)C)cc1 ZINC000539162639 1047739124 /nfs/dbraw/zinc/73/91/24/1047739124.db2.gz IHPAZWVTSLSNRG-YLJYHZDGSA-N 2 1 300.490 4.020 20 0 DIADMP CCC(CC)[C@@H]([NH2+]CCCn1cc[nH+]c1C)c1cccs1 ZINC000539277332 1047744340 /nfs/dbraw/zinc/74/43/40/1047744340.db2.gz SUTKGIZFRZPJKO-QGZVFWFLSA-N 2 1 305.491 4.410 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC[N@H+]1C)c1ccc(-c2ccncc2)cc1 ZINC000539339019 1047747887 /nfs/dbraw/zinc/74/78/87/1047747887.db2.gz APDOVYKCUOQGOL-LAUBAEHRSA-N 2 1 323.484 4.274 20 0 DIADMP Cc1[nH+]c2c(Nc3ccc([C@H]4CCC[NH2+]4)cc3)cccn2c1C ZINC001159394957 1047839471 /nfs/dbraw/zinc/83/94/71/1047839471.db2.gz CMBZJMHFKWQKLW-QGZVFWFLSA-N 2 1 306.413 4.119 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961468 1047868145 /nfs/dbraw/zinc/86/81/45/1047868145.db2.gz YYHIHPOSONXJPZ-RDTXWAMCSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001182961468 1047868155 /nfs/dbraw/zinc/86/81/55/1047868155.db2.gz YYHIHPOSONXJPZ-RDTXWAMCSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)cc1Cl ZINC001183065743 1047888179 /nfs/dbraw/zinc/88/81/79/1047888179.db2.gz OYRNHGWXCWKVLT-MAUKXSAKSA-N 2 1 308.897 4.201 20 0 DIADMP Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)cc1Cl ZINC001183065743 1047888199 /nfs/dbraw/zinc/88/81/99/1047888199.db2.gz OYRNHGWXCWKVLT-MAUKXSAKSA-N 2 1 308.897 4.201 20 0 DIADMP CC[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1cccc(Cl)c1 ZINC000479522045 1047915222 /nfs/dbraw/zinc/91/52/22/1047915222.db2.gz LUDQOIJGOMVMDV-DAWZGUTISA-N 2 1 306.881 4.398 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccccc1 ZINC000479531952 1047926853 /nfs/dbraw/zinc/92/68/53/1047926853.db2.gz ZMGJHHFACAPMCQ-MHJFOBGBSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1Nc1cccc2c1CC[NH2+]C2 ZINC001159817981 1047929710 /nfs/dbraw/zinc/92/97/10/1047929710.db2.gz DRXUCQCDCPRLNW-UHFFFAOYSA-N 2 1 321.468 4.375 20 0 DIADMP CC[C@H](C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1)c1ccccc1 ZINC001183464656 1047931041 /nfs/dbraw/zinc/93/10/41/1047931041.db2.gz VQXCJNLULNFJFY-HXUWFJFHSA-N 2 1 316.533 4.480 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001183570525 1047941690 /nfs/dbraw/zinc/94/16/90/1047941690.db2.gz BWLWDIRZZQPAES-YFVAEKQCSA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)C[C@]1(C)C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001183570525 1047941693 /nfs/dbraw/zinc/94/16/93/1047941693.db2.gz BWLWDIRZZQPAES-YFVAEKQCSA-N 2 1 312.501 4.380 20 0 DIADMP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3[nH+]c(C)cc4[nH]ccc43)c2c1 ZINC001160013369 1047968789 /nfs/dbraw/zinc/96/87/89/1047968789.db2.gz WJMYIQYSNLBMHW-CYBMUJFWSA-N 2 1 318.424 4.013 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC001184024244 1047990557 /nfs/dbraw/zinc/99/05/57/1047990557.db2.gz YBZCNCYYXNGYMN-RTBURBONSA-N 2 1 300.490 4.177 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@H+](C)Cc1cccc(C2CCCC2)c1 ZINC001184198444 1048006342 /nfs/dbraw/zinc/00/63/42/1048006342.db2.gz XTSJWKUGPAXWKU-UHFFFAOYSA-N 2 1 302.506 4.364 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@@H+](C)Cc1cccc(C2CCCC2)c1 ZINC001184198444 1048006355 /nfs/dbraw/zinc/00/63/55/1048006355.db2.gz XTSJWKUGPAXWKU-UHFFFAOYSA-N 2 1 302.506 4.364 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000554089727 1048007918 /nfs/dbraw/zinc/00/79/18/1048007918.db2.gz YQMMQUJMXXZGLM-ZCNNSNEGSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000554089727 1048007921 /nfs/dbraw/zinc/00/79/21/1048007921.db2.gz YQMMQUJMXXZGLM-ZCNNSNEGSA-N 2 1 312.501 4.065 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCCc3ccc(Cl)cc32)CC1 ZINC000480035504 1048031141 /nfs/dbraw/zinc/03/11/41/1048031141.db2.gz CACZBBQWAMDERT-GOSISDBHSA-N 2 1 306.881 4.181 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)cc1C ZINC001184375671 1048032684 /nfs/dbraw/zinc/03/26/84/1048032684.db2.gz WFBNVJMYRYQVQA-CMDGGOBGSA-N 2 1 314.517 4.478 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)cc1C ZINC001184375671 1048032693 /nfs/dbraw/zinc/03/26/93/1048032693.db2.gz WFBNVJMYRYQVQA-CMDGGOBGSA-N 2 1 314.517 4.478 20 0 DIADMP c1ccc2c(c1)CC[N@@H+](CCC[NH2+]Cc1ccc(C3CC3)cc1)C2 ZINC001199239116 1048047389 /nfs/dbraw/zinc/04/73/89/1048047389.db2.gz ZDWCJRGIEAZEBN-UHFFFAOYSA-N 2 1 320.480 4.102 20 0 DIADMP c1ccc2c(c1)CC[N@H+](CCC[NH2+]Cc1ccc(C3CC3)cc1)C2 ZINC001199239116 1048047403 /nfs/dbraw/zinc/04/74/03/1048047403.db2.gz ZDWCJRGIEAZEBN-UHFFFAOYSA-N 2 1 320.480 4.102 20 0 DIADMP CC(C)C1CCC(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)CC1 ZINC001199329148 1048057905 /nfs/dbraw/zinc/05/79/05/1048057905.db2.gz ODHZHQJBQLPMMC-VCWRXUFXSA-N 2 1 308.554 4.406 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2SCC)CC1 ZINC000480138340 1048063017 /nfs/dbraw/zinc/06/30/17/1048063017.db2.gz GSRVJRMKRCYGQD-HNNXBMFYSA-N 2 1 306.519 4.324 20 0 DIADMP Cc1cccc2cc[nH+]c(N(Cc3ccccc3)C[C@@H](C)C[NH3+])c12 ZINC001160666370 1048075490 /nfs/dbraw/zinc/07/54/90/1048075490.db2.gz VZTBIAAVVLDCAR-INIZCTEOSA-N 2 1 319.452 4.145 20 0 DIADMP CCc1nc(C)c([C@H](C)NCCC[N@@H+](C)C2CCCCC2)s1 ZINC000480249801 1048103406 /nfs/dbraw/zinc/10/34/06/1048103406.db2.gz QHIVGMJPFUEEIP-AWEZNQCLSA-N 2 1 323.550 4.319 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)s1 ZINC000480249801 1048103411 /nfs/dbraw/zinc/10/34/11/1048103411.db2.gz QHIVGMJPFUEEIP-AWEZNQCLSA-N 2 1 323.550 4.319 20 0 DIADMP CCc1nc(C)c([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)s1 ZINC000480249801 1048103418 /nfs/dbraw/zinc/10/34/18/1048103418.db2.gz QHIVGMJPFUEEIP-AWEZNQCLSA-N 2 1 323.550 4.319 20 0 DIADMP Cc1nc2c(s1)[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)CCC2 ZINC000480268669 1048106443 /nfs/dbraw/zinc/10/64/43/1048106443.db2.gz SWFFDSJCTXTDAK-INIZCTEOSA-N 2 1 321.534 4.073 20 0 DIADMP Cc1nc2c(s1)[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)CCC2 ZINC000480268669 1048106452 /nfs/dbraw/zinc/10/64/52/1048106452.db2.gz SWFFDSJCTXTDAK-INIZCTEOSA-N 2 1 321.534 4.073 20 0 DIADMP Cc1cccc2cc[nH+]c(NCC3CC[NH+](CC4CCC4)CC3)c12 ZINC001161233788 1048115336 /nfs/dbraw/zinc/11/53/36/1048115336.db2.gz BPDRPQAYQNDHQI-UHFFFAOYSA-N 2 1 323.484 4.467 20 0 DIADMP CC[N@H+](CC[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1)C(C)C ZINC001199991122 1048132281 /nfs/dbraw/zinc/13/22/81/1048132281.db2.gz RDRCOPAUBNCYOC-YSIASYRMSA-N 2 1 302.506 4.279 20 0 DIADMP CC[N@@H+](CC[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1)C(C)C ZINC001199991122 1048132284 /nfs/dbraw/zinc/13/22/84/1048132284.db2.gz RDRCOPAUBNCYOC-YSIASYRMSA-N 2 1 302.506 4.279 20 0 DIADMP Cc1ccc2cc[nH+]c(N3CCC([NH3+])(CC4CCC4)CC3)c2c1 ZINC001161571738 1048140611 /nfs/dbraw/zinc/14/06/11/1048140611.db2.gz RIDUPNWZGKPLRU-UHFFFAOYSA-N 2 1 309.457 4.031 20 0 DIADMP CCSc1cccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)c1 ZINC001200921237 1048156225 /nfs/dbraw/zinc/15/62/25/1048156225.db2.gz FBQWXITWPYAEMY-UHFFFAOYSA-N 2 1 308.535 4.397 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000554742150 1048170811 /nfs/dbraw/zinc/17/08/11/1048170811.db2.gz QCAMGROJWNLADG-OTWHNJEPSA-N 2 1 317.521 4.126 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000554742150 1048170814 /nfs/dbraw/zinc/17/08/14/1048170814.db2.gz QCAMGROJWNLADG-OTWHNJEPSA-N 2 1 317.521 4.126 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc(F)ccc1F ZINC000480608635 1048192084 /nfs/dbraw/zinc/19/20/84/1048192084.db2.gz KKOGQSXTHKIIFC-LSDHHAIUSA-N 2 1 310.432 4.128 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1 ZINC000480616872 1048192363 /nfs/dbraw/zinc/19/23/63/1048192363.db2.gz WNTGBXLPRZBDFW-KFKAGJAMSA-N 2 1 318.530 4.465 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)cc1 ZINC000480616872 1048192366 /nfs/dbraw/zinc/19/23/66/1048192366.db2.gz WNTGBXLPRZBDFW-KFKAGJAMSA-N 2 1 318.530 4.465 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000480618006 1048193646 /nfs/dbraw/zinc/19/36/46/1048193646.db2.gz ZZTLTTIFSYCREE-IRXDYDNUSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000480606266 1048195311 /nfs/dbraw/zinc/19/53/11/1048195311.db2.gz CEZJVMGPAZKMMQ-RXVVDRJESA-N 2 1 314.517 4.252 20 0 DIADMP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000480630664 1048196019 /nfs/dbraw/zinc/19/60/19/1048196019.db2.gz MUVQZWJTNAAHMR-IAGOWNOFSA-N 2 1 304.478 4.000 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@H+]3CCC[C@H]3C1)CCCC2 ZINC000480743108 1048233419 /nfs/dbraw/zinc/23/34/19/1048233419.db2.gz FWKDPTHRDUBYIQ-ZIFCJYIRSA-N 2 1 318.892 4.324 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)cc(Cl)c1 ZINC000480741944 1048233534 /nfs/dbraw/zinc/23/35/34/1048233534.db2.gz VBRNJYVTCYBRSQ-KNXALSJPSA-N 2 1 313.272 4.271 20 0 DIADMP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000480746339 1048235922 /nfs/dbraw/zinc/23/59/22/1048235922.db2.gz QOVMTKFUZMSZHY-FXAWDEMLSA-N 2 1 300.490 4.156 20 0 DIADMP CC[C@@H](C[NH2+][C@H](C)c1cccc(-c2ccncc2)c1)[NH+]1CCCC1 ZINC000480803277 1048249743 /nfs/dbraw/zinc/24/97/43/1048249743.db2.gz IOLQWGKNVWMHCY-UTKZUKDTSA-N 2 1 323.484 4.274 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001201417729 1048261701 /nfs/dbraw/zinc/26/17/01/1048261701.db2.gz IMZGLDRQBDDRKI-IBGZPJMESA-N 2 1 312.501 4.329 20 0 DIADMP Cc1cc(C)[nH+]c(NC2=C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001201469990 1048270731 /nfs/dbraw/zinc/27/07/31/1048270731.db2.gz HUABMUWHCRFYRB-UXHICEINSA-N 2 1 319.452 4.431 20 0 DIADMP Cc1cc(C)[nH+]c(NC2=C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001201469990 1048270741 /nfs/dbraw/zinc/27/07/41/1048270741.db2.gz HUABMUWHCRFYRB-UXHICEINSA-N 2 1 319.452 4.431 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+][C@H]2CCC[C@@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC001201491427 1048282320 /nfs/dbraw/zinc/28/23/20/1048282320.db2.gz JTDRPIYFFCVWMD-ZFMNYDKASA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201501762 1048290392 /nfs/dbraw/zinc/29/03/92/1048290392.db2.gz BCKOPSCUQNGEII-MRXNPFEDSA-N 2 1 306.519 4.082 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC000481028228 1048296324 /nfs/dbraw/zinc/29/63/24/1048296324.db2.gz YEAYJPYQMLLNSD-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1sc(Cl)c2ccccc21 ZINC001205922830 1048311714 /nfs/dbraw/zinc/31/17/14/1048311714.db2.gz BLILRRIWGBGLGW-NEPJUHHUSA-N 2 1 308.878 4.114 20 0 DIADMP CCCC[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201706457 1048351580 /nfs/dbraw/zinc/35/15/80/1048351580.db2.gz NIQZFEPSKGYMCH-CGTJXYLNSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201706457 1048351593 /nfs/dbraw/zinc/35/15/93/1048351593.db2.gz NIQZFEPSKGYMCH-CGTJXYLNSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001201706457 1048351605 /nfs/dbraw/zinc/35/16/05/1048351605.db2.gz NIQZFEPSKGYMCH-CGTJXYLNSA-N 2 1 306.519 4.081 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](CCc2ccccc2)c2ccccc2)C1 ZINC000481324023 1048366381 /nfs/dbraw/zinc/36/63/81/1048366381.db2.gz YATOKPFQGBZMBE-IFMALSPDSA-N 2 1 322.496 4.292 20 0 DIADMP CCCCCC[NH+]1CCC([N@@H+](C)Cc2cccc(F)c2)CC1 ZINC001201755870 1048367399 /nfs/dbraw/zinc/36/73/99/1048367399.db2.gz AQOBBJANLBTZCE-UHFFFAOYSA-N 2 1 306.469 4.302 20 0 DIADMP Cc1ccc2c(C)cc(NC3CC4(C3)CCC[NH2+]C4)[nH+]c2c1C ZINC001162986831 1048399682 /nfs/dbraw/zinc/39/96/82/1048399682.db2.gz UPBPAKKHQBRNOG-UHFFFAOYSA-N 2 1 309.457 4.104 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2F)cc1 ZINC000775122129 1048401655 /nfs/dbraw/zinc/40/16/55/1048401655.db2.gz IOXOCLNXLDPVRH-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2F)cc1 ZINC000775122129 1048401666 /nfs/dbraw/zinc/40/16/66/1048401666.db2.gz IOXOCLNXLDPVRH-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC001206680607 1048401972 /nfs/dbraw/zinc/40/19/72/1048401972.db2.gz NZYWOWLYDASBLU-QZTJIDSGSA-N 2 1 302.506 4.064 20 0 DIADMP CCc1cccc(N[C@@H]2CC3(CC[NH2+]CC3)c3ccc(C)cc32)[nH+]1 ZINC001163035854 1048405292 /nfs/dbraw/zinc/40/52/92/1048405292.db2.gz DKZWHOPGCBYCMG-LJQANCHMSA-N 2 1 321.468 4.131 20 0 DIADMP Cc1ccc2c(c1)[C@H](Nc1c(C)cc[nH+]c1C)CC21CC[NH2+]CC1 ZINC001163033307 1048405984 /nfs/dbraw/zinc/40/59/84/1048405984.db2.gz CIUHTBKBYNOREY-LJQANCHMSA-N 2 1 321.468 4.185 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(-c2ccccc2)o1)[NH+]1CCCCC1 ZINC001201962430 1048411824 /nfs/dbraw/zinc/41/18/24/1048411824.db2.gz BVJKPYHPLIIQKD-KRWDZBQOSA-N 2 1 312.457 4.301 20 0 DIADMP CC(C)=CCC[C@@H](C)CC[NH+]1CC2(C1)CC[N@H+](CC1CC1)C2 ZINC001201973543 1048414851 /nfs/dbraw/zinc/41/48/51/1048414851.db2.gz PAUSHSMDTLXWRP-GOSISDBHSA-N 2 1 304.522 4.177 20 0 DIADMP CC(C)=CCC[C@@H](C)CC[NH+]1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001201973543 1048414854 /nfs/dbraw/zinc/41/48/54/1048414854.db2.gz PAUSHSMDTLXWRP-GOSISDBHSA-N 2 1 304.522 4.177 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CC[C@@H](c2ccc(C)cc2)C1(C)C ZINC001175717169 1048423499 /nfs/dbraw/zinc/42/34/99/1048423499.db2.gz XZNCWOQHUZMZRY-IBGZPJMESA-N 2 1 311.473 4.158 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CC[C@@H](c2ccc(C)cc2)C1(C)C ZINC001175717169 1048423500 /nfs/dbraw/zinc/42/35/00/1048423500.db2.gz XZNCWOQHUZMZRY-IBGZPJMESA-N 2 1 311.473 4.158 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2(c3cccc(F)c3)CCCCC2)CC[N@H+]1C ZINC000481539969 1048427434 /nfs/dbraw/zinc/42/74/34/1048427434.db2.gz FPCBNCFNVAEUPA-APWZRJJASA-N 2 1 318.480 4.100 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2)CCCC1 ZINC000481559601 1048433153 /nfs/dbraw/zinc/43/31/53/1048433153.db2.gz RZIHYBWYYHQHOW-YJBOKZPZSA-N 2 1 320.908 4.082 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](CC2CCCC2)CC1 ZINC001202166508 1048468402 /nfs/dbraw/zinc/46/84/02/1048468402.db2.gz GCCZHFMXKWWTTR-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP C[N@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC2CCCC2)CC1 ZINC001202189663 1048476403 /nfs/dbraw/zinc/47/64/03/1048476403.db2.gz GAZXVTRXUWJGHN-UHFFFAOYSA-N 2 1 320.908 4.426 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH+](CC2CCCC2)CC1 ZINC001202189663 1048476408 /nfs/dbraw/zinc/47/64/08/1048476408.db2.gz GAZXVTRXUWJGHN-UHFFFAOYSA-N 2 1 320.908 4.426 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202204828 1048480435 /nfs/dbraw/zinc/48/04/35/1048480435.db2.gz ICZVEBOXXKHSKF-NHCUHLMSSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]3C[NH+](CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202204828 1048480442 /nfs/dbraw/zinc/48/04/42/1048480442.db2.gz ICZVEBOXXKHSKF-NHCUHLMSSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]3C[NH+](CC4CCCC4)CC[C@@H]3C2)cc1 ZINC001202204828 1048480446 /nfs/dbraw/zinc/48/04/46/1048480446.db2.gz ICZVEBOXXKHSKF-NHCUHLMSSA-N 2 1 312.501 4.021 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(c2ccc(Cl)cc2)CC1 ZINC000481816980 1048492424 /nfs/dbraw/zinc/49/24/24/1048492424.db2.gz SARBTYJHUADOKI-GOSISDBHSA-N 2 1 306.881 4.004 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)c2ccccc21 ZINC000556047837 1048518702 /nfs/dbraw/zinc/51/87/02/1048518702.db2.gz DPHGRLSLGHVFLJ-CQSZACIVSA-N 2 1 312.432 4.256 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2cc3c(cc(C)cc3C)[nH]2)CC1 ZINC000481891120 1048526858 /nfs/dbraw/zinc/52/68/58/1048526858.db2.gz JMYGBEDXBIEXIE-UHFFFAOYSA-N 2 1 313.489 4.091 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2cc3c(cc(C)cc3C)[nH]2)CC1 ZINC000481891120 1048526869 /nfs/dbraw/zinc/52/68/69/1048526869.db2.gz JMYGBEDXBIEXIE-UHFFFAOYSA-N 2 1 313.489 4.091 20 0 DIADMP Cc1[nH]c2ccc(NC(=[NH2+])C34CC5CC(CC(C5)C3)C4)cc2[nH+]1 ZINC001163844301 1048535692 /nfs/dbraw/zinc/53/56/92/1048535692.db2.gz SQQUWGIHEQNJSM-UHFFFAOYSA-N 2 1 308.429 4.477 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C ZINC000481988733 1048539648 /nfs/dbraw/zinc/53/96/48/1048539648.db2.gz GIFFFFYSJKGLTO-SJLPKXTDSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C ZINC000481988733 1048539662 /nfs/dbraw/zinc/53/96/62/1048539662.db2.gz GIFFFFYSJKGLTO-SJLPKXTDSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C ZINC000481988733 1048539677 /nfs/dbraw/zinc/53/96/77/1048539677.db2.gz GIFFFFYSJKGLTO-SJLPKXTDSA-N 2 1 313.489 4.089 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)C1 ZINC000482321585 1048588360 /nfs/dbraw/zinc/58/83/60/1048588360.db2.gz PSRCKKQKJQNGGJ-KBPBESRZSA-N 2 1 312.860 4.250 20 0 DIADMP Cc1ccccc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000482438076 1048608802 /nfs/dbraw/zinc/60/88/02/1048608802.db2.gz LESARQUQTXOFHI-FPOVZHCZSA-N 2 1 322.496 4.210 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000482454166 1048611951 /nfs/dbraw/zinc/61/19/51/1048611951.db2.gz WQOBJAKRYHJICS-UNMCSNQZSA-N 2 1 322.496 4.292 20 0 DIADMP Cc1ccc(C)c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)[nH+]1 ZINC001164486708 1048634858 /nfs/dbraw/zinc/63/48/58/1048634858.db2.gz QGRUDFQZQBYSLF-SLFFLAALSA-N 2 1 321.468 4.021 20 0 DIADMP Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CCC[NH+]2CCCCC2)C1 ZINC000482693126 1048661053 /nfs/dbraw/zinc/66/10/53/1048661053.db2.gz NUGADUFRGBUNHQ-RBUKOAKNSA-N 2 1 300.490 4.049 20 0 DIADMP CC[NH+](CC)CCC[N@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC001190597701 1048763926 /nfs/dbraw/zinc/76/39/26/1048763926.db2.gz RPLMRXKCJHYTBF-AWEZNQCLSA-N 2 1 316.411 4.430 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC001190597701 1048763940 /nfs/dbraw/zinc/76/39/40/1048763940.db2.gz RPLMRXKCJHYTBF-AWEZNQCLSA-N 2 1 316.411 4.430 20 0 DIADMP C[C@H](C1CC1)[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C1CC1 ZINC001190673654 1048775023 /nfs/dbraw/zinc/77/50/23/1048775023.db2.gz LDRCJLUOHYZSEB-QGZVFWFLSA-N 2 1 312.501 4.435 20 0 DIADMP C[C@@H](C1CC1)[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C1CC1 ZINC001190673653 1048775761 /nfs/dbraw/zinc/77/57/61/1048775761.db2.gz LDRCJLUOHYZSEB-KRWDZBQOSA-N 2 1 312.501 4.435 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[C@@H]([NH2+]CC[C@@H]2CC=CCC2)C3)cc1 ZINC000716654376 1048785661 /nfs/dbraw/zinc/78/56/61/1048785661.db2.gz GAEZJDCFMPDMHM-GBAJDQEWSA-N 2 1 324.512 4.376 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H]3CCC(C)(C)C[C@H]3C)CC2)[nH+]c1 ZINC000483500152 1048808522 /nfs/dbraw/zinc/80/85/22/1048808522.db2.gz GIPLXCHLIOMRFS-AEFFLSMTSA-N 2 1 315.505 4.163 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483507744 1048808758 /nfs/dbraw/zinc/80/87/58/1048808758.db2.gz ZOSSBJWFARRRGC-JQHSSLGASA-N 2 1 306.881 4.207 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000483507744 1048808768 /nfs/dbraw/zinc/80/87/68/1048808768.db2.gz ZOSSBJWFARRRGC-JQHSSLGASA-N 2 1 306.881 4.207 20 0 DIADMP Cc1cc(-n2ccnc2)ccc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000483513617 1048812905 /nfs/dbraw/zinc/81/29/05/1048812905.db2.gz NSPBUAHMIFIOCD-KRWDZBQOSA-N 2 1 305.425 4.374 20 0 DIADMP CCC[C@@H](C[NH2+]CC(C)(C)[NH+]1CCCCC1)c1ccccc1 ZINC001177086981 1048828664 /nfs/dbraw/zinc/82/86/64/1048828664.db2.gz RHMQKNDUYUTVQN-IBGZPJMESA-N 2 1 302.506 4.424 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721998 1048844928 /nfs/dbraw/zinc/84/49/28/1048844928.db2.gz CRAYOZYNXIGAMA-WWMYMODYSA-N 2 1 308.469 4.487 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000483721998 1048844946 /nfs/dbraw/zinc/84/49/46/1048844946.db2.gz CRAYOZYNXIGAMA-WWMYMODYSA-N 2 1 308.469 4.487 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000483726135 1048845325 /nfs/dbraw/zinc/84/53/25/1048845325.db2.gz MCFLMTDWMRQREL-LNLFQRSKSA-N 2 1 318.505 4.389 20 0 DIADMP CCCCCOc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000483726135 1048845339 /nfs/dbraw/zinc/84/53/39/1048845339.db2.gz MCFLMTDWMRQREL-LNLFQRSKSA-N 2 1 318.505 4.389 20 0 DIADMP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C1CC1 ZINC000483731563 1048849820 /nfs/dbraw/zinc/84/98/20/1048849820.db2.gz SNVCYNQMLKMFJU-FQEVSTJZSA-N 2 1 312.457 4.190 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1 ZINC001177231599 1048852300 /nfs/dbraw/zinc/85/23/00/1048852300.db2.gz XAJYXGZMGCICDW-PMACEKPBSA-N 2 1 302.506 4.423 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1 ZINC001177231602 1048852417 /nfs/dbraw/zinc/85/24/17/1048852417.db2.gz XAJYXGZMGCICDW-WOJBJXKFSA-N 2 1 302.506 4.423 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483737219 1048852973 /nfs/dbraw/zinc/85/29/73/1048852973.db2.gz UBIWGHYQEAGBOS-OLMNPRSZSA-N 2 1 308.897 4.500 20 0 DIADMP CC(C)C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483737219 1048852984 /nfs/dbraw/zinc/85/29/84/1048852984.db2.gz UBIWGHYQEAGBOS-OLMNPRSZSA-N 2 1 308.897 4.500 20 0 DIADMP C[NH+](C)[C@@H](C[NH2+]C1CCc2ccccc2CC1)C1CCCCC1 ZINC001177294434 1048857849 /nfs/dbraw/zinc/85/78/49/1048857849.db2.gz KJGNPQLIMHLJQE-NRFANRHFSA-N 2 1 314.517 4.034 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1cnc2ccsc2c1)C(C)C ZINC000483848743 1048866201 /nfs/dbraw/zinc/86/62/01/1048866201.db2.gz GOVWEZGEBXESRV-HNNXBMFYSA-N 2 1 319.518 4.456 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@H](C)C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001177458785 1048890112 /nfs/dbraw/zinc/89/01/12/1048890112.db2.gz IGPLOINXOJVVNB-UAFMIMERSA-N 2 1 316.533 4.211 20 0 DIADMP CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCC[NH+](CC)CC ZINC001191233222 1048905738 /nfs/dbraw/zinc/90/57/38/1048905738.db2.gz LRKIUKXCBYOVSI-PMACEKPBSA-N 2 1 302.506 4.377 20 0 DIADMP CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1CCC[NH+](CC)CC ZINC001191233225 1048907564 /nfs/dbraw/zinc/90/75/64/1048907564.db2.gz LRKIUKXCBYOVSI-WOJBJXKFSA-N 2 1 302.506 4.377 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@]3(CC[N@H+](CCC4CCC4)C3)C2)cc1 ZINC001191358552 1048924649 /nfs/dbraw/zinc/92/46/49/1048924649.db2.gz MXHSGTNGAHTMGI-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@]3(CC[NH+](CCC4CCC4)C3)C2)cc1 ZINC001191358552 1048924657 /nfs/dbraw/zinc/92/46/57/1048924657.db2.gz MXHSGTNGAHTMGI-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](CCC4CCC4)C3)C2)cc1 ZINC001191358552 1048924662 /nfs/dbraw/zinc/92/46/62/1048924662.db2.gz MXHSGTNGAHTMGI-NRFANRHFSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CCC[C@]3(CC[N@H+](CCC4CCC4)C3)C2)cc1 ZINC001191358553 1048926213 /nfs/dbraw/zinc/92/62/13/1048926213.db2.gz MXHSGTNGAHTMGI-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@]3(CC[NH+](CCC4CCC4)C3)C2)cc1 ZINC001191358553 1048926225 /nfs/dbraw/zinc/92/62/25/1048926225.db2.gz MXHSGTNGAHTMGI-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](CCC4CCC4)C3)C2)cc1 ZINC001191358553 1048926238 /nfs/dbraw/zinc/92/62/38/1048926238.db2.gz MXHSGTNGAHTMGI-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2c(C)ccc3cc(C)ccc32)C1 ZINC001191390221 1048929083 /nfs/dbraw/zinc/92/90/83/1048929083.db2.gz JROPUZQFJUKSKK-GOSISDBHSA-N 2 1 310.485 4.230 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2c(C)ccc3cc(C)ccc32)C1 ZINC001191390221 1048929091 /nfs/dbraw/zinc/92/90/91/1048929091.db2.gz JROPUZQFJUKSKK-GOSISDBHSA-N 2 1 310.485 4.230 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2c(C)ccc3cc(C)ccc32)C1 ZINC001191390221 1048929100 /nfs/dbraw/zinc/92/91/00/1048929100.db2.gz JROPUZQFJUKSKK-GOSISDBHSA-N 2 1 310.485 4.230 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2c(C)ccc3cc(C)ccc32)C1 ZINC001191390222 1048931058 /nfs/dbraw/zinc/93/10/58/1048931058.db2.gz JROPUZQFJUKSKK-SFHVURJKSA-N 2 1 310.485 4.230 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2c(C)ccc3cc(C)ccc32)C1 ZINC001191390222 1048931070 /nfs/dbraw/zinc/93/10/70/1048931070.db2.gz JROPUZQFJUKSKK-SFHVURJKSA-N 2 1 310.485 4.230 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2c(C)ccc3cc(C)ccc32)C1 ZINC001191390222 1048931087 /nfs/dbraw/zinc/93/10/87/1048931087.db2.gz JROPUZQFJUKSKK-SFHVURJKSA-N 2 1 310.485 4.230 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2cccc(OC(C)(C)C)c2)C1 ZINC001177744652 1048939293 /nfs/dbraw/zinc/93/92/93/1048939293.db2.gz YTUCSAGXOQCMRX-SFHVURJKSA-N 2 1 318.505 4.074 20 0 DIADMP CCc1cccc2cc(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)oc21 ZINC001177822207 1048944327 /nfs/dbraw/zinc/94/43/27/1048944327.db2.gz IHSGJOKOSQVJCD-SFHVURJKSA-N 2 1 316.489 4.451 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001191521815 1048959113 /nfs/dbraw/zinc/95/91/13/1048959113.db2.gz WEEGCYAYZVZACK-YSIASYRMSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001191521815 1048959123 /nfs/dbraw/zinc/95/91/23/1048959123.db2.gz WEEGCYAYZVZACK-YSIASYRMSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001191521815 1048959134 /nfs/dbraw/zinc/95/91/34/1048959134.db2.gz WEEGCYAYZVZACK-YSIASYRMSA-N 2 1 300.490 4.162 20 0 DIADMP Cc1ccccc1C[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001203703934 1048970505 /nfs/dbraw/zinc/97/05/05/1048970505.db2.gz CAFSPLPLQFDLDR-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1ccccc1C[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001203709610 1048973567 /nfs/dbraw/zinc/97/35/67/1048973567.db2.gz KOMOUZVLQFZGQB-UHFFFAOYSA-N 2 1 322.496 4.339 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2CCc3cccc4cccc2c43)CC1(C)C ZINC001203750796 1048990590 /nfs/dbraw/zinc/99/05/90/1048990590.db2.gz PIJPXSONVBXMEJ-MJGOQNOKSA-N 2 1 308.469 4.290 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CCc3cccc4cccc2c43)CC1(C)C ZINC001203750795 1048991880 /nfs/dbraw/zinc/99/18/80/1048991880.db2.gz PIJPXSONVBXMEJ-IEBWSBKVSA-N 2 1 308.469 4.290 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2c(Cl)cc(F)cc2Cl)CC1 ZINC001206327023 1049024787 /nfs/dbraw/zinc/02/47/87/1049024787.db2.gz RMXIJRSLRPAJEZ-HNNXBMFYSA-N 2 1 319.251 4.083 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)ccc1Cl ZINC001178408874 1049034540 /nfs/dbraw/zinc/03/45/40/1049034540.db2.gz IOGJZCZTEPXXQE-UHFFFAOYSA-N 2 1 320.908 4.393 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001178629683 1049068550 /nfs/dbraw/zinc/06/85/50/1049068550.db2.gz SBSXSLXSHOVYPG-QZTJIDSGSA-N 2 1 318.549 4.483 20 0 DIADMP C[N@H+](Cc1ccsc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001204039956 1049069623 /nfs/dbraw/zinc/06/96/23/1049069623.db2.gz DTAKAGNCXSWAOR-UHFFFAOYSA-N 2 1 314.498 4.092 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000195132161 1049069915 /nfs/dbraw/zinc/06/99/15/1049069915.db2.gz YMYSLWZTYDQSKP-SJLPKXTDSA-N 2 1 314.498 4.229 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](CC2CC(C)(C)C2)CC1)CC1CC1 ZINC001192500105 1049111532 /nfs/dbraw/zinc/11/15/32/1049111532.db2.gz HEKASQSEMZGGNC-UHFFFAOYSA-N 2 1 306.538 4.257 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2c(C)cc(Cl)cc2C)C[C@H]1C ZINC001204238193 1049118337 /nfs/dbraw/zinc/11/83/37/1049118337.db2.gz OZCPPJHOUHPMPY-NVXWUHKLSA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@H]1C ZINC001204238193 1049118341 /nfs/dbraw/zinc/11/83/41/1049118341.db2.gz OZCPPJHOUHPMPY-NVXWUHKLSA-N 2 1 308.897 4.261 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2c(C)cc(Cl)cc2C)C[C@H]1C ZINC001204238193 1049118352 /nfs/dbraw/zinc/11/83/52/1049118352.db2.gz OZCPPJHOUHPMPY-NVXWUHKLSA-N 2 1 308.897 4.261 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1ccc(C)c(C)c1)C1CCCCC1 ZINC001179090956 1049129918 /nfs/dbraw/zinc/12/99/18/1049129918.db2.gz LSBXWWPIZQXKIA-UHFFFAOYSA-N 2 1 302.506 4.438 20 0 DIADMP Cc1[nH]c2ccccc2c1C[N@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001204288593 1049130124 /nfs/dbraw/zinc/13/01/24/1049130124.db2.gz JWDRMMZLFKMGFD-UHFFFAOYSA-N 2 1 313.489 4.029 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(OCCC)cc2)CC1 ZINC001204310654 1049138457 /nfs/dbraw/zinc/13/84/57/1049138457.db2.gz YKWUOJTUNVXUPP-UHFFFAOYSA-N 2 1 318.505 4.172 20 0 DIADMP CCC[N@H+](CCC[NH+](C)C)Cc1ccc(F)cc1C(F)(F)F ZINC001204483870 1049172982 /nfs/dbraw/zinc/17/29/82/1049172982.db2.gz CMUBQZXLVHVUKZ-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(F)cc1C(F)(F)F ZINC001204483870 1049172987 /nfs/dbraw/zinc/17/29/87/1049172987.db2.gz CMUBQZXLVHVUKZ-UHFFFAOYSA-N 2 1 320.374 4.008 20 0 DIADMP c1ccc2nc(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2c1 ZINC001204503634 1049177271 /nfs/dbraw/zinc/17/72/71/1049177271.db2.gz FWXSAZXPOFGQOP-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP c1ccc2nc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2c1 ZINC001204503634 1049177281 /nfs/dbraw/zinc/17/72/81/1049177281.db2.gz FWXSAZXPOFGQOP-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001204550048 1049187416 /nfs/dbraw/zinc/18/74/16/1049187416.db2.gz FNWBPWWIHRDXCI-CVEARBPZSA-N 2 1 322.924 4.496 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)CC1 ZINC001204550049 1049187522 /nfs/dbraw/zinc/18/75/22/1049187522.db2.gz FNWBPWWIHRDXCI-HOTGVXAUSA-N 2 1 322.924 4.496 20 0 DIADMP CC(C)[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Cl)cc1F ZINC001193260143 1049192071 /nfs/dbraw/zinc/19/20/71/1049192071.db2.gz GADBHMBMXKXUDT-WMLDXEAASA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[C@@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(Cl)cc1F ZINC001193260143 1049192079 /nfs/dbraw/zinc/19/20/79/1049192079.db2.gz GADBHMBMXKXUDT-WMLDXEAASA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)Cc1ccc2c(c1)C[NH2+]CC2 ZINC001204604662 1049197541 /nfs/dbraw/zinc/19/75/41/1049197541.db2.gz UKSFWPUHEVVJII-UHFFFAOYSA-N 2 1 308.469 4.133 20 0 DIADMP C[NH+](CCc1ccc(C(C)(C)C)cc1)CC[C@@H]1CCCC[N@@H+]1C ZINC001204616099 1049201771 /nfs/dbraw/zinc/20/17/71/1049201771.db2.gz OGNXFRDEFBJAID-FQEVSTJZSA-N 2 1 316.533 4.333 20 0 DIADMP C[NH+](CCc1ccc(C(C)(C)C)cc1)CC[C@@H]1CCCC[N@H+]1C ZINC001204616099 1049201784 /nfs/dbraw/zinc/20/17/84/1049201784.db2.gz OGNXFRDEFBJAID-FQEVSTJZSA-N 2 1 316.533 4.333 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(-c2ccc(C[NH+](C)C)cc2)nc1 ZINC001204625354 1049204678 /nfs/dbraw/zinc/20/46/78/1049204678.db2.gz HENCTPLMFVZNLK-NRFANRHFSA-N 2 1 323.484 4.357 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](C3c4ccccc4-c4ccccc43)CC[C@H]21 ZINC000485335777 1049223976 /nfs/dbraw/zinc/22/39/76/1049223976.db2.gz GQCAAPFTYMNWOC-IIBYNOLFSA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](C3c4ccccc4-c4ccccc43)CC[C@H]21 ZINC000485335777 1049223987 /nfs/dbraw/zinc/22/39/87/1049223987.db2.gz GQCAAPFTYMNWOC-IIBYNOLFSA-N 2 1 318.464 4.173 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](C3c4ccccc4-c4ccccc43)CC[C@H]21 ZINC000485335777 1049223998 /nfs/dbraw/zinc/22/39/98/1049223998.db2.gz GQCAAPFTYMNWOC-IIBYNOLFSA-N 2 1 318.464 4.173 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c(C)c1 ZINC001179919549 1049240897 /nfs/dbraw/zinc/24/08/97/1049240897.db2.gz NEUDPYRYFYIZQX-DZEDTGDLSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919549 1049240901 /nfs/dbraw/zinc/24/09/01/1049240901.db2.gz NEUDPYRYFYIZQX-DZEDTGDLSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(C)c1 ZINC001179919549 1049240906 /nfs/dbraw/zinc/24/09/06/1049240906.db2.gz NEUDPYRYFYIZQX-DZEDTGDLSA-N 2 1 312.501 4.041 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000195614664 1049241654 /nfs/dbraw/zinc/24/16/54/1049241654.db2.gz CJUXCIHEZQDXEV-OAHLLOKOSA-N 2 1 300.490 4.262 20 0 DIADMP CC(C)(C)C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000195651629 1049244509 /nfs/dbraw/zinc/24/45/09/1049244509.db2.gz AYGFKBGUGFIVOD-QFBILLFUSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(C)(C)C)cc1 ZINC000195651614 1049244862 /nfs/dbraw/zinc/24/48/62/1049244862.db2.gz BBENRTRHLUTFRK-HZPDHXFCSA-N 2 1 300.490 4.119 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)c2)cc1 ZINC001204742160 1049248322 /nfs/dbraw/zinc/24/83/22/1049248322.db2.gz IWNFBHXHDQOZSR-UHFFFAOYSA-N 2 1 320.480 4.319 20 0 DIADMP FCCCCC[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485465232 1049256375 /nfs/dbraw/zinc/25/63/75/1049256375.db2.gz KZRUWMKITFJQTN-UHFFFAOYSA-N 2 1 318.480 4.114 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2ccns2)cc1 ZINC000858577459 1049280180 /nfs/dbraw/zinc/28/01/80/1049280180.db2.gz QCJCLEAENYIXOM-CHWSQXEVSA-N 2 1 312.442 4.049 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001180129501 1049280062 /nfs/dbraw/zinc/28/00/62/1049280062.db2.gz USNNGEZUUNNEPH-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2C(C)=CCC[C@H]2C)CC1 ZINC001180125297 1049291169 /nfs/dbraw/zinc/29/11/69/1049291169.db2.gz XBNDWXROYYGJCP-UYAOXDASSA-N 2 1 306.538 4.423 20 0 DIADMP C[C@]1([NH3+])CCC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001204937581 1049314772 /nfs/dbraw/zinc/31/47/72/1049314772.db2.gz FKPGDNPBYWXKJM-IBGZPJMESA-N 2 1 314.860 4.320 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001204937581 1049314782 /nfs/dbraw/zinc/31/47/82/1049314782.db2.gz FKPGDNPBYWXKJM-IBGZPJMESA-N 2 1 314.860 4.320 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001204937433 1049316110 /nfs/dbraw/zinc/31/61/10/1049316110.db2.gz JUYVYUIWLZIOFB-SSSFQFABSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000485698080 1049322068 /nfs/dbraw/zinc/32/20/68/1049322068.db2.gz XUBYLWHFHJICDG-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000485698080 1049322082 /nfs/dbraw/zinc/32/20/82/1049322082.db2.gz XUBYLWHFHJICDG-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](CC[C@H]1CCC[NH+]1C)C1CCCC1 ZINC001194175716 1049335084 /nfs/dbraw/zinc/33/50/84/1049335084.db2.gz FKCGCRQAQVNKLY-PKOBYXMFSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@@H](c1ccccc1)[NH+](CC[C@H]1CCC[N@@H+]1C)C1CCCC1 ZINC001194175716 1049335097 /nfs/dbraw/zinc/33/50/97/1049335097.db2.gz FKCGCRQAQVNKLY-PKOBYXMFSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@@H](c1ccccc1)[NH+](CC[C@H]1CCC[N@H+]1C)C1CCCC1 ZINC001194175716 1049335106 /nfs/dbraw/zinc/33/51/06/1049335106.db2.gz FKCGCRQAQVNKLY-PKOBYXMFSA-N 2 1 300.490 4.477 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC001205009294 1049340478 /nfs/dbraw/zinc/34/04/78/1049340478.db2.gz MSBBIHIWYPYESG-INIZCTEOSA-N 2 1 308.425 4.017 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001205015328 1049341176 /nfs/dbraw/zinc/34/11/76/1049341176.db2.gz AYUJBYWNYAKGPY-INIZCTEOSA-N 2 1 324.493 4.486 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc(C)c3)cc2)C1 ZINC001205018360 1049343768 /nfs/dbraw/zinc/34/37/68/1049343768.db2.gz TZIFDPMACVQFEY-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP CCC(C)(C)CC[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001194270508 1049353867 /nfs/dbraw/zinc/35/38/67/1049353867.db2.gz XYZIPHTYOWEUCN-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CCC(C)(C)CC[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001194270508 1049353881 /nfs/dbraw/zinc/35/38/81/1049353881.db2.gz XYZIPHTYOWEUCN-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP CC[NH+](CC)C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001180372123 1049354779 /nfs/dbraw/zinc/35/47/79/1049354779.db2.gz KPZPKBIIKKOKHR-FQEVSTJZSA-N 2 1 302.506 4.267 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001205068342 1049360127 /nfs/dbraw/zinc/36/01/27/1049360127.db2.gz GUOZWRBOIBWJHB-ZFWWWQNUSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001205068342 1049360133 /nfs/dbraw/zinc/36/01/33/1049360133.db2.gz GUOZWRBOIBWJHB-ZFWWWQNUSA-N 2 1 310.466 4.366 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)CC1 ZINC001205102090 1049378078 /nfs/dbraw/zinc/37/80/78/1049378078.db2.gz OHYXDNVCFWFRNF-KRWDZBQOSA-N 2 1 319.452 4.148 20 0 DIADMP CCn1c2ccccc2c2cc(C[N@H+]3CCC[C@H]([NH3+])CC3)ccc21 ZINC001205109466 1049380409 /nfs/dbraw/zinc/38/04/09/1049380409.db2.gz GROODRQMWLSOGU-KRWDZBQOSA-N 2 1 321.468 4.128 20 0 DIADMP [NH3+][C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC1 ZINC001205123657 1049385700 /nfs/dbraw/zinc/38/57/00/1049385700.db2.gz DOYPTZGHMKDGSV-GOSISDBHSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC1 ZINC001205123657 1049385715 /nfs/dbraw/zinc/38/57/15/1049385715.db2.gz DOYPTZGHMKDGSV-GOSISDBHSA-N 2 1 314.860 4.320 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@@H]([NH3+])CC2)c1 ZINC001205124433 1049385987 /nfs/dbraw/zinc/38/59/87/1049385987.db2.gz RLXVGXASXMJYOF-HXUWFJFHSA-N 2 1 308.469 4.284 20 0 DIADMP [NH3+][C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC1 ZINC001205123658 1049386215 /nfs/dbraw/zinc/38/62/15/1049386215.db2.gz DOYPTZGHMKDGSV-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)CC1 ZINC001205123658 1049386225 /nfs/dbraw/zinc/38/62/25/1049386225.db2.gz DOYPTZGHMKDGSV-SFHVURJKSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc3sc4ccccc4c3c2)C[C@H]1C[NH3+] ZINC001205151514 1049396188 /nfs/dbraw/zinc/39/61/88/1049396188.db2.gz WDVHXQGWTGFHML-DZGCQCFKSA-N 2 1 310.466 4.081 20 0 DIADMP c1c(C[N@H+]2CCCC[C@@H]2c2ccccc2)sc2c1CC[NH2+]C2 ZINC001205171159 1049402348 /nfs/dbraw/zinc/40/23/48/1049402348.db2.gz LJUGJWJOALVMTQ-GOSISDBHSA-N 2 1 312.482 4.121 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC001194640930 1049403500 /nfs/dbraw/zinc/40/35/00/1049403500.db2.gz JZKCWQFHFRATTG-UTKZUKDTSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC001194640930 1049403505 /nfs/dbraw/zinc/40/35/05/1049403505.db2.gz JZKCWQFHFRATTG-UTKZUKDTSA-N 2 1 314.517 4.463 20 0 DIADMP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC001194640930 1049403510 /nfs/dbraw/zinc/40/35/10/1049403510.db2.gz JZKCWQFHFRATTG-UTKZUKDTSA-N 2 1 314.517 4.463 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205257245 1049418385 /nfs/dbraw/zinc/41/83/85/1049418385.db2.gz UUPMEPGBOUKYKH-PXNSSMCTSA-N 2 1 302.506 4.192 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 ZINC001205274568 1049423555 /nfs/dbraw/zinc/42/35/55/1049423555.db2.gz XWHQRCLFRYLMTP-GOSISDBHSA-N 2 1 318.848 4.303 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccccc2-c2cccs2)CC1 ZINC001205273229 1049424023 /nfs/dbraw/zinc/42/40/23/1049424023.db2.gz IJVFEFGHMDLLPX-SFHVURJKSA-N 2 1 300.471 4.118 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC001180978367 1049426394 /nfs/dbraw/zinc/42/63/94/1049426394.db2.gz ZRHOUEDQSMSNED-LZLYRXPVSA-N 2 1 314.498 4.309 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@](C)([NH3+])CC3)cc2)cc1 ZINC001205280703 1049426462 /nfs/dbraw/zinc/42/64/62/1049426462.db2.gz GSZGZGVGRLRCFX-NRFANRHFSA-N 2 1 308.469 4.365 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)c2)cc1 ZINC001205280982 1049426554 /nfs/dbraw/zinc/42/65/54/1049426554.db2.gz NKVSYFWYSMKUGU-OAQYLSRUSA-N 2 1 324.468 4.491 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@H+]2CCC[C@@](C)([NH3+])CC2)c1 ZINC001205288754 1049428850 /nfs/dbraw/zinc/42/88/50/1049428850.db2.gz ODNITYAFPPWIPR-OAQYLSRUSA-N 2 1 324.468 4.066 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)CC1 ZINC001205296305 1049430706 /nfs/dbraw/zinc/43/07/06/1049430706.db2.gz LOTBMVBUCJHZQP-HXUWFJFHSA-N 2 1 300.490 4.438 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C[C@@H]1C[NH3+] ZINC001205303653 1049432656 /nfs/dbraw/zinc/43/26/56/1049432656.db2.gz JBTBZNXMEMRIGA-ZBFHGGJFSA-N 2 1 308.425 4.003 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC001205303493 1049432781 /nfs/dbraw/zinc/43/27/81/1049432781.db2.gz GGYRNICQDWUTGR-LPHOPBHVSA-N 2 1 308.469 4.079 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C[C@H]1C[NH3+] ZINC001205305898 1049433245 /nfs/dbraw/zinc/43/32/45/1049433245.db2.gz UDYUHPJOARPQMR-DZGCQCFKSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@@H]1CC[NH2+]CC[N@@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001205331527 1049441535 /nfs/dbraw/zinc/44/15/35/1049441535.db2.gz HOELSMIIYGRIHU-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@@H]1CC[NH2+]CC[N@H+]1Cc1ccccc1-c1ccc(Cl)cc1 ZINC001205331527 1049441540 /nfs/dbraw/zinc/44/15/40/1049441540.db2.gz HOELSMIIYGRIHU-OAHLLOKOSA-N 2 1 314.860 4.191 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+]C3CCC4(CC4)CC3)C2)c1 ZINC000486683972 1049454658 /nfs/dbraw/zinc/45/46/58/1049454658.db2.gz AIHXTFIBHGGXFQ-MRXNPFEDSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+]C3CCC4(CC4)CC3)C2)c1 ZINC000486683972 1049454661 /nfs/dbraw/zinc/45/46/61/1049454661.db2.gz AIHXTFIBHGGXFQ-MRXNPFEDSA-N 2 1 318.530 4.273 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cc2ccccc2[nH]1 ZINC000775624162 1049457397 /nfs/dbraw/zinc/45/73/97/1049457397.db2.gz YHWLAGHOHDCEFM-KRWDZBQOSA-N 2 1 321.468 4.341 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1C[C@H]1c1ccccc1 ZINC001181486686 1049486779 /nfs/dbraw/zinc/48/67/79/1049486779.db2.gz LUTLSCBVFJFHCG-YADHBBJMSA-N 2 1 322.496 4.374 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2CC=CCC2)CC1)CC(C)C ZINC001181515016 1049486793 /nfs/dbraw/zinc/48/67/93/1049486793.db2.gz PGHYBQMSFLKSJW-FQEVSTJZSA-N 2 1 306.538 4.423 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC001205571888 1049501344 /nfs/dbraw/zinc/50/13/44/1049501344.db2.gz YVTCUJSMDTYHSH-GOSISDBHSA-N 2 1 318.461 4.068 20 0 DIADMP [NH3+]C[C@@]1(F)CCC[N@@H+](Cc2cccc(-c3ccccc3)c2)CC1 ZINC001205570015 1049501373 /nfs/dbraw/zinc/50/13/73/1049501373.db2.gz CMUSHRPBLUWVTJ-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP CC[C@H]1CCC[C@H](C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)C1 ZINC001205622412 1049513813 /nfs/dbraw/zinc/51/38/13/1049513813.db2.gz SAVONTWBRLWPEG-ROUUACIJSA-N 2 1 316.489 4.450 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4oc32)CC[C@H]1C[NH3+] ZINC001205625949 1049513990 /nfs/dbraw/zinc/51/39/90/1049513990.db2.gz CXFWZQYKRBAKPT-CVEARBPZSA-N 2 1 322.452 4.393 20 0 DIADMP Cc1cc(Cl)c(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])CC2)c(Cl)c1 ZINC001205639444 1049518828 /nfs/dbraw/zinc/51/88/28/1049518828.db2.gz ZAMVSLCNOPTXBY-CHWSQXEVSA-N 2 1 315.288 4.109 20 0 DIADMP Cc1csc2sc(C[N@@H+]3CC[C@H](C)[C@@H](C[NH3+])CC3)c(C)c12 ZINC001205638675 1049519061 /nfs/dbraw/zinc/51/90/61/1049519061.db2.gz QQWIIXOERHTEKW-SMDDNHRTSA-N 2 1 322.543 4.386 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001205654163 1049522857 /nfs/dbraw/zinc/52/28/57/1049522857.db2.gz WOVJHUUCQTWPTN-WCQYABFASA-N 2 1 315.288 4.109 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC001205692617 1049534907 /nfs/dbraw/zinc/53/49/07/1049534907.db2.gz HGGKZVPFNUQGLM-CQSZACIVSA-N 2 1 316.411 4.083 20 0 DIADMP CCSc1cccc(C[N@H+](CC)CCC[NH+]2CCCC2)c1 ZINC001205692838 1049536257 /nfs/dbraw/zinc/53/62/57/1049536257.db2.gz LQLVYSGQWACDJV-UHFFFAOYSA-N 2 1 306.519 4.106 20 0 DIADMP CCSc1cccc(C[N@@H+](CC)CCC[NH+]2CCCC2)c1 ZINC001205692838 1049536270 /nfs/dbraw/zinc/53/62/70/1049536270.db2.gz LQLVYSGQWACDJV-UHFFFAOYSA-N 2 1 306.519 4.106 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001205718315 1049540132 /nfs/dbraw/zinc/54/01/32/1049540132.db2.gz WUYURBMRDSCXCH-PMACEKPBSA-N 2 1 316.464 4.226 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001205718315 1049540140 /nfs/dbraw/zinc/54/01/40/1049540140.db2.gz WUYURBMRDSCXCH-PMACEKPBSA-N 2 1 316.464 4.226 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)[C@H]1CC1(C)C ZINC000487270526 1049540454 /nfs/dbraw/zinc/54/04/54/1049540454.db2.gz PXKOXCBUWLAWMJ-LJIGWXMPSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)[C@H]1CC1(C)C ZINC000487270526 1049540471 /nfs/dbraw/zinc/54/04/71/1049540471.db2.gz PXKOXCBUWLAWMJ-LJIGWXMPSA-N 2 1 306.519 4.155 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)CCCC(F)(F)F ZINC001181934756 1049551788 /nfs/dbraw/zinc/55/17/88/1049551788.db2.gz VARLVYAGBGNHCM-CABCVRRESA-N 2 1 308.432 4.208 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814836 1049572079 /nfs/dbraw/zinc/57/20/79/1049572079.db2.gz DOIFYIVORJTYDF-GJZGRUSLSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2c3ccccc3[nH]c2C(C)(C)C)C1 ZINC001205814836 1049572088 /nfs/dbraw/zinc/57/20/88/1049572088.db2.gz DOIFYIVORJTYDF-GJZGRUSLSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C[C@@H]1[NH3+] ZINC001205868976 1049587402 /nfs/dbraw/zinc/58/74/02/1049587402.db2.gz ZIDIQBBOSPOMBV-BEFAXECRSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C[C@@H]1[NH3+] ZINC001205868976 1049587422 /nfs/dbraw/zinc/58/74/22/1049587422.db2.gz ZIDIQBBOSPOMBV-BEFAXECRSA-N 2 1 319.452 4.004 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@@H](C[NH3+])[C@H]2C)cc1 ZINC001205902243 1049596870 /nfs/dbraw/zinc/59/68/70/1049596870.db2.gz JDQGJARCZHTMEK-HLIPFELVSA-N 2 1 302.506 4.048 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001205903443 1049597465 /nfs/dbraw/zinc/59/74/65/1049597465.db2.gz OZIYBBNFZWHQLG-DZGCQCFKSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001205903445 1049598507 /nfs/dbraw/zinc/59/85/07/1049598507.db2.gz OZIYBBNFZWHQLG-UKRRQHHQSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001205912846 1049599484 /nfs/dbraw/zinc/59/94/84/1049599484.db2.gz DBAARMHMWPAIJM-LSDHHAIUSA-N 2 1 316.470 4.100 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(F)c(-c2ccccc2)c1 ZINC001205923224 1049602765 /nfs/dbraw/zinc/60/27/65/1049602765.db2.gz LGTZDVBXVAQRHG-CRAIPNDOSA-N 2 1 312.432 4.052 20 0 DIADMP [NH3+][C@H]1CCCC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001205932713 1049606043 /nfs/dbraw/zinc/60/60/43/1049606043.db2.gz TWLUZKJMFFMUDC-KRWDZBQOSA-N 2 1 314.860 4.320 20 0 DIADMP [NH3+][C@H]1CCCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001205932713 1049606050 /nfs/dbraw/zinc/60/60/50/1049606050.db2.gz TWLUZKJMFFMUDC-KRWDZBQOSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000774188855 1049618203 /nfs/dbraw/zinc/61/82/03/1049618203.db2.gz JVSDLMAVLULZER-RSPOEFSDSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1)c1cccc2ccccc21 ZINC001205984673 1049618242 /nfs/dbraw/zinc/61/82/42/1049618242.db2.gz UCBQYDZLFJEACJ-LMMKCTJWSA-N 2 1 310.485 4.250 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2-c2cccs2)CCC[C@@H]1C[NH3+] ZINC001206004790 1049626108 /nfs/dbraw/zinc/62/61/08/1049626108.db2.gz VKVOTWFHOYPYTQ-JKSUJKDBSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC001206004861 1049626500 /nfs/dbraw/zinc/62/65/00/1049626500.db2.gz HXBCYZBMPIJRCR-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001206004861 1049626502 /nfs/dbraw/zinc/62/65/02/1049626502.db2.gz HXBCYZBMPIJRCR-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001206004861 1049626509 /nfs/dbraw/zinc/62/65/09/1049626509.db2.gz HXBCYZBMPIJRCR-QFIPXVFZSA-N 2 1 320.480 4.190 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2-c2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206011522 1049629063 /nfs/dbraw/zinc/62/90/63/1049629063.db2.gz DCZOCRYLRLNLRO-IEBWSBKVSA-N 2 1 308.469 4.160 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c1Cl ZINC001206027318 1049632358 /nfs/dbraw/zinc/63/23/58/1049632358.db2.gz WDQQWDHGKGDYIU-CHWSQXEVSA-N 2 1 315.288 4.109 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001206049817 1049641619 /nfs/dbraw/zinc/64/16/19/1049641619.db2.gz RMMWGFRSAJLLFG-IBGZPJMESA-N 2 1 304.453 4.275 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)cc1 ZINC001206049817 1049641629 /nfs/dbraw/zinc/64/16/29/1049641629.db2.gz RMMWGFRSAJLLFG-IBGZPJMESA-N 2 1 304.453 4.275 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000488368228 1049642982 /nfs/dbraw/zinc/64/29/82/1049642982.db2.gz QBTMEUXZVXMAAA-NBYUQASBSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000488470307 1049661759 /nfs/dbraw/zinc/66/17/59/1049661759.db2.gz VHWPMIQDLDALSN-AFKBCAQJSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000488470308 1049661936 /nfs/dbraw/zinc/66/19/36/1049661936.db2.gz VHWPMIQDLDALSN-BDUQCRIQSA-N 2 1 300.490 4.031 20 0 DIADMP Cc1ccc(C[C@@]2(C)CCC[N@H+]2CCC[NH+]2CCCCC2)cc1 ZINC001196595280 1049672090 /nfs/dbraw/zinc/67/20/90/1049672090.db2.gz RMIKFEXSRVOFBB-OAQYLSRUSA-N 2 1 314.517 4.268 20 0 DIADMP CCc1ccc2ccccc2c1C[N@@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001196632315 1049679833 /nfs/dbraw/zinc/67/98/33/1049679833.db2.gz NMPRNAINHMBBRR-SZPZYZBQSA-N 2 1 322.496 4.176 20 0 DIADMP CCc1ccc2ccccc2c1C[N@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001196632315 1049679838 /nfs/dbraw/zinc/67/98/38/1049679838.db2.gz NMPRNAINHMBBRR-SZPZYZBQSA-N 2 1 322.496 4.176 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1C[C@@]2(C)C[N@H+](C)C[C@@]2(C)C1 ZINC001196632315 1049679839 /nfs/dbraw/zinc/67/98/39/1049679839.db2.gz NMPRNAINHMBBRR-SZPZYZBQSA-N 2 1 322.496 4.176 20 0 DIADMP CCc1ccc2ccccc2c1C[NH+]1C[C@@]2(C)C[N@@H+](C)C[C@@]2(C)C1 ZINC001196632315 1049679845 /nfs/dbraw/zinc/67/98/45/1049679845.db2.gz NMPRNAINHMBBRR-SZPZYZBQSA-N 2 1 322.496 4.176 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001206225008 1049685491 /nfs/dbraw/zinc/68/54/91/1049685491.db2.gz XVTFKBSEHITAFB-KOUHRCEDSA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001206225008 1049685495 /nfs/dbraw/zinc/68/54/95/1049685495.db2.gz XVTFKBSEHITAFB-KOUHRCEDSA-N 2 1 312.501 4.379 20 0 DIADMP CCCCCOc1ccc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)cc1 ZINC001206296214 1049702878 /nfs/dbraw/zinc/70/28/78/1049702878.db2.gz QHTQXCNAEJYTQE-HXUWFJFHSA-N 2 1 318.505 4.207 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC[N@@H+]1C ZINC001206335312 1049715084 /nfs/dbraw/zinc/71/50/84/1049715084.db2.gz GDNXKOOKHXSJIU-TWKWOARYSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC[N@H+]1C ZINC001206335312 1049715093 /nfs/dbraw/zinc/71/50/93/1049715093.db2.gz GDNXKOOKHXSJIU-TWKWOARYSA-N 2 1 320.908 4.439 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001206343795 1049717022 /nfs/dbraw/zinc/71/70/22/1049717022.db2.gz IKYCDBQVHMOLCC-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC001206343795 1049717025 /nfs/dbraw/zinc/71/70/25/1049717025.db2.gz IKYCDBQVHMOLCC-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@](C)(C[NH3+])C1)c1cccc2ccccc21 ZINC001206542075 1049752699 /nfs/dbraw/zinc/75/26/99/1049752699.db2.gz QVMJPUOYJZBNAB-DYESRHJHSA-N 2 1 310.485 4.394 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H](C)Cc1ccc(F)cc1)C1CCCCC1 ZINC001206559192 1049754872 /nfs/dbraw/zinc/75/48/72/1049754872.db2.gz AQJBPHKJMMCHHS-QGZVFWFLSA-N 2 1 320.496 4.391 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206556066 1049755500 /nfs/dbraw/zinc/75/55/00/1049755500.db2.gz MYNOJXYAOLAGSU-NRFANRHFSA-N 2 1 308.469 4.305 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3ccccc3)s2)C1 ZINC001206556902 1049755560 /nfs/dbraw/zinc/75/55/60/1049755560.db2.gz ZLQOGQQKOWVCTI-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(-c3ccccc3)c2)C1 ZINC001206565500 1049756803 /nfs/dbraw/zinc/75/68/03/1049756803.db2.gz TYRVKNORRYVSSJ-NRFANRHFSA-N 2 1 308.469 4.305 20 0 DIADMP CC(C)Oc1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)cc1Cl ZINC001206563527 1049757809 /nfs/dbraw/zinc/75/78/09/1049757809.db2.gz FSXLJTORQVQNFK-SFHVURJKSA-N 2 1 324.896 4.078 20 0 DIADMP CC(C)Oc1ccc(C[N@H+]2CCCC[C@@](C)(C[NH3+])C2)cc1Cl ZINC001206563527 1049757819 /nfs/dbraw/zinc/75/78/19/1049757819.db2.gz FSXLJTORQVQNFK-SFHVURJKSA-N 2 1 324.896 4.078 20 0 DIADMP CC(C)[N@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206580987 1049762191 /nfs/dbraw/zinc/76/21/91/1049762191.db2.gz GYLHSIUDOYVJAH-OAHLLOKOSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001206580987 1049762195 /nfs/dbraw/zinc/76/21/95/1049762195.db2.gz GYLHSIUDOYVJAH-OAHLLOKOSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(-c2ccncc2)c1)[C@H]1CCC[NH2+]CC1 ZINC001206583437 1049762405 /nfs/dbraw/zinc/76/24/05/1049762405.db2.gz UTUXXKGAGSZDNW-NRFANRHFSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](CCC(C)(C)c1ccccc1)[C@H]1CCC[NH2+]CC1 ZINC001206583710 1049762783 /nfs/dbraw/zinc/76/27/83/1049762783.db2.gz VOZGKIPUBBWKJR-IBGZPJMESA-N 2 1 302.506 4.207 20 0 DIADMP CC(C)[N@@H+](CCC(C)(C)c1ccccc1)[C@@H]1CCC[NH2+]CC1 ZINC001206583713 1049762936 /nfs/dbraw/zinc/76/29/36/1049762936.db2.gz VOZGKIPUBBWKJR-LJQANCHMSA-N 2 1 302.506 4.207 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC001206580082 1049762960 /nfs/dbraw/zinc/76/29/60/1049762960.db2.gz CBCIYFUUQLXYOQ-CQSZACIVSA-N 2 1 315.288 4.346 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1C(F)(F)F)[C@H]1CCC[NH2+]CC1 ZINC001206582700 1049763010 /nfs/dbraw/zinc/76/30/10/1049763010.db2.gz OMXRGJDLRFQEIB-HNNXBMFYSA-N 2 1 314.395 4.058 20 0 DIADMP COc1ccc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1C(C)C ZINC001206592234 1049763721 /nfs/dbraw/zinc/76/37/21/1049763721.db2.gz ZAZWRIBJXYWOPN-GOSISDBHSA-N 2 1 318.505 4.171 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(F)c2ccccc12)[C@H]1CCC[NH2+]CC1 ZINC001206590016 1049764559 /nfs/dbraw/zinc/76/45/59/1049764559.db2.gz KPDVUPAVYAHJSK-KRWDZBQOSA-N 2 1 314.448 4.331 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(-c2ccccn2)c1)[C@H]1CCC[NH2+]CC1 ZINC001206588597 1049764656 /nfs/dbraw/zinc/76/46/56/1049764656.db2.gz CJIOSDKFLSWYIH-FQEVSTJZSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(OC(C)(C)C)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001206597967 1049766139 /nfs/dbraw/zinc/76/61/39/1049766139.db2.gz GYDGFDTZAMPZTR-GOSISDBHSA-N 2 1 318.505 4.216 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001206616050 1049769843 /nfs/dbraw/zinc/76/98/43/1049769843.db2.gz MNBNKCBGEUTDMX-AWEZNQCLSA-N 2 1 318.848 4.161 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CCCC[C@H](C[NH3+])C2)cc1 ZINC001206615491 1049770071 /nfs/dbraw/zinc/77/00/71/1049770071.db2.gz GEACTMUNTMNSMY-LJQANCHMSA-N 2 1 318.505 4.207 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C1 ZINC001206616418 1049770703 /nfs/dbraw/zinc/77/07/03/1049770703.db2.gz NYACMRSMCDNKPS-AWEZNQCLSA-N 2 1 318.848 4.161 20 0 DIADMP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC001206624314 1049772412 /nfs/dbraw/zinc/77/24/12/1049772412.db2.gz UEDRIGBGARUCJF-INIZCTEOSA-N 2 1 308.425 4.147 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)cc1 ZINC001206715793 1049783814 /nfs/dbraw/zinc/78/38/14/1049783814.db2.gz XYHNALIHBSGSOO-HXUWFJFHSA-N 2 1 314.517 4.349 20 0 DIADMP CC(C)c1ccc(CC[NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)cc1 ZINC001206715793 1049783818 /nfs/dbraw/zinc/78/38/18/1049783818.db2.gz XYHNALIHBSGSOO-HXUWFJFHSA-N 2 1 314.517 4.349 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@H]3C)c2)cc1 ZINC001206768007 1049794974 /nfs/dbraw/zinc/79/49/74/1049794974.db2.gz GRABIHVBMXJUPV-IEBWSBKVSA-N 2 1 324.468 4.347 20 0 DIADMP Cc1csc2sc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@H]3C)c(C)c12 ZINC001206769079 1049795761 /nfs/dbraw/zinc/79/57/61/1049795761.db2.gz NHKGILVOTFWFGJ-DGCLKSJQSA-N 2 1 308.516 4.139 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001206771463 1049796526 /nfs/dbraw/zinc/79/65/26/1049796526.db2.gz WYZTYXXUVBTQNT-ZIAGYGMSSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001206769712 1049796976 /nfs/dbraw/zinc/79/69/76/1049796976.db2.gz POBNLZHIHNDXRW-SJORKVTESA-N 2 1 310.441 4.038 20 0 DIADMP Cc1ccc([C@H]2C[C@H](C)[N@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000490046283 1049797035 /nfs/dbraw/zinc/79/70/35/1049797035.db2.gz UJCMTNDHCQOVAY-ICSRJNTNSA-N 2 1 300.490 4.049 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3C[C@H](C[NH3+])CC[C@H]3C)c2)cc1 ZINC001206806543 1049803129 /nfs/dbraw/zinc/80/31/29/1049803129.db2.gz GNBHMYUTKYWETC-MJGOQNOKSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1occc1C[N@@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000490423107 1049828902 /nfs/dbraw/zinc/82/89/02/1049828902.db2.gz NDXWEGYDDKBITA-OXQOHEQNSA-N 2 1 312.457 4.073 20 0 DIADMP Cc1occc1C[N@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000490423107 1049828911 /nfs/dbraw/zinc/82/89/11/1049828911.db2.gz NDXWEGYDDKBITA-OXQOHEQNSA-N 2 1 312.457 4.073 20 0 DIADMP CSCC1CCC([NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)CC1 ZINC001207186913 1049856573 /nfs/dbraw/zinc/85/65/73/1049856573.db2.gz YJEHDOOCLYJYIA-FAFZWHIHSA-N 2 1 324.578 4.295 20 0 DIADMP CSCC1CCC([NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)CC1 ZINC001207186913 1049856595 /nfs/dbraw/zinc/85/65/95/1049856595.db2.gz YJEHDOOCLYJYIA-FAFZWHIHSA-N 2 1 324.578 4.295 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001207185616 1049858269 /nfs/dbraw/zinc/85/82/69/1049858269.db2.gz QSTLXLIXIWEPJS-ZBFHGGJFSA-N 2 1 320.443 4.494 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001207185616 1049858279 /nfs/dbraw/zinc/85/82/79/1049858279.db2.gz QSTLXLIXIWEPJS-ZBFHGGJFSA-N 2 1 320.443 4.494 20 0 DIADMP CC1=CCC[C@@H](C)[C@H]1C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001207252303 1049869726 /nfs/dbraw/zinc/86/97/26/1049869726.db2.gz DMUDEOHRFSRGCS-QUCCMNQESA-N 2 1 306.538 4.279 20 0 DIADMP C(C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1)C1CCCCC1 ZINC001207257413 1049871657 /nfs/dbraw/zinc/87/16/57/1049871657.db2.gz VIWBMIXFDXQECN-UHFFFAOYSA-N 2 1 304.522 4.297 20 0 DIADMP C[C@H]1CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001207286414 1049874393 /nfs/dbraw/zinc/87/43/93/1049874393.db2.gz IPZRELYVCHJBQU-SFHVURJKSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H]1C[C@@H](C)CC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207291904 1049876156 /nfs/dbraw/zinc/87/61/56/1049876156.db2.gz FWTWRCKWXWKZPK-ZWKOTPCHSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491059037 1049883113 /nfs/dbraw/zinc/88/31/13/1049883113.db2.gz QTFJCUCQWDNUEH-ZWKOTPCHSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491059037 1049883116 /nfs/dbraw/zinc/88/31/16/1049883116.db2.gz QTFJCUCQWDNUEH-ZWKOTPCHSA-N 2 1 318.480 4.475 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(C)s1 ZINC000491056835 1049883578 /nfs/dbraw/zinc/88/35/78/1049883578.db2.gz JWSDNJPDYFFQFX-SFHVURJKSA-N 2 1 320.546 4.453 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(C)s1 ZINC000491056835 1049883582 /nfs/dbraw/zinc/88/35/82/1049883582.db2.gz JWSDNJPDYFFQFX-SFHVURJKSA-N 2 1 320.546 4.453 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491061212 1049883648 /nfs/dbraw/zinc/88/36/48/1049883648.db2.gz ZSAYHHWFAHNAFM-ROUUACIJSA-N 2 1 318.480 4.475 20 0 DIADMP C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491061212 1049883660 /nfs/dbraw/zinc/88/36/60/1049883660.db2.gz ZSAYHHWFAHNAFM-ROUUACIJSA-N 2 1 318.480 4.475 20 0 DIADMP CC[N@H+](CCC1CC[NH+](C)CC1)Cc1c(F)cccc1Cl ZINC001207486879 1049897494 /nfs/dbraw/zinc/89/74/94/1049897494.db2.gz FIYRJSZVIOKHEM-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C)CC1)Cc1c(F)cccc1Cl ZINC001207486879 1049897497 /nfs/dbraw/zinc/89/74/97/1049897497.db2.gz FIYRJSZVIOKHEM-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP C[N@@H+](CCc1ccc(F)cc1)C1CC[NH+](C2CCCCC2)CC1 ZINC001207519474 1049902232 /nfs/dbraw/zinc/90/22/32/1049902232.db2.gz WFRIINJDVLWYFR-UHFFFAOYSA-N 2 1 318.480 4.097 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)CCCc2cccc(Cl)c2)CC1 ZINC001207589750 1049913152 /nfs/dbraw/zinc/91/31/52/1049913152.db2.gz RMZAFVUMCYSVQY-UHFFFAOYSA-N 2 1 322.924 4.325 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+](C[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 ZINC001207626902 1049918769 /nfs/dbraw/zinc/91/87/69/1049918769.db2.gz NNLKXWVBXGCIBE-PWRODBHTSA-N 2 1 324.512 4.185 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@H]([NH2+]CC3CCC4(CCCCC4)CC3)[C@H]2C1 ZINC001207836656 1049942887 /nfs/dbraw/zinc/94/28/87/1049942887.db2.gz KOFPLPLTOQIAMC-FHWLQOOXSA-N 2 1 304.522 4.057 20 0 DIADMP c1ccc(C2(C[NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)CC2)cc1 ZINC001207831340 1049943470 /nfs/dbraw/zinc/94/34/70/1049943470.db2.gz BPPNUDCVWHKWLQ-UHFFFAOYSA-N 2 1 324.512 4.059 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)cc1 ZINC001207936475 1049958361 /nfs/dbraw/zinc/95/83/61/1049958361.db2.gz HFULEJFDGYXRPK-RXVVDRJESA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)cc1 ZINC001207936475 1049958368 /nfs/dbraw/zinc/95/83/68/1049958368.db2.gz HFULEJFDGYXRPK-RXVVDRJESA-N 2 1 314.517 4.016 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)cc1 ZINC001207936475 1049958376 /nfs/dbraw/zinc/95/83/76/1049958376.db2.gz HFULEJFDGYXRPK-RXVVDRJESA-N 2 1 314.517 4.016 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000588177497 1049973384 /nfs/dbraw/zinc/97/33/84/1049973384.db2.gz YWIYQZXOWFQDNB-KNTRCKAVSA-N 2 1 320.480 4.128 20 0 DIADMP C/C(=C\c1ccccc1)C[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000588177497 1049973388 /nfs/dbraw/zinc/97/33/88/1049973388.db2.gz YWIYQZXOWFQDNB-KNTRCKAVSA-N 2 1 320.480 4.128 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2CC2(C)CC[NH+](C)CC2)c1 ZINC001208112237 1049973867 /nfs/dbraw/zinc/97/38/67/1049973867.db2.gz UJUOJMOHENKWKA-IBGZPJMESA-N 2 1 300.490 4.172 20 0 DIADMP CC1=C[C@H](C)[C@H](C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)CC1 ZINC001208166235 1049980427 /nfs/dbraw/zinc/98/04/27/1049980427.db2.gz AHPSLGHIXKZGDG-ICSRJNTNSA-N 2 1 316.533 4.319 20 0 DIADMP Cc1ccc([C@H]2CCC[N@@H+]2CC2(C[NH+](C)C)CCCC2)cc1 ZINC001208191219 1049983020 /nfs/dbraw/zinc/98/30/20/1049983020.db2.gz LVXHVKVIKGXTOG-LJQANCHMSA-N 2 1 300.490 4.254 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC001208593752 1049997769 /nfs/dbraw/zinc/99/77/69/1049997769.db2.gz IQWAGVMVEGSIBY-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2cc(C)cc(C)c2)CC1 ZINC001208603233 1049997810 /nfs/dbraw/zinc/99/78/10/1049997810.db2.gz WWNTVCIELSHBIZ-FQEVSTJZSA-N 2 1 300.490 4.172 20 0 DIADMP CC/C=C\CC[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001208727758 1050007194 /nfs/dbraw/zinc/00/71/94/1050007194.db2.gz QVSUCKRDGQQPDU-ARJAWSKDSA-N 2 1 318.530 4.392 20 0 DIADMP CC/C=C\CC[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001208728201 1050007371 /nfs/dbraw/zinc/00/73/71/1050007371.db2.gz ZPMZCMQXMADFCL-HMECNJMJSA-N 2 1 316.489 4.312 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)CCCc2ccccc2Cl)CC1 ZINC001208871512 1050018812 /nfs/dbraw/zinc/01/88/12/1050018812.db2.gz LCWJPLOGTZJGMD-UHFFFAOYSA-N 2 1 322.924 4.325 20 0 DIADMP C[N@@H+](CCc1ccccc1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208930052 1050024993 /nfs/dbraw/zinc/02/49/93/1050024993.db2.gz YWEGXGUNPZZREJ-QFIPXVFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCc1ccccc1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208930052 1050025000 /nfs/dbraw/zinc/02/50/00/1050025000.db2.gz YWEGXGUNPZZREJ-QFIPXVFZSA-N 2 1 322.496 4.073 20 0 DIADMP C[NH+](CCc1ccccc1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208930052 1050025006 /nfs/dbraw/zinc/02/50/06/1050025006.db2.gz YWEGXGUNPZZREJ-QFIPXVFZSA-N 2 1 322.496 4.073 20 0 DIADMP CCC[N@H+](CC1CC1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929148 1050025097 /nfs/dbraw/zinc/02/50/97/1050025097.db2.gz OKUDUOHYJGBENS-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[N@@H+](CC1CC1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929148 1050025103 /nfs/dbraw/zinc/02/51/03/1050025103.db2.gz OKUDUOHYJGBENS-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[NH+](CC1CC1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929148 1050025110 /nfs/dbraw/zinc/02/51/10/1050025110.db2.gz OKUDUOHYJGBENS-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC[NH+](CC1CC1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929148 1050025116 /nfs/dbraw/zinc/02/51/16/1050025116.db2.gz OKUDUOHYJGBENS-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931795 1050025340 /nfs/dbraw/zinc/02/53/40/1050025340.db2.gz MVMFFXHRURRPMO-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931795 1050025343 /nfs/dbraw/zinc/02/53/43/1050025343.db2.gz MVMFFXHRURRPMO-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@H]1CCCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931795 1050025347 /nfs/dbraw/zinc/02/53/47/1050025347.db2.gz MVMFFXHRURRPMO-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3C[C@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208932101 1050025913 /nfs/dbraw/zinc/02/59/13/1050025913.db2.gz OESTVQSDXSONIJ-PWRODBHTSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC4(CCCC4)C3)C2)cc1 ZINC001208940361 1050026908 /nfs/dbraw/zinc/02/69/08/1050026908.db2.gz BWSBOFXCZZXLAA-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@@H+]3CCCC4(CCCC4)C3)C2)cc1 ZINC001208940361 1050026914 /nfs/dbraw/zinc/02/69/14/1050026914.db2.gz BWSBOFXCZZXLAA-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@H+]3CCCC4(CCCC4)C3)C2)cc1 ZINC001208940361 1050026920 /nfs/dbraw/zinc/02/69/20/1050026920.db2.gz BWSBOFXCZZXLAA-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC[C@H]4CCC[C@@H]43)C2)cc1 ZINC001208939919 1050027525 /nfs/dbraw/zinc/02/75/25/1050027525.db2.gz LHPPAQALTNZKKE-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCC[C@H]4CCC[C@@H]43)C2)cc1 ZINC001208939919 1050027532 /nfs/dbraw/zinc/02/75/32/1050027532.db2.gz LHPPAQALTNZKKE-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCC[C@H]4CCC[C@@H]43)C2)cc1 ZINC001208939919 1050027538 /nfs/dbraw/zinc/02/75/38/1050027538.db2.gz LHPPAQALTNZKKE-HBMCJLEFSA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)[N@H+](CC1CC1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208937610 1050027719 /nfs/dbraw/zinc/02/77/19/1050027719.db2.gz USYWTPJBCVGCJI-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[N@@H+](CC1CC1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208937610 1050027725 /nfs/dbraw/zinc/02/77/25/1050027725.db2.gz USYWTPJBCVGCJI-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[NH+](CC1CC1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208937610 1050027730 /nfs/dbraw/zinc/02/77/30/1050027730.db2.gz USYWTPJBCVGCJI-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)[NH+](CC1CC1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208937610 1050027736 /nfs/dbraw/zinc/02/77/36/1050027736.db2.gz USYWTPJBCVGCJI-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CC[C@@H]3c3ccccc3)C2)cc1 ZINC001208938721 1050027749 /nfs/dbraw/zinc/02/77/49/1050027749.db2.gz DLYMZZVQHMQBQO-IFMALSPDSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CC[C@@H]3c3ccccc3)C2)cc1 ZINC001208938721 1050027755 /nfs/dbraw/zinc/02/77/55/1050027755.db2.gz DLYMZZVQHMQBQO-IFMALSPDSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CC[C@@H]3c3ccccc3)C2)cc1 ZINC001208938721 1050027758 /nfs/dbraw/zinc/02/77/58/1050027758.db2.gz DLYMZZVQHMQBQO-IFMALSPDSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CC[C@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208950319 1050029323 /nfs/dbraw/zinc/02/93/23/1050029323.db2.gz RXHQKRYBMCKDGH-NJYVYQBISA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@@H+]3CC[C@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208950319 1050029327 /nfs/dbraw/zinc/02/93/27/1050029327.db2.gz RXHQKRYBMCKDGH-NJYVYQBISA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@H+]3CC[C@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208950319 1050029332 /nfs/dbraw/zinc/02/93/32/1050029332.db2.gz RXHQKRYBMCKDGH-NJYVYQBISA-N 2 1 312.501 4.021 20 0 DIADMP CC[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949814 1050029448 /nfs/dbraw/zinc/02/94/48/1050029448.db2.gz XLHHQJLPSNIRKM-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP CC[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949814 1050029453 /nfs/dbraw/zinc/02/94/53/1050029453.db2.gz XLHHQJLPSNIRKM-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949814 1050029459 /nfs/dbraw/zinc/02/94/59/1050029459.db2.gz XLHHQJLPSNIRKM-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949814 1050029462 /nfs/dbraw/zinc/02/94/62/1050029462.db2.gz XLHHQJLPSNIRKM-IBGZPJMESA-N 2 1 300.490 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCC4(C3)CCCCC4)C2)cc1 ZINC001208963589 1050030025 /nfs/dbraw/zinc/03/00/25/1050030025.db2.gz OWXHDWDGGHLPCY-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@@H+]3CCC4(C3)CCCCC4)C2)cc1 ZINC001208963589 1050030031 /nfs/dbraw/zinc/03/00/31/1050030031.db2.gz OWXHDWDGGHLPCY-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H](C[N@H+]3CCC4(C3)CCCCC4)C2)cc1 ZINC001208963589 1050030037 /nfs/dbraw/zinc/03/00/37/1050030037.db2.gz OWXHDWDGGHLPCY-HXUWFJFHSA-N 2 1 312.501 4.165 20 0 DIADMP CC[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949815 1050030413 /nfs/dbraw/zinc/03/04/13/1050030413.db2.gz XLHHQJLPSNIRKM-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP CC[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949815 1050030419 /nfs/dbraw/zinc/03/04/19/1050030419.db2.gz XLHHQJLPSNIRKM-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949815 1050030424 /nfs/dbraw/zinc/03/04/24/1050030424.db2.gz XLHHQJLPSNIRKM-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP CC[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001208949815 1050030429 /nfs/dbraw/zinc/03/04/29/1050030429.db2.gz XLHHQJLPSNIRKM-LJQANCHMSA-N 2 1 300.490 4.163 20 0 DIADMP CC/C=C\CCCCCC[NH+]1CCC2(CC(N(C)C)=[NH+]O2)CC1 ZINC001209286257 1050050594 /nfs/dbraw/zinc/05/05/94/1050050594.db2.gz WEHYZKCOQFPTKP-WAYWQWQTSA-N 2 1 321.509 4.033 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cccc(Cl)c2)C1 ZINC000589836021 1050060442 /nfs/dbraw/zinc/06/04/42/1050060442.db2.gz DOTOULICRIVVMN-IYBDPMFKSA-N 2 1 308.897 4.188 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc2cc[nH]c2c1 ZINC001209515661 1050064808 /nfs/dbraw/zinc/06/48/08/1050064808.db2.gz ZSCKVFGQDJPMLC-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc2cc[nH]c2c1 ZINC001209515661 1050064811 /nfs/dbraw/zinc/06/48/11/1050064811.db2.gz ZSCKVFGQDJPMLC-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1ccc2cc[nH]c2c1 ZINC001209515661 1050064814 /nfs/dbraw/zinc/06/48/14/1050064814.db2.gz ZSCKVFGQDJPMLC-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP CC(C)[N@H+]([C@@H](C)c1ccccc1)C1CC[NH+](CC2CC2)CC1 ZINC001168395230 1050064805 /nfs/dbraw/zinc/06/48/05/1050064805.db2.gz RQXJDDKLFFMLKT-KRWDZBQOSA-N 2 1 300.490 4.332 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)C1CC[NH+](CC2CC2)CC1 ZINC001168395230 1050064807 /nfs/dbraw/zinc/06/48/07/1050064807.db2.gz RQXJDDKLFFMLKT-KRWDZBQOSA-N 2 1 300.490 4.332 20 0 DIADMP CC[NH+](CC)Cc1ccc(Nc2cc[nH+]cc2C(F)(F)F)cc1 ZINC001209822126 1050089252 /nfs/dbraw/zinc/08/92/52/1050089252.db2.gz WEBUEIQCPZRZLP-UHFFFAOYSA-N 2 1 323.362 4.108 20 0 DIADMP C(=C\C[N@H+]1CCC[C@@H]1C1CCC1)\C[NH+]1CCC[C@@H]1C1CCC1 ZINC000590598448 1050098512 /nfs/dbraw/zinc/09/85/12/1050098512.db2.gz BTUWNVJLHGUENQ-JLGNTZPISA-N 2 1 302.506 4.072 20 0 DIADMP C[NH+](C)[C@H]1CCOc2c(Nc3ccc4c[nH+]ccc4c3)cccc21 ZINC001210051636 1050130177 /nfs/dbraw/zinc/13/01/77/1050130177.db2.gz KJYKIIWXGLPJRW-IBGZPJMESA-N 2 1 319.408 4.364 20 0 DIADMP Cc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)o1 ZINC000057970676 1050134724 /nfs/dbraw/zinc/13/47/24/1050134724.db2.gz NMMFYAIKSFLHND-UHFFFAOYSA-N 2 1 312.457 4.254 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@@H]2CCc3c(Cl)cccc3C2)C1 ZINC001171032584 1050156108 /nfs/dbraw/zinc/15/61/08/1050156108.db2.gz GSHGYKWFUZERPF-NVXWUHKLSA-N 2 1 320.908 4.038 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@H]2CCc3c(Cl)cccc3C2)C1 ZINC001171032586 1050156643 /nfs/dbraw/zinc/15/66/43/1050156643.db2.gz GSHGYKWFUZERPF-WBVHZDCISA-N 2 1 320.908 4.038 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCCNc2ccccc21)Cc1ccccc1 ZINC000347952604 1050164110 /nfs/dbraw/zinc/16/41/10/1050164110.db2.gz YIZSXMRWRUBYEN-NRFANRHFSA-N 2 1 323.484 4.045 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000348070344 1050174014 /nfs/dbraw/zinc/17/40/14/1050174014.db2.gz JCVWAEJOEWRYCP-UHFFFAOYSA-N 2 1 307.441 4.257 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1ccc2ccccc2c1 ZINC000348070344 1050174021 /nfs/dbraw/zinc/17/40/21/1050174021.db2.gz JCVWAEJOEWRYCP-UHFFFAOYSA-N 2 1 307.441 4.257 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000591692607 1050196894 /nfs/dbraw/zinc/19/68/94/1050196894.db2.gz VUNFFJSWKUWHKD-YADHBBJMSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)c1 ZINC000591692607 1050196903 /nfs/dbraw/zinc/19/69/03/1050196903.db2.gz VUNFFJSWKUWHKD-YADHBBJMSA-N 2 1 320.480 4.378 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H](C[NH3+])C(C)(C)C ZINC001246347138 1050245059 /nfs/dbraw/zinc/24/50/59/1050245059.db2.gz SUKHNUYJXVVYQV-NHYWBVRUSA-N 2 1 317.304 4.278 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CC[NH2+][C@@H](C)CC2)c1 ZINC001210499270 1050269230 /nfs/dbraw/zinc/26/92/30/1050269230.db2.gz ULDJZYIGCCEJMO-SFHVURJKSA-N 2 1 308.469 4.154 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[NH2+][C@@H](C)CC2)c1 ZINC001210499270 1050269246 /nfs/dbraw/zinc/26/92/46/1050269246.db2.gz ULDJZYIGCCEJMO-SFHVURJKSA-N 2 1 308.469 4.154 20 0 DIADMP c1ccc(C[N@H+](CCC2CC[NH2+]CC2)C2CCCCC2)cc1 ZINC001210580128 1050303380 /nfs/dbraw/zinc/30/33/80/1050303380.db2.gz FPMFDPNJFLDMCW-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@@H]2CCc3cc(Cl)ccc3C2)C1 ZINC001171113163 1050383540 /nfs/dbraw/zinc/38/35/40/1050383540.db2.gz OYHDCLAHVCLZHI-DNVCBOLYSA-N 2 1 320.908 4.038 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+]C(C)(C)c1ccc2ccccc2c1 ZINC000626116044 1050487413 /nfs/dbraw/zinc/48/74/13/1050487413.db2.gz OGXBWEKAMXJVLA-UHFFFAOYSA-N 2 1 307.441 4.031 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(-c2ccccc2Cl)s1 ZINC000574581008 1050496351 /nfs/dbraw/zinc/49/63/51/1050496351.db2.gz LYEXJGNYPZAVOB-OLZOCXBDSA-N 2 1 320.889 4.380 20 0 DIADMP c1cc2cccc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c2[nH]1 ZINC001144717014 1050667861 /nfs/dbraw/zinc/66/78/61/1050667861.db2.gz VGOBDYAGBFFFGS-LJQANCHMSA-N 2 1 311.473 4.008 20 0 DIADMP CC(C)c1ccc(C[N@@H+](CC2CC[NH+](C)CC2)C2CC2)cc1 ZINC000788470785 1050684906 /nfs/dbraw/zinc/68/49/06/1050684906.db2.gz NPNAQIXWDOCBEJ-UHFFFAOYSA-N 2 1 300.490 4.116 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](CC1CC[NH+](C)CC1)C1CC1 ZINC000788477716 1050687891 /nfs/dbraw/zinc/68/78/91/1050687891.db2.gz YOXYBFVBISWQEB-CQSZACIVSA-N 2 1 306.881 4.207 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccccc1SC(C)(C)C ZINC000788581920 1050707527 /nfs/dbraw/zinc/70/75/27/1050707527.db2.gz CHGVACABGBHWME-CQSZACIVSA-N 2 1 317.502 4.433 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccccc1SC(C)(C)C ZINC000788693335 1050728060 /nfs/dbraw/zinc/72/80/60/1050728060.db2.gz SFPCECMJSJHCOZ-HNNXBMFYSA-N 2 1 318.530 4.490 20 0 DIADMP Cc1ccc[nH+]c1N([C@H](C)CCCC(C)C)C1CC[NH2+]CC1 ZINC001170089683 1050752516 /nfs/dbraw/zinc/75/25/16/1050752516.db2.gz AIEQHEUKRAJCOR-QGZVFWFLSA-N 2 1 303.494 4.163 20 0 DIADMP CCCCCC[C@H](CCC)[N@H+]1CC[C@H]([NH3+])[C@H](C(F)(F)F)C1 ZINC001246941573 1050887130 /nfs/dbraw/zinc/88/71/30/1050887130.db2.gz WHCRDBNOWYYXTP-ZNMIVQPWSA-N 2 1 308.432 4.337 20 0 DIADMP Cc1ccccc1C[N@H+]([C@H]1CC[C@@H](C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170121723 1050892559 /nfs/dbraw/zinc/89/25/59/1050892559.db2.gz NREREZHVEGJVGA-XLNTUCKNSA-N 2 1 300.490 4.256 20 0 DIADMP Cc1cc([C@H](C)[NH2+]CCC[NH2+][C@@H](C)c2cc(C)oc2C)c(C)o1 ZINC000348095987 1050985918 /nfs/dbraw/zinc/98/59/18/1050985918.db2.gz NPGUJGSHDBEBQK-GJZGRUSLSA-N 2 1 318.461 4.498 20 0 DIADMP C[C@H]1CC[C@H]([N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC001170149195 1051030558 /nfs/dbraw/zinc/03/05/58/1051030558.db2.gz AUUDRHHVGGIULS-ICSRJNTNSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)C1 ZINC001170162987 1051119542 /nfs/dbraw/zinc/11/95/42/1051119542.db2.gz VSXOSXHDJSOKNI-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)CC[C@H]3C2)C1 ZINC001170162987 1051119548 /nfs/dbraw/zinc/11/95/48/1051119548.db2.gz VSXOSXHDJSOKNI-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)C1 ZINC001170162987 1051119552 /nfs/dbraw/zinc/11/95/52/1051119552.db2.gz VSXOSXHDJSOKNI-PBASOCQRSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001170259555 1051165648 /nfs/dbraw/zinc/16/56/48/1051165648.db2.gz DQPVYYIFUQIFQL-DOTOQJQBSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001170259555 1051165653 /nfs/dbraw/zinc/16/56/53/1051165653.db2.gz DQPVYYIFUQIFQL-DOTOQJQBSA-N 2 1 320.908 4.268 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1ccccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170260313 1051166373 /nfs/dbraw/zinc/16/63/73/1051166373.db2.gz HVSBORHDVRQPNK-XIRDDKMYSA-N 2 1 308.897 4.251 20 0 DIADMP COc1c(F)cccc1[C@H](C)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171629501 1051172155 /nfs/dbraw/zinc/17/21/55/1051172155.db2.gz UCXFLKGUMFBIBK-ZDUSSCGKSA-N 2 1 322.468 4.136 20 0 DIADMP Cc1cccc2c1CC[N@H+](C1CC(C)(C)[NH+](C)C(C)(C)C1)C2 ZINC001171632007 1051174633 /nfs/dbraw/zinc/17/46/33/1051174633.db2.gz SMXYFZQJSIWUCC-UHFFFAOYSA-N 2 1 300.490 4.005 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CC[C@@H](c3ccccc3)C2)CC1(C)C ZINC001171631187 1051175534 /nfs/dbraw/zinc/17/55/34/1051175534.db2.gz GCVLNLJUZUGMSJ-QGZVFWFLSA-N 2 1 300.490 4.127 20 0 DIADMP C[C@H]1CC[N@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC1(F)F ZINC001171632239 1051175598 /nfs/dbraw/zinc/17/55/98/1051175598.db2.gz XXNLQHVENYRTNC-ZDUSSCGKSA-N 2 1 302.453 4.005 20 0 DIADMP C[C@@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1cc(F)cc(F)c1 ZINC001171623104 1051178690 /nfs/dbraw/zinc/17/86/90/1051178690.db2.gz KQLOUDYXPILSBC-GFCCVEGCSA-N 2 1 310.432 4.267 20 0 DIADMP COc1ccc(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1Cl ZINC001171619489 1051178908 /nfs/dbraw/zinc/17/89/08/1051178908.db2.gz MKZKKUIXWGDFTR-UHFFFAOYSA-N 2 1 324.896 4.090 20 0 DIADMP Cc1ccc(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c(Cl)c1 ZINC001171622978 1051179649 /nfs/dbraw/zinc/17/96/49/1051179649.db2.gz FSUWQRIZKOFNPU-UHFFFAOYSA-N 2 1 308.897 4.389 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3c2cc(F)cc3F)CC1(C)C ZINC001171623995 1051179691 /nfs/dbraw/zinc/17/96/91/1051179691.db2.gz KOHWRECMEUZFTK-KRWDZBQOSA-N 2 1 322.443 4.193 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1ccccn1 ZINC001171622863 1051179843 /nfs/dbraw/zinc/17/98/43/1051179843.db2.gz AHOJLGDGKQYKEP-KRWDZBQOSA-N 2 1 303.494 4.020 20 0 DIADMP Cc1ccc(C)c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[nH+]1 ZINC001170329892 1051186165 /nfs/dbraw/zinc/18/61/65/1051186165.db2.gz AGBOOZSHAUXLKM-OWZKRDHZSA-N 2 1 321.468 4.306 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCC[C@@H]2c2ccccc2)CC1(C)C ZINC001171636027 1051193775 /nfs/dbraw/zinc/19/37/75/1051193775.db2.gz CYCUPTYBHRJQNI-GOSISDBHSA-N 2 1 300.490 4.475 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCCc3ccccc3C2)CC1(C)C ZINC001171639502 1051194835 /nfs/dbraw/zinc/19/48/35/1051194835.db2.gz MWZNFOUIGPOTCX-UHFFFAOYSA-N 2 1 300.490 4.086 20 0 DIADMP CC1(C)C[C@H]([NH2+]CCc2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001171964269 1051248482 /nfs/dbraw/zinc/24/84/82/1051248482.db2.gz LFXBFNMPEZWOCM-OAQYLSRUSA-N 2 1 322.496 4.262 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966020 1051249071 /nfs/dbraw/zinc/24/90/71/1051249071.db2.gz SDYBQQRGWBKNDR-FXAWDEMLSA-N 2 1 323.484 4.175 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171966020 1051249084 /nfs/dbraw/zinc/24/90/84/1051249084.db2.gz SDYBQQRGWBKNDR-FXAWDEMLSA-N 2 1 323.484 4.175 20 0 DIADMP CC1(C)C[C@@H]([NH2+]CC2CC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171968703 1051254518 /nfs/dbraw/zinc/25/45/18/1051254518.db2.gz QVFRVWAGBDTDBK-KRWDZBQOSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C(C)(C)C ZINC001171970095 1051260059 /nfs/dbraw/zinc/26/00/59/1051260059.db2.gz YKERNCIOOVYOSJ-AEFFLSMTSA-N 2 1 302.506 4.454 20 0 DIADMP CC1(C)CCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171976117 1051262831 /nfs/dbraw/zinc/26/28/31/1051262831.db2.gz IDSAQVOLDBKPPD-SFHVURJKSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)CCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171976117 1051262845 /nfs/dbraw/zinc/26/28/45/1051262845.db2.gz IDSAQVOLDBKPPD-SFHVURJKSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)CCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171976117 1051262857 /nfs/dbraw/zinc/26/28/57/1051262857.db2.gz IDSAQVOLDBKPPD-SFHVURJKSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)CCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171976117 1051262867 /nfs/dbraw/zinc/26/28/67/1051262867.db2.gz IDSAQVOLDBKPPD-SFHVURJKSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCCC[C@@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976323 1051264442 /nfs/dbraw/zinc/26/44/42/1051264442.db2.gz KDZIJNTZCSDMQI-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCCC[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976323 1051264452 /nfs/dbraw/zinc/26/44/52/1051264452.db2.gz KDZIJNTZCSDMQI-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCCC[C@@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976323 1051264466 /nfs/dbraw/zinc/26/44/66/1051264466.db2.gz KDZIJNTZCSDMQI-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCCC[C@@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976323 1051264472 /nfs/dbraw/zinc/26/44/72/1051264472.db2.gz KDZIJNTZCSDMQI-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP C[N@@H+](CC1CCC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171980450 1051268149 /nfs/dbraw/zinc/26/81/49/1051268149.db2.gz FEGDGRIHJVGPBG-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CC1CCC1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980450 1051268156 /nfs/dbraw/zinc/26/81/56/1051268156.db2.gz FEGDGRIHJVGPBG-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CC1CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980450 1051268169 /nfs/dbraw/zinc/26/81/69/1051268169.db2.gz FEGDGRIHJVGPBG-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)C[C@@H]([NH+](CC2CC2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171983850 1051268400 /nfs/dbraw/zinc/26/84/00/1051268400.db2.gz APJPOJIVGOARCP-FQEVSTJZSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@@H]([NH+](CC2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC001171983850 1051268410 /nfs/dbraw/zinc/26/84/10/1051268410.db2.gz APJPOJIVGOARCP-FQEVSTJZSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@@H]([N@H+](CC2CC2)C2CC2)CC[NH+]1Cc1ccccc1 ZINC001171983850 1051268421 /nfs/dbraw/zinc/26/84/21/1051268421.db2.gz APJPOJIVGOARCP-FQEVSTJZSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@@H]([N@@H+](CC2CC2)C2CC2)CC[NH+]1Cc1ccccc1 ZINC001171983850 1051268429 /nfs/dbraw/zinc/26/84/29/1051268429.db2.gz APJPOJIVGOARCP-FQEVSTJZSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC(F)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171978369 1051269282 /nfs/dbraw/zinc/26/92/82/1051269282.db2.gz YIVUIMKPUBSBOD-KRWDZBQOSA-N 2 1 322.443 4.161 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC(F)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978369 1051269296 /nfs/dbraw/zinc/26/92/96/1051269296.db2.gz YIVUIMKPUBSBOD-KRWDZBQOSA-N 2 1 322.443 4.161 20 0 DIADMP CC[C@H]1CCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985325 1051271979 /nfs/dbraw/zinc/27/19/79/1051271979.db2.gz VEZWMMIGABKSQR-RBUKOAKNSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985325 1051271989 /nfs/dbraw/zinc/27/19/89/1051271989.db2.gz VEZWMMIGABKSQR-RBUKOAKNSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985325 1051271998 /nfs/dbraw/zinc/27/19/98/1051271998.db2.gz VEZWMMIGABKSQR-RBUKOAKNSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985325 1051272008 /nfs/dbraw/zinc/27/20/08/1051272008.db2.gz VEZWMMIGABKSQR-RBUKOAKNSA-N 2 1 300.490 4.304 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@H](CF)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988250 1051273063 /nfs/dbraw/zinc/27/30/63/1051273063.db2.gz QEFGPYRKMBRLBF-RTBURBONSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCC[C@H](CF)C2)CC[N@H+]1Cc1ccccc1 ZINC001171988250 1051273078 /nfs/dbraw/zinc/27/30/78/1051273078.db2.gz QEFGPYRKMBRLBF-RTBURBONSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCC[C@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988250 1051273093 /nfs/dbraw/zinc/27/30/93/1051273093.db2.gz QEFGPYRKMBRLBF-RTBURBONSA-N 2 1 318.480 4.111 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCC[C@H](CF)C2)CC[NH+]1Cc1ccccc1 ZINC001171988250 1051273100 /nfs/dbraw/zinc/27/31/00/1051273100.db2.gz QEFGPYRKMBRLBF-RTBURBONSA-N 2 1 318.480 4.111 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CCC1 ZINC001172070888 1051275219 /nfs/dbraw/zinc/27/52/19/1051275219.db2.gz SBNZSDMTCJWEDP-RZXSNQJFSA-N 2 1 312.501 4.350 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172079699 1051276571 /nfs/dbraw/zinc/27/65/71/1051276571.db2.gz PNAGUUBCLMTEKL-YXIAPDDASA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2C[C@H]4CCC[C@@H]4C2)C3)cc1 ZINC001172079699 1051276578 /nfs/dbraw/zinc/27/65/78/1051276578.db2.gz PNAGUUBCLMTEKL-YXIAPDDASA-N 2 1 324.512 4.304 20 0 DIADMP CC[C@H]1CCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076098 1051276809 /nfs/dbraw/zinc/27/68/09/1051276809.db2.gz VGKCQFNVDVSBOI-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076098 1051276820 /nfs/dbraw/zinc/27/68/20/1051276820.db2.gz VGKCQFNVDVSBOI-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076098 1051276829 /nfs/dbraw/zinc/27/68/29/1051276829.db2.gz VGKCQFNVDVSBOI-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076098 1051276839 /nfs/dbraw/zinc/27/68/39/1051276839.db2.gz VGKCQFNVDVSBOI-UWHLTILDSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078546 1051277629 /nfs/dbraw/zinc/27/76/29/1051277629.db2.gz HVZDMBZRWNREPD-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078546 1051277642 /nfs/dbraw/zinc/27/76/42/1051277642.db2.gz HVZDMBZRWNREPD-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172078546 1051277655 /nfs/dbraw/zinc/27/76/55/1051277655.db2.gz HVZDMBZRWNREPD-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172078546 1051277670 /nfs/dbraw/zinc/27/76/70/1051277670.db2.gz HVZDMBZRWNREPD-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076475 1051278349 /nfs/dbraw/zinc/27/83/49/1051278349.db2.gz ZGRMGRIOBPSAMY-PMOLBWCYSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)CC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076475 1051278356 /nfs/dbraw/zinc/27/83/56/1051278356.db2.gz ZGRMGRIOBPSAMY-PMOLBWCYSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172076475 1051278367 /nfs/dbraw/zinc/27/83/67/1051278367.db2.gz ZGRMGRIOBPSAMY-PMOLBWCYSA-N 2 1 312.501 4.304 20 0 DIADMP CC1(C)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172076475 1051278374 /nfs/dbraw/zinc/27/83/74/1051278374.db2.gz ZGRMGRIOBPSAMY-PMOLBWCYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100256 1051284162 /nfs/dbraw/zinc/28/41/62/1051284162.db2.gz CBRPBKQNKPAJLX-HUJKARHJSA-N 2 1 312.501 4.231 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc2c(c1)CCCC2 ZINC001172100256 1051284176 /nfs/dbraw/zinc/28/41/76/1051284176.db2.gz CBRPBKQNKPAJLX-HUJKARHJSA-N 2 1 312.501 4.231 20 0 DIADMP F[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172064077 1051285103 /nfs/dbraw/zinc/28/51/03/1051285103.db2.gz FJAJGYMDJPZGPF-UJMXGEILSA-N 2 1 316.464 4.052 20 0 DIADMP CCC(CC)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172064058 1051285983 /nfs/dbraw/zinc/28/59/83/1051285983.db2.gz DZQSBAXQBKTMQF-OWZKRDHZSA-N 2 1 300.490 4.350 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCSc1ccc(Cl)cc1)C2 ZINC001172100248 1051286729 /nfs/dbraw/zinc/28/67/29/1051286729.db2.gz CAFVEFFMFILZKW-MUJYYYPQSA-N 2 1 324.921 4.037 20 0 DIADMP CCC(C)(C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069230 1051289367 /nfs/dbraw/zinc/28/93/67/1051289367.db2.gz SGUHCLBPWZYRHP-LDLYASANSA-N 2 1 300.490 4.350 20 0 DIADMP CCC(C)(C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069230 1051289377 /nfs/dbraw/zinc/28/93/77/1051289377.db2.gz SGUHCLBPWZYRHP-LDLYASANSA-N 2 1 300.490 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2(CC4CC4)CC2)C3)cc1 ZINC001172070363 1051290582 /nfs/dbraw/zinc/29/05/82/1051290582.db2.gz NNTDSJZFXDNSBD-MZADTFQBSA-N 2 1 324.512 4.494 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127398 1051290775 /nfs/dbraw/zinc/29/07/75/1051290775.db2.gz JCTMLUKOXOIJDU-BURNTYAHSA-N 2 1 312.501 4.271 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127398 1051290787 /nfs/dbraw/zinc/29/07/87/1051290787.db2.gz JCTMLUKOXOIJDU-BURNTYAHSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127398 1051290796 /nfs/dbraw/zinc/29/07/96/1051290796.db2.gz JCTMLUKOXOIJDU-BURNTYAHSA-N 2 1 312.501 4.271 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H](c3ccccc3)CC1)C2 ZINC001172127398 1051290807 /nfs/dbraw/zinc/29/08/07/1051290807.db2.gz JCTMLUKOXOIJDU-BURNTYAHSA-N 2 1 312.501 4.271 20 0 DIADMP Cc1cccc(C[NH+](C2CC2)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1C ZINC001172134624 1051292793 /nfs/dbraw/zinc/29/27/93/1051292793.db2.gz YIDMSGNXCFHQTK-WKCHPHFGSA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[NH+](C2CC2)[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1C ZINC001172134624 1051292804 /nfs/dbraw/zinc/29/28/04/1051292804.db2.gz YIDMSGNXCFHQTK-WKCHPHFGSA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[N@H+](C2CC2)[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1C ZINC001172134624 1051292816 /nfs/dbraw/zinc/29/28/16/1051292816.db2.gz YIDMSGNXCFHQTK-WKCHPHFGSA-N 2 1 312.501 4.283 20 0 DIADMP Cc1cccc(C[N@@H+](C2CC2)[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1C ZINC001172134624 1051292823 /nfs/dbraw/zinc/29/28/23/1051292823.db2.gz YIDMSGNXCFHQTK-WKCHPHFGSA-N 2 1 312.501 4.283 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)cc1 ZINC001172104801 1051296260 /nfs/dbraw/zinc/29/62/60/1051296260.db2.gz CWZVOFCEXPGZIO-RDGPPVDQSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001172104801 1051296273 /nfs/dbraw/zinc/29/62/73/1051296273.db2.gz CWZVOFCEXPGZIO-RDGPPVDQSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105921 1051297462 /nfs/dbraw/zinc/29/74/62/1051297462.db2.gz LEYJMTPAZQVDFN-AKHDSKFASA-N 2 1 318.892 4.396 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172105921 1051297469 /nfs/dbraw/zinc/29/74/69/1051297469.db2.gz LEYJMTPAZQVDFN-AKHDSKFASA-N 2 1 318.892 4.396 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112454 1051298821 /nfs/dbraw/zinc/29/88/21/1051298821.db2.gz XCUDCSBLPPZMEG-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1cccc(F)c1)C1CCC1)C2 ZINC001172112454 1051298831 /nfs/dbraw/zinc/29/88/31/1051298831.db2.gz XCUDCSBLPPZMEG-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110832 1051299468 /nfs/dbraw/zinc/29/94/68/1051299468.db2.gz PTPHPDZBNUZCAO-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110832 1051299477 /nfs/dbraw/zinc/29/94/77/1051299477.db2.gz PTPHPDZBNUZCAO-IYWMVGAKSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCCCc1ccc(Cl)cc1)C2 ZINC001172110273 1051300264 /nfs/dbraw/zinc/30/02/64/1051300264.db2.gz JIDBUMNHYNSFGT-REPLKXPHSA-N 2 1 320.908 4.268 20 0 DIADMP Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172113904 1051300384 /nfs/dbraw/zinc/30/03/84/1051300384.db2.gz KTIYZENOISBWBO-DZUCGIPZSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172113904 1051300393 /nfs/dbraw/zinc/30/03/93/1051300393.db2.gz KTIYZENOISBWBO-DZUCGIPZSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)C(C)C)c1 ZINC001172111581 1051301593 /nfs/dbraw/zinc/30/15/93/1051301593.db2.gz VRAHVWLQIIOMIT-IYWMVGAKSA-N 2 1 300.490 4.297 20 0 DIADMP Cc1cccc([C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)C(C)C)c1 ZINC001172111581 1051301605 /nfs/dbraw/zinc/30/16/05/1051301605.db2.gz VRAHVWLQIIOMIT-IYWMVGAKSA-N 2 1 300.490 4.297 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110831 1051302200 /nfs/dbraw/zinc/30/22/00/1051302200.db2.gz PTPHPDZBNUZCAO-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CC1)c1cccc(F)c1)C2 ZINC001172110831 1051302208 /nfs/dbraw/zinc/30/22/08/1051302208.db2.gz PTPHPDZBNUZCAO-HAGHYFMRSA-N 2 1 316.464 4.272 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172109691 1051302752 /nfs/dbraw/zinc/30/27/52/1051302752.db2.gz JZASRAQQGVMMMB-AKHDSKFASA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172109691 1051302760 /nfs/dbraw/zinc/30/27/60/1051302760.db2.gz JZASRAQQGVMMMB-AKHDSKFASA-N 2 1 304.453 4.128 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120267 1051303847 /nfs/dbraw/zinc/30/38/47/1051303847.db2.gz CEHVPUIIPBXLEG-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120267 1051303857 /nfs/dbraw/zinc/30/38/57/1051303857.db2.gz CEHVPUIIPBXLEG-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120267 1051303864 /nfs/dbraw/zinc/30/38/64/1051303864.db2.gz CEHVPUIIPBXLEG-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CC[C@H](c3ccc(Cl)cc3)C1)C2 ZINC001172120267 1051303871 /nfs/dbraw/zinc/30/38/71/1051303871.db2.gz CEHVPUIIPBXLEG-GDAAHCPNSA-N 2 1 318.892 4.145 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121782 1051306967 /nfs/dbraw/zinc/30/69/67/1051306967.db2.gz MLIBZZVJJLZRRQ-NHAYFPRASA-N 2 1 316.464 4.368 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121782 1051306970 /nfs/dbraw/zinc/30/69/70/1051306970.db2.gz MLIBZZVJJLZRRQ-NHAYFPRASA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121782 1051306974 /nfs/dbraw/zinc/30/69/74/1051306974.db2.gz MLIBZZVJJLZRRQ-NHAYFPRASA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121782 1051306978 /nfs/dbraw/zinc/30/69/78/1051306978.db2.gz MLIBZZVJJLZRRQ-NHAYFPRASA-N 2 1 316.464 4.368 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1Cl ZINC001172115868 1051307213 /nfs/dbraw/zinc/30/72/13/1051307213.db2.gz FTGBRGIFWRJVSZ-QSPRXWTASA-N 2 1 306.881 4.314 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1Cl ZINC001172115868 1051307218 /nfs/dbraw/zinc/30/72/18/1051307218.db2.gz FTGBRGIFWRJVSZ-QSPRXWTASA-N 2 1 306.881 4.314 20 0 DIADMP CCCC[N@H+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172121462 1051307468 /nfs/dbraw/zinc/30/74/68/1051307468.db2.gz JQWMLOMBSKVXAU-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172121462 1051307478 /nfs/dbraw/zinc/30/74/78/1051307478.db2.gz JQWMLOMBSKVXAU-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172121462 1051307490 /nfs/dbraw/zinc/30/74/90/1051307490.db2.gz JQWMLOMBSKVXAU-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](Cc1ccccc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172121462 1051307500 /nfs/dbraw/zinc/30/75/00/1051307500.db2.gz JQWMLOMBSKVXAU-PMOLBWCYSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000380956180 1051365701 /nfs/dbraw/zinc/36/57/01/1051365701.db2.gz UOYIRPGFNPCJIP-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)o1 ZINC000380907866 1051366157 /nfs/dbraw/zinc/36/61/57/1051366157.db2.gz IJWOTXLIDKEBCM-PKOBYXMFSA-N 2 1 312.457 4.151 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)o1 ZINC000380907866 1051366165 /nfs/dbraw/zinc/36/61/65/1051366165.db2.gz IJWOTXLIDKEBCM-PKOBYXMFSA-N 2 1 312.457 4.151 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CCSc3c(F)cccc32)CC(C)(C)[NH2+]1 ZINC000191747835 1051366479 /nfs/dbraw/zinc/36/64/79/1051366479.db2.gz QKDQLODMALXNTM-HNNXBMFYSA-N 2 1 322.493 4.261 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@H]1C ZINC001172370115 1051377977 /nfs/dbraw/zinc/37/79/77/1051377977.db2.gz VOAGHUARVYUKMA-QWFCFKBJSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H](CC(C)C)[NH+]1CCC([NH3+])(c2ccccc2Cl)CC1 ZINC001172397776 1051398699 /nfs/dbraw/zinc/39/86/99/1051398699.db2.gz CAKHNANHNPTREB-HNNXBMFYSA-N 2 1 308.897 4.415 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172549514 1051432256 /nfs/dbraw/zinc/43/22/56/1051432256.db2.gz PPZPQOZJMDWHFA-NQIIRXRSSA-N 2 1 312.501 4.271 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([NH2+][C@H]3CC[N@@H+](CC4CCCC4)C3)C2)cc1 ZINC001172558214 1051440762 /nfs/dbraw/zinc/44/07/62/1051440762.db2.gz UDLHITPLPQALJV-NJYVYQBISA-N 2 1 312.501 4.177 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([NH2+][C@H]3CC[N@H+](CC4CCCC4)C3)C2)cc1 ZINC001172558214 1051440770 /nfs/dbraw/zinc/44/07/70/1051440770.db2.gz UDLHITPLPQALJV-NJYVYQBISA-N 2 1 312.501 4.177 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172561348 1051442636 /nfs/dbraw/zinc/44/26/36/1051442636.db2.gz QCIOEWQBSXZNNL-NHCUHLMSSA-N 2 1 314.517 4.375 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001172538090 1051452528 /nfs/dbraw/zinc/45/25/28/1051452528.db2.gz LUEKXFJCVWUAQA-SXLOBPIMSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)C[N@@H+]([C@H]1Cc2ccc(Cl)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172713281 1051497035 /nfs/dbraw/zinc/49/70/35/1051497035.db2.gz SSSFWCKTNQKXKR-FHWLQOOXSA-N 2 1 320.908 4.035 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169099574 1051507902 /nfs/dbraw/zinc/50/79/02/1051507902.db2.gz BTENAESUJNSTES-AKHDSKFASA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1cccc(-c3ccccc3)c1)C2 ZINC001169092681 1051509460 /nfs/dbraw/zinc/50/94/60/1051509460.db2.gz CJSCUVCMLUAGSO-MZADTFQBSA-N 2 1 306.453 4.068 20 0 DIADMP CC(C)=CCC/C(C)=C/CNc1ccc2c(C3C[NH2+]C3)[nH+]cn2c1 ZINC001169136122 1051526844 /nfs/dbraw/zinc/52/68/44/1051526844.db2.gz WDQJLLGEBMYNBK-CXUHLZMHSA-N 2 1 324.472 4.126 20 0 DIADMP Cc1cc[nH+]c2cc(N[C@@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)ccc12 ZINC001169152426 1051537172 /nfs/dbraw/zinc/53/71/72/1051537172.db2.gz PRMBGPKCLBRDQG-UZLBHIALSA-N 2 1 311.473 4.499 20 0 DIADMP Cc1ccc([C@@H]2CCCC[NH+]2[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC001169155081 1051537467 /nfs/dbraw/zinc/53/74/67/1051537467.db2.gz XNBCIQCDSVPYMW-WOZUAGRISA-N 2 1 312.501 4.456 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001169155081 1051537478 /nfs/dbraw/zinc/53/74/78/1051537478.db2.gz XNBCIQCDSVPYMW-WOZUAGRISA-N 2 1 312.501 4.456 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2[C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1C ZINC001169155081 1051537486 /nfs/dbraw/zinc/53/74/86/1051537486.db2.gz XNBCIQCDSVPYMW-WOZUAGRISA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc[nH+]c2cc(N[C@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)ccc12 ZINC001169152423 1051538228 /nfs/dbraw/zinc/53/82/28/1051538228.db2.gz PRMBGPKCLBRDQG-JXFKEZNVSA-N 2 1 311.473 4.499 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155650 1051539000 /nfs/dbraw/zinc/53/90/00/1051539000.db2.gz UDCOQLOMXPTCAR-LHHMISFZSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169155650 1051539016 /nfs/dbraw/zinc/53/90/16/1051539016.db2.gz UDCOQLOMXPTCAR-LHHMISFZSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169155650 1051539032 /nfs/dbraw/zinc/53/90/32/1051539032.db2.gz UDCOQLOMXPTCAR-LHHMISFZSA-N 2 1 316.514 4.171 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160296 1051539930 /nfs/dbraw/zinc/53/99/30/1051539930.db2.gz CGAQEYJHOHFFJL-ZSHCYNCHSA-N 2 1 313.272 4.050 20 0 DIADMP C[N@@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160296 1051539940 /nfs/dbraw/zinc/53/99/40/1051539940.db2.gz CGAQEYJHOHFFJL-ZSHCYNCHSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169160296 1051539950 /nfs/dbraw/zinc/53/99/50/1051539950.db2.gz CGAQEYJHOHFFJL-ZSHCYNCHSA-N 2 1 313.272 4.050 20 0 DIADMP C[NH+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169160296 1051539959 /nfs/dbraw/zinc/53/99/59/1051539959.db2.gz CGAQEYJHOHFFJL-ZSHCYNCHSA-N 2 1 313.272 4.050 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc3c(c2)Cc2ccccc2-3)CCC[C@@H]1C[NH3+] ZINC001206004566 1051546090 /nfs/dbraw/zinc/54/60/90/1051546090.db2.gz UBGUUFWCLNVRJJ-QFBILLFUSA-N 2 1 320.480 4.065 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@@H]1CCC[C@@H](C)C1 ZINC001169224302 1051555948 /nfs/dbraw/zinc/55/59/48/1051555948.db2.gz GQLBHUPSKPOMKZ-MSOLQXFVSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@@H]1CCC[C@@H](C)C1 ZINC001169224302 1051555965 /nfs/dbraw/zinc/55/59/65/1051555965.db2.gz GQLBHUPSKPOMKZ-MSOLQXFVSA-N 2 1 305.510 4.374 20 0 DIADMP CC[NH+]1CCC([NH2+]C(C)(C)c2ccc(C(F)(F)F)cc2)CC1 ZINC001169224167 1051556229 /nfs/dbraw/zinc/55/62/29/1051556229.db2.gz ASZSUKHPAKJLPR-UHFFFAOYSA-N 2 1 314.395 4.014 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001172874700 1051558068 /nfs/dbraw/zinc/55/80/68/1051558068.db2.gz HYZVQOYGKZCRQI-DMRZNYOFSA-N 2 1 324.921 4.035 20 0 DIADMP CC[NH+]1CCC([NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC001169259010 1051563927 /nfs/dbraw/zinc/56/39/27/1051563927.db2.gz YIQOQQYZXMTWQO-UHFFFAOYSA-N 2 1 308.469 4.173 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+](C)C1CCC([NH3+])CC1 ZINC001172882735 1051565867 /nfs/dbraw/zinc/56/58/67/1051565867.db2.gz PMOSLYSWFKTWFQ-LRVUVFPRSA-N 2 1 312.910 4.022 20 0 DIADMP CCCOC1CCC([N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173094031 1051600631 /nfs/dbraw/zinc/60/06/31/1051600631.db2.gz DEWCVQSHBNQKOO-CAAWEGIDSA-N 2 1 322.537 4.239 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2ccccc2Cl)CC1 ZINC001173112185 1051610327 /nfs/dbraw/zinc/61/03/27/1051610327.db2.gz SBLHRXQYZUNDFL-UHFFFAOYSA-N 2 1 308.897 4.425 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2Cc3cccc(Cl)c3C2)CC1 ZINC001173113161 1051611691 /nfs/dbraw/zinc/61/16/91/1051611691.db2.gz JQBBRLFOKNQHGJ-UHFFFAOYSA-N 2 1 306.881 4.309 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCCC3(CC(F)C3)CC2)CC1 ZINC001173113299 1051611723 /nfs/dbraw/zinc/61/17/23/1051611723.db2.gz MRKYXOYHJPOBHX-UHFFFAOYSA-N 2 1 310.501 4.244 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](c3ccccc3F)C2)CC1 ZINC001173115183 1051611848 /nfs/dbraw/zinc/61/18/48/1051611848.db2.gz YAOVFKRPSJRBIP-WWDZGPRUSA-N 2 1 318.480 4.268 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)CCc2ccc(C)cc2)CC1 ZINC001173114589 1051611906 /nfs/dbraw/zinc/61/19/06/1051611906.db2.gz QDJDNJDKTQHFBG-UHFFFAOYSA-N 2 1 302.506 4.122 20 0 DIADMP C(C1CC1)[N@@H+]1CCC2(C[NH+](C3CCC4(CCCCC4)CC3)C2)C1 ZINC001173117137 1051613643 /nfs/dbraw/zinc/61/36/43/1051613643.db2.gz YBXUSUXHQZEPFM-UHFFFAOYSA-N 2 1 316.533 4.297 20 0 DIADMP C(C1CC1)[N@H+]1CCC2(C[NH+](C3CCC4(CCCCC4)CC3)C2)C1 ZINC001173117137 1051613651 /nfs/dbraw/zinc/61/36/51/1051613651.db2.gz YBXUSUXHQZEPFM-UHFFFAOYSA-N 2 1 316.533 4.297 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+](C2CCC3(CCCCC3)CC2)CC1 ZINC001173120948 1051615915 /nfs/dbraw/zinc/61/59/15/1051615915.db2.gz KFEVVAAZNLIJEW-UHFFFAOYSA-N 2 1 304.522 4.438 20 0 DIADMP CC[C@@H]1CC[C@@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173268928 1051667455 /nfs/dbraw/zinc/66/74/55/1051667455.db2.gz FGBDJOIPOXOTPM-HUYLIWGRSA-N 2 1 318.480 4.476 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)c1 ZINC001169782191 1051699450 /nfs/dbraw/zinc/69/94/50/1051699450.db2.gz WGPZDYGDEGTORM-UHFFFAOYSA-N 2 1 300.490 4.118 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342446 1051700475 /nfs/dbraw/zinc/70/04/75/1051700475.db2.gz YHWUWQOWGBPIBN-OKYOBFRVSA-N 2 1 304.522 4.484 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342446 1051700490 /nfs/dbraw/zinc/70/04/90/1051700490.db2.gz YHWUWQOWGBPIBN-OKYOBFRVSA-N 2 1 304.522 4.484 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(Cl)cc1Cl ZINC001206023584 1051715588 /nfs/dbraw/zinc/71/55/88/1051715588.db2.gz FXSNOVFMDBXDSR-CHWSQXEVSA-N 2 1 315.288 4.109 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186283135 1051804151 /nfs/dbraw/zinc/80/41/51/1051804151.db2.gz PJIMSYDLCKBJJH-QLFBSQMISA-N 2 1 322.518 4.060 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186283135 1051804164 /nfs/dbraw/zinc/80/41/64/1051804164.db2.gz PJIMSYDLCKBJJH-QLFBSQMISA-N 2 1 322.518 4.060 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000186299950 1051807258 /nfs/dbraw/zinc/80/72/58/1051807258.db2.gz JPALNPSUSBGLLT-NVXWUHKLSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@H](CCC1CC1)[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000186299950 1051807270 /nfs/dbraw/zinc/80/72/70/1051807270.db2.gz JPALNPSUSBGLLT-NVXWUHKLSA-N 2 1 306.519 4.128 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)C1CCSCC1 ZINC000187000299 1051833205 /nfs/dbraw/zinc/83/32/05/1051833205.db2.gz SMGJHMNILBZBPN-INIZCTEOSA-N 2 1 320.546 4.148 20 0 DIADMP Cc1cscc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000494495253 1051905972 /nfs/dbraw/zinc/90/59/72/1051905972.db2.gz MVBVNIHJBOCKMS-HNAYVOBHSA-N 2 1 314.498 4.057 20 0 DIADMP C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768330727 1051917902 /nfs/dbraw/zinc/91/79/02/1051917902.db2.gz ZCGVRYHXKWJIOE-OAHLLOKOSA-N 2 1 300.421 4.080 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000191268188 1051968965 /nfs/dbraw/zinc/96/89/65/1051968965.db2.gz DZMNORDPZFGKBQ-QWHCGFSZSA-N 2 1 300.899 4.173 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000191268188 1051968974 /nfs/dbraw/zinc/96/89/74/1051968974.db2.gz DZMNORDPZFGKBQ-QWHCGFSZSA-N 2 1 300.899 4.173 20 0 DIADMP Cc1c([C@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cnn1C(C)(C)C ZINC000191324731 1051969944 /nfs/dbraw/zinc/96/99/44/1051969944.db2.gz NPPQMQQBTQXHBE-INIZCTEOSA-N 2 1 322.541 4.106 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2F)cc1 ZINC000769353104 1052031376 /nfs/dbraw/zinc/03/13/76/1052031376.db2.gz SFLRCRHPAWSKFL-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2F)cc1 ZINC000769353104 1052031386 /nfs/dbraw/zinc/03/13/86/1052031386.db2.gz SFLRCRHPAWSKFL-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000769405306 1052041567 /nfs/dbraw/zinc/04/15/67/1052041567.db2.gz UCAMRCUMEKYNMQ-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCCOc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000769405306 1052041583 /nfs/dbraw/zinc/04/15/83/1052041583.db2.gz UCAMRCUMEKYNMQ-IBGZPJMESA-N 2 1 318.505 4.029 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)C1CCCC1 ZINC000495052946 1052203247 /nfs/dbraw/zinc/20/32/47/1052203247.db2.gz ZYSBBHYJRQFEHO-ILZDJORESA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)C1CCCC1 ZINC000495052946 1052203258 /nfs/dbraw/zinc/20/32/58/1052203258.db2.gz ZYSBBHYJRQFEHO-ILZDJORESA-N 2 1 300.490 4.299 20 0 DIADMP CC[C@@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)c1ccccc1 ZINC001218176697 1052203576 /nfs/dbraw/zinc/20/35/76/1052203576.db2.gz HTEOAEABINAGNE-HXUWFJFHSA-N 2 1 324.468 4.140 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)C1CCCC1 ZINC000495052960 1052204576 /nfs/dbraw/zinc/20/45/76/1052204576.db2.gz ZYSBBHYJRQFEHO-YVWKXTFCSA-N 2 1 300.490 4.299 20 0 DIADMP Cc1ccccc1[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)C1CCCC1 ZINC000495052960 1052204583 /nfs/dbraw/zinc/20/45/83/1052204583.db2.gz ZYSBBHYJRQFEHO-YVWKXTFCSA-N 2 1 300.490 4.299 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CCS2 ZINC000250022264 1052217631 /nfs/dbraw/zinc/21/76/31/1052217631.db2.gz MYTLDITXSXLPCK-OFQRWUPVSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCS2 ZINC000250022264 1052217635 /nfs/dbraw/zinc/21/76/35/1052217635.db2.gz MYTLDITXSXLPCK-OFQRWUPVSA-N 2 1 322.905 4.093 20 0 DIADMP CC[C@H](C)C[C@H](CC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218297186 1052218923 /nfs/dbraw/zinc/21/89/23/1052218923.db2.gz ZYDDZVBLSCOEIU-LPHOPBHVSA-N 2 1 318.505 4.203 20 0 DIADMP CC[C@H](C)C[C@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218294184 1052219417 /nfs/dbraw/zinc/21/94/17/1052219417.db2.gz ISMVKRQIKPYYAM-LPHOPBHVSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)CCC[C@@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218311192 1052222685 /nfs/dbraw/zinc/22/26/85/1052222685.db2.gz OSPASUQWNSFNPK-QGZVFWFLSA-N 2 1 318.505 4.203 20 0 DIADMP CCCC[C@H](CCC)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218354216 1052229322 /nfs/dbraw/zinc/22/93/22/1052229322.db2.gz CPWAFKZMUFRSDY-IBGZPJMESA-N 2 1 318.505 4.347 20 0 DIADMP CC(C)CCC[C@@H](C)[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309645021 1052229680 /nfs/dbraw/zinc/22/96/80/1052229680.db2.gz QCTJCFVUKNBLLO-GOSISDBHSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC[C@H](CCC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218355987 1052230158 /nfs/dbraw/zinc/23/01/58/1052230158.db2.gz ZDDSBUSEDPULJN-IBGZPJMESA-N 2 1 318.505 4.347 20 0 DIADMP CCC[C@H](C)[C@@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218439802 1052239532 /nfs/dbraw/zinc/23/95/32/1052239532.db2.gz WSYFMXXNIULCML-QFBILLFUSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1cccc(C)c1C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310340985 1052267050 /nfs/dbraw/zinc/26/70/50/1052267050.db2.gz CSVPGJWLAJYFMC-OAQYLSRUSA-N 2 1 322.496 4.305 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2ccccc2C(F)(F)F)CC1 ZINC000231131942 1052280208 /nfs/dbraw/zinc/28/02/08/1052280208.db2.gz WVIKDEYCIXENCO-UHFFFAOYSA-N 2 1 314.395 4.060 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)[C@@H](C)C1 ZINC000495400494 1052334664 /nfs/dbraw/zinc/33/46/64/1052334664.db2.gz BQTUBEAKDVSCDA-BEVDRBHNSA-N 2 1 316.464 4.082 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1 ZINC000495415045 1052341379 /nfs/dbraw/zinc/34/13/79/1052341379.db2.gz MENVEIZRWVZREY-IONDEXAJSA-N 2 1 316.464 4.080 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000236695906 1052428643 /nfs/dbraw/zinc/42/86/43/1052428643.db2.gz VBFKXNMZGDVYBJ-MNDPQUGUSA-N 2 1 320.480 4.344 20 0 DIADMP CCc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000237142007 1052435760 /nfs/dbraw/zinc/43/57/60/1052435760.db2.gz DRXXCLPYQOKHHO-UHFFFAOYSA-N 2 1 314.498 4.065 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)C1CCCCC1 ZINC000237531387 1052442041 /nfs/dbraw/zinc/44/20/41/1052442041.db2.gz ICPFODRDWOWSQY-SFHVURJKSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H]1CCCC[C@@H]1C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000237536578 1052442753 /nfs/dbraw/zinc/44/27/53/1052442753.db2.gz HWLKTNDBFGBEIV-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]1CC([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C[C@H](C)C1 ZINC000237610642 1052443041 /nfs/dbraw/zinc/44/30/41/1052443041.db2.gz BTTNWADXZZSIQH-IAGOWNOFSA-N 2 1 300.490 4.065 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CC[C@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222141398 1052449393 /nfs/dbraw/zinc/44/93/93/1052449393.db2.gz KIENYHJQKZWZCD-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222141398 1052449394 /nfs/dbraw/zinc/44/93/94/1052449394.db2.gz KIENYHJQKZWZCD-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC001222147962 1052450583 /nfs/dbraw/zinc/45/05/83/1052450583.db2.gz GFAGUAHGTWQMPF-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)cc1 ZINC001222147962 1052450586 /nfs/dbraw/zinc/45/05/86/1052450586.db2.gz GFAGUAHGTWQMPF-OAQYLSRUSA-N 2 1 322.452 4.054 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1)c1ccccc1 ZINC001222153914 1052451473 /nfs/dbraw/zinc/45/14/73/1052451473.db2.gz CNUUYWPEPBFTIR-UYAOXDASSA-N 2 1 300.490 4.036 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1)c1ccccc1 ZINC001222153911 1052451528 /nfs/dbraw/zinc/45/15/28/1052451528.db2.gz CNUUYWPEPBFTIR-AZUAARDMSA-N 2 1 300.490 4.036 20 0 DIADMP c1cc2cc(C[N@H+]3CCCC[C@@]4(CCCC[NH2+]C4)C3)ccc2o1 ZINC001222160283 1052453857 /nfs/dbraw/zinc/45/38/57/1052453857.db2.gz DQZZZCUQQPSVIH-HXUWFJFHSA-N 2 1 312.457 4.179 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c(C)s1 ZINC001222162081 1052453890 /nfs/dbraw/zinc/45/38/90/1052453890.db2.gz XJADLAPTQGMAPX-SFHVURJKSA-N 2 1 306.519 4.111 20 0 DIADMP CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)[nH]1 ZINC001222161612 1052454133 /nfs/dbraw/zinc/45/41/33/1052454133.db2.gz QFZMLFMPVWMJPJ-FQEVSTJZSA-N 2 1 317.521 4.058 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)[nH]1 ZINC001222161612 1052454137 /nfs/dbraw/zinc/45/41/37/1052454137.db2.gz QFZMLFMPVWMJPJ-FQEVSTJZSA-N 2 1 317.521 4.058 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)sc1C ZINC001222173023 1052456936 /nfs/dbraw/zinc/45/69/36/1052456936.db2.gz PVLODYSLJNXUPB-GOSISDBHSA-N 2 1 306.519 4.111 20 0 DIADMP c1ccc(-c2ccc(C[N@@H+]3CCC[C@]34CCC[NH2+]C4)cc2)cc1 ZINC001222237508 1052467250 /nfs/dbraw/zinc/46/72/50/1052467250.db2.gz LJLZVJMKMCKEMK-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2ccc(C[N@H+]3CCC[C@]34CCC[NH2+]C4)cc2)cc1 ZINC001222237508 1052467253 /nfs/dbraw/zinc/46/72/53/1052467253.db2.gz LJLZVJMKMCKEMK-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1cc(-c2ccccc2)sc1C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222243797 1052468089 /nfs/dbraw/zinc/46/80/89/1052468089.db2.gz OLWYANZUTZKTEM-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP c1cc(-c2ccccc2)sc1C[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222243797 1052468090 /nfs/dbraw/zinc/46/80/90/1052468090.db2.gz OLWYANZUTZKTEM-IBGZPJMESA-N 2 1 312.482 4.133 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222242144 1052468107 /nfs/dbraw/zinc/46/81/07/1052468107.db2.gz BNKMXUYECAEFCW-NRFANRHFSA-N 2 1 320.436 4.304 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCC[C@@]23CCC[NH2+]C3)cc1 ZINC001222248618 1052468692 /nfs/dbraw/zinc/46/86/92/1052468692.db2.gz LSAAZHDGWQPUAN-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@@]23CCC[NH2+]C3)cc1 ZINC001222248618 1052468695 /nfs/dbraw/zinc/46/86/95/1052468695.db2.gz LSAAZHDGWQPUAN-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP CCCCc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000316667336 1052471562 /nfs/dbraw/zinc/47/15/62/1052471562.db2.gz UTYKKBZLKLOJQE-PWIZWCRZSA-N 2 1 300.490 4.307 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000316789449 1052472704 /nfs/dbraw/zinc/47/27/04/1052472704.db2.gz NPCSNVZUARPIFW-NWANDNLSSA-N 2 1 321.534 4.026 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000316789449 1052472709 /nfs/dbraw/zinc/47/27/09/1052472709.db2.gz NPCSNVZUARPIFW-NWANDNLSSA-N 2 1 321.534 4.026 20 0 DIADMP c1ccc(CCCCC[NH+]2CCC3(CCCC[NH2+]3)CC2)cc1 ZINC001222287244 1052473845 /nfs/dbraw/zinc/47/38/45/1052473845.db2.gz DVXGMPSFLLPJJE-UHFFFAOYSA-N 2 1 300.490 4.008 20 0 DIADMP c1c2ccccc2sc1C[NH+]1CCC2(CCCC[NH2+]2)CC1 ZINC001222293199 1052475216 /nfs/dbraw/zinc/47/52/16/1052475216.db2.gz QDLVVAJFZOQWGP-UHFFFAOYSA-N 2 1 300.471 4.009 20 0 DIADMP Clc1cccc(C[N@@H+]2CCC[C@@]23CCC[NH2+]CC3)c1Cl ZINC001222308673 1052478742 /nfs/dbraw/zinc/47/87/42/1052478742.db2.gz LCLQLTNXOKAYIJ-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1cccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c1Cl ZINC001222308673 1052478745 /nfs/dbraw/zinc/47/87/45/1052478745.db2.gz LCLQLTNXOKAYIJ-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP c1ccc(CCCCC[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001222310894 1052478964 /nfs/dbraw/zinc/47/89/64/1052478964.db2.gz XZYFNSCIDIRCQJ-FQEVSTJZSA-N 2 1 300.490 4.008 20 0 DIADMP Clc1ccc(C[N@@H+]2CCC[C@]23CCC[NH2+]CC3)cc1Cl ZINC001222309264 1052479002 /nfs/dbraw/zinc/47/90/02/1052479002.db2.gz PDJTZCYJBDZBFW-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1Cl ZINC001222309264 1052479006 /nfs/dbraw/zinc/47/90/06/1052479006.db2.gz PDJTZCYJBDZBFW-INIZCTEOSA-N 2 1 313.272 4.102 20 0 DIADMP Fc1ccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c2ccccc12 ZINC001222314819 1052480101 /nfs/dbraw/zinc/48/01/01/1052480101.db2.gz IUHZNEZSGACRAS-HXUWFJFHSA-N 2 1 312.432 4.087 20 0 DIADMP Fc1cccc2c(C[N@H+]3CCC[C@]34CCC[NH2+]CC4)cccc12 ZINC001222320694 1052481544 /nfs/dbraw/zinc/48/15/44/1052481544.db2.gz KXLSLRKHNCNBHB-FQEVSTJZSA-N 2 1 312.432 4.087 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@]23CCC[NH2+]CC3)c1C ZINC001222321600 1052481982 /nfs/dbraw/zinc/48/19/82/1052481982.db2.gz ZYLGYYQPYNEELO-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345075 1052487559 /nfs/dbraw/zinc/48/75/59/1052487559.db2.gz IFTGRNZKPGCLDP-LAUBAEHRSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@]2(CCC[NH2+]2)C1)c1cccc2ccccc21 ZINC001222345075 1052487563 /nfs/dbraw/zinc/48/75/63/1052487563.db2.gz IFTGRNZKPGCLDP-LAUBAEHRSA-N 2 1 308.469 4.161 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222391157 1052495402 /nfs/dbraw/zinc/49/54/02/1052495402.db2.gz YOWPWTCZYIFISC-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)cc1 ZINC001222391157 1052495403 /nfs/dbraw/zinc/49/54/03/1052495403.db2.gz YOWPWTCZYIFISC-QFIPXVFZSA-N 2 1 320.480 4.462 20 0 DIADMP c1ccc(C(C[N@@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c2ccccc2)cc1 ZINC001222422030 1052498474 /nfs/dbraw/zinc/49/84/74/1052498474.db2.gz QEPIPSKOAXECAW-JOCHJYFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc(C(C[N@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c2ccccc2)cc1 ZINC001222422030 1052498478 /nfs/dbraw/zinc/49/84/78/1052498478.db2.gz QEPIPSKOAXECAW-JOCHJYFZSA-N 2 1 320.480 4.037 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222426341 1052499303 /nfs/dbraw/zinc/49/93/03/1052499303.db2.gz AXQXDIBCWGXZDI-OAQYLSRUSA-N 2 1 320.436 4.304 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222426341 1052499309 /nfs/dbraw/zinc/49/93/09/1052499309.db2.gz AXQXDIBCWGXZDI-OAQYLSRUSA-N 2 1 320.436 4.304 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@H]3C[NH2+]CC[C@H]32)c1 ZINC001222623980 1052519669 /nfs/dbraw/zinc/51/96/69/1052519669.db2.gz QZZLHUYLNLWACW-FUHWJXTLSA-N 2 1 306.519 4.055 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267227 1052544346 /nfs/dbraw/zinc/54/43/46/1052544346.db2.gz WGDUCIZWVNVASS-HZPDHXFCSA-N 2 1 308.535 4.232 20 0 DIADMP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267227 1052544350 /nfs/dbraw/zinc/54/43/50/1052544350.db2.gz WGDUCIZWVNVASS-HZPDHXFCSA-N 2 1 308.535 4.232 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000398045959 1052563702 /nfs/dbraw/zinc/56/37/02/1052563702.db2.gz VSXISAMDUQXTHA-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398157312 1052565741 /nfs/dbraw/zinc/56/57/41/1052565741.db2.gz RBSMTKGNSVLMML-LVCYWYKZSA-N 2 1 308.469 4.248 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398157312 1052565748 /nfs/dbraw/zinc/56/57/48/1052565748.db2.gz RBSMTKGNSVLMML-LVCYWYKZSA-N 2 1 308.469 4.248 20 0 DIADMP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000036975354 1052575168 /nfs/dbraw/zinc/57/51/68/1052575168.db2.gz HBPFLQNZXMARQX-FBVQUNGASA-N 2 1 306.881 4.252 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644332 1052628187 /nfs/dbraw/zinc/62/81/87/1052628187.db2.gz FVZFHIIJJQJGMC-MLGOLLRUSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(Cl)cc1Cl ZINC000037644332 1052628188 /nfs/dbraw/zinc/62/81/88/1052628188.db2.gz FVZFHIIJJQJGMC-MLGOLLRUSA-N 2 1 315.288 4.376 20 0 DIADMP C[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1ccco1 ZINC000124712755 1052643356 /nfs/dbraw/zinc/64/33/56/1052643356.db2.gz OGZDSENAZYLQIY-ULQDDVLXSA-N 2 1 312.457 4.087 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1 ZINC000125773439 1052653778 /nfs/dbraw/zinc/65/37/78/1052653778.db2.gz GDSJLRYJLJBNGX-GDBMZVCRSA-N 2 1 323.550 4.346 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000125773203 1052653899 /nfs/dbraw/zinc/65/38/99/1052653899.db2.gz GDSJLRYJLJBNGX-HOCLYGCPSA-N 2 1 323.550 4.346 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125906408 1052655863 /nfs/dbraw/zinc/65/58/63/1052655863.db2.gz XXWWKGDVZVAVQQ-ROUUACIJSA-N 2 1 318.505 4.245 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1cnc2ccsc2c1 ZINC000126462666 1052669966 /nfs/dbraw/zinc/66/99/66/1052669966.db2.gz OQTAYXZIHUSNNN-OAHLLOKOSA-N 2 1 317.502 4.069 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1cccs1 ZINC000126797556 1052678327 /nfs/dbraw/zinc/67/83/27/1052678327.db2.gz VDZDYDCDDAHTDK-HUUCEWRRSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccs1 ZINC000126797556 1052678330 /nfs/dbraw/zinc/67/83/30/1052678330.db2.gz VDZDYDCDDAHTDK-HUUCEWRRSA-N 2 1 320.527 4.372 20 0 DIADMP C[N@@H+](Cc1ccccc1C[NH2+]C1CCCC1)C1CCCCC1 ZINC000917640940 1052747064 /nfs/dbraw/zinc/74/70/64/1052747064.db2.gz HIBBBLRPMVLCFW-UHFFFAOYSA-N 2 1 300.490 4.483 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129456645 1052790976 /nfs/dbraw/zinc/79/09/76/1052790976.db2.gz YAHRNOVUEBQUGZ-IAGOWNOFSA-N 2 1 314.498 4.311 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000129456645 1052790977 /nfs/dbraw/zinc/79/09/77/1052790977.db2.gz YAHRNOVUEBQUGZ-IAGOWNOFSA-N 2 1 314.498 4.311 20 0 DIADMP CCc1ccccc1C[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556093417 1052797863 /nfs/dbraw/zinc/79/78/63/1052797863.db2.gz IBTXPRGPUNBIHW-LEWJYISDSA-N 2 1 308.469 4.174 20 0 DIADMP CCc1ccccc1C[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556093417 1052797867 /nfs/dbraw/zinc/79/78/67/1052797867.db2.gz IBTXPRGPUNBIHW-LEWJYISDSA-N 2 1 308.469 4.174 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000556177556 1052815993 /nfs/dbraw/zinc/81/59/93/1052815993.db2.gz BHYHFKCMRUMCRO-SFTDATJTSA-N 2 1 320.480 4.187 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2(Cc3ccccc3)CC2)C[C@H]1c1ccccc1 ZINC000556177556 1052815997 /nfs/dbraw/zinc/81/59/97/1052815997.db2.gz BHYHFKCMRUMCRO-SFTDATJTSA-N 2 1 320.480 4.187 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)C[C@H]1C ZINC000556172735 1052816045 /nfs/dbraw/zinc/81/60/45/1052816045.db2.gz VXCQDYHPGGLEHZ-AFKBCAQJSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)C[C@H]1C ZINC000556172735 1052816050 /nfs/dbraw/zinc/81/60/50/1052816050.db2.gz VXCQDYHPGGLEHZ-AFKBCAQJSA-N 2 1 300.490 4.236 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000556178296 1052816936 /nfs/dbraw/zinc/81/69/36/1052816936.db2.gz YZZCEXQWCRXFOE-PMPSAXMXSA-N 2 1 314.395 4.143 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000556178296 1052816942 /nfs/dbraw/zinc/81/69/42/1052816942.db2.gz YZZCEXQWCRXFOE-PMPSAXMXSA-N 2 1 314.395 4.143 20 0 DIADMP FCCCCC[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000556501371 1052855979 /nfs/dbraw/zinc/85/59/79/1052855979.db2.gz AEZXLYWNALXZIO-FQEVSTJZSA-N 2 1 318.480 4.114 20 0 DIADMP FCCCCC[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000556501371 1052855984 /nfs/dbraw/zinc/85/59/84/1052855984.db2.gz AEZXLYWNALXZIO-FQEVSTJZSA-N 2 1 318.480 4.114 20 0 DIADMP FCCCCC[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000556501371 1052855987 /nfs/dbraw/zinc/85/59/87/1052855987.db2.gz AEZXLYWNALXZIO-FQEVSTJZSA-N 2 1 318.480 4.114 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000556584041 1052867380 /nfs/dbraw/zinc/86/73/80/1052867380.db2.gz OKBMTHBTBFPGPK-GJZGRUSLSA-N 2 1 324.896 4.120 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)[C@@H]2CCC[C@H]21 ZINC000556880250 1052893355 /nfs/dbraw/zinc/89/33/55/1052893355.db2.gz XYQARARHDBSPJU-XFUTXVRSSA-N 2 1 318.892 4.048 20 0 DIADMP Cc1cccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000078704769 1052987825 /nfs/dbraw/zinc/98/78/25/1052987825.db2.gz VSVLWAPOGQMAGW-AZUAARDMSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000078704769 1052987828 /nfs/dbraw/zinc/98/78/28/1052987828.db2.gz VSVLWAPOGQMAGW-AZUAARDMSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000078704769 1052987831 /nfs/dbraw/zinc/98/78/31/1052987831.db2.gz VSVLWAPOGQMAGW-AZUAARDMSA-N 2 1 300.490 4.081 20 0 DIADMP C[C@@H](Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1)C1CCC1 ZINC000179955665 1053037452 /nfs/dbraw/zinc/03/74/52/1053037452.db2.gz TXITVGSDADRKFU-MRXNPFEDSA-N 2 1 315.505 4.065 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC001319192153 1053225815 /nfs/dbraw/zinc/22/58/15/1053225815.db2.gz JHMVAZGRDBBMRR-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC001319199014 1053225979 /nfs/dbraw/zinc/22/59/79/1053225979.db2.gz LSXLBOYEXKSXIR-STQMWFEESA-N 2 1 315.288 4.376 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)s1 ZINC000090585301 1053236957 /nfs/dbraw/zinc/23/69/57/1053236957.db2.gz SCZWJOGMKIZNSL-ZBFHGGJFSA-N 2 1 323.550 4.033 20 0 DIADMP CC[N@H+]1CCC[C@@H](CN[C@H](C)c2cc(Cl)sc2Cl)C1 ZINC001319383067 1053239803 /nfs/dbraw/zinc/23/98/03/1053239803.db2.gz IZBZPEINSOWNCI-MNOVXSKESA-N 2 1 321.317 4.437 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@@H](C)CCSc2ccccc2)CC1 ZINC001319404104 1053241010 /nfs/dbraw/zinc/24/10/10/1053241010.db2.gz PNVZTLUOJCETCC-KRWDZBQOSA-N 2 1 320.546 4.364 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCSc2ccccc21 ZINC000252096508 1053255585 /nfs/dbraw/zinc/25/55/85/1053255585.db2.gz FNUPIFJQSVZZOV-WBVHZDCISA-N 2 1 304.503 4.078 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCSc2ccccc21 ZINC000252096508 1053255592 /nfs/dbraw/zinc/25/55/92/1053255592.db2.gz FNUPIFJQSVZZOV-WBVHZDCISA-N 2 1 304.503 4.078 20 0 DIADMP Fc1ccc([C@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000091284481 1053257959 /nfs/dbraw/zinc/25/79/59/1053257959.db2.gz MRZGQDZWUBVECD-MGPUTAFESA-N 2 1 316.464 4.131 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3ccc(Cl)cc32)C1 ZINC001319685171 1053263174 /nfs/dbraw/zinc/26/31/74/1053263174.db2.gz MSNZMHFDEXLAQF-KDOFPFPSSA-N 2 1 306.881 4.039 20 0 DIADMP CCc1oc2ccccc2c1C[NH+]1CCC([NH+](CC)CC)CC1 ZINC001319695766 1053265007 /nfs/dbraw/zinc/26/50/07/1053265007.db2.gz VEARNJCWWQERKM-UHFFFAOYSA-N 2 1 314.473 4.301 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2[NH+](C)C)C[C@@H](c2ccccc2)C1 ZINC001200089769 1053370050 /nfs/dbraw/zinc/37/00/50/1053370050.db2.gz XQMITNYCYHLMHB-OFOKGCAXSA-N 2 1 314.517 4.421 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC001200105895 1053386913 /nfs/dbraw/zinc/38/69/13/1053386913.db2.gz PMCNAEOSIOXWTN-NEWSRXKRSA-N 2 1 306.538 4.445 20 0 DIADMP Cc1ccsc1C[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093336858 1053387558 /nfs/dbraw/zinc/38/75/58/1053387558.db2.gz UQGNTXUXVPPHKP-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccsc1C[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000093336858 1053387573 /nfs/dbraw/zinc/38/75/73/1053387573.db2.gz UQGNTXUXVPPHKP-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1ccsc1C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000093336858 1053387585 /nfs/dbraw/zinc/38/75/85/1053387585.db2.gz UQGNTXUXVPPHKP-GOSISDBHSA-N 2 1 314.498 4.010 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000093563743 1053425931 /nfs/dbraw/zinc/42/59/31/1053425931.db2.gz IERTXUOQZPMQIZ-KRWDZBQOSA-N 2 1 314.498 4.352 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@@H]1c1ccccc1 ZINC000414175718 1053675455 /nfs/dbraw/zinc/67/54/55/1053675455.db2.gz ZKYISRRBMBEQLH-XRULBBBTSA-N 2 1 324.443 4.107 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2F)C[C@@H]1c1ccccc1 ZINC000414175718 1053675461 /nfs/dbraw/zinc/67/54/61/1053675461.db2.gz ZKYISRRBMBEQLH-XRULBBBTSA-N 2 1 324.443 4.107 20 0 DIADMP Clc1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1Cl ZINC000620758013 1053727532 /nfs/dbraw/zinc/72/75/32/1053727532.db2.gz RRBZMHJTULEUCF-UHFFFAOYSA-N 2 1 313.272 4.100 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000154733689 1053748040 /nfs/dbraw/zinc/74/80/40/1053748040.db2.gz IFNGXFCZYMCLPV-INIZCTEOSA-N 2 1 313.272 4.055 20 0 DIADMP CC1(C)CCCC[C@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309762170 1053750237 /nfs/dbraw/zinc/75/02/37/1053750237.db2.gz YKDZFXCVMRZJTF-RTBURBONSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)(CCCc1ccccc1)C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001200562950 1053765613 /nfs/dbraw/zinc/76/56/13/1053765613.db2.gz RZAAKKLARJIWRJ-VQTJNVASSA-N 2 1 314.517 4.252 20 0 DIADMP CC(C)(CCCc1ccccc1)C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001200562954 1053765717 /nfs/dbraw/zinc/76/57/17/1053765717.db2.gz RZAAKKLARJIWRJ-WOJBJXKFSA-N 2 1 314.517 4.252 20 0 DIADMP CCc1ccc(C[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)s1 ZINC001231502362 1053771964 /nfs/dbraw/zinc/77/19/64/1053771964.db2.gz ATPCJCZDCCHYOF-JKSUJKDBSA-N 2 1 306.519 4.149 20 0 DIADMP CCc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)s1 ZINC001231502362 1053771973 /nfs/dbraw/zinc/77/19/73/1053771973.db2.gz ATPCJCZDCCHYOF-JKSUJKDBSA-N 2 1 306.519 4.149 20 0 DIADMP CCc1ccc(C[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)s1 ZINC001231502362 1053771984 /nfs/dbraw/zinc/77/19/84/1053771984.db2.gz ATPCJCZDCCHYOF-JKSUJKDBSA-N 2 1 306.519 4.149 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000156048828 1053795136 /nfs/dbraw/zinc/79/51/36/1053795136.db2.gz XSOQYMNELBTVCQ-FGSXEWAUSA-N 2 1 322.496 4.137 20 0 DIADMP CC[NH+]1CCC(N(C)Cc2ccc(-c3ccc(C)o3)cc2)CC1 ZINC001231597127 1053796217 /nfs/dbraw/zinc/79/62/17/1053796217.db2.gz FIAAIBMHVAQOTH-UHFFFAOYSA-N 2 1 312.457 4.171 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccc(C)o3)cc2)CC1 ZINC001231597127 1053796228 /nfs/dbraw/zinc/79/62/28/1053796228.db2.gz FIAAIBMHVAQOTH-UHFFFAOYSA-N 2 1 312.457 4.171 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccc(C)o3)cc2)CC1 ZINC001231597127 1053796239 /nfs/dbraw/zinc/79/62/39/1053796239.db2.gz FIAAIBMHVAQOTH-UHFFFAOYSA-N 2 1 312.457 4.171 20 0 DIADMP CC[N@@H+](C)C1CCN(Cc2ccc(-c3ccc(C)o3)cc2)CC1 ZINC001231600072 1053798200 /nfs/dbraw/zinc/79/82/00/1053798200.db2.gz SQQLSDDMUMHJFW-UHFFFAOYSA-N 2 1 312.457 4.171 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)C1CCC([NH3+])CC1 ZINC001326992187 1053820754 /nfs/dbraw/zinc/82/07/54/1053820754.db2.gz ZHEFOHGPFHZTMW-UHFFFAOYSA-N 2 1 300.471 4.117 20 0 DIADMP c1ccc(-c2cccc(C[NH+]3CCC([NH+]4CCCC4)CC3)c2)cc1 ZINC000506501107 1053834413 /nfs/dbraw/zinc/83/44/13/1053834413.db2.gz ZPACFUBFWSZARY-UHFFFAOYSA-N 2 1 320.480 4.414 20 0 DIADMP CSc1ccccc1C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001231785298 1053855676 /nfs/dbraw/zinc/85/56/76/1053855676.db2.gz KIKMJEMMODFBBM-GOSISDBHSA-N 2 1 318.530 4.249 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH+]1C[C@H]2CC[N@H+](C)C[C@H]2C1 ZINC001231812186 1053872911 /nfs/dbraw/zinc/87/29/11/1053872911.db2.gz KUYKJUQMYFQOJM-QUCCMNQESA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001231812186 1053872924 /nfs/dbraw/zinc/87/29/24/1053872924.db2.gz KUYKJUQMYFQOJM-QUCCMNQESA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001231812186 1053872944 /nfs/dbraw/zinc/87/29/44/1053872944.db2.gz KUYKJUQMYFQOJM-QUCCMNQESA-N 2 1 320.480 4.046 20 0 DIADMP CCc1ccccc1C[NH2+]Cc1cccc(C[N@@H+](C)C(C)C)c1 ZINC001200672273 1053872963 /nfs/dbraw/zinc/87/29/63/1053872963.db2.gz OKAFNANWMUMYJV-UHFFFAOYSA-N 2 1 310.485 4.379 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000158195466 1053893269 /nfs/dbraw/zinc/89/32/69/1053893269.db2.gz IFDGEIBFGBIVMD-JKSUJKDBSA-N 2 1 306.519 4.180 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)C(C)(C)c1ccccc1 ZINC001200702868 1053905475 /nfs/dbraw/zinc/90/54/75/1053905475.db2.gz HLFFCZJLXRADTJ-MSOLQXFVSA-N 2 1 302.506 4.205 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC001200713676 1053916872 /nfs/dbraw/zinc/91/68/72/1053916872.db2.gz FOVWHJMAWCIOTA-WMLDXEAASA-N 2 1 320.527 4.291 20 0 DIADMP Cc1ccsc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC001200713676 1053916883 /nfs/dbraw/zinc/91/68/83/1053916883.db2.gz FOVWHJMAWCIOTA-WMLDXEAASA-N 2 1 320.527 4.291 20 0 DIADMP C[N@@H+](CCCCc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000621294954 1053942752 /nfs/dbraw/zinc/94/27/52/1053942752.db2.gz SWLKALHDFFIVDQ-DFNIBXOVSA-N 2 1 320.908 4.220 20 0 DIADMP C[NH+](CCCCc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000621294954 1053942768 /nfs/dbraw/zinc/94/27/68/1053942768.db2.gz SWLKALHDFFIVDQ-DFNIBXOVSA-N 2 1 320.908 4.220 20 0 DIADMP C[NH+](CCCCc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000621294954 1053942772 /nfs/dbraw/zinc/94/27/72/1053942772.db2.gz SWLKALHDFFIVDQ-DFNIBXOVSA-N 2 1 320.908 4.220 20 0 DIADMP C[N@@H+](Cc1cc2c[nH+]ccc2[nH]1)Cc1ccc(C(F)(F)F)cc1 ZINC001232016015 1053944185 /nfs/dbraw/zinc/94/41/85/1053944185.db2.gz QQIMFXXQRIYMQV-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP c1c2c[nH+]ccc2[nH]c1C[N@@H+]1CCC[C@@H](CCc2ccccc2)C1 ZINC001232019150 1053944237 /nfs/dbraw/zinc/94/42/37/1053944237.db2.gz WSZZJAZYKQNFAC-SFHVURJKSA-N 2 1 319.452 4.408 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1 ZINC001232145953 1053971727 /nfs/dbraw/zinc/97/17/27/1053971727.db2.gz FUDZWBFZOAZHEQ-PKOBYXMFSA-N 2 1 304.453 4.042 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+](C)C/C=C/c2ccccc2)c1 ZINC001232146346 1053973586 /nfs/dbraw/zinc/97/35/86/1053973586.db2.gz NNHJLVOMRJEICK-JXMROGBWSA-N 2 1 312.432 4.033 20 0 DIADMP CN1CCC([N@@H+](Cc2nccc3ccccc32)C2CCCC2)CC1 ZINC001232251495 1054003673 /nfs/dbraw/zinc/00/36/73/1054003673.db2.gz WQFISULQKNFDLZ-UHFFFAOYSA-N 2 1 323.484 4.074 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@H]2CC2(F)F)CC1 ZINC000621767878 1054013302 /nfs/dbraw/zinc/01/33/02/1054013302.db2.gz KLQQYYKJCKBZEK-AOCRQIFASA-N 2 1 322.443 4.065 20 0 DIADMP CC(C)C[NH2+]Cc1ccccc1OCCC[N@@H+](C)C1CCCC1 ZINC001200844095 1054033450 /nfs/dbraw/zinc/03/34/50/1054033450.db2.gz AMLZJWGRWSKMQN-UHFFFAOYSA-N 2 1 318.505 4.076 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]CCCC(F)(F)F)[C@@H]1c1cccs1 ZINC001355263085 1054096454 /nfs/dbraw/zinc/09/64/54/1054096454.db2.gz HTPRWTFWEPKKAJ-GXTWGEPZSA-N 2 1 320.424 4.063 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]CCCC(F)(F)F)[C@@H]1c1cccs1 ZINC001355263085 1054096468 /nfs/dbraw/zinc/09/64/68/1054096468.db2.gz HTPRWTFWEPKKAJ-GXTWGEPZSA-N 2 1 320.424 4.063 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001333000170 1054135523 /nfs/dbraw/zinc/13/55/23/1054135523.db2.gz ISPXWIKKPZUDLI-LXZJYRNTSA-N 2 1 316.464 4.225 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)C1 ZINC001333000170 1054135531 /nfs/dbraw/zinc/13/55/31/1054135531.db2.gz ISPXWIKKPZUDLI-LXZJYRNTSA-N 2 1 316.464 4.225 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421705 1054154623 /nfs/dbraw/zinc/15/46/23/1054154623.db2.gz MCLQHKDJEJGSKE-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC001333421705 1054154628 /nfs/dbraw/zinc/15/46/28/1054154628.db2.gz MCLQHKDJEJGSKE-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+](C)C1CCN(Cc2ccc(Cc3ccccc3)cc2)CC1 ZINC001233331848 1054235118 /nfs/dbraw/zinc/23/51/18/1054235118.db2.gz NEIHQSOZFCVXJF-UHFFFAOYSA-N 2 1 322.496 4.194 20 0 DIADMP CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC001340977213 1054372133 /nfs/dbraw/zinc/37/21/33/1054372133.db2.gz QFWLJMLFPMYGTN-VYDXJSESSA-N 2 1 323.550 4.003 20 0 DIADMP CC[NH+](CC)[C@@H](CNC(=[NH2+])Nc1ccccc1C)c1ccccc1 ZINC001346588331 1054540828 /nfs/dbraw/zinc/54/08/28/1054540828.db2.gz FNIICPIPYXLKKI-IBGZPJMESA-N 2 1 324.472 4.014 20 0 DIADMP C[N@H+]1CC[C@H](N[C@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344395 1054565345 /nfs/dbraw/zinc/56/53/45/1054565345.db2.gz KRTMMDCRRMCKDR-ZFWWWQNUSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344395 1054565376 /nfs/dbraw/zinc/56/53/76/1054565376.db2.gz KRTMMDCRRMCKDR-ZFWWWQNUSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344395 1054565386 /nfs/dbraw/zinc/56/53/86/1054565386.db2.gz KRTMMDCRRMCKDR-ZFWWWQNUSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1(C)C ZINC000623487194 1054604401 /nfs/dbraw/zinc/60/44/01/1054604401.db2.gz WJXPVNUCCFCTOC-RTBURBONSA-N 2 1 316.464 4.224 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1(C)C ZINC000623487192 1054604422 /nfs/dbraw/zinc/60/44/22/1054604422.db2.gz WJXPVNUCCFCTOC-OALUTQOASA-N 2 1 316.464 4.224 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485193 1054605444 /nfs/dbraw/zinc/60/54/44/1054605444.db2.gz RCRBPKPFEBAQCO-GOEBONIOSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1(C)C ZINC000623485193 1054605448 /nfs/dbraw/zinc/60/54/48/1054605448.db2.gz RCRBPKPFEBAQCO-GOEBONIOSA-N 2 1 322.880 4.016 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)CC1(C)C ZINC000623533938 1054611580 /nfs/dbraw/zinc/61/15/80/1054611580.db2.gz OHOKHQIUPDLPSL-RBSFLKMASA-N 2 1 306.881 4.048 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234993807 1054637149 /nfs/dbraw/zinc/63/71/49/1054637149.db2.gz RVURACZLPZFFOP-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP Fc1ccc(-c2cccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001234991434 1054637312 /nfs/dbraw/zinc/63/73/12/1054637312.db2.gz GAJXAKVCPJYQAV-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC001234995267 1054637765 /nfs/dbraw/zinc/63/77/65/1054637765.db2.gz VBJIRYNYPNXBSE-RXVVDRJESA-N 2 1 314.517 4.064 20 0 DIADMP Cc1c(Cl)ccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c1C ZINC001235036745 1054643934 /nfs/dbraw/zinc/64/39/34/1054643934.db2.gz BAPBPAZEURSKBE-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1c(Cl)ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c1C ZINC001235036745 1054643935 /nfs/dbraw/zinc/64/39/35/1054643935.db2.gz BAPBPAZEURSKBE-SFHVURJKSA-N 2 1 306.881 4.065 20 0 DIADMP C(=C/c1ccc(C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1)\c1ccccc1 ZINC001235034027 1054643991 /nfs/dbraw/zinc/64/39/91/1054643991.db2.gz SJPAUTLRSJSPTR-XYXUZSOXSA-N 2 1 318.464 4.042 20 0 DIADMP c1sc2ccccc2c1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235046567 1054645654 /nfs/dbraw/zinc/64/56/54/1054645654.db2.gz RFAIJLDELGPWLG-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)c2)cc1 ZINC001235047173 1054646720 /nfs/dbraw/zinc/64/67/20/1054646720.db2.gz SOLUZRKUQSKDJI-JOCHJYFZSA-N 2 1 320.480 4.462 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000178183213 1054648480 /nfs/dbraw/zinc/64/84/80/1054648480.db2.gz WWGKIWSQIPCQOY-KRWDZBQOSA-N 2 1 319.452 4.207 20 0 DIADMP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1ccoc1 ZINC000178489098 1054651298 /nfs/dbraw/zinc/65/12/98/1054651298.db2.gz MCDXQJCUKWWSNN-ZACQAIPSSA-N 2 1 312.457 4.087 20 0 DIADMP Cc1c(C[N@H+]2CCC3(C2)CC[NH2+]CC3)cccc1-c1ccccc1 ZINC001235094477 1054657480 /nfs/dbraw/zinc/65/74/80/1054657480.db2.gz XQUCSLJGDAZMNC-UHFFFAOYSA-N 2 1 320.480 4.238 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CCC[C@@]23CC[NH2+]C3)CC1 ZINC001235111699 1054659791 /nfs/dbraw/zinc/65/97/91/1054659791.db2.gz SJEYPIAVPXSRFC-PMACEKPBSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CCC[C@]23CC[NH2+]C3)CC1 ZINC001235111704 1054660449 /nfs/dbraw/zinc/66/04/49/1054660449.db2.gz SJEYPIAVPXSRFC-WOJBJXKFSA-N 2 1 302.506 4.287 20 0 DIADMP C[C@H](C[N@H+]1CCCC12CC[NH2+]CC2)c1cccc2ccccc21 ZINC001235140340 1054664688 /nfs/dbraw/zinc/66/46/88/1054664688.db2.gz JMLKNNSTGUDBPO-QGZVFWFLSA-N 2 1 308.469 4.161 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CCCC34CC[NH2+]CC4)cc2)cc1 ZINC001235141713 1054665180 /nfs/dbraw/zinc/66/51/80/1054665180.db2.gz WSADBERXOVXAQZ-UHFFFAOYSA-N 2 1 322.452 4.197 20 0 DIADMP Cc1c(C[N@H+]2CCCC23CC[NH2+]CC3)cccc1-c1ccccc1 ZINC001235145227 1054665380 /nfs/dbraw/zinc/66/53/80/1054665380.db2.gz QYYDZPXNGJQXKS-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCCC34CC[NH2+]CC4)cc2)cc1 ZINC001235145300 1054667076 /nfs/dbraw/zinc/66/70/76/1054667076.db2.gz SUBPWDIUHLUWQE-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP CCCc1ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)s1 ZINC001235156855 1054667959 /nfs/dbraw/zinc/66/79/59/1054667959.db2.gz RTTKIJLEWIIVIW-SFHVURJKSA-N 2 1 306.519 4.055 20 0 DIADMP Fc1ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1C1CC1 ZINC001235154644 1054668080 /nfs/dbraw/zinc/66/80/80/1054668080.db2.gz JKQQYNFZZRLXBL-FQEVSTJZSA-N 2 1 316.464 4.057 20 0 DIADMP Cc1ccc(F)c(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1Cl ZINC001235160654 1054669325 /nfs/dbraw/zinc/66/93/25/1054669325.db2.gz YFLWJPXREUNPBA-KRWDZBQOSA-N 2 1 324.871 4.142 20 0 DIADMP Clc1ccc([C@H]2C[C@H]2C[N@H+]2CCCCC23CC[NH2+]CC3)cc1 ZINC001235191799 1054681222 /nfs/dbraw/zinc/68/12/22/1054681222.db2.gz ZEBKPACNXSWCSZ-FUHWJXTLSA-N 2 1 318.892 4.052 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001235191688 1054682000 /nfs/dbraw/zinc/68/20/00/1054682000.db2.gz VWXUHPVIZBCMQU-GOSISDBHSA-N 2 1 324.553 4.216 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235191688 1054682006 /nfs/dbraw/zinc/68/20/06/1054682006.db2.gz VWXUHPVIZBCMQU-GOSISDBHSA-N 2 1 324.553 4.216 20 0 DIADMP CC1=C[C@H](C)[C@H](C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)CC1 ZINC001235247243 1054691774 /nfs/dbraw/zinc/69/17/74/1054691774.db2.gz BQBPPVUIGRFQCF-VXSCBNMQSA-N 2 1 324.512 4.200 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@]12C[NH2+]C[C@@H]2c1ccccc1)c1ccccc1 ZINC001235247236 1054692024 /nfs/dbraw/zinc/69/20/24/1054692024.db2.gz BKHIWUWPADVUDH-STZQEDGTSA-N 2 1 320.480 4.012 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)CC1 ZINC001235247241 1054692281 /nfs/dbraw/zinc/69/22/81/1054692281.db2.gz BQBPPVUIGRFQCF-BDKRGJGYSA-N 2 1 324.512 4.200 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235260686 1054694829 /nfs/dbraw/zinc/69/48/29/1054694829.db2.gz HFBDPBWEHHNRFZ-AEFFLSMTSA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1 ZINC001235260686 1054694839 /nfs/dbraw/zinc/69/48/39/1054694839.db2.gz HFBDPBWEHHNRFZ-AEFFLSMTSA-N 2 1 306.519 4.055 20 0 DIADMP CC1(C[N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CCCCC1 ZINC001235350148 1054707948 /nfs/dbraw/zinc/70/79/48/1054707948.db2.gz VCKWYXXZLMXPEB-TZIWHRDSSA-N 2 1 312.501 4.036 20 0 DIADMP CC(C)(CC[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC001235424048 1054715433 /nfs/dbraw/zinc/71/54/33/1054715433.db2.gz JCFCZYRYLBVUJI-RBUKOAKNSA-N 2 1 314.517 4.066 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c2ccccc12 ZINC001235424002 1054715518 /nfs/dbraw/zinc/71/55/18/1054715518.db2.gz ILRVSUVLHKNAEQ-OALUTQOASA-N 2 1 322.496 4.360 20 0 DIADMP CC(C)(CC[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1)c1ccccc1 ZINC001235424044 1054716619 /nfs/dbraw/zinc/71/66/19/1054716619.db2.gz JCFCZYRYLBVUJI-MOPGFXCFSA-N 2 1 314.517 4.066 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235428211 1054717243 /nfs/dbraw/zinc/71/72/43/1054717243.db2.gz ULAJZRQMSYZWDU-OALUTQOASA-N 2 1 308.469 4.051 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c(C)c1Cl ZINC001235430095 1054718462 /nfs/dbraw/zinc/71/84/62/1054718462.db2.gz DFOSFTBXEXKXHL-WMZOPIPTSA-N 2 1 320.908 4.168 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+](C)CC2CC[NH2+]CC2)CC1 ZINC001235433640 1054719390 /nfs/dbraw/zinc/71/93/90/1054719390.db2.gz OGQSGQLDCIUOMT-LJQANCHMSA-N 2 1 304.522 4.391 20 0 DIADMP C[N@H+](Cc1ccc(C2CCCCC2)cc1)CC1CC[NH2+]CC1 ZINC001235433540 1054719224 /nfs/dbraw/zinc/71/92/24/1054719224.db2.gz YWZWOOSIAKRXAL-UHFFFAOYSA-N 2 1 300.490 4.166 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1ccc(Cl)cc1)C1CC1 ZINC000180093623 1054733549 /nfs/dbraw/zinc/73/35/49/1054733549.db2.gz LDWSOLQAJFBVLM-ACJLOTCBSA-N 2 1 317.864 4.222 20 0 DIADMP CC[C@@H](C)[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180113839 1054736954 /nfs/dbraw/zinc/73/69/54/1054736954.db2.gz DSQACTBMAPFPTC-GYMWCJPTSA-N 2 1 300.490 4.206 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1F ZINC000180404171 1054755927 /nfs/dbraw/zinc/75/59/27/1054755927.db2.gz SAELCCCQOZKAFX-CYBMUJFWSA-N 2 1 310.482 4.071 20 0 DIADMP CCCC[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1ccccc1 ZINC001235664330 1054763982 /nfs/dbraw/zinc/76/39/82/1054763982.db2.gz RBTIYJNKKKFNMS-UHFFFAOYSA-N 2 1 314.498 4.196 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@H](C[NH3+])C2)c1 ZINC001235673524 1054767836 /nfs/dbraw/zinc/76/78/36/1054767836.db2.gz BQAPVYDURQVSCT-LJQANCHMSA-N 2 1 308.469 4.141 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC001235674785 1054770324 /nfs/dbraw/zinc/77/03/24/1054770324.db2.gz OYVAHUCAMRNOTA-GOSISDBHSA-N 2 1 300.833 4.136 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc3c(s2)C[NH2+]CC3)cc1 ZINC001235677292 1054770631 /nfs/dbraw/zinc/77/06/31/1054770631.db2.gz GGEZAGYWAOYJGC-SFHVURJKSA-N 2 1 312.482 4.039 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001235677016 1054771610 /nfs/dbraw/zinc/77/16/10/1054771610.db2.gz WBMPRIYFEONRGQ-MRXNPFEDSA-N 2 1 314.860 4.178 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CCCC3(C[NH2+]C3)C2)CC1 ZINC001235710809 1054785037 /nfs/dbraw/zinc/78/50/37/1054785037.db2.gz GCMKHFHGEXRVLF-LJQANCHMSA-N 2 1 302.506 4.145 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC001235713006 1054786611 /nfs/dbraw/zinc/78/66/11/1054786611.db2.gz VJRSVIGOELHBKA-HNNXBMFYSA-N 2 1 314.395 4.014 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+](C)CCC2CC[NH2+]CC2)c1Cl ZINC001235717762 1054788276 /nfs/dbraw/zinc/78/82/76/1054788276.db2.gz LWEGNAPZXPXQEC-UHFFFAOYSA-N 2 1 315.288 4.123 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](C)CCC2CC[NH2+]CC2)c1Cl ZINC001235717762 1054788287 /nfs/dbraw/zinc/78/82/87/1054788287.db2.gz LWEGNAPZXPXQEC-UHFFFAOYSA-N 2 1 315.288 4.123 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)CC1(C)C ZINC001474152918 1054788434 /nfs/dbraw/zinc/78/84/34/1054788434.db2.gz YLMMOBRAYYWWHI-PBHICJAKSA-N 2 1 324.871 4.393 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001235717616 1054790194 /nfs/dbraw/zinc/79/01/94/1054790194.db2.gz WJRLKZJOZZNTFL-UHFFFAOYSA-N 2 1 302.487 4.031 20 0 DIADMP CCC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(C)sc1C ZINC000623861171 1054790973 /nfs/dbraw/zinc/79/09/73/1054790973.db2.gz QLTXRRGHZLQPMU-CRAIPNDOSA-N 2 1 306.519 4.280 20 0 DIADMP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(C)sc1C ZINC000623861173 1054792798 /nfs/dbraw/zinc/79/27/98/1054792798.db2.gz QLTXRRGHZLQPMU-QAPCUYQASA-N 2 1 306.519 4.280 20 0 DIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2nc(C)cs2)cc1 ZINC000623853609 1054793532 /nfs/dbraw/zinc/79/35/32/1054793532.db2.gz ADJNHQWZAWYDDH-HNNXBMFYSA-N 2 1 317.502 4.144 20 0 DIADMP CC[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)C1CC[NH2+]CC1 ZINC001235764911 1054800551 /nfs/dbraw/zinc/80/05/51/1054800551.db2.gz QIQCZFBPWRHTQU-UHFFFAOYSA-N 2 1 312.432 4.067 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccccc2Cl)o1)C1CC[NH2+]CC1 ZINC001235762461 1054800988 /nfs/dbraw/zinc/80/09/88/1054800988.db2.gz UTSLBYWBFKTHDI-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)C1CC[NH2+]CC1 ZINC001235762461 1054800995 /nfs/dbraw/zinc/80/09/95/1054800995.db2.gz UTSLBYWBFKTHDI-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP CCCCCCc1ccc(C[N@@H+](CC)C2CC[NH2+]CC2)s1 ZINC001235764462 1054801851 /nfs/dbraw/zinc/80/18/51/1054801851.db2.gz FHNXQHQWEIAJOB-UHFFFAOYSA-N 2 1 308.535 4.445 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)cc1 ZINC001235838786 1054818922 /nfs/dbraw/zinc/81/89/22/1054818922.db2.gz BZMRUMURLINUSK-CQSZACIVSA-N 2 1 306.862 4.197 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(Cl)cc2)cc1)C[C@H]1CC[NH2+]C1 ZINC001235841363 1054819317 /nfs/dbraw/zinc/81/93/17/1054819317.db2.gz DQLPLLQTYUOLGK-INIZCTEOSA-N 2 1 314.860 4.048 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccccc1Cl)C[C@H]1CC[NH2+]C1 ZINC001235843135 1054822629 /nfs/dbraw/zinc/82/26/29/1054822629.db2.gz WHIYVHSFIISUGG-HNNXBMFYSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906857 1054842740 /nfs/dbraw/zinc/84/27/40/1054842740.db2.gz OZVOESBSVQDIRG-UKRRQHHQSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@@H]1CC[C@@H]([NH3+])C[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001235906857 1054842746 /nfs/dbraw/zinc/84/27/46/1054842746.db2.gz OZVOESBSVQDIRG-UKRRQHHQSA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908541 1054844586 /nfs/dbraw/zinc/84/45/86/1054844586.db2.gz YFSBDJZRIJWFLJ-RDJZCZTQSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@H]1CC[C@H]([NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908541 1054844594 /nfs/dbraw/zinc/84/45/94/1054844594.db2.gz YFSBDJZRIJWFLJ-RDJZCZTQSA-N 2 1 319.452 4.147 20 0 DIADMP Cc1ccc(N(C)c2ccc(C[N@H+]3CCC[C@H]3CC[NH3+])cc2)cc1 ZINC001235925025 1054848230 /nfs/dbraw/zinc/84/82/30/1054848230.db2.gz GQBKSXYIPIEVNV-NRFANRHFSA-N 2 1 323.484 4.076 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@@H+]1C[C@H]2C[NH2+]CC[C@@H]2C1 ZINC001235940885 1054860674 /nfs/dbraw/zinc/86/06/74/1054860674.db2.gz TYPQANPNRWRQGW-GDBMZVCRSA-N 2 1 322.477 4.096 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)CC1 ZINC001235951387 1054865878 /nfs/dbraw/zinc/86/58/78/1054865878.db2.gz RSRXBKZCCPDXCR-WOJBJXKFSA-N 2 1 304.522 4.391 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)C[C@H]1CCC[NH2+]C1 ZINC001235950424 1054866186 /nfs/dbraw/zinc/86/61/86/1054866186.db2.gz FSHCPFVVUBDPRS-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)C[C@H]1CCC[NH2+]C1 ZINC001235950424 1054866195 /nfs/dbraw/zinc/86/61/95/1054866195.db2.gz FSHCPFVVUBDPRS-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP COc1cccc([C@@H]2CCC[N@H+]2CCC[NH2+]C2CCCCC2)c1 ZINC001235950086 1054867085 /nfs/dbraw/zinc/86/70/85/1054867085.db2.gz OEUBIZVIEBXNDC-FQEVSTJZSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)CC1CC2(C1)CC[NH2+]CC2 ZINC001235949637 1054867614 /nfs/dbraw/zinc/86/76/14/1054867614.db2.gz OYDFKGADQFABNK-CQSZACIVSA-N 2 1 306.881 4.113 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)CC1 ZINC001235951386 1054867953 /nfs/dbraw/zinc/86/79/53/1054867953.db2.gz RSRXBKZCCPDXCR-VQTJNVASSA-N 2 1 304.522 4.391 20 0 DIADMP C[N@H+](Cc1ccc2sc3ccccc3c2c1)C[C@@H]1CCC[NH2+]C1 ZINC001235957873 1054869262 /nfs/dbraw/zinc/86/92/62/1054869262.db2.gz VKVACPGRRGEJLX-MRXNPFEDSA-N 2 1 324.493 4.486 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@@H+](C)C[C@H]3CCC[NH2+]C3)c2)cc1 ZINC001235956759 1054870212 /nfs/dbraw/zinc/87/02/12/1054870212.db2.gz HKVIMUQTMTWMTI-IBGZPJMESA-N 2 1 324.468 4.219 20 0 DIADMP Cc1c(C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)cccc1-c1ccccc1 ZINC001235956779 1054870649 /nfs/dbraw/zinc/87/06/49/1054870649.db2.gz HZPAEKGMDVKORX-GOSISDBHSA-N 2 1 308.469 4.093 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2CC2CC3(C2)CC[NH2+]CC3)c1 ZINC001236152491 1054970389 /nfs/dbraw/zinc/97/03/89/1054970389.db2.gz QKTDEIIQEVJPAV-GOSISDBHSA-N 2 1 318.892 4.257 20 0 DIADMP [NH3+]Cc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)cc1 ZINC001236151922 1054971546 /nfs/dbraw/zinc/97/15/46/1054971546.db2.gz KEDBDKAIUXZCSP-GOSISDBHSA-N 2 1 300.833 4.136 20 0 DIADMP CCC[N@@H+](Cc1cc(C(C)C)c(OC)cc1C)C1CC[NH2+]CC1 ZINC001236182457 1054980519 /nfs/dbraw/zinc/98/05/19/1054980519.db2.gz PHFDWQUCYLYEEG-UHFFFAOYSA-N 2 1 318.505 4.091 20 0 DIADMP CCC[N@@H+](Cc1ccc(-c2cccs2)cc1)C1CC[NH2+]CC1 ZINC001236182560 1054981216 /nfs/dbraw/zinc/98/12/16/1054981216.db2.gz RGSFWZQMMIKWQC-UHFFFAOYSA-N 2 1 314.498 4.379 20 0 DIADMP CCC[N@@H+](Cc1ccc(-c2ccc(O)cc2)cc1)C1CC[NH2+]CC1 ZINC001236184365 1054983585 /nfs/dbraw/zinc/98/35/85/1054983585.db2.gz JKQKPYZEWHJZTB-UHFFFAOYSA-N 2 1 324.468 4.023 20 0 DIADMP CCC[N@@H+](Cc1cnc(-c2ccccc2)c(C)c1)C1CC[NH2+]CC1 ZINC001236184325 1054984926 /nfs/dbraw/zinc/98/49/26/1054984926.db2.gz IHANQXNEUANGMD-UHFFFAOYSA-N 2 1 323.484 4.021 20 0 DIADMP c1[nH]c2ccccc2c1[C@H]1CCC[N@@H+]1Cc1cc2c[nH+]ccc2[nH]1 ZINC001236189247 1054988481 /nfs/dbraw/zinc/98/84/81/1054988481.db2.gz CRDRLOLIBQFJHD-HXUWFJFHSA-N 2 1 316.408 4.381 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccc(F)cc1)[C@]1(C)CCC[NH2+]C1 ZINC001236208193 1054999738 /nfs/dbraw/zinc/99/97/38/1054999738.db2.gz STRCMPUGDFSUTO-HXUWFJFHSA-N 2 1 312.432 4.067 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)[C@]1(C)CCC[NH2+]C1 ZINC001236208193 1054999745 /nfs/dbraw/zinc/99/97/45/1054999745.db2.gz STRCMPUGDFSUTO-HXUWFJFHSA-N 2 1 312.432 4.067 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2c(C)cc(OC(C)C)cc2C)CC1 ZINC001236214261 1055000951 /nfs/dbraw/zinc/00/09/51/1055000951.db2.gz AEQURXIKYIDSOR-UHFFFAOYSA-N 2 1 318.505 4.053 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(Cl)ccc2SC)CC1 ZINC001236214464 1055001275 /nfs/dbraw/zinc/00/12/75/1055001275.db2.gz FRRORTZIJANTOR-UHFFFAOYSA-N 2 1 312.910 4.024 20 0 DIADMP CCC(C)(C)c1ccc(C[N@@H+](C)C2CCC([NH2+]C)CC2)cc1 ZINC001236215257 1055001364 /nfs/dbraw/zinc/00/13/64/1055001364.db2.gz MICGMDBVBGGCOG-UHFFFAOYSA-N 2 1 302.506 4.337 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)C2CCC([NH2+]C)CC2)cc1 ZINC001236213351 1055001444 /nfs/dbraw/zinc/00/14/44/1055001444.db2.gz POPWMMSROXIDQH-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC001236215251 1055002048 /nfs/dbraw/zinc/00/20/48/1055002048.db2.gz GDDHFWZQTZDBQZ-WOJBJXKFSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC001236215251 1055002063 /nfs/dbraw/zinc/00/20/63/1055002063.db2.gz GDDHFWZQTZDBQZ-WOJBJXKFSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@H+](Cc1ccc2oc3ccccc3c2c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236214677 1055002122 /nfs/dbraw/zinc/00/21/22/1055002122.db2.gz DNCSBCPFSRQDJS-ROUUACIJSA-N 2 1 308.425 4.288 20 0 DIADMP C[N@@H+](Cc1ccc2oc3ccccc3c2c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236214677 1055002136 /nfs/dbraw/zinc/00/21/36/1055002136.db2.gz DNCSBCPFSRQDJS-ROUUACIJSA-N 2 1 308.425 4.288 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(-c3cccs3)cc2)CC1 ZINC001236215233 1055002296 /nfs/dbraw/zinc/00/22/96/1055002296.db2.gz LTEKCZQUYZUZJQ-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(-c3ccc(C)o3)cc2)CC1 ZINC001236215283 1055002339 /nfs/dbraw/zinc/00/23/39/1055002339.db2.gz NCBUNQOLPWZWBB-UHFFFAOYSA-N 2 1 312.457 4.217 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(-c3ccccc3)s2)CC1 ZINC001236212183 1055002833 /nfs/dbraw/zinc/00/28/33/1055002833.db2.gz GBCNISPYZZDPDZ-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)C[C@@H](C)Cc2ccc(C(C)C)cc2)CC1 ZINC001236213360 1055003334 /nfs/dbraw/zinc/00/33/34/1055003334.db2.gz QDDYGVDTTCLNSI-RPCJCACASA-N 2 1 316.533 4.451 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@H+](C)[C@H]2CCCC[C@H]2[NH3+])c1 ZINC001236215403 1055004152 /nfs/dbraw/zinc/00/41/52/1055004152.db2.gz HVBJAPFINJRSPR-RTWAWAEBSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@@H+](C)[C@H]2CCCC[C@H]2[NH3+])c1 ZINC001236215403 1055004161 /nfs/dbraw/zinc/00/41/61/1055004161.db2.gz HVBJAPFINJRSPR-RTWAWAEBSA-N 2 1 324.468 4.064 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(Cl)cc(Cl)c2F)CC1 ZINC001236215615 1055005671 /nfs/dbraw/zinc/00/56/71/1055005671.db2.gz FGYQIKLGMVFXCJ-UHFFFAOYSA-N 2 1 319.251 4.095 20 0 DIADMP COc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])cc2)cc1 ZINC001236218724 1055008853 /nfs/dbraw/zinc/00/88/53/1055008853.db2.gz SXSZYYZFUMBMQG-LEWJYISDSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CCCC[C@@H]3[NH3+])cc2)cc1 ZINC001236218724 1055008868 /nfs/dbraw/zinc/00/88/68/1055008868.db2.gz SXSZYYZFUMBMQG-LEWJYISDSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236221214 1055012293 /nfs/dbraw/zinc/01/22/93/1055012293.db2.gz CKJYUUBDYMEAKO-MXVIHJGJSA-N 2 1 312.432 4.194 20 0 DIADMP Cc1cc(C[N@H+](C)[C@H]2CC[C@H]([NH3+])CC2)c(Cl)cc1Cl ZINC001236221721 1055012748 /nfs/dbraw/zinc/01/27/48/1055012748.db2.gz DVDPHEKYYAFWOW-JOCQHMNTSA-N 2 1 301.261 4.004 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@@H+](C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236222289 1055013264 /nfs/dbraw/zinc/01/32/64/1055013264.db2.gz HLKLKHJYYDOFJU-WGSAOQKQSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224871 1055013921 /nfs/dbraw/zinc/01/39/21/1055013921.db2.gz XXVNBNZCNVGQQS-IYARVYRRSA-N 2 1 310.441 4.181 20 0 DIADMP C[N@@H+](Cc1ccc(C2CCCCC2)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236225072 1055014525 /nfs/dbraw/zinc/01/45/25/1055014525.db2.gz ZFMXKVHSGFKKJG-MXVIHJGJSA-N 2 1 300.490 4.436 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+](C)[C@H]3CC[C@H]([NH3+])CC3)cn2)c1C ZINC001236224086 1055015089 /nfs/dbraw/zinc/01/50/89/1055015089.db2.gz RJRNDALDXFMOAX-WGSAOQKQSA-N 2 1 323.484 4.067 20 0 DIADMP Cc1csc2sc(C[N@H+](C)[C@H]3CC[C@H]([NH3+])CC3)c(C)c12 ZINC001236224639 1055015657 /nfs/dbraw/zinc/01/56/57/1055015657.db2.gz UIWWGKLCFANVOJ-JOCQHMNTSA-N 2 1 308.516 4.281 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C1(C)CC[NH2+]CC1 ZINC001236227056 1055017306 /nfs/dbraw/zinc/01/73/06/1055017306.db2.gz YRSPCSDEXBCTCI-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP C[N@@H+](Cc1sc(Cl)c2ccccc21)C1(C)CC[NH2+]CC1 ZINC001236228817 1055019333 /nfs/dbraw/zinc/01/93/33/1055019333.db2.gz ZZPLBFSTCXGZEB-UHFFFAOYSA-N 2 1 308.878 4.129 20 0 DIADMP CC[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1ccc(C)c(C)c1 ZINC001236239449 1055027497 /nfs/dbraw/zinc/02/74/97/1055027497.db2.gz FPBXATFKRQGHFI-UHFFFAOYSA-N 2 1 314.498 4.033 20 0 DIADMP c1ccc(C[N@H+](CCCC2CCCC2)C2CC[NH2+]CC2)cc1 ZINC001236285225 1055048458 /nfs/dbraw/zinc/04/84/58/1055048458.db2.gz DCCAATIRUTVDFH-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP [NH3+]CCCCCC[N@H+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC001236303350 1055050180 /nfs/dbraw/zinc/05/01/80/1055050180.db2.gz PCZYLKUQVJSWAN-MRXNPFEDSA-N 2 1 314.395 4.361 20 0 DIADMP c1c2ccccc2oc1C[N@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236299662 1055050233 /nfs/dbraw/zinc/05/02/33/1055050233.db2.gz IBTFOCDWMNKOPK-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP c1c2ccccc2oc1C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236299662 1055050247 /nfs/dbraw/zinc/05/02/47/1055050247.db2.gz IBTFOCDWMNKOPK-UHFFFAOYSA-N 2 1 320.436 4.187 20 0 DIADMP Cc1csc2sc(C[N@@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)c(C)c12 ZINC001236321724 1055056035 /nfs/dbraw/zinc/05/60/35/1055056035.db2.gz LLTKKZNIODKCRF-OKILXGFUSA-N 2 1 320.527 4.011 20 0 DIADMP Clc1ccc(CC[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236370460 1055076348 /nfs/dbraw/zinc/07/63/48/1055076348.db2.gz FYMJEXYWXBMSHP-QGZVFWFLSA-N 2 1 320.908 4.127 20 0 DIADMP CC(C)C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccccn1 ZINC000184500757 1055076725 /nfs/dbraw/zinc/07/67/25/1055076725.db2.gz VZXAOHBUYXSLQX-PKOBYXMFSA-N 2 1 303.494 4.023 20 0 DIADMP CC(C)C[C@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccccn1 ZINC000184500705 1055076812 /nfs/dbraw/zinc/07/68/12/1055076812.db2.gz VZXAOHBUYXSLQX-MJGOQNOKSA-N 2 1 303.494 4.023 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)c1ccc2ccccc2n1)[NH+]1CCCCC1 ZINC000184500509 1055077203 /nfs/dbraw/zinc/07/72/03/1055077203.db2.gz CBMBFGZPQKYHMG-IRXDYDNUSA-N 2 1 311.473 4.150 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cnc2ccsc2c1 ZINC000184513016 1055077404 /nfs/dbraw/zinc/07/74/04/1055077404.db2.gz PSOFOOBKTGYASK-LSDHHAIUSA-N 2 1 317.502 4.211 20 0 DIADMP Fc1ccc(CCC[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001236370383 1055077725 /nfs/dbraw/zinc/07/77/25/1055077725.db2.gz DXDXUETYFHOSBB-SFHVURJKSA-N 2 1 318.480 4.003 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236372879 1055079059 /nfs/dbraw/zinc/07/90/59/1055079059.db2.gz FBYBJOKKCUQQAF-GOSISDBHSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)o1 ZINC001236371234 1055079639 /nfs/dbraw/zinc/07/96/39/1055079639.db2.gz IICZYVFYJONOGK-WMZOPIPTSA-N 2 1 318.505 4.326 20 0 DIADMP Cc1cccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1C ZINC001236373706 1055079788 /nfs/dbraw/zinc/07/97/88/1055079788.db2.gz JODCHULXPNJHON-GOSISDBHSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(Cl)c1 ZINC001236374536 1055081946 /nfs/dbraw/zinc/08/19/46/1055081946.db2.gz DPGVGCAGOCTOLZ-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)cc1C ZINC001236375452 1055083276 /nfs/dbraw/zinc/08/32/76/1055083276.db2.gz XYIHUXDDBGXDEB-IBGZPJMESA-N 2 1 300.490 4.048 20 0 DIADMP c1cc2cccc(C[N@H+](C[C@@H]3CCC[NH2+]C3)C3CCCC3)c2o1 ZINC001236376525 1055083364 /nfs/dbraw/zinc/08/33/64/1055083364.db2.gz SWZLKKWTZBKVDS-MRXNPFEDSA-N 2 1 312.457 4.177 20 0 DIADMP CC(C)CSCCC[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185672805 1055094423 /nfs/dbraw/zinc/09/44/23/1055094423.db2.gz AZDJCKJOBYUJRC-IRXDYDNUSA-N 2 1 312.567 4.008 20 0 DIADMP CCCCCCc1ccc(C[N@@H+](CC)C[C@H]2CC[NH2+]C2)s1 ZINC001236412363 1055101946 /nfs/dbraw/zinc/10/19/46/1055101946.db2.gz SVYWGGSYVUACLF-INIZCTEOSA-N 2 1 308.535 4.302 20 0 DIADMP CC[N@H+](Cc1ccc2sc3ccccc3c2c1)C[C@@H]1CC[NH2+]C1 ZINC001236412520 1055102633 /nfs/dbraw/zinc/10/26/33/1055102633.db2.gz WDWZXHJSANSPRO-MRXNPFEDSA-N 2 1 324.493 4.486 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(-c2cccc(C[NH+](C)C)c2)nc1 ZINC001236420378 1055105441 /nfs/dbraw/zinc/10/54/41/1055105441.db2.gz OVXJTUGCDZAAAF-NRFANRHFSA-N 2 1 323.484 4.357 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2C[C@H]([NH3+])Cc2ccccc2)c1 ZINC001236428941 1055110401 /nfs/dbraw/zinc/11/04/01/1055110401.db2.gz RVRDFKUTJVFTMR-RTWAWAEBSA-N 2 1 308.469 4.010 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2C[C@H]([NH3+])Cc2ccccc2)c1 ZINC001236428941 1055110409 /nfs/dbraw/zinc/11/04/09/1055110409.db2.gz RVRDFKUTJVFTMR-RTWAWAEBSA-N 2 1 308.469 4.010 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC001236428345 1055110929 /nfs/dbraw/zinc/11/09/29/1055110929.db2.gz ITLSJZFADXRDCF-NRFANRHFSA-N 2 1 306.453 4.244 20 0 DIADMP C[C@@H](CC[N@H+](Cc1ccccn1)C1CC[NH2+]CC1)CC(C)(C)C ZINC001236448660 1055119367 /nfs/dbraw/zinc/11/93/67/1055119367.db2.gz WSMZKLPKDYDZPJ-KRWDZBQOSA-N 2 1 317.521 4.098 20 0 DIADMP C[C@@H](CC[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1)CC(C)(C)C ZINC001236448660 1055119374 /nfs/dbraw/zinc/11/93/74/1055119374.db2.gz WSMZKLPKDYDZPJ-KRWDZBQOSA-N 2 1 317.521 4.098 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(C(F)F)cc1)C1CC[NH2+]CC1 ZINC001236456669 1055124834 /nfs/dbraw/zinc/12/48/34/1055124834.db2.gz CZIQAJIPRHYTIY-UHFFFAOYSA-N 2 1 310.432 4.224 20 0 DIADMP Cc1ccc2[nH]c(C[N@@H+](CC(C)(C)C)C3CC[NH2+]CC3)cc2c1 ZINC001236457975 1055124656 /nfs/dbraw/zinc/12/46/56/1055124656.db2.gz PAGSRRKJVMBARU-UHFFFAOYSA-N 2 1 313.489 4.076 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccccc1C(F)F)C1CC[NH2+]CC1 ZINC001236456628 1055124784 /nfs/dbraw/zinc/12/47/84/1055124784.db2.gz APGJZZHXJRKMHD-UHFFFAOYSA-N 2 1 310.432 4.224 20 0 DIADMP Cc1ccc(Cl)cc1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236459562 1055126610 /nfs/dbraw/zinc/12/66/10/1055126610.db2.gz VAMCGOPZNOIURO-UHFFFAOYSA-N 2 1 308.897 4.249 20 0 DIADMP CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380927934 1055136376 /nfs/dbraw/zinc/13/63/76/1055136376.db2.gz DJDQQLYYGKXKDI-AQNXPRMDSA-N 2 1 300.490 4.067 20 0 DIADMP CC/C=C\CCC[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236481398 1055138638 /nfs/dbraw/zinc/13/86/38/1055138638.db2.gz VXDHZMMTMNGNOT-PLNGDYQASA-N 2 1 318.480 4.435 20 0 DIADMP CC/C=C\CC[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001236480914 1055139007 /nfs/dbraw/zinc/13/90/07/1055139007.db2.gz LFJICTVDVPMDPT-PLNGDYQASA-N 2 1 304.453 4.044 20 0 DIADMP CCCCCC[N@@H+](Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001236517634 1055158382 /nfs/dbraw/zinc/15/83/82/1055158382.db2.gz MTBWUEXWAJARLJ-UHFFFAOYSA-N 2 1 306.469 4.268 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccs2)Cc2ccccc2F)CC1 ZINC001236534240 1055165015 /nfs/dbraw/zinc/16/50/15/1055165015.db2.gz SVBRRMQKZAQALP-WKILWMFISA-N 2 1 318.461 4.159 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3cc[nH]c32)CC2CCC2)CC1 ZINC001236541740 1055170705 /nfs/dbraw/zinc/17/07/05/1055170705.db2.gz SHTIPYXGAXWJBC-WGSAOQKQSA-N 2 1 311.473 4.040 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236540498 1055171256 /nfs/dbraw/zinc/17/12/56/1055171256.db2.gz FHIXLEIEFJNSIR-GSEOLPGOSA-N 2 1 304.522 4.351 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236543325 1055172285 /nfs/dbraw/zinc/17/22/85/1055172285.db2.gz PEZWTQGKOSPXBL-BHIYHBOVSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236542928 1055172564 /nfs/dbraw/zinc/17/25/64/1055172564.db2.gz XONYKKRNINVEHZ-WGSAOQKQSA-N 2 1 304.453 4.006 20 0 DIADMP Cc1ccc2nc(C[N@@H+](CC3CC3)[C@H]3CC[C@H]([NH3+])CC3)ccc2c1 ZINC001236550631 1055177417 /nfs/dbraw/zinc/17/74/17/1055177417.db2.gz FWKMUGSHIMZJOP-KESTWPANSA-N 2 1 323.484 4.025 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(C(F)(F)F)o1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550230 1055177480 /nfs/dbraw/zinc/17/74/80/1055177480.db2.gz AOJVLWWPVISTGY-JOCQHMNTSA-N 2 1 318.383 4.026 20 0 DIADMP COc1ccc(Cl)c(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236550717 1055177589 /nfs/dbraw/zinc/17/75/89/1055177589.db2.gz MDDBDUCTHPLFTE-WKILWMFISA-N 2 1 324.896 4.077 20 0 DIADMP CC(C)c1ccc(CC[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236550155 1055177823 /nfs/dbraw/zinc/17/78/23/1055177823.db2.gz FAPBLHTYSFBCOR-MEMLXQNLSA-N 2 1 314.517 4.334 20 0 DIADMP CC(C)C[N@@H+](Cc1c[nH]c2c1cccc2F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550215 1055177944 /nfs/dbraw/zinc/17/79/44/1055177944.db2.gz IUMORKBVGWIVTE-WKILWMFISA-N 2 1 317.452 4.035 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1C(F)F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550286 1055177961 /nfs/dbraw/zinc/17/79/61/1055177961.db2.gz KOXHGOGVRPSPMA-WKILWMFISA-N 2 1 310.432 4.352 20 0 DIADMP Cc1ccc(Cl)cc1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550411 1055178210 /nfs/dbraw/zinc/17/82/10/1055178210.db2.gz IGPJHXYWNGAWTB-IYARVYRRSA-N 2 1 306.881 4.130 20 0 DIADMP CSc1ccccc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552587 1055179565 /nfs/dbraw/zinc/17/95/65/1055179565.db2.gz SLICAUBWTQMZGD-QAQDUYKDSA-N 2 1 306.519 4.136 20 0 DIADMP COc1c(Cl)cccc1C[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551876 1055179907 /nfs/dbraw/zinc/17/99/07/1055179907.db2.gz NCNJUEHHPODQIW-WKILWMFISA-N 2 1 324.896 4.077 20 0 DIADMP Cc1c(F)ccc(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236551827 1055180281 /nfs/dbraw/zinc/18/02/81/1055180281.db2.gz LUJFFLLJJSOGMY-WKILWMFISA-N 2 1 310.432 4.001 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCCCc2ccccc2)CC2CC2)CC1 ZINC001236552505 1055180420 /nfs/dbraw/zinc/18/04/20/1055180420.db2.gz REWJXQHTRLGBKJ-MEMLXQNLSA-N 2 1 314.517 4.381 20 0 DIADMP Cc1c(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc(F)c1F ZINC001236554566 1055181237 /nfs/dbraw/zinc/18/12/37/1055181237.db2.gz LCKBZIIEACVYHX-WKILWMFISA-N 2 1 310.432 4.001 20 0 DIADMP CSc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236553183 1055181431 /nfs/dbraw/zinc/18/14/31/1055181431.db2.gz XUAHGWLJQAOUNQ-HDJSIYSDSA-N 2 1 312.548 4.198 20 0 DIADMP CC(C)C[N@@H+](Cc1cc(F)cc2cc[nH]c21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554683 1055181753 /nfs/dbraw/zinc/18/17/53/1055181753.db2.gz QERACCLURHXBEW-IYARVYRRSA-N 2 1 317.452 4.035 20 0 DIADMP C[C@@H](CC[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1)CC(C)(C)C ZINC001236554439 1055182496 /nfs/dbraw/zinc/18/24/96/1055182496.db2.gz ZZPKNWFDYUFBBG-BZSNNMDCSA-N 2 1 324.553 4.200 20 0 DIADMP Cc1ccccc1C[N@@H+](Cc1ccsc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236555175 1055184677 /nfs/dbraw/zinc/18/46/77/1055184677.db2.gz FMRCAMDQUIIHIG-WGSAOQKQSA-N 2 1 314.498 4.329 20 0 DIADMP CCc1ccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236565708 1055185345 /nfs/dbraw/zinc/18/53/45/1055185345.db2.gz NQNOHZKHUYAUDI-JCNLHEQBSA-N 2 1 304.478 4.247 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2c(F)cccc2F)C2CCCCC2)CC1 ZINC001236565448 1055186188 /nfs/dbraw/zinc/18/61/88/1055186188.db2.gz GRDOSIQCAGQCJB-KOMQPUFPSA-N 2 1 322.443 4.369 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3occc3c2)C2CCCC2)CC1 ZINC001236566487 1055186538 /nfs/dbraw/zinc/18/65/38/1055186538.db2.gz IYXZIXNXKJSQPW-UAPYVXQJSA-N 2 1 312.457 4.447 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(O)cc(Cl)c2)C2CCCC2)CC1 ZINC001236570751 1055191322 /nfs/dbraw/zinc/19/13/22/1055191322.db2.gz ASCFXXMFHIOXHJ-JCNLHEQBSA-N 2 1 322.880 4.060 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001236571175 1055191897 /nfs/dbraw/zinc/19/18/97/1055191897.db2.gz ANNBGDSRJIVUMG-CTYIDZIISA-N 2 1 324.871 4.412 20 0 DIADMP C[C@H]([NH2+]C1CCCCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381945452 1055193175 /nfs/dbraw/zinc/19/31/75/1055193175.db2.gz YXIYNDNPVYXKBT-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1c(F)cc(F)cc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236571957 1055193948 /nfs/dbraw/zinc/19/39/48/1055193948.db2.gz NYEOSAWTCZYLPE-SAABIXHNSA-N 2 1 322.443 4.288 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCCc2ccc(Cl)cc2)C2CCC2)CC1 ZINC001236573242 1055195185 /nfs/dbraw/zinc/19/51/85/1055195185.db2.gz ZWVPNJAYJBLAJA-UAPYVXQJSA-N 2 1 320.908 4.397 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236576318 1055197040 /nfs/dbraw/zinc/19/70/40/1055197040.db2.gz IXRJSLDCOKRDSC-JCNLHEQBSA-N 2 1 306.881 4.273 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(O)cc3ccccc32)C2CCC2)CC1 ZINC001236577656 1055197695 /nfs/dbraw/zinc/19/76/95/1055197695.db2.gz XBTUPAPSCXRDSG-UAPYVXQJSA-N 2 1 324.468 4.170 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236603871 1055203209 /nfs/dbraw/zinc/20/32/09/1055203209.db2.gz CQOUVJRSZIRRFE-IBGZPJMESA-N 2 1 314.860 4.178 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236616895 1055205554 /nfs/dbraw/zinc/20/55/54/1055205554.db2.gz RQZAHGYDZOBLLL-IBGZPJMESA-N 2 1 314.860 4.178 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001236616895 1055205565 /nfs/dbraw/zinc/20/55/65/1055205565.db2.gz RQZAHGYDZOBLLL-IBGZPJMESA-N 2 1 314.860 4.178 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)c(C)c1C ZINC001236636807 1055208124 /nfs/dbraw/zinc/20/81/24/1055208124.db2.gz JFECAYAUZNRODZ-UHFFFAOYSA-N 2 1 314.517 4.335 20 0 DIADMP COc1ccccc1C[N@@H+](CCC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236701438 1055230998 /nfs/dbraw/zinc/23/09/98/1055230998.db2.gz SZZQKWZTHGIBPK-IYARVYRRSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1cc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)cs1 ZINC001236699448 1055232474 /nfs/dbraw/zinc/23/24/74/1055232474.db2.gz ADJKNQLWBOWNSE-WGSAOQKQSA-N 2 1 314.498 4.329 20 0 DIADMP CC(C)(C)CC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236741756 1055246977 /nfs/dbraw/zinc/24/69/77/1055246977.db2.gz JNJCTWSVLSJBHV-IYARVYRRSA-N 2 1 306.469 4.334 20 0 DIADMP CCCCCC[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236741621 1055248074 /nfs/dbraw/zinc/24/80/74/1055248074.db2.gz FXPIRLBXBOSBEC-WGSAOQKQSA-N 2 1 306.469 4.478 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767806 1055250450 /nfs/dbraw/zinc/25/04/50/1055250450.db2.gz KECFLWRNEJAZDQ-WKILWMFISA-N 2 1 308.897 4.458 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236766710 1055250959 /nfs/dbraw/zinc/25/09/59/1055250959.db2.gz BSYWHIRJSZFKFH-WGSAOQKQSA-N 2 1 302.506 4.421 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccsc2)CC2CCCCC2)CC1 ZINC001236753852 1055252317 /nfs/dbraw/zinc/25/23/17/1055252317.db2.gz ACBHYJFGAFLIBV-IYARVYRRSA-N 2 1 306.519 4.400 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccs2)CC2CCCCC2)CC1 ZINC001236755206 1055252571 /nfs/dbraw/zinc/25/25/71/1055252571.db2.gz LXWZDEWXPVINAT-QAQDUYKDSA-N 2 1 306.519 4.400 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236768694 1055253918 /nfs/dbraw/zinc/25/39/18/1055253918.db2.gz OGSURSJKJXWNBG-WGSAOQKQSA-N 2 1 302.506 4.421 20 0 DIADMP CCc1cccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236779863 1055254044 /nfs/dbraw/zinc/25/40/44/1055254044.db2.gz LMDXCVLIEJHPHC-WGSAOQKQSA-N 2 1 302.506 4.367 20 0 DIADMP CCC(CC)[N@@H+](Cc1cccc(N(C)C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781228 1055255360 /nfs/dbraw/zinc/25/53/60/1055255360.db2.gz DBOFWRSMLYSUMA-UAPYVXQJSA-N 2 1 317.521 4.013 20 0 DIADMP Cc1cc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)ccc1F ZINC001236767888 1055256297 /nfs/dbraw/zinc/25/62/97/1055256297.db2.gz PUFPNPYDHVBOBP-QAQDUYKDSA-N 2 1 306.469 4.252 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)ccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783016 1055257840 /nfs/dbraw/zinc/25/78/40/1055257840.db2.gz XIFAERUKDNGXHM-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(F)cc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783668 1055258076 /nfs/dbraw/zinc/25/80/76/1055258076.db2.gz WWXLPPOSHNUJQZ-SAABIXHNSA-N 2 1 310.432 4.225 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(F)ccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781903 1055258691 /nfs/dbraw/zinc/25/86/91/1055258691.db2.gz AWPXBAUVZPVBLD-JCNLHEQBSA-N 2 1 310.432 4.225 20 0 DIADMP CCC(CC)[N@@H+](Cc1cc(C)cc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236791435 1055263528 /nfs/dbraw/zinc/26/35/28/1055263528.db2.gz UAUVLAFFSDHKJZ-UAPYVXQJSA-N 2 1 306.469 4.395 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+](C)CCC[NH+](C)C)c1 ZINC001236824813 1055275873 /nfs/dbraw/zinc/27/58/73/1055275873.db2.gz WBWPNOJPXLTMCF-UHFFFAOYSA-N 2 1 310.485 4.354 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+](C)CCC[NH+](C)C)c1 ZINC001236824813 1055275889 /nfs/dbraw/zinc/27/58/89/1055275889.db2.gz WBWPNOJPXLTMCF-UHFFFAOYSA-N 2 1 310.485 4.354 20 0 DIADMP CCCCCCc1csc(C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1 ZINC001236826992 1055280758 /nfs/dbraw/zinc/28/07/58/1055280758.db2.gz DNPXZOZCUDGQDQ-RYQLBKOJSA-N 2 1 306.519 4.040 20 0 DIADMP C[C@@H]1C[C@@H]1c1ccc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000383482381 1055281159 /nfs/dbraw/zinc/28/11/59/1055281159.db2.gz SQYUZFGHPIYEQI-POAQFYNOSA-N 2 1 324.468 4.015 20 0 DIADMP CCC[N@H+](Cc1cccc2c3ccccc3oc21)C[C@H]1CC[NH2+]C1 ZINC001236833410 1055283057 /nfs/dbraw/zinc/28/30/57/1055283057.db2.gz ASQMGGOESQMCSO-INIZCTEOSA-N 2 1 322.452 4.408 20 0 DIADMP CCC[N@@H+](C[C@H](C)c1cccc2ccccc21)C[C@H]1CC[NH2+]C1 ZINC001236832305 1055284352 /nfs/dbraw/zinc/28/43/52/1055284352.db2.gz UEKSPROTILDXRL-ROUUACIJSA-N 2 1 310.485 4.265 20 0 DIADMP CCC[N@H+](Cc1cccc(Oc2ccccc2)c1)C[C@H]1CC[NH2+]C1 ZINC001236835652 1055285219 /nfs/dbraw/zinc/28/52/19/1055285219.db2.gz OOJQSPMSMJGTMG-IBGZPJMESA-N 2 1 324.468 4.300 20 0 DIADMP CCC[N@H+](Cc1cccc(-c2ccccc2)c1)C[C@H]1CC[NH2+]C1 ZINC001236843044 1055288319 /nfs/dbraw/zinc/28/83/19/1055288319.db2.gz KTDQZOJOKGXBCU-IBGZPJMESA-N 2 1 308.469 4.175 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(F)c3ccoc32)CC1 ZINC001236893728 1055305161 /nfs/dbraw/zinc/30/51/61/1055305161.db2.gz CCKZRRJAZOPBKG-UHFFFAOYSA-N 2 1 318.436 4.268 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236907004 1055309853 /nfs/dbraw/zinc/30/98/53/1055309853.db2.gz YWRFJZSPEDOWNW-CQSZACIVSA-N 2 1 303.837 4.290 20 0 DIADMP Clc1cc(C[N@H+]2CCC23CCCCC3)ccc1-n1ccnc1 ZINC001236906643 1055313774 /nfs/dbraw/zinc/31/37/74/1055313774.db2.gz LOZMIBOCMXHZSB-UHFFFAOYSA-N 2 1 315.848 4.434 20 0 DIADMP [NH3+]CCCCC[N@H+]1CCSC[C@H]1c1cccc2ccccc21 ZINC001237001650 1055334585 /nfs/dbraw/zinc/33/45/85/1055334585.db2.gz ZXDCQOPXPZGHRP-IBGZPJMESA-N 2 1 314.498 4.059 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(F)cc3)cc2)C1 ZINC001237059229 1055353227 /nfs/dbraw/zinc/35/32/27/1055353227.db2.gz RVTGXNFEAKDCOY-HXUWFJFHSA-N 2 1 312.432 4.054 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@](C)(C[NH3+])C3)cc2)cc1 ZINC001237058643 1055353532 /nfs/dbraw/zinc/35/35/32/1055353532.db2.gz QREVDBLFNYLPIG-NRFANRHFSA-N 2 1 308.469 4.223 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@](C)(C[NH3+])C2)cc1 ZINC001237057845 1055354354 /nfs/dbraw/zinc/35/43/54/1055354354.db2.gz NUNXBEGMUIKUKV-YLJYHZDGSA-N 2 1 302.506 4.049 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+]1CCC[C@@](C)(C[NH3+])C1 ZINC001237059381 1055359210 /nfs/dbraw/zinc/35/92/10/1055359210.db2.gz UBGISHIQUXHLSB-FQEVSTJZSA-N 2 1 318.505 4.207 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@@](C)(C[NH3+])C1 ZINC001237059381 1055359225 /nfs/dbraw/zinc/35/92/25/1055359225.db2.gz UBGISHIQUXHLSB-FQEVSTJZSA-N 2 1 318.505 4.207 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(c1ccccc1)c1ccccc1 ZINC001237080576 1055365119 /nfs/dbraw/zinc/36/51/19/1055365119.db2.gz GPRUJVXQOMDSRC-PRJVBOEPSA-N 2 1 320.480 4.020 20 0 DIADMP c1ccc2c(c1)ccnc2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000765401744 1055379308 /nfs/dbraw/zinc/37/93/08/1055379308.db2.gz CAHFNRJAKYQGEU-UHFFFAOYSA-N 2 1 323.484 4.122 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+](C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237153058 1055386022 /nfs/dbraw/zinc/38/60/22/1055386022.db2.gz CBGSYVSVLJYFQM-INIZCTEOSA-N 2 1 314.498 4.316 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+](C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237153058 1055386032 /nfs/dbraw/zinc/38/60/32/1055386032.db2.gz CBGSYVSVLJYFQM-INIZCTEOSA-N 2 1 314.498 4.316 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@H](C)c2cc3ccccc3o2)CC1 ZINC000386080403 1055413655 /nfs/dbraw/zinc/41/36/55/1055413655.db2.gz DDEKLMAZEPWDNV-OAHLLOKOSA-N 2 1 300.446 4.348 20 0 DIADMP Cc1cc(C)c(C[N@@H+]2Cc3ccccc3C23CC[NH2+]CC3)c(C)c1 ZINC001237304299 1055423549 /nfs/dbraw/zinc/42/35/49/1055423549.db2.gz GOZSUKLTQHJZNC-UHFFFAOYSA-N 2 1 320.480 4.206 20 0 DIADMP Cc1cc(C)c(C[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)c(C)c1 ZINC001237304299 1055423561 /nfs/dbraw/zinc/42/35/61/1055423561.db2.gz GOZSUKLTQHJZNC-UHFFFAOYSA-N 2 1 320.480 4.206 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237388183 1055444275 /nfs/dbraw/zinc/44/42/75/1055444275.db2.gz CMFUIFCNOVLZDV-FXAWDEMLSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237388183 1055444279 /nfs/dbraw/zinc/44/42/79/1055444279.db2.gz CMFUIFCNOVLZDV-FXAWDEMLSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)c2)cc1 ZINC001237380191 1055445079 /nfs/dbraw/zinc/44/50/79/1055445079.db2.gz FYHHBLALAFFNMI-GHTZIAJQSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CC[C@H]4[NH2+]CCC[C@H]4C3)c2)cc1 ZINC001237380191 1055445094 /nfs/dbraw/zinc/44/50/94/1055445094.db2.gz FYHHBLALAFFNMI-GHTZIAJQSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237388194 1055445673 /nfs/dbraw/zinc/44/56/73/1055445673.db2.gz CMFUIFCNOVLZDV-YLJYHZDGSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)cc1 ZINC001237388194 1055445686 /nfs/dbraw/zinc/44/56/86/1055445686.db2.gz CMFUIFCNOVLZDV-YLJYHZDGSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2cccc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)c2)cc1 ZINC001237380199 1055446160 /nfs/dbraw/zinc/44/61/60/1055446160.db2.gz FYHHBLALAFFNMI-RXVVDRJESA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2cccc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)c2)cc1 ZINC001237380199 1055446166 /nfs/dbraw/zinc/44/61/66/1055446166.db2.gz FYHHBLALAFFNMI-RXVVDRJESA-N 2 1 322.452 4.053 20 0 DIADMP Fc1ccc(C[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1-c1ccccc1 ZINC001237411008 1055449636 /nfs/dbraw/zinc/44/96/36/1055449636.db2.gz FGSWSOOGTIMRNF-GHTZIAJQSA-N 2 1 324.443 4.067 20 0 DIADMP Fc1ccc(C[N@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)cc1-c1ccccc1 ZINC001237411008 1055449643 /nfs/dbraw/zinc/44/96/43/1055449643.db2.gz FGSWSOOGTIMRNF-GHTZIAJQSA-N 2 1 324.443 4.067 20 0 DIADMP CC(C)c1cccc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)c1 ZINC001237460662 1055456204 /nfs/dbraw/zinc/45/62/04/1055456204.db2.gz UXNJHOMRPAOSFH-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP C[N@@H+]1CCC[C@@]2(CCC[NH+](CCCc3ccccc3Cl)C2)C1 ZINC001278135422 1055511877 /nfs/dbraw/zinc/51/18/77/1055511877.db2.gz RVVJXJLXPOAXHK-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+]1CCC[C@@]2(CCC[NH+](CCCc3ccccc3Cl)C2)C1 ZINC001278135422 1055511889 /nfs/dbraw/zinc/51/18/89/1055511889.db2.gz RVVJXJLXPOAXHK-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CCC[N@H+](CCCc3ccccc3Cl)C2)C1 ZINC001278135422 1055511899 /nfs/dbraw/zinc/51/18/99/1055511899.db2.gz RVVJXJLXPOAXHK-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CCC[N@@H+](CCCc3ccccc3Cl)C2)C1 ZINC001278135422 1055511908 /nfs/dbraw/zinc/51/19/08/1055511908.db2.gz RVVJXJLXPOAXHK-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+]1CCCC2(CC[NH+](CCCc3ccccc3Cl)CC2)C1 ZINC001278135820 1055513081 /nfs/dbraw/zinc/51/30/81/1055513081.db2.gz YONKMPFFVVFRSB-UHFFFAOYSA-N 2 1 320.908 4.080 20 0 DIADMP Fc1ccc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1Cl ZINC001620890248 1055515942 /nfs/dbraw/zinc/51/59/42/1055515942.db2.gz DRINFMHRVLHCSA-UHFFFAOYSA-N 2 1 324.871 4.223 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(C(F)(F)F)cc1)[NH+]1CCCCC1 ZINC001620898071 1055523471 /nfs/dbraw/zinc/52/34/71/1055523471.db2.gz GXUCVLDQJQRFSY-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1 ZINC001620924805 1055544876 /nfs/dbraw/zinc/54/48/76/1055544876.db2.gz NGGKGPRUHFGFJR-HOJAQTOUSA-N 2 1 302.506 4.423 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CCc4ccsc4C3)cc21 ZINC001237877612 1055549139 /nfs/dbraw/zinc/54/91/39/1055549139.db2.gz AVCOTTSKQYZANR-UHFFFAOYSA-N 2 1 324.493 4.308 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCc4ccsc4C3)cc21 ZINC001237877612 1055549150 /nfs/dbraw/zinc/54/91/50/1055549150.db2.gz AVCOTTSKQYZANR-UHFFFAOYSA-N 2 1 324.493 4.308 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+](C)Cc3cccc(F)c3)cc21 ZINC001237881013 1055549352 /nfs/dbraw/zinc/54/93/52/1055549352.db2.gz MVGBRAPCKOLRTL-UHFFFAOYSA-N 2 1 324.443 4.459 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC[C@H](C(F)F)C3)cc21 ZINC001237886629 1055551214 /nfs/dbraw/zinc/55/12/14/1055551214.db2.gz PIEYMYAEKLHJOH-INIZCTEOSA-N 2 1 320.427 4.165 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCC2(C1)CC[NH+](CCCOC)CC2 ZINC001278208524 1055629138 /nfs/dbraw/zinc/62/91/38/1055629138.db2.gz XSZVEQRSNVOHDR-IBGZPJMESA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCCOC)C2 ZINC001278208095 1055629320 /nfs/dbraw/zinc/62/93/20/1055629320.db2.gz SOIUTCZBHCANTG-PMACEKPBSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCCOC)C2 ZINC001278208095 1055629331 /nfs/dbraw/zinc/62/93/31/1055629331.db2.gz SOIUTCZBHCANTG-PMACEKPBSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC[C@@]2(C1)CCC[N@H+](CCCOC)C2 ZINC001278208096 1055630146 /nfs/dbraw/zinc/63/01/46/1055630146.db2.gz SOIUTCZBHCANTG-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CC[C@@]2(C1)CCC[N@@H+](CCCOC)C2 ZINC001278208096 1055630150 /nfs/dbraw/zinc/63/01/50/1055630150.db2.gz SOIUTCZBHCANTG-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1 ZINC001238555719 1055686338 /nfs/dbraw/zinc/68/63/38/1055686338.db2.gz CRPDMYCQPSAZIE-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCC[C@]2(CCC[NH+](CCOC)C2)C1 ZINC001278273473 1055737382 /nfs/dbraw/zinc/73/73/82/1055737382.db2.gz XOMCWZWDWWHDND-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCC[C@]2(CCC[N@H+](CCOC)C2)C1 ZINC001278273473 1055737396 /nfs/dbraw/zinc/73/73/96/1055737396.db2.gz XOMCWZWDWWHDND-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCC[C@]2(CCC[N@@H+](CCOC)C2)C1 ZINC001278273473 1055737400 /nfs/dbraw/zinc/73/74/00/1055737400.db2.gz XOMCWZWDWWHDND-UXHICEINSA-N 2 1 324.553 4.027 20 0 DIADMP C[C@@H](C[NH2+]CC(C)(C)C[N@@H+](C)Cc1ccccc1)CC(F)F ZINC001620982846 1055933085 /nfs/dbraw/zinc/93/30/85/1055933085.db2.gz HYKIXLBIZYHQJV-OAHLLOKOSA-N 2 1 312.448 4.026 20 0 DIADMP C[C@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001620746667 1055991307 /nfs/dbraw/zinc/99/13/07/1055991307.db2.gz WDPDNEHBCPBXAB-IVMQYODDSA-N 2 1 306.538 4.445 20 0 DIADMP C[C@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001620746667 1055991319 /nfs/dbraw/zinc/99/13/19/1055991319.db2.gz WDPDNEHBCPBXAB-IVMQYODDSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccc(Cl)o1 ZINC000067668377 1055995067 /nfs/dbraw/zinc/99/50/67/1055995067.db2.gz JUCHYIPZKCEEHE-UHFFFAOYSA-N 2 1 306.837 4.063 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccc(Cl)o1 ZINC000067668377 1055995076 /nfs/dbraw/zinc/99/50/76/1055995076.db2.gz JUCHYIPZKCEEHE-UHFFFAOYSA-N 2 1 306.837 4.063 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1N[C@H]1CCCC[C@@H]1[NH+](C)C ZINC001168602338 1056019740 /nfs/dbraw/zinc/01/97/40/1056019740.db2.gz MJSXKWKVGBLLRS-PMACEKPBSA-N 2 1 315.505 4.270 20 0 DIADMP CC[N@H+]1CCc2cc(-c3ccc(C[NH+]4CCCC4)cc3)ccc2C1 ZINC001240058280 1056291144 /nfs/dbraw/zinc/29/11/44/1056291144.db2.gz FAHLRMGIJHOIGX-UHFFFAOYSA-N 2 1 320.480 4.327 20 0 DIADMP CCOC(=[NH2+])c1cccc(-c2ccc(C[NH+]3CCCC3)cc2)c1 ZINC001240059359 1056294585 /nfs/dbraw/zinc/29/45/85/1056294585.db2.gz SFNTZWPFHRYJOY-UHFFFAOYSA-N 2 1 308.425 4.311 20 0 DIADMP CCN1CCC([N@@H+](C)Cc2cccc(-c3ccccc3)c2)CC1 ZINC000506689432 1056343870 /nfs/dbraw/zinc/34/38/70/1056343870.db2.gz LBWBPLXRQJLRGM-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2cccc(-c3ccccc3)c2)CC1 ZINC000506689432 1056343898 /nfs/dbraw/zinc/34/38/98/1056343898.db2.gz LBWBPLXRQJLRGM-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP COC(=[NH2+])c1cccc(-c2cccc(C[NH+]3CCCCC3)c2)c1 ZINC001240173727 1056361667 /nfs/dbraw/zinc/36/16/67/1056361667.db2.gz FFWWVTBQBFNLOV-UHFFFAOYSA-N 2 1 308.425 4.311 20 0 DIADMP C[N@H+]1CCc2ccc(-c3cccc(C[NH+]4CCCCC4)c3)cc2C1 ZINC001240174614 1056364181 /nfs/dbraw/zinc/36/41/81/1056364181.db2.gz ZIPCMDFWMJLANA-UHFFFAOYSA-N 2 1 320.480 4.327 20 0 DIADMP C[NH+](C)Cc1ccccc1C1=CCC[N@@H+](Cc2ccccc2)C1 ZINC001240386888 1056468395 /nfs/dbraw/zinc/46/83/95/1056468395.db2.gz HXRCJVOPRNTUSP-UHFFFAOYSA-N 2 1 306.453 4.038 20 0 DIADMP C[NH+](C)Cc1ccc(C2=CCC[N@@H+](Cc3ccccc3)C2)cc1F ZINC001240388912 1056472030 /nfs/dbraw/zinc/47/20/30/1056472030.db2.gz OZUAPKUNINNFTL-UHFFFAOYSA-N 2 1 324.443 4.177 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](Cc1ccccc1)C1CCCCC1 ZINC001615230121 1056479534 /nfs/dbraw/zinc/47/95/34/1056479534.db2.gz SULFLOKACMPFFP-LJQANCHMSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](Cc1ccccc1)C1CCCCC1 ZINC001615230121 1056479536 /nfs/dbraw/zinc/47/95/36/1056479536.db2.gz SULFLOKACMPFFP-LJQANCHMSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](Cc1ccccc1)C1CCCCC1 ZINC001615230121 1056479540 /nfs/dbraw/zinc/47/95/40/1056479540.db2.gz SULFLOKACMPFFP-LJQANCHMSA-N 2 1 300.490 4.306 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](Cc1ccccc1)C1CCCCC1 ZINC001615230119 1056480286 /nfs/dbraw/zinc/48/02/86/1056480286.db2.gz SULFLOKACMPFFP-IBGZPJMESA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](Cc1ccccc1)C1CCCCC1 ZINC001615230119 1056480293 /nfs/dbraw/zinc/48/02/93/1056480293.db2.gz SULFLOKACMPFFP-IBGZPJMESA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](Cc1ccccc1)C1CCCCC1 ZINC001615230119 1056480298 /nfs/dbraw/zinc/48/02/98/1056480298.db2.gz SULFLOKACMPFFP-IBGZPJMESA-N 2 1 300.490 4.306 20 0 DIADMP CCC[N@@H+](CCC[NH+]1CCCCC1)[C@H]1CCc2ccccc2C1 ZINC001615255727 1056484701 /nfs/dbraw/zinc/48/47/01/1056484701.db2.gz HZJVOGHOXWWFGN-NRFANRHFSA-N 2 1 314.517 4.132 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC[C@H]1c1cccc2ccccc21 ZINC001615252272 1056484798 /nfs/dbraw/zinc/48/47/98/1056484798.db2.gz XRTPIEZEUMIMCG-RXVVDRJESA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC001615252272 1056484801 /nfs/dbraw/zinc/48/48/01/1056484801.db2.gz XRTPIEZEUMIMCG-RXVVDRJESA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC001615252272 1056484802 /nfs/dbraw/zinc/48/48/02/1056484802.db2.gz XRTPIEZEUMIMCG-RXVVDRJESA-N 2 1 308.469 4.461 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)CCC[NH+]1CCCCC1 ZINC001615510492 1056523255 /nfs/dbraw/zinc/52/32/55/1056523255.db2.gz TVSNFIWBLYHNFD-INIZCTEOSA-N 2 1 308.897 4.079 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2CC(C)C)[C@H](C)C1 ZINC001615896642 1056593102 /nfs/dbraw/zinc/59/31/02/1056593102.db2.gz YZEJGEMLSDCJND-YLJYHZDGSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2CC(C)C)[C@H](C)C1 ZINC001615896642 1056593119 /nfs/dbraw/zinc/59/31/19/1056593119.db2.gz YZEJGEMLSDCJND-YLJYHZDGSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2CC(C)C)[C@H](C)C1 ZINC001615896642 1056593122 /nfs/dbraw/zinc/59/31/22/1056593122.db2.gz YZEJGEMLSDCJND-YLJYHZDGSA-N 2 1 302.506 4.047 20 0 DIADMP CC[C@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Cl)s1 ZINC001617089166 1056773579 /nfs/dbraw/zinc/77/35/79/1056773579.db2.gz SCMFBTFZFXEVFD-ZDUSSCGKSA-N 2 1 300.899 4.318 20 0 DIADMP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC001617104849 1056776859 /nfs/dbraw/zinc/77/68/59/1056776859.db2.gz ZIJJNDJIWZEFTL-PKOBYXMFSA-N 2 1 300.490 4.046 20 0 DIADMP Cc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)c1 ZINC001617104848 1056777030 /nfs/dbraw/zinc/77/70/30/1056777030.db2.gz ZIJJNDJIWZEFTL-MJGOQNOKSA-N 2 1 300.490 4.046 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+]([C@H](C)c2cc(C)c(OC)cc2C)C1 ZINC000682076047 1056887346 /nfs/dbraw/zinc/88/73/46/1056887346.db2.gz SOYZUPSFKDHYIW-MSOLQXFVSA-N 2 1 318.505 4.037 20 0 DIADMP CCC(C)(C)c1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC001617868590 1056892708 /nfs/dbraw/zinc/89/27/08/1056892708.db2.gz SFPOSYKVRQMSMA-YOFSQIOKSA-N 2 1 314.517 4.431 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC001617868590 1056892716 /nfs/dbraw/zinc/89/27/16/1056892716.db2.gz SFPOSYKVRQMSMA-YOFSQIOKSA-N 2 1 314.517 4.431 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC001617868590 1056892721 /nfs/dbraw/zinc/89/27/21/1056892721.db2.gz SFPOSYKVRQMSMA-YOFSQIOKSA-N 2 1 314.517 4.431 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+]([C@@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868198 1056893026 /nfs/dbraw/zinc/89/30/26/1056893026.db2.gz MMWCDZVJTWYFNO-YADHBBJMSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+]([C@@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868198 1056893031 /nfs/dbraw/zinc/89/30/31/1056893031.db2.gz MMWCDZVJTWYFNO-YADHBBJMSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+]([C@@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868198 1056893038 /nfs/dbraw/zinc/89/30/38/1056893038.db2.gz MMWCDZVJTWYFNO-YADHBBJMSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+]([C@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868197 1056893672 /nfs/dbraw/zinc/89/36/72/1056893672.db2.gz MMWCDZVJTWYFNO-VXKWHMMOSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+]([C@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868197 1056893678 /nfs/dbraw/zinc/89/36/78/1056893678.db2.gz MMWCDZVJTWYFNO-VXKWHMMOSA-N 2 1 324.512 4.473 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+]([C@H]4C=CCCCCC4)C3)C2)cc1 ZINC001617868197 1056893686 /nfs/dbraw/zinc/89/36/86/1056893686.db2.gz MMWCDZVJTWYFNO-VXKWHMMOSA-N 2 1 324.512 4.473 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc2ccncc2s1 ZINC000657310332 1056929393 /nfs/dbraw/zinc/92/93/93/1056929393.db2.gz BXVTWYQQCAEJKB-HNNXBMFYSA-N 2 1 317.502 4.041 20 0 DIADMP C[NH+](C)Cc1cccc(C2=CC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001241503981 1057072858 /nfs/dbraw/zinc/07/28/58/1057072858.db2.gz KVBOTKMTIMHCMZ-UHFFFAOYSA-N 2 1 306.453 4.038 20 0 DIADMP CC(C)([NH3+])c1ccccc1C1=CC[N@@H+](Cc2ccccc2)CC1 ZINC001241506374 1057077504 /nfs/dbraw/zinc/07/75/04/1057077504.db2.gz DFSAKOFTXIFJHA-UHFFFAOYSA-N 2 1 306.453 4.170 20 0 DIADMP C[NH+](C)Cc1ccc(C2=CC[N@@H+](Cc3ccccc3)CC2)cc1F ZINC001241507753 1057078312 /nfs/dbraw/zinc/07/83/12/1057078312.db2.gz OFEQODWJYBKSRG-UHFFFAOYSA-N 2 1 324.443 4.177 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474463233 1057094755 /nfs/dbraw/zinc/09/47/55/1057094755.db2.gz BONGSCURARTRQG-NFOMZHRRSA-N 2 1 308.432 4.064 20 0 DIADMP CC(C)Sc1ccc(-c2ccc3c(C4C[NH2+]C4)[nH+]cn3c2)cc1 ZINC001241611250 1057109068 /nfs/dbraw/zinc/10/90/68/1057109068.db2.gz MHEFFBBLMGPFLE-UHFFFAOYSA-N 2 1 323.465 4.189 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCCOC(C)(C)C)CC1 ZINC000675641499 1057390104 /nfs/dbraw/zinc/39/01/04/1057390104.db2.gz JORSXIADVGDCKQ-SFHVURJKSA-N 2 1 324.553 4.168 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H](C)c2ccncc2)cc1 ZINC000675926901 1057432897 /nfs/dbraw/zinc/43/28/97/1057432897.db2.gz IUBNEFOPPJGJQM-HOTGVXAUSA-N 2 1 320.440 4.030 20 0 DIADMP C[C@H](CC[N@H+]1CCCC(F)(F)CC1)[NH+]1CCCC(F)(F)CC1 ZINC000625769174 1057513246 /nfs/dbraw/zinc/51/32/46/1057513246.db2.gz DHYLBIUMAWQKPJ-CQSZACIVSA-N 2 1 324.406 4.007 20 0 DIADMP C[C@H](CC[NH+]1CCCC(F)(F)CC1)[N@@H+]1CCCC(F)(F)CC1 ZINC000625769174 1057513250 /nfs/dbraw/zinc/51/32/50/1057513250.db2.gz DHYLBIUMAWQKPJ-CQSZACIVSA-N 2 1 324.406 4.007 20 0 DIADMP C[C@H](CC[NH+]1CCCC(F)(F)CC1)[N@H+]1CCCC(F)(F)CC1 ZINC000625769174 1057513254 /nfs/dbraw/zinc/51/32/54/1057513254.db2.gz DHYLBIUMAWQKPJ-CQSZACIVSA-N 2 1 324.406 4.007 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCNc2ccccc21 ZINC000347913884 1057532732 /nfs/dbraw/zinc/53/27/32/1057532732.db2.gz HKOUUWIHLZSEGZ-FXAWDEMLSA-N 2 1 315.505 4.178 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCNc2ccccc21 ZINC000347913900 1057533170 /nfs/dbraw/zinc/53/31/70/1057533170.db2.gz HKOUUWIHLZSEGZ-PXNSSMCTSA-N 2 1 315.505 4.178 20 0 DIADMP CC[N@H+]1CCCC[C@H]1c1ccc(-c2cccc(C[NH2+]C)c2)nc1 ZINC001242997156 1057540113 /nfs/dbraw/zinc/54/01/13/1057540113.db2.gz WWWGGIBMFYBGDY-FQEVSTJZSA-N 2 1 309.457 4.015 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000166484368 1057583245 /nfs/dbraw/zinc/58/32/45/1057583245.db2.gz TYTNYROZMSMPLQ-USXIJHARSA-N 2 1 304.503 4.076 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]Cc3ccoc3)cc2)C1 ZINC000727467189 1057654979 /nfs/dbraw/zinc/65/49/79/1057654979.db2.gz PVMXFWDGPAOHOK-CALCHBBNSA-N 2 1 312.457 4.047 20 0 DIADMP c1[nH+]c(C2C[NH2+]C2)c2ccc(-c3ccc(C4CCCC4)cc3)cn12 ZINC001243493289 1057695582 /nfs/dbraw/zinc/69/55/82/1057695582.db2.gz UIWXIAYADQXWCZ-UHFFFAOYSA-N 2 1 317.436 4.346 20 0 DIADMP CCCCCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000731041780 1057733297 /nfs/dbraw/zinc/73/32/97/1057733297.db2.gz VWPWOLFHVLITCM-IBGZPJMESA-N 2 1 318.505 4.077 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@@H]([NH2+][C@H]2CCCC23CCCCC3)C1 ZINC001550515577 1058340904 /nfs/dbraw/zinc/34/09/04/1058340904.db2.gz QKMYOFVCCYTRKE-ZACQAIPSSA-N 2 1 301.478 4.149 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[C@@H](c2[nH+]ccn2C)C1)c1cccc(C2CC2)c1 ZINC001550505029 1058342561 /nfs/dbraw/zinc/34/25/61/1058342561.db2.gz GUYVSUQDWSOPIF-GDIGMMSISA-N 2 1 309.457 4.284 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C2CCC(C)CC2)CC[NH2+]1 ZINC001246066469 1058659173 /nfs/dbraw/zinc/65/91/73/1058659173.db2.gz QYOLWRVKKXHAFU-BZBZEQRQSA-N 2 1 304.453 4.096 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CC2CCCCC2)CC[NH2+]1 ZINC001246065840 1058659856 /nfs/dbraw/zinc/65/98/56/1058659856.db2.gz NGKXNBIPTDQBRT-HKUYNNGSSA-N 2 1 304.453 4.097 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC001246076658 1058665728 /nfs/dbraw/zinc/66/57/28/1058665728.db2.gz DNVUOXWTVCEBMD-HMXCVIKNSA-N 2 1 306.453 4.147 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246083726 1058670580 /nfs/dbraw/zinc/67/05/80/1058670580.db2.gz IUPDYIMDDCDFJD-WBVHZDCISA-N 2 1 318.461 4.087 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246084121 1058671187 /nfs/dbraw/zinc/67/11/87/1058671187.db2.gz WBOVVCUOBPCGBM-SJLPKXTDSA-N 2 1 304.453 4.240 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)s1 ZINC001246085122 1058671693 /nfs/dbraw/zinc/67/16/93/1058671693.db2.gz NHZHEDDKTXQIBS-MAUKXSAKSA-N 2 1 318.461 4.087 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CC2(C)CCCC2)CC[NH2+]1 ZINC001246081334 1058672077 /nfs/dbraw/zinc/67/20/77/1058672077.db2.gz MSMNFXKEQDIARA-WMZOPIPTSA-N 2 1 304.453 4.097 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cccc(Cl)c1F ZINC001246101780 1058677848 /nfs/dbraw/zinc/67/78/48/1058677848.db2.gz AYTDDAKLUMGGQR-JMSVASOKSA-N 2 1 312.860 4.296 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1C[NH2+]CC[C@H]1C ZINC001246119933 1058684506 /nfs/dbraw/zinc/68/45/06/1058684506.db2.gz XYBUIWYEHOGWSK-KGVIQGDOSA-N 2 1 322.496 4.185 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](C)C2)CC[NH2+]1 ZINC001246115332 1058684556 /nfs/dbraw/zinc/68/45/56/1058684556.db2.gz HGWZQDNFEAWLSK-YUFWVBKYSA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246155207 1058702092 /nfs/dbraw/zinc/70/20/92/1058702092.db2.gz VSZPBEVLAXDWDO-HUUCEWRRSA-N 2 1 315.288 4.250 20 0 DIADMP CCC1CCC([NH2+][C@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)CC1 ZINC001246171212 1058715768 /nfs/dbraw/zinc/71/57/68/1058715768.db2.gz KXOAEXHTLJFKPM-IVJQXSGXSA-N 2 1 318.480 4.486 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246173568 1058716034 /nfs/dbraw/zinc/71/60/34/1058716034.db2.gz BDMNVDUKPBWMHB-AZUAARDMSA-N 2 1 324.443 4.206 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CCC2CCCCC2)CC[NH2+]1 ZINC001246177286 1058723068 /nfs/dbraw/zinc/72/30/68/1058723068.db2.gz IKPCGCRWMAFYAC-QUCCMNQESA-N 2 1 318.480 4.487 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]Cc3ccccc3C3CC3)CC[NH2+]2)cc1 ZINC001246186980 1058729264 /nfs/dbraw/zinc/72/92/64/1058729264.db2.gz DXFDWVBBDQRLAM-CTNGQTDRSA-N 2 1 306.453 4.147 20 0 DIADMP C[C@H]1CC([NH2+]Cc2ccccc2Oc2ccccc2)C[C@H](C)[NH2+]1 ZINC001246189714 1058730167 /nfs/dbraw/zinc/73/01/67/1058730167.db2.gz DVMIUNLKUVIDSL-HOTGVXAUSA-N 2 1 310.441 4.098 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1Cl ZINC001246195802 1058736568 /nfs/dbraw/zinc/73/65/68/1058736568.db2.gz PVVUWWBQMTWTQM-PKOBYXMFSA-N 2 1 314.860 4.231 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@H]1CC[NH2+][C@H](C(C)C)C1 ZINC001246195968 1058737029 /nfs/dbraw/zinc/73/70/29/1058737029.db2.gz CXOVGSIDXSNONJ-BBRMVZONSA-N 2 1 315.288 4.168 20 0 DIADMP CC[C@H]1CC([NH2+]Cc2ccc(Cl)c(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246196206 1058737808 /nfs/dbraw/zinc/73/78/08/1058737808.db2.gz RMDDIWDTCIGZKG-STQMWFEESA-N 2 1 315.288 4.392 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(Cl)c(F)c2)CC[NH2+]1 ZINC001246211720 1058743520 /nfs/dbraw/zinc/74/35/20/1058743520.db2.gz LJJICUHPHKJJOQ-BPLDGKMQSA-N 2 1 312.860 4.441 20 0 DIADMP C[C@@]1(C[NH2+]C2CCC3(CCCCC3)CC2)CC[NH2+]CC1(F)F ZINC001246221416 1058746669 /nfs/dbraw/zinc/74/66/69/1058746669.db2.gz OEHYVBJAIIKQDG-INIZCTEOSA-N 2 1 314.464 4.104 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246214369 1058748085 /nfs/dbraw/zinc/74/80/85/1058748085.db2.gz ZTQYMYOGAHDYKS-VMXMFDLUSA-N 2 1 324.443 4.073 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H](C)CCC(C)C)CC[NH2+]1 ZINC001246230855 1058751937 /nfs/dbraw/zinc/75/19/37/1058751937.db2.gz UBEMFJSDSNTTBJ-IEZWGBDMSA-N 2 1 306.469 4.342 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246230902 1058753167 /nfs/dbraw/zinc/75/31/67/1058753167.db2.gz ASERINBTSDFOBV-KVSKMBFKSA-N 2 1 306.469 4.486 20 0 DIADMP Cc1ccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246237815 1058759975 /nfs/dbraw/zinc/75/99/75/1058759975.db2.gz IINCDEZCLOUXEB-WOJBJXKFSA-N 2 1 308.469 4.313 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]CCCC2CCCC2)CC[NH2+]1 ZINC001246237921 1058762720 /nfs/dbraw/zinc/76/27/20/1058762720.db2.gz JYBIZJLXWROTBT-UYAOXDASSA-N 2 1 318.480 4.487 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C(C(C)C)C(C)C)CC[NH2+]1 ZINC001246241283 1058765109 /nfs/dbraw/zinc/76/51/09/1058765109.db2.gz YTRXONFJXVPUKY-SJLPKXTDSA-N 2 1 306.469 4.197 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@@H](C)C2CCCC2)CC[NH2+]1 ZINC001246268898 1058784402 /nfs/dbraw/zinc/78/44/02/1058784402.db2.gz JYHAVBYGLWPVJS-POZUXBRTSA-N 2 1 304.453 4.096 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1cc(F)ccc1F ZINC001246270029 1058784539 /nfs/dbraw/zinc/78/45/39/1058784539.db2.gz SSYKCGIWMWSHBE-BORJPKMPSA-N 2 1 310.432 4.315 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1ccc(Cl)cc1Cl ZINC001246273765 1058788439 /nfs/dbraw/zinc/78/84/39/1058788439.db2.gz VCWWLTPTAKCRKF-LBPRGKRZSA-N 2 1 315.288 4.349 20 0 DIADMP CC[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2F)C(C)C)C[C@H](CC)[NH2+]1 ZINC001246275453 1058790284 /nfs/dbraw/zinc/79/02/84/1058790284.db2.gz UPJQWSBPVLUMEI-MKSNKDDYSA-N 2 1 306.469 4.422 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](c2ccccc2F)C(C)C)C[C@@H](CC)[NH2+]1 ZINC001246275456 1058790870 /nfs/dbraw/zinc/79/08/70/1058790870.db2.gz UPJQWSBPVLUMEI-SPYBWZPUSA-N 2 1 306.469 4.422 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246274685 1058791459 /nfs/dbraw/zinc/79/14/59/1058791459.db2.gz ZTQYMYOGAHDYKS-MJUUVYJYSA-N 2 1 324.443 4.073 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246282266 1058799555 /nfs/dbraw/zinc/79/95/55/1058799555.db2.gz UUVBSJCUIIGJIJ-SNRMKQJTSA-N 2 1 304.453 4.033 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc(F)c1 ZINC001246290992 1058807196 /nfs/dbraw/zinc/80/71/96/1058807196.db2.gz PTRMZUBPWMEJFK-HSALFYBXSA-N 2 1 312.432 4.360 20 0 DIADMP CCC(C)(C)C1CCC([NH2+]C[C@@H]([NH3+])Cc2ccccc2)CC1 ZINC001246301440 1058811751 /nfs/dbraw/zinc/81/17/51/1058811751.db2.gz WRXYWHZPCHIGNO-XBMUEBEBSA-N 2 1 302.506 4.141 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)C2CC2)cc1 ZINC001246313097 1058818964 /nfs/dbraw/zinc/81/89/64/1058818964.db2.gz IUOMOKRXZVODLP-PWRODBHTSA-N 2 1 324.443 4.360 20 0 DIADMP CC[C@H]([NH2+][C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1ccccc1OC ZINC001246316572 1058823669 /nfs/dbraw/zinc/82/36/69/1058823669.db2.gz JNGPNMLMUKONLI-DFGXFYAUSA-N 2 1 304.478 4.045 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(OC)cc1 ZINC001246316482 1058825943 /nfs/dbraw/zinc/82/59/43/1058825943.db2.gz ZMCDAYBBKHGDNR-TYPHKJRUSA-N 2 1 324.468 4.229 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccc(F)cc1F ZINC001246317068 1058827911 /nfs/dbraw/zinc/82/79/11/1058827911.db2.gz KWTTXMAFZYCFPM-MAUKXSAKSA-N 2 1 322.443 4.460 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+][C@H]1C[NH2+]CCC1(C)C ZINC001246324794 1058833731 /nfs/dbraw/zinc/83/37/31/1058833731.db2.gz GKLKUECVLRALBR-ZBFHGGJFSA-N 2 1 324.534 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC[C@@H]2C)CC[NH2+]1 ZINC001246330136 1058836572 /nfs/dbraw/zinc/83/65/72/1058836572.db2.gz AVEQQSJIVRYDMA-IVJVFBROSA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)C1CCC([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CC1 ZINC001246332592 1058842657 /nfs/dbraw/zinc/84/26/57/1058842657.db2.gz FXMOFYDFHNSKBF-QUDVFMAMSA-N 2 1 300.490 4.284 20 0 DIADMP c1cc2ccc(C[NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)cc2o1 ZINC001246330869 1058842951 /nfs/dbraw/zinc/84/29/51/1058842951.db2.gz ZAFGTVDTPSTEKD-RTBURBONSA-N 2 1 306.409 4.016 20 0 DIADMP CCC(C)(C)C1CCC([NH2+][C@@H]2CC[NH2+]C[C@@H]2C(F)(F)F)CC1 ZINC001246341892 1058854771 /nfs/dbraw/zinc/85/47/71/1058854771.db2.gz QEOKKKLSUCMVQJ-PFSRBDOWSA-N 2 1 320.443 4.111 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC001246346027 1058856386 /nfs/dbraw/zinc/85/63/86/1058856386.db2.gz LOLNBIIIFKBOQP-NTSGDEEZSA-N 2 1 320.480 4.080 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)C1CCCCC1 ZINC001246350362 1058860132 /nfs/dbraw/zinc/86/01/32/1058860132.db2.gz HEPXVXVOANJNRO-RBUKOAKNSA-N 2 1 300.490 4.428 20 0 DIADMP Cc1ccc(F)cc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246347500 1058862694 /nfs/dbraw/zinc/86/26/94/1058862694.db2.gz HETVLSOTFCPMDX-QKYXUNIQSA-N 2 1 312.432 4.278 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246351174 1058863128 /nfs/dbraw/zinc/86/31/28/1058863128.db2.gz SDMHOFXYABEVGS-BQFCYCMXSA-N 2 1 304.453 4.096 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+]C2(c3ccccc3F)CCC2)CC[NH2+]1 ZINC001246362609 1058868876 /nfs/dbraw/zinc/86/88/76/1058868876.db2.gz BIARBGDQODBXQV-HZPDHXFCSA-N 2 1 304.453 4.105 20 0 DIADMP CC[C@H]1CC([NH2+]C2(c3ccccc3F)CCC2)C[C@H](CC)[NH2+]1 ZINC001246368967 1058873255 /nfs/dbraw/zinc/87/32/55/1058873255.db2.gz URPBEKQNQFBSRA-GJZGRUSLSA-N 2 1 304.453 4.104 20 0 DIADMP Fc1ccccc1C1([NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)CCC1 ZINC001246366229 1058873790 /nfs/dbraw/zinc/87/37/90/1058873790.db2.gz NHOPMJKRLXNUJQ-INIZCTEOSA-N 2 1 316.464 4.249 20 0 DIADMP Clc1ccccc1C1([NH2+]C2CCCCCC2)CC[NH2+]CC1 ZINC001246374105 1058876591 /nfs/dbraw/zinc/87/65/91/1058876591.db2.gz KGNOWHNMQWFQOT-UHFFFAOYSA-N 2 1 306.881 4.231 20 0 DIADMP CCCC[C@@H](CC)[NH2+]C1(c2ccccc2Cl)CC[NH2+]CC1 ZINC001246377037 1058885032 /nfs/dbraw/zinc/88/50/32/1058885032.db2.gz YFTOSSFIURXMRE-OAHLLOKOSA-N 2 1 308.897 4.477 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)CC1CCC1 ZINC001246387502 1058893655 /nfs/dbraw/zinc/89/36/55/1058893655.db2.gz GDLPLHJXQSDEIG-MOPGFXCFSA-N 2 1 300.490 4.286 20 0 DIADMP CCCC[C@@H]1C[C@@H]([NH2+][C@H](c2ccncc2Cl)C2CC2)CC[NH2+]1 ZINC001246398149 1058901808 /nfs/dbraw/zinc/90/18/08/1058901808.db2.gz UWZZBBCTEJLKEU-VKJFTORMSA-N 2 1 321.896 4.087 20 0 DIADMP CCOc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246414921 1058918459 /nfs/dbraw/zinc/91/84/59/1058918459.db2.gz VDSNDAKDFZEPGE-PBEJRMEISA-N 2 1 324.468 4.229 20 0 DIADMP CCC1([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246417948 1058920135 /nfs/dbraw/zinc/92/01/35/1058920135.db2.gz WXNRBOGFHRQAIL-IRXDYDNUSA-N 2 1 322.443 4.427 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cc(F)cc(F)c1 ZINC001246460653 1058944386 /nfs/dbraw/zinc/94/43/86/1058944386.db2.gz GLRQWVJNAFSRNT-BRWVUGGUSA-N 2 1 310.432 4.172 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001246463333 1058950209 /nfs/dbraw/zinc/95/02/09/1058950209.db2.gz RJTWCSQWTYRCRL-ZWKOTPCHSA-N 2 1 322.443 4.460 20 0 DIADMP Cc1cccc(C2([NH2+][C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)c1 ZINC001246477965 1058963741 /nfs/dbraw/zinc/96/37/41/1058963741.db2.gz KYEWYHYGBOKTTN-WOJBJXKFSA-N 2 1 306.453 4.067 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](C(C)(C)C)C1)c1cc(F)cc(Cl)c1 ZINC001246490222 1058965975 /nfs/dbraw/zinc/96/59/75/1058965975.db2.gz OCQVDQRBMKIVBH-HFBAOOFYSA-N 2 1 312.860 4.296 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246521263 1058983715 /nfs/dbraw/zinc/98/37/15/1058983715.db2.gz NPQDDMQDXYCIKN-YADHBBJMSA-N 2 1 322.496 4.260 20 0 DIADMP CCC[N@H+](CC1CC1)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532466 1058985149 /nfs/dbraw/zinc/98/51/49/1058985149.db2.gz QOHGVXNKFHOYBV-HKUYNNGSSA-N 2 1 304.453 4.049 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246532466 1058985169 /nfs/dbraw/zinc/98/51/69/1058985169.db2.gz QOHGVXNKFHOYBV-HKUYNNGSSA-N 2 1 304.453 4.049 20 0 DIADMP CCC[N@H+](CC1CC1)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532469 1058988651 /nfs/dbraw/zinc/98/86/51/1058988651.db2.gz QOHGVXNKFHOYBV-PKOBYXMFSA-N 2 1 304.453 4.049 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532469 1058988673 /nfs/dbraw/zinc/98/86/73/1058988673.db2.gz QOHGVXNKFHOYBV-PKOBYXMFSA-N 2 1 304.453 4.049 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@H+]3CCCC4(CC[NH2+]CC4)C3)C2)cc1 ZINC001246524888 1058990233 /nfs/dbraw/zinc/99/02/33/1058990233.db2.gz UQWBLPMMJZZKPA-UXHICEINSA-N 2 1 312.501 4.178 20 0 DIADMP CC(C)(C)C1CC[NH+]([C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246540614 1058992592 /nfs/dbraw/zinc/99/25/92/1058992592.db2.gz BQJYOTDNHGHXSW-RTBURBONSA-N 2 1 300.490 4.238 20 0 DIADMP C1CCC2(CC1)CC[NH+]([C@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246548329 1058996809 /nfs/dbraw/zinc/99/68/09/1058996809.db2.gz HTBOXJDGPODWMD-SFHVURJKSA-N 2 1 304.522 4.488 20 0 DIADMP C[C@@H]1CC[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC[C@@H]1C[NH3+] ZINC001246555344 1058997708 /nfs/dbraw/zinc/99/77/08/1058997708.db2.gz DTXXRRTVTKHXAH-AFYVEPGGSA-N 2 1 300.490 4.020 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001246548884 1058998527 /nfs/dbraw/zinc/99/85/27/1058998527.db2.gz IGBZPVRQVNKNTF-LSJNQWAISA-N 2 1 320.908 4.298 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CCC[C@H](c3ccccc3)C2)CC[C@H]1C[NH3+] ZINC001246555345 1058998949 /nfs/dbraw/zinc/99/89/49/1058998949.db2.gz DTXXRRTVTKHXAH-BTHPGYMESA-N 2 1 300.490 4.020 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCCC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246550992 1058998989 /nfs/dbraw/zinc/99/89/89/1058998989.db2.gz RUMZSTRGWZKHKO-FHWLQOOXSA-N 2 1 300.490 4.380 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246561505 1059001271 /nfs/dbraw/zinc/00/12/71/1059001271.db2.gz USHKDJMYFOIRBJ-PMACEKPBSA-N 2 1 300.490 4.067 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246564051 1059003874 /nfs/dbraw/zinc/00/38/74/1059003874.db2.gz WRGFOFKRXVOCSB-MOPGFXCFSA-N 2 1 316.464 4.418 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@H](C[NH3+])[C@@H]1C ZINC001246565172 1059003934 /nfs/dbraw/zinc/00/39/34/1059003934.db2.gz OUCUGYXWZIXEDT-OWCLPIDISA-N 2 1 324.534 4.129 20 0 DIADMP CC(C)[N@@H+]([C@H]1CCc2cc(Cl)ccc2C1)[C@H]1CCC[NH2+]CC1 ZINC001246581821 1059010444 /nfs/dbraw/zinc/01/04/44/1059010444.db2.gz AXIKYMPDXLPYSG-OALUTQOASA-N 2 1 320.908 4.050 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001246583267 1059013898 /nfs/dbraw/zinc/01/38/98/1059013898.db2.gz QGPNOKOOGZOTDN-LSJNQWAISA-N 2 1 320.908 4.427 20 0 DIADMP CC1(C)C[C@H]([N@@H+](Cc2ccccc2)C2CCCCC2)CC[NH2+]1 ZINC001246593243 1059016364 /nfs/dbraw/zinc/01/63/64/1059016364.db2.gz AYOMRUZULFQYJW-LJQANCHMSA-N 2 1 300.490 4.352 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CC[C@@H](c2ccccc2)C1)[C@@H]1CCC[NH2+]CC1 ZINC001246590745 1059017759 /nfs/dbraw/zinc/01/77/59/1059017759.db2.gz HVFDOLAQNVNRJG-VAMGGRTRSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001246595157 1059020109 /nfs/dbraw/zinc/02/01/09/1059020109.db2.gz RNUWTWZPCWQCPF-AABGKKOBSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)[N@@H+]([C@@H]1CCc2c(Cl)cccc2C1)[C@@H]1CCC[NH2+]CC1 ZINC001246593429 1059020397 /nfs/dbraw/zinc/02/03/97/1059020397.db2.gz MZJMOLHYMAEEOU-IAGOWNOFSA-N 2 1 320.908 4.050 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246602907 1059023855 /nfs/dbraw/zinc/02/38/55/1059023855.db2.gz DTYYJDRUDWCRSO-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246612327 1059025124 /nfs/dbraw/zinc/02/51/24/1059025124.db2.gz VPFGORKOLUPMEO-XLIONFOSSA-N 2 1 318.480 4.003 20 0 DIADMP C1CCC2(CC1)CCC[C@H]([NH+]1CCC3(CCCC[NH2+]3)CC1)C2 ZINC001246610231 1059025314 /nfs/dbraw/zinc/02/53/14/1059025314.db2.gz LVCCIUHOQUZHNN-SFHVURJKSA-N 2 1 304.522 4.488 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609738 1059026236 /nfs/dbraw/zinc/02/62/36/1059026236.db2.gz MZOYVXZIVFOBGE-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246610185 1059026322 /nfs/dbraw/zinc/02/63/22/1059026322.db2.gz QDMZERVCMFTBEC-XLIONFOSSA-N 2 1 318.480 4.003 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246608936 1059026612 /nfs/dbraw/zinc/02/66/12/1059026612.db2.gz WBYAQCZQDZKYRM-RTWAWAEBSA-N 2 1 314.517 4.396 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCC[C@]23CCC[NH2+]CC3)cc1 ZINC001246608138 1059029116 /nfs/dbraw/zinc/02/91/16/1059029116.db2.gz SXYSMLALHYCWNE-HKUYNNGSSA-N 2 1 318.530 4.084 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246613424 1059030394 /nfs/dbraw/zinc/03/03/94/1059030394.db2.gz ZHYPYUACDNTXGB-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(C[C@H]2C[C@@H]([N@H+]3CCCC4(CCCC4)C3)CC[NH2+]2)cc1 ZINC001246614678 1059032876 /nfs/dbraw/zinc/03/28/76/1059032876.db2.gz PABWAVMLSQHAAF-PMACEKPBSA-N 2 1 312.501 4.006 20 0 DIADMP Clc1ccc(C2CCC([N@H+]3CC[C@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC001246630982 1059040215 /nfs/dbraw/zinc/04/02/15/1059040215.db2.gz NAANHGCAZSUTNA-KVZIAJEVSA-N 2 1 318.892 4.052 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001246625777 1059041172 /nfs/dbraw/zinc/04/11/72/1059041172.db2.gz UNJZHPVCMJRUAS-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)C2)cc1 ZINC001246636670 1059042486 /nfs/dbraw/zinc/04/24/86/1059042486.db2.gz VYHAOHGAUAPMBY-NJYVYQBISA-N 2 1 312.501 4.321 20 0 DIADMP CCCCCC[C@H](CC)[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001246638560 1059043917 /nfs/dbraw/zinc/04/39/17/1059043917.db2.gz MOOQKUGUJPSXKH-HOTGVXAUSA-N 2 1 302.453 4.056 20 0 DIADMP CCCCC[C@H](CCC)[N@H+]1CC[C@@]2(C1)C[NH2+]CCC2(F)F ZINC001246640327 1059044025 /nfs/dbraw/zinc/04/40/25/1059044025.db2.gz SNDDPEPREUCRBG-HOTGVXAUSA-N 2 1 302.453 4.056 20 0 DIADMP CCCCC[C@H](CCC)[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001246640329 1059046440 /nfs/dbraw/zinc/04/64/40/1059046440.db2.gz SNDDPEPREUCRBG-JKSUJKDBSA-N 2 1 302.453 4.056 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001246644722 1059050806 /nfs/dbraw/zinc/05/08/06/1059050806.db2.gz LKNPBNARFCJGAP-HNAYVOBHSA-N 2 1 320.908 4.125 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCCC12CC[NH2+]CC2 ZINC001246656072 1059052292 /nfs/dbraw/zinc/05/22/92/1059052292.db2.gz SLRJKINLLULEPY-LJQANCHMSA-N 2 1 300.490 4.006 20 0 DIADMP C1CCC2(C1)CCC([N@H+]1CCCC[C@H]1C1CC[NH2+]CC1)CC2 ZINC001246659220 1059056598 /nfs/dbraw/zinc/05/65/98/1059056598.db2.gz RATIISBIYAEMPM-IBGZPJMESA-N 2 1 304.522 4.344 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246675850 1059059662 /nfs/dbraw/zinc/05/96/62/1059059662.db2.gz YJWKRLPFTVUKQG-TZIWHRDSSA-N 2 1 314.517 4.208 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2C)CC[NH2+]1 ZINC001246681396 1059062587 /nfs/dbraw/zinc/06/25/87/1059062587.db2.gz OBQOWYHEGKSHHT-WSTZPKSXSA-N 2 1 300.490 4.443 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246680748 1059062726 /nfs/dbraw/zinc/06/27/26/1059062726.db2.gz KZIDPIJCQCPCJL-NEWSRXKRSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C[C@@H](C)C1 ZINC001246678486 1059063371 /nfs/dbraw/zinc/06/33/71/1059063371.db2.gz XLZJLERSDNKNKI-KZEVZHLLSA-N 2 1 312.501 4.033 20 0 DIADMP c1ccc([C@@H]2CC[C@H]([N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)C2)cc1 ZINC001246678037 1059064427 /nfs/dbraw/zinc/06/44/27/1059064427.db2.gz LVBBHYJKDGCPQC-CGXNFDGLSA-N 2 1 312.501 4.034 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@H]1CC[NH2+][C@H](C)C1 ZINC001246677122 1059065205 /nfs/dbraw/zinc/06/52/05/1059065205.db2.gz BVLSHEKPGCILNP-LQWHRVPQSA-N 2 1 308.469 4.390 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@H+]1CC[C@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246682333 1059065741 /nfs/dbraw/zinc/06/57/41/1059065741.db2.gz BQWODRXYFVZAID-KCLUMXDGSA-N 2 1 314.517 4.280 20 0 DIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246690458 1059068842 /nfs/dbraw/zinc/06/88/42/1059068842.db2.gz NNINCIJXRUQNHV-BTTYYORXSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246690458 1059068864 /nfs/dbraw/zinc/06/88/64/1059068864.db2.gz NNINCIJXRUQNHV-BTTYYORXSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246688825 1059069445 /nfs/dbraw/zinc/06/94/45/1059069445.db2.gz HSQHJEXNXGIWKC-ZDUSSCGKSA-N 2 1 313.272 4.100 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1CC[NH2+]C2(CCC2)C1 ZINC001246688825 1059069466 /nfs/dbraw/zinc/06/94/66/1059069466.db2.gz HSQHJEXNXGIWKC-ZDUSSCGKSA-N 2 1 313.272 4.100 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246771200 1059071660 /nfs/dbraw/zinc/07/16/60/1059071660.db2.gz WKBWSLJKOSGWRN-KRWDZBQOSA-N 2 1 306.881 4.227 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCCCC[C@H]2C)CC[NH2+]1 ZINC001246767244 1059072728 /nfs/dbraw/zinc/07/27/28/1059072728.db2.gz AWHBVMDHQDQYRK-AYBZRNKSSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCCCC[C@H]2C)CC[NH2+]1 ZINC001246767244 1059072754 /nfs/dbraw/zinc/07/27/54/1059072754.db2.gz AWHBVMDHQDQYRK-AYBZRNKSSA-N 2 1 304.453 4.192 20 0 DIADMP C[N@H+](CCCc1ccccc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246773651 1059073121 /nfs/dbraw/zinc/07/31/21/1059073121.db2.gz CBILMWRGLKMILF-NHCUHLMSSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@@H+](CCCc1ccccc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246773651 1059073140 /nfs/dbraw/zinc/07/31/40/1059073140.db2.gz CBILMWRGLKMILF-NHCUHLMSSA-N 2 1 308.469 4.044 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H](c3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246774590 1059073613 /nfs/dbraw/zinc/07/36/13/1059073613.db2.gz FXWKBBBQMFSXAZ-VNTMZGSJSA-N 2 1 300.490 4.175 20 0 DIADMP CCC[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246774067 1059074483 /nfs/dbraw/zinc/07/44/83/1059074483.db2.gz FVYVSTGZVKECPT-FGZHOGPDSA-N 2 1 322.496 4.262 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H](c3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246774587 1059075066 /nfs/dbraw/zinc/07/50/66/1059075066.db2.gz FXWKBBBQMFSXAZ-HAGHYFMRSA-N 2 1 300.490 4.175 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)C1CCC2(CC[NH2+]C2)CC1 ZINC001246775451 1059076347 /nfs/dbraw/zinc/07/63/47/1059076347.db2.gz IKDIWTBJFDTAKQ-UHFFFAOYSA-N 2 1 308.469 4.194 20 0 DIADMP c1ccc([C@@H]2CCC[N@@H+](C3CCC4(CC[NH2+]CC4)CC3)C2)cc1 ZINC001246781754 1059080629 /nfs/dbraw/zinc/08/06/29/1059080629.db2.gz XWGWSAAKKMIYSR-LJQANCHMSA-N 2 1 312.501 4.178 20 0 DIADMP c1csc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)c1 ZINC001246780838 1059082083 /nfs/dbraw/zinc/08/20/83/1059082083.db2.gz AHGHLJMDBQSQNR-MRXNPFEDSA-N 2 1 304.503 4.197 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H](Cc3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246776770 1059082127 /nfs/dbraw/zinc/08/21/27/1059082127.db2.gz PBJXJCCXALZFOF-MXEMCNAFSA-N 2 1 314.517 4.250 20 0 DIADMP c1ccc(C[C@@H]2C[C@@H]([N@H+]3CCC[C@@H]3c3ccccc3)CC[NH2+]2)cc1 ZINC001246784124 1059086047 /nfs/dbraw/zinc/08/60/47/1059086047.db2.gz FBOGUIHOMKJARI-BHIFYINESA-N 2 1 320.480 4.187 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246791835 1059089663 /nfs/dbraw/zinc/08/96/63/1059089663.db2.gz YVFYNUHETSLZTB-PASDCYSWSA-N 2 1 302.437 4.026 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246791940 1059090768 /nfs/dbraw/zinc/09/07/68/1059090768.db2.gz ZIEHGHYHVZFLDM-MLHJIOFPSA-N 2 1 304.865 4.150 20 0 DIADMP c1ccc(C[C@@H]2CC[N@@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246791644 1059091479 /nfs/dbraw/zinc/09/14/79/1059091479.db2.gz LKTAXNZUADDJRK-ILWGZMRPSA-N 2 1 320.480 4.044 20 0 DIADMP c1ccc(C[C@@H]2CC[N@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246791644 1059091500 /nfs/dbraw/zinc/09/15/00/1059091500.db2.gz LKTAXNZUADDJRK-ILWGZMRPSA-N 2 1 320.480 4.044 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246791831 1059091860 /nfs/dbraw/zinc/09/18/60/1059091860.db2.gz YVFYNUHETSLZTB-MKSNKDDYSA-N 2 1 302.437 4.026 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788761 1059091934 /nfs/dbraw/zinc/09/19/34/1059091934.db2.gz IZHKNPDLYHUVIF-HKUYNNGSSA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+](CC2CC2)C(C)C)CC[NH2+]1 ZINC001246788761 1059091954 /nfs/dbraw/zinc/09/19/54/1059091954.db2.gz IZHKNPDLYHUVIF-HKUYNNGSSA-N 2 1 304.453 4.048 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246791909 1059092410 /nfs/dbraw/zinc/09/24/10/1059092410.db2.gz PQSADZBDCTWFTO-YJBOKZPZSA-N 2 1 318.892 4.399 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2OC)CC[NH2+]1 ZINC001246790894 1059093365 /nfs/dbraw/zinc/09/33/65/1059093365.db2.gz IERNEZWKEYEETR-ZHALLVOQSA-N 2 1 316.489 4.143 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2F)CC[NH2+]1 ZINC001246795136 1059096468 /nfs/dbraw/zinc/09/64/68/1059096468.db2.gz IEGWMVVRRQABNF-JTDSTZFVSA-N 2 1 304.453 4.273 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2ccccc2OC)C[C@H](CC)[NH2+]1 ZINC001246792523 1059096583 /nfs/dbraw/zinc/09/65/83/1059096583.db2.gz QLXBIEUVPPTQFA-FAJBIJEISA-N 2 1 316.489 4.141 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@@H](CC)[NH2+]1 ZINC001246792153 1059096766 /nfs/dbraw/zinc/09/67/66/1059096766.db2.gz OBVIZPPCRGLPKY-SPYBWZPUSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@@H](CC)[NH2+]1 ZINC001246792153 1059096786 /nfs/dbraw/zinc/09/67/86/1059096786.db2.gz OBVIZPPCRGLPKY-SPYBWZPUSA-N 2 1 322.443 4.411 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246792464 1059097164 /nfs/dbraw/zinc/09/71/64/1059097164.db2.gz SRHWZHMOOUYHJH-MNEFBYGVSA-N 2 1 318.892 4.399 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2F)CC[NH2+]1 ZINC001246795134 1059098179 /nfs/dbraw/zinc/09/81/79/1059098179.db2.gz IEGWMVVRRQABNF-GJYPPUQNSA-N 2 1 304.453 4.273 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792150 1059098675 /nfs/dbraw/zinc/09/86/75/1059098675.db2.gz OBVIZPPCRGLPKY-PASDCYSWSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)C[C@H](CC)[NH2+]1 ZINC001246792150 1059098693 /nfs/dbraw/zinc/09/86/93/1059098693.db2.gz OBVIZPPCRGLPKY-PASDCYSWSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2ccccc2F)C[C@@H](CC)[NH2+]1 ZINC001246794592 1059099462 /nfs/dbraw/zinc/09/94/62/1059099462.db2.gz GDIXYIVSTIBNNL-CLCXKQKWSA-N 2 1 304.453 4.272 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCSC[C@H]2c2ccccc2)C[C@@H](CC)[NH2+]1 ZINC001246806681 1059102225 /nfs/dbraw/zinc/10/22/25/1059102225.db2.gz HREACBCWCHGTCT-LMMKCTJWSA-N 2 1 318.530 4.086 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246801063 1059102525 /nfs/dbraw/zinc/10/25/25/1059102525.db2.gz YLRZPJXTZFRXFA-QMMLZNLJSA-N 2 1 324.443 4.456 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246801063 1059102534 /nfs/dbraw/zinc/10/25/34/1059102534.db2.gz YLRZPJXTZFRXFA-QMMLZNLJSA-N 2 1 324.443 4.456 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+]([C@H]2CCC[C@]3(CC[NH2+]C3)C2)C1 ZINC001246809011 1059105209 /nfs/dbraw/zinc/10/52/09/1059105209.db2.gz FYIKHPLZIASQKT-GJYPPUQNSA-N 2 1 318.892 4.052 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)C[C@H](CC)[NH2+]1 ZINC001246809840 1059106542 /nfs/dbraw/zinc/10/65/42/1059106542.db2.gz KXRVRYPDTDLWRG-NCOADZHNSA-N 2 1 320.908 4.439 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809602 1059107533 /nfs/dbraw/zinc/10/75/33/1059107533.db2.gz KKRNLOWHHNQBOT-BRWVUGGUSA-N 2 1 320.908 4.440 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)s1 ZINC001246822528 1059108816 /nfs/dbraw/zinc/10/88/16/1059108816.db2.gz LMHODICGTFFNGD-GRDNDAEWSA-N 2 1 324.921 4.461 20 0 DIADMP C[NH2+]CC[C@@H](C)[N@H+]1CCC[C@@H]1C(c1ccccc1)c1ccccc1 ZINC001246819575 1059110896 /nfs/dbraw/zinc/11/08/96/1059110896.db2.gz CREJECIEOTVSTE-WIYYLYMNSA-N 2 1 322.496 4.281 20 0 DIADMP Clc1ccc([C@H]2CCC[N@@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821015 1059112017 /nfs/dbraw/zinc/11/20/17/1059112017.db2.gz HPIUYGROLAEZEM-QWHCGFSZSA-N 2 1 310.894 4.213 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821015 1059112029 /nfs/dbraw/zinc/11/20/29/1059112029.db2.gz HPIUYGROLAEZEM-QWHCGFSZSA-N 2 1 310.894 4.213 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2C2CCC3(C[NH2+]C3)CC2)s1 ZINC001246825314 1059112065 /nfs/dbraw/zinc/11/20/65/1059112065.db2.gz URNHWHBZVFZJBY-CYBMUJFWSA-N 2 1 310.894 4.071 20 0 DIADMP [NH3+][C@H]1C[C@@H](C(F)(F)F)C[N@@H+]([C@@H]2CCCC3(CCCCC3)C2)C1 ZINC001246826813 1059114274 /nfs/dbraw/zinc/11/42/74/1059114274.db2.gz FDBZEPMYRNNDDB-QLFBSQMISA-N 2 1 318.427 4.091 20 0 DIADMP [NH3+][C@H]1C[C@@H](C(F)(F)F)C[N@H+]([C@@H]2CCCC3(CCCCC3)C2)C1 ZINC001246826813 1059114288 /nfs/dbraw/zinc/11/42/88/1059114288.db2.gz FDBZEPMYRNNDDB-QLFBSQMISA-N 2 1 318.427 4.091 20 0 DIADMP Clc1ccc2c(c1)CC[N@@H+](C1CCC3(CCC[NH2+]C3)CC1)C2 ZINC001246834720 1059115789 /nfs/dbraw/zinc/11/57/89/1059115789.db2.gz GABABRPZGXGTEA-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)[C@@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246841955 1059119697 /nfs/dbraw/zinc/11/96/97/1059119697.db2.gz CQMBRGKBSBFUOF-BHDDXSALSA-N 2 1 322.496 4.433 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(OC)c2)CC[NH2+]1 ZINC001246846407 1059121925 /nfs/dbraw/zinc/12/19/25/1059121925.db2.gz GWDQRSMPOKSTDU-GGPKGHCWSA-N 2 1 316.489 4.143 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246843810 1059122477 /nfs/dbraw/zinc/12/24/77/1059122477.db2.gz FEEWWTORMSVEDL-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001246843743 1059122604 /nfs/dbraw/zinc/12/26/04/1059122604.db2.gz WALIRTNYZXJHEG-HZPDHXFCSA-N 2 1 324.534 4.001 20 0 DIADMP CC[C@H]1C[C@H]([N@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845530 1059123261 /nfs/dbraw/zinc/12/32/61/1059123261.db2.gz OOUVPVULLSOYSJ-RBUKOAKNSA-N 2 1 324.468 4.441 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2Oc2ccccc2)CC[NH2+]1 ZINC001246845530 1059123269 /nfs/dbraw/zinc/12/32/69/1059123269.db2.gz OOUVPVULLSOYSJ-RBUKOAKNSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CCC2(C[NH2+]C2)C1 ZINC001246842973 1059123778 /nfs/dbraw/zinc/12/37/78/1059123778.db2.gz HGVPQSARPHSZDH-SFHVURJKSA-N 2 1 322.452 4.053 20 0 DIADMP COc1ccc([C@H](C)[N@H+](C)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246848786 1059127358 /nfs/dbraw/zinc/12/73/58/1059127358.db2.gz FDBXMLQJSPYOAN-NBHGPNQESA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)[C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246848786 1059127373 /nfs/dbraw/zinc/12/73/73/1059127373.db2.gz FDBXMLQJSPYOAN-NBHGPNQESA-N 2 1 324.468 4.181 20 0 DIADMP C1C[N@H+](C2CCC3(CCC[NH2+]C3)CC2)C[C@H]1C1CCCCC1 ZINC001246847072 1059127445 /nfs/dbraw/zinc/12/74/45/1059127445.db2.gz ICELZKSBVUCXDH-HDYDNRTBSA-N 2 1 304.522 4.201 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(OC)c2)CC[NH2+]1 ZINC001246846409 1059128656 /nfs/dbraw/zinc/12/86/56/1059128656.db2.gz GWDQRSMPOKSTDU-QWFCFKBJSA-N 2 1 316.489 4.143 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+]([C@@H]3CCC[C@@]4(CC[NH2+]C4)C3)C2)c1 ZINC001246848759 1059129804 /nfs/dbraw/zinc/12/98/04/1059129804.db2.gz DNBYKDDFLUJEBP-BHIYHBOVSA-N 2 1 318.892 4.052 20 0 DIADMP C[N@@H+]([C@H]1CCC2(C1)CC[NH2+]CC2)C1CCC(C(C)(C)C)CC1 ZINC001246851800 1059131807 /nfs/dbraw/zinc/13/18/07/1059131807.db2.gz AFJBDPFNDPFHEF-ABHNRTSZSA-N 2 1 306.538 4.445 20 0 DIADMP F[C@@H]1CCC2(C1)CC[NH+]([C@@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246851288 1059132875 /nfs/dbraw/zinc/13/28/75/1059132875.db2.gz FENXSYJERGCKBT-QRVBRYPASA-N 2 1 316.464 4.084 20 0 DIADMP F[C@@H]1CCC2(C1)CC[NH+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246850621 1059133513 /nfs/dbraw/zinc/13/35/13/1059133513.db2.gz CGCTUQVVGDMDTL-IAGOWNOFSA-N 2 1 308.485 4.046 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852136 1059133936 /nfs/dbraw/zinc/13/39/36/1059133936.db2.gz MVXCMQBINYJGBB-NJAFHUGGSA-N 2 1 320.908 4.296 20 0 DIADMP CCCCC[C@@H](C)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246857526 1059135717 /nfs/dbraw/zinc/13/57/17/1059135717.db2.gz ALAYHISXXMJKCC-QGZVFWFLSA-N 2 1 300.490 4.092 20 0 DIADMP CC[C@H]1CC([N@H+]2CCC[C@H](c3ccccc3)C2)C[C@H](CC)[NH2+]1 ZINC001246862378 1059138795 /nfs/dbraw/zinc/13/87/95/1059138795.db2.gz FXWKBBBQMFSXAZ-FHWLQOOXSA-N 2 1 300.490 4.175 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246869037 1059141915 /nfs/dbraw/zinc/14/19/15/1059141915.db2.gz QIMHNFIIKHCDPP-NJDAHSKKSA-N 2 1 306.453 4.317 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246869037 1059141924 /nfs/dbraw/zinc/14/19/24/1059141924.db2.gz QIMHNFIIKHCDPP-NJDAHSKKSA-N 2 1 306.453 4.317 20 0 DIADMP CC[C@@H]1CC([N@H+]2Cc3ccccc3C(C)(C)C2)C[C@@H](CC)[NH2+]1 ZINC001246869520 1059143145 /nfs/dbraw/zinc/14/31/45/1059143145.db2.gz IBDAWFQCBSGXGT-IAGOWNOFSA-N 2 1 300.490 4.089 20 0 DIADMP CC[C@H]1C[C@@H]([NH+]2CCC(c3ccccc3Cl)CC2)CC[NH2+]1 ZINC001246867778 1059143378 /nfs/dbraw/zinc/14/33/78/1059143378.db2.gz JEAQJMLIBSXQSK-HOTGVXAUSA-N 2 1 306.881 4.050 20 0 DIADMP CC[N@H+](Cc1cccs1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246880438 1059145412 /nfs/dbraw/zinc/14/54/12/1059145412.db2.gz DZAPMYPAZLBBSK-AEFFLSMTSA-N 2 1 300.471 4.063 20 0 DIADMP CC[N@@H+](Cc1cccs1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246880438 1059145418 /nfs/dbraw/zinc/14/54/18/1059145418.db2.gz DZAPMYPAZLBBSK-AEFFLSMTSA-N 2 1 300.471 4.063 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c(F)c1 ZINC001246884394 1059148737 /nfs/dbraw/zinc/14/87/37/1059148737.db2.gz AOFJZXVKLXRBCH-ZYSHUDEJSA-N 2 1 320.427 4.024 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886428 1059148822 /nfs/dbraw/zinc/14/88/22/1059148822.db2.gz KPXHCDNHQIEFJL-QGTPRVQTSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2F)CC[NH2+]1 ZINC001246886428 1059148833 /nfs/dbraw/zinc/14/88/33/1059148833.db2.gz KPXHCDNHQIEFJL-QGTPRVQTSA-N 2 1 322.443 4.268 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2SC)CC[NH2+]1 ZINC001246886608 1059149539 /nfs/dbraw/zinc/14/95/39/1059149539.db2.gz HOFMHWXSFHSOSQ-HLLBOEOZSA-N 2 1 304.503 4.076 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884561 1059150132 /nfs/dbraw/zinc/15/01/32/1059150132.db2.gz BLJZKEGRAWTCTQ-PASDCYSWSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2F)C[C@H](CC)[NH2+]1 ZINC001246884561 1059150140 /nfs/dbraw/zinc/15/01/40/1059150140.db2.gz BLJZKEGRAWTCTQ-PASDCYSWSA-N 2 1 322.443 4.411 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C1C[C@@H](C)[NH2+][C@H](C)C1 ZINC001246889631 1059154738 /nfs/dbraw/zinc/15/47/38/1059154738.db2.gz RJEGRFJFJZFKKR-CKEIUWERSA-N 2 1 304.503 4.074 20 0 DIADMP C[N@H+]([C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892838 1059155742 /nfs/dbraw/zinc/15/57/42/1059155742.db2.gz OJVJPKALBYWRCP-NHCUHLMSSA-N 2 1 322.496 4.433 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C(C)(C)Cc1ccccc1 ZINC001246892838 1059155748 /nfs/dbraw/zinc/15/57/48/1059155748.db2.gz OJVJPKALBYWRCP-NHCUHLMSSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](C)C(C)(C)Cc2ccccc2)C[C@H](CC)[NH2+]1 ZINC001246892931 1059155930 /nfs/dbraw/zinc/15/59/30/1059155930.db2.gz PKWIMSWOHAIJGO-BWTSREIZSA-N 2 1 302.506 4.249 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC001246887337 1059156023 /nfs/dbraw/zinc/15/60/23/1059156023.db2.gz KSSOMCGIHZGLKQ-SJORKVTESA-N 2 1 304.865 4.152 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](CCC)C1CC[NH2+]CC1 ZINC001246892361 1059156122 /nfs/dbraw/zinc/15/61/22/1059156122.db2.gz BOEOIBSWZZITDP-HXUWFJFHSA-N 2 1 302.506 4.252 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246887422 1059156265 /nfs/dbraw/zinc/15/62/65/1059156265.db2.gz NQJGLHPROROLJU-ROUUACIJSA-N 2 1 318.892 4.399 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+](C)C(C)(C)Cc2ccccc2)CC[NH2+]1 ZINC001246894426 1059160876 /nfs/dbraw/zinc/16/08/76/1059160876.db2.gz TYEUWUFXSCETNB-RTBURBONSA-N 2 1 302.506 4.250 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@H+]3CCSc4ccccc4C3)CCN2)cc1 ZINC001246904847 1059162497 /nfs/dbraw/zinc/16/24/97/1059162497.db2.gz JHZQJIVWAYOSLK-RBUKOAKNSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@H]2C[C@@H](N3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904847 1059162507 /nfs/dbraw/zinc/16/25/07/1059162507.db2.gz JHZQJIVWAYOSLK-RBUKOAKNSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904847 1059162519 /nfs/dbraw/zinc/16/25/19/1059162519.db2.gz JHZQJIVWAYOSLK-RBUKOAKNSA-N 2 1 324.493 4.088 20 0 DIADMP c1ccc([C@H]2C[C@@H]([N@H+]3CCSc4ccccc4C3)CC[NH2+]2)cc1 ZINC001246904847 1059162526 /nfs/dbraw/zinc/16/25/26/1059162526.db2.gz JHZQJIVWAYOSLK-RBUKOAKNSA-N 2 1 324.493 4.088 20 0 DIADMP Fc1cccc(F)c1[C@H]1CCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246901336 1059164165 /nfs/dbraw/zinc/16/41/65/1059164165.db2.gz MCQQWPCDWLMAST-RHSMWYFYSA-N 2 1 320.427 4.024 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246907241 1059166453 /nfs/dbraw/zinc/16/64/53/1059166453.db2.gz UIIAPSOZDPCPIU-CMTQZCSUSA-N 2 1 300.490 4.337 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246905720 1059166617 /nfs/dbraw/zinc/16/66/17/1059166617.db2.gz AZAZIVRUAIHFCM-OALUTQOASA-N 2 1 302.506 4.292 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CCC([NH2+]C)CC1 ZINC001246907000 1059168986 /nfs/dbraw/zinc/16/89/86/1059168986.db2.gz TVTPXRMPDRLXDL-UHFFFAOYSA-N 2 1 314.395 4.058 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)C[C@H]1C ZINC001246912103 1059171335 /nfs/dbraw/zinc/17/13/35/1059171335.db2.gz DFNCJBTXGBSGAP-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246910984 1059171650 /nfs/dbraw/zinc/17/16/50/1059171650.db2.gz OSDDWADHKFHWSY-ACAXCVFMSA-N 2 1 300.490 4.337 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246908828 1059172218 /nfs/dbraw/zinc/17/22/18/1059172218.db2.gz NKGSRAPJMGNTAB-RVKKMQEKSA-N 2 1 306.881 4.255 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)[C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001246921734 1059174449 /nfs/dbraw/zinc/17/44/49/1059174449.db2.gz RQLCQDNQXZLASL-YNIZLOQISA-N 2 1 300.490 4.175 20 0 DIADMP FC(F)(F)c1ccc([C@H]2CCC[N@H+]2[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246920256 1059176254 /nfs/dbraw/zinc/17/62/54/1059176254.db2.gz DJLMVAKVXNITEG-LTIDMASMSA-N 2 1 324.390 4.125 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001246916910 1059176279 /nfs/dbraw/zinc/17/62/79/1059176279.db2.gz UMXWCJOFBJVZIO-MJGOQNOKSA-N 2 1 302.506 4.455 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC001246917413 1059177434 /nfs/dbraw/zinc/17/74/34/1059177434.db2.gz CUANCDHSVHRJEA-SJLPKXTDSA-N 2 1 320.546 4.161 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC001246917413 1059177442 /nfs/dbraw/zinc/17/74/42/1059177442.db2.gz CUANCDHSVHRJEA-SJLPKXTDSA-N 2 1 320.546 4.161 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+]1[C@H](C)CC(c1ccccc1)c1ccccc1 ZINC001246940488 1059183884 /nfs/dbraw/zinc/18/38/84/1059183884.db2.gz VBVGWGTUKXVFPY-WIYYLYMNSA-N 2 1 322.496 4.281 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1 ZINC001246934034 1059184515 /nfs/dbraw/zinc/18/45/15/1059184515.db2.gz NBPZSKRREPPGAM-UYAOXDASSA-N 2 1 314.517 4.170 20 0 DIADMP CCCC(CCC)[N@@H+](Cc1ccccc1F)C1CC[NH2+]CC1 ZINC001246937126 1059184824 /nfs/dbraw/zinc/18/48/24/1059184824.db2.gz ZDOKVLCGBOSXBT-UHFFFAOYSA-N 2 1 306.469 4.349 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CCC[C@@H]([NH3+])[C@@H]1C ZINC001246937967 1059185192 /nfs/dbraw/zinc/18/51/92/1059185192.db2.gz KSCXNKAGXSDCGD-BFQNTYOBSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@@H]([NH3+])[C@@H]1C ZINC001246937967 1059185203 /nfs/dbraw/zinc/18/52/03/1059185203.db2.gz KSCXNKAGXSDCGD-BFQNTYOBSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C[C@H]1C ZINC001246936613 1059186359 /nfs/dbraw/zinc/18/63/59/1059186359.db2.gz WTNRNNIAWJDFMV-GPMSIDNRSA-N 2 1 318.480 4.204 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)CC2CC[NH2+]CC2)C1 ZINC001246945554 1059188870 /nfs/dbraw/zinc/18/88/70/1059188870.db2.gz ZIOHXRVJSXVBRC-UZLBHIALSA-N 2 1 318.480 4.206 20 0 DIADMP Fc1ccc(C[N@H+](C2CCC3(CC3)CC2)[C@H]2CCC[NH2+]C2)cc1 ZINC001246941771 1059189092 /nfs/dbraw/zinc/18/90/92/1059189092.db2.gz HXAJUYFJIVSIQP-IBGZPJMESA-N 2 1 316.464 4.103 20 0 DIADMP Fc1ccc(C[N@@H+](C2CCC3(CC3)CC2)[C@H]2CCC[NH2+]C2)cc1 ZINC001246941771 1059189098 /nfs/dbraw/zinc/18/90/98/1059189098.db2.gz HXAJUYFJIVSIQP-IBGZPJMESA-N 2 1 316.464 4.103 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CC[C@@H]([NH3+])[C@@H](C(F)(F)F)C2)CC1 ZINC001246942995 1059189573 /nfs/dbraw/zinc/18/95/73/1059189573.db2.gz YSCZDMGRRDYHAS-PFSRBDOWSA-N 2 1 320.443 4.193 20 0 DIADMP Fc1ccc(F)c([C@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246947975 1059193014 /nfs/dbraw/zinc/19/30/14/1059193014.db2.gz OMLOESRTDQSSKW-ATZDWAIDSA-N 2 1 320.427 4.024 20 0 DIADMP CCC[C@@H](C)CC[C@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246950254 1059195643 /nfs/dbraw/zinc/19/56/43/1059195643.db2.gz FPFUURZXLRRBNC-MSOLQXFVSA-N 2 1 317.521 4.241 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1cc(C)cc(F)c1)C1CC[NH2+]CC1 ZINC001246952842 1059201649 /nfs/dbraw/zinc/20/16/49/1059201649.db2.gz XWTQTFOSIPTLQY-INIZCTEOSA-N 2 1 306.469 4.267 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246956644 1059203617 /nfs/dbraw/zinc/20/36/17/1059203617.db2.gz ZKVMSIWLLCYMTH-ROUUACIJSA-N 2 1 317.521 4.096 20 0 DIADMP CCCC[C@H](CC(C)C)[N@H+](Cc1ccncc1)[C@@H]1CCC[NH2+]C1 ZINC001246963454 1059206544 /nfs/dbraw/zinc/20/65/44/1059206544.db2.gz KPIATZLTNRJMHY-WOJBJXKFSA-N 2 1 317.521 4.241 20 0 DIADMP CCCC[C@H](CC(C)C)[N@@H+](Cc1ccncc1)[C@@H]1CCC[NH2+]C1 ZINC001246963454 1059206556 /nfs/dbraw/zinc/20/65/56/1059206556.db2.gz KPIATZLTNRJMHY-WOJBJXKFSA-N 2 1 317.521 4.241 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@@H+](Cc2ccccc2)C2CCC2)CC[NH2+]1 ZINC001246962579 1059206913 /nfs/dbraw/zinc/20/69/13/1059206913.db2.gz KEHSIPCXVFBFNP-RBUKOAKNSA-N 2 1 300.490 4.208 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001246963794 1059208119 /nfs/dbraw/zinc/20/81/19/1059208119.db2.gz ZAKRSCIAYZXKHS-INIZCTEOSA-N 2 1 306.469 4.267 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](CCC)C[C@@H]1CC[NH2+]C1 ZINC001246972394 1059216449 /nfs/dbraw/zinc/21/64/49/1059216449.db2.gz DRAPOKRGAJPWSK-UXHICEINSA-N 2 1 302.506 4.109 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001246971512 1059218095 /nfs/dbraw/zinc/21/80/95/1059218095.db2.gz HCOWBNBHOINWIP-CTNGQTDRSA-N 2 1 314.517 4.252 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246974779 1059218585 /nfs/dbraw/zinc/21/85/85/1059218585.db2.gz QYPYJGLWWQZVON-IHPCNDPISA-N 2 1 300.490 4.380 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@H]1CC[NH2+][C@@H](C)C1 ZINC001246975272 1059219838 /nfs/dbraw/zinc/21/98/38/1059219838.db2.gz BNSDPRXJMGOJIA-IHPCNDPISA-N 2 1 302.506 4.250 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246977938 1059221003 /nfs/dbraw/zinc/22/10/03/1059221003.db2.gz RRELRVRFMZYGHV-IBGZPJMESA-N 2 1 314.517 4.394 20 0 DIADMP c1ccc(CC[C@H]2CCC[N@H+]([C@H]3CC[NH2+]C4(CCC4)C3)C2)cc1 ZINC001246980206 1059221543 /nfs/dbraw/zinc/22/15/43/1059221543.db2.gz QFVVEIHJJBNYOW-UXHICEINSA-N 2 1 312.501 4.006 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246976360 1059224612 /nfs/dbraw/zinc/22/46/12/1059224612.db2.gz ZQKSVQJSJLSIOK-HKUYNNGSSA-N 2 1 300.490 4.380 20 0 DIADMP CCC[N@@H+](C[C@H]1CC[NH2+]C1)C1CCC(c2ccccc2)CC1 ZINC001246979622 1059224986 /nfs/dbraw/zinc/22/49/86/1059224986.db2.gz ZXPYEEDCMNMHOX-KKXNLOMOSA-N 2 1 300.490 4.034 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[N@@H+](C1CCC1)C1CC[NH2+]CC1 ZINC001246977795 1059225146 /nfs/dbraw/zinc/22/51/46/1059225146.db2.gz RCRCTUCIDJTVRB-ZDUSSCGKSA-N 2 1 324.871 4.017 20 0 DIADMP Fc1cc(F)cc([C@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001247000315 1059228799 /nfs/dbraw/zinc/22/87/99/1059228799.db2.gz HKUSWEKOTXUGLA-OTWHNJEPSA-N 2 1 320.427 4.024 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2Cc2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246998182 1059228990 /nfs/dbraw/zinc/22/89/90/1059228990.db2.gz BALAGPVWKNZMPJ-ZGXWSNOMSA-N 2 1 318.480 4.142 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1CCC[C@](C)(C[NH3+])C1 ZINC001247001813 1059233621 /nfs/dbraw/zinc/23/36/21/1059233621.db2.gz LLQNPJHRTVRNGP-MAUKXSAKSA-N 2 1 324.534 4.131 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH+]1CCC2(CC1)[NH2+]CCc1ccccc12 ZINC001247007540 1059235630 /nfs/dbraw/zinc/23/56/30/1059235630.db2.gz XRSQGLNNHNQJON-GOSISDBHSA-N 2 1 312.501 4.258 20 0 DIADMP CC(C)C1CCC([N@H+]2Cc3ccccc3C23CC[NH2+]CC3)CC1 ZINC001247012309 1059243015 /nfs/dbraw/zinc/24/30/15/1059243015.db2.gz VLUWGCFAHIHMMF-UHFFFAOYSA-N 2 1 312.501 4.296 20 0 DIADMP CCCCC[C@@H](CC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247013071 1059245198 /nfs/dbraw/zinc/24/51/98/1059245198.db2.gz FKRWCOVDVFLEQD-GOSISDBHSA-N 2 1 300.490 4.440 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1C ZINC001559508759 1059301560 /nfs/dbraw/zinc/30/15/60/1059301560.db2.gz KJCRVSSTDHCGFE-NRFANRHFSA-N 2 1 314.517 4.247 20 0 DIADMP CC(C)Cc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1 ZINC001559524146 1059321069 /nfs/dbraw/zinc/32/10/69/1059321069.db2.gz SVJLOGMMWDRSFI-UHFFFAOYSA-N 2 1 316.533 4.437 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)C1 ZINC001559545856 1059350288 /nfs/dbraw/zinc/35/02/88/1059350288.db2.gz ICBHBCBBZJJBMR-YSTOQKLRSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)C1 ZINC001559545856 1059350311 /nfs/dbraw/zinc/35/03/11/1059350311.db2.gz ICBHBCBBZJJBMR-YSTOQKLRSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)C1 ZINC001559545856 1059350322 /nfs/dbraw/zinc/35/03/22/1059350322.db2.gz ICBHBCBBZJJBMR-YSTOQKLRSA-N 2 1 306.538 4.399 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568200 1059395971 /nfs/dbraw/zinc/39/59/71/1059395971.db2.gz RXRCPWMVKVFXCN-HKUYNNGSSA-N 2 1 318.505 4.491 20 0 DIADMP CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559568200 1059395989 /nfs/dbraw/zinc/39/59/89/1059395989.db2.gz RXRCPWMVKVFXCN-HKUYNNGSSA-N 2 1 318.505 4.491 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559578804 1059412611 /nfs/dbraw/zinc/41/26/11/1059412611.db2.gz SVPCSGJXTYKHIC-SVFBPWRDSA-N 2 1 314.517 4.234 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559578804 1059412615 /nfs/dbraw/zinc/41/26/15/1059412615.db2.gz SVPCSGJXTYKHIC-SVFBPWRDSA-N 2 1 314.517 4.234 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559578804 1059412620 /nfs/dbraw/zinc/41/26/20/1059412620.db2.gz SVPCSGJXTYKHIC-SVFBPWRDSA-N 2 1 314.517 4.234 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CC=C(Cl)Cl)CC1 ZINC001559596707 1059431871 /nfs/dbraw/zinc/43/18/71/1059431871.db2.gz XSKLILZZQMXLNP-CQSZACIVSA-N 2 1 319.320 4.282 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CC=C(Cl)Cl)CC1 ZINC001559596707 1059431875 /nfs/dbraw/zinc/43/18/75/1059431875.db2.gz XSKLILZZQMXLNP-CQSZACIVSA-N 2 1 319.320 4.282 20 0 DIADMP CCCc1ccc([C@H]([NH2+]CC[C@@H]2CCC[N@H+]2C)C(C)C)cc1 ZINC001559670013 1059496793 /nfs/dbraw/zinc/49/67/93/1059496793.db2.gz XTBBZRCKNPBGCI-VQTJNVASSA-N 2 1 302.506 4.410 20 0 DIADMP C1=C(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)CCC1 ZINC001559717925 1059545429 /nfs/dbraw/zinc/54/54/29/1059545429.db2.gz ALYLDXSDCYQOFB-UHFFFAOYSA-N 2 1 310.485 4.085 20 0 DIADMP CC1CC(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)C1 ZINC001559717939 1059546672 /nfs/dbraw/zinc/54/66/72/1059546672.db2.gz BAQQDZPYMOPRLZ-UHFFFAOYSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(Cl)c1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001559737045 1059570814 /nfs/dbraw/zinc/57/08/14/1059570814.db2.gz FRQIOQCTVLKQBL-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1cccc(Cl)c1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737045 1059570831 /nfs/dbraw/zinc/57/08/31/1059570831.db2.gz FRQIOQCTVLKQBL-UKRRQHHQSA-N 2 1 324.871 4.222 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CCC(C)(C)C)C2)s1 ZINC001559819242 1059652869 /nfs/dbraw/zinc/65/28/69/1059652869.db2.gz SHAXIOMISFVFNX-INIZCTEOSA-N 2 1 308.535 4.246 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CCC(C)(C)C)C2)s1 ZINC001559819242 1059652875 /nfs/dbraw/zinc/65/28/75/1059652875.db2.gz SHAXIOMISFVFNX-INIZCTEOSA-N 2 1 308.535 4.246 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CCC(C)(C)C)C2)s1 ZINC001559819242 1059652887 /nfs/dbraw/zinc/65/28/87/1059652887.db2.gz SHAXIOMISFVFNX-INIZCTEOSA-N 2 1 308.535 4.246 20 0 DIADMP CCCC[N@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001560036765 1059850723 /nfs/dbraw/zinc/85/07/23/1059850723.db2.gz MHXRCGQQRVOSBZ-FQEVSTJZSA-N 2 1 314.517 4.409 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](Cc2ccccc2CC(C)C)CC1 ZINC001560048332 1059863664 /nfs/dbraw/zinc/86/36/64/1059863664.db2.gz MBIQDUKEFBQXPV-UHFFFAOYSA-N 2 1 302.506 4.191 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2ccc3ncccc3c2)CC1 ZINC001560050101 1059864798 /nfs/dbraw/zinc/86/47/98/1059864798.db2.gz JSJCPTBBPURCNX-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)CC1 ZINC001560263552 1060033121 /nfs/dbraw/zinc/03/31/21/1060033121.db2.gz AEHYZHIMAVSPMK-HXUWFJFHSA-N 2 1 314.517 4.383 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)CC1 ZINC001560263552 1060033148 /nfs/dbraw/zinc/03/31/48/1060033148.db2.gz AEHYZHIMAVSPMK-HXUWFJFHSA-N 2 1 314.517 4.383 20 0 DIADMP C[N@H+](Cc1ccc(C2CCCCC2)cc1)C1CC[NH+](C)CC1 ZINC001248885381 1060040411 /nfs/dbraw/zinc/04/04/11/1060040411.db2.gz UMFAAJQWVSMMGI-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP C[N@@H+](Cc1ccc(C2CCCCC2)cc1)C1CC[NH+](C)CC1 ZINC001248885381 1060040430 /nfs/dbraw/zinc/04/04/30/1060040430.db2.gz UMFAAJQWVSMMGI-UHFFFAOYSA-N 2 1 300.490 4.260 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1ccc(F)cc1 ZINC001560271181 1060045206 /nfs/dbraw/zinc/04/52/06/1060045206.db2.gz YHIACGXYXBIHLB-JKNJVXJCSA-N 2 1 304.453 4.083 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(Cl)c1F ZINC001560270626 1060045338 /nfs/dbraw/zinc/04/53/38/1060045338.db2.gz BYOQMMZCGBFAIZ-AWEZNQCLSA-N 2 1 312.860 4.223 20 0 DIADMP C[C@@H]1CCC[C@](C[NH2+][C@@H]2CCCc3ccccc3C2)([NH+](C)C)C1 ZINC001560285829 1060063778 /nfs/dbraw/zinc/06/37/78/1060063778.db2.gz JTWJUQGRRWADJO-UIFIKXQLSA-N 2 1 314.517 4.034 20 0 DIADMP CC[N@H+](CC[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1)C(C)C ZINC001560306315 1060091739 /nfs/dbraw/zinc/09/17/39/1060091739.db2.gz BFIHVDLMPMITNW-WOJBJXKFSA-N 2 1 302.506 4.423 20 0 DIADMP CC[N@@H+](CC[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1)C(C)C ZINC001560306315 1060091758 /nfs/dbraw/zinc/09/17/58/1060091758.db2.gz BFIHVDLMPMITNW-WOJBJXKFSA-N 2 1 302.506 4.423 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC001560321016 1060106517 /nfs/dbraw/zinc/10/65/17/1060106517.db2.gz XRERKAFUJAJNAG-NSDNCLLMSA-N 2 1 314.517 4.335 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC001560321017 1060106629 /nfs/dbraw/zinc/10/66/29/1060106629.db2.gz XRERKAFUJAJNAG-QKWWCAPFSA-N 2 1 314.517 4.335 20 0 DIADMP CCc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001560418392 1060202507 /nfs/dbraw/zinc/20/25/07/1060202507.db2.gz LLWWTACPDANILN-PGRDOPGGSA-N 2 1 322.496 4.249 20 0 DIADMP c1cc2c(c(CN3CCC4(CCC[N@@H+]4CC4CC4)CC3)c1)CCC2 ZINC001249456990 1060258502 /nfs/dbraw/zinc/25/85/02/1060258502.db2.gz NVCCKBOWUAXZBS-UHFFFAOYSA-N 2 1 324.512 4.016 20 0 DIADMP c1cc2c(c(C[NH+]3CCC4(CCC[N@H+]4CC4CC4)CC3)c1)CCC2 ZINC001249456990 1060258512 /nfs/dbraw/zinc/25/85/12/1060258512.db2.gz NVCCKBOWUAXZBS-UHFFFAOYSA-N 2 1 324.512 4.016 20 0 DIADMP c1cc2c(c(C[NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)c1)CCC2 ZINC001249456990 1060258537 /nfs/dbraw/zinc/25/85/37/1060258537.db2.gz NVCCKBOWUAXZBS-UHFFFAOYSA-N 2 1 324.512 4.016 20 0 DIADMP Clc1ccccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC000469877993 1060260408 /nfs/dbraw/zinc/26/04/08/1060260408.db2.gz JHFGWUJCFLLCLW-HNNXBMFYSA-N 2 1 306.881 4.084 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+](Cc1ccccc1)C[C@@H]1CCC[NH2+]C1 ZINC000469883337 1060263189 /nfs/dbraw/zinc/26/31/89/1060263189.db2.gz XHSUXWGADWFIBZ-AZUAARDMSA-N 2 1 308.469 4.249 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3CCC[C@@H]3C3CC3)CC2)cc1 ZINC001560503479 1060297956 /nfs/dbraw/zinc/29/79/56/1060297956.db2.gz OAXAKHSFNHVYNT-PZJWPPBQSA-N 2 1 312.501 4.067 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccc(Cl)cc32)CC1(C)C ZINC001560549835 1060361837 /nfs/dbraw/zinc/36/18/37/1060361837.db2.gz SUVHALRYJDLXLD-DOTOQJQBSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC[C@H]2C=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001560576908 1060391287 /nfs/dbraw/zinc/39/12/87/1060391287.db2.gz UDOWUAJMFBPSAC-DYXWJJEUSA-N 2 1 312.501 4.376 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC[C@H]2C=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001560576908 1060391302 /nfs/dbraw/zinc/39/13/02/1060391302.db2.gz UDOWUAJMFBPSAC-DYXWJJEUSA-N 2 1 312.501 4.376 20 0 DIADMP CC1(C)C(C)(C)C1(C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001560610430 1060424698 /nfs/dbraw/zinc/42/46/98/1060424698.db2.gz VXXLQAGGYCYUGX-UHFFFAOYSA-N 2 1 314.517 4.108 20 0 DIADMP CC(C)CCC[NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001560616182 1060429929 /nfs/dbraw/zinc/42/99/29/1060429929.db2.gz RUWMFANQANKZJG-HKBOAZHASA-N 2 1 314.517 4.313 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2coc3ccccc23)CC1 ZINC001560673116 1060504428 /nfs/dbraw/zinc/50/44/28/1060504428.db2.gz FNLWDMHEAGLFOK-UHFFFAOYSA-N 2 1 314.473 4.377 20 0 DIADMP CC(C)C1(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700935 1060554483 /nfs/dbraw/zinc/55/44/83/1060554483.db2.gz VNYQSPKSDLKLEX-ICSRJNTNSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700935 1060554497 /nfs/dbraw/zinc/55/44/97/1060554497.db2.gz VNYQSPKSDLKLEX-ICSRJNTNSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700935 1060554514 /nfs/dbraw/zinc/55/45/14/1060554514.db2.gz VNYQSPKSDLKLEX-ICSRJNTNSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001560700935 1060554530 /nfs/dbraw/zinc/55/45/30/1060554530.db2.gz VNYQSPKSDLKLEX-ICSRJNTNSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001560703744 1060557785 /nfs/dbraw/zinc/55/77/85/1060557785.db2.gz LNRJGZODAFXROH-FYZZASKESA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001560791546 1060651338 /nfs/dbraw/zinc/65/13/38/1060651338.db2.gz LUZJQUISLZIYPM-OXJNMPFZSA-N 2 1 318.480 4.143 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C/C=C\c1cccc(F)c1 ZINC001560812408 1060671593 /nfs/dbraw/zinc/67/15/93/1060671593.db2.gz RBPDYLVLFCPBEE-YVMONPNESA-N 2 1 315.436 4.010 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C/C=C\c1cccc(F)c1 ZINC001560812408 1060671600 /nfs/dbraw/zinc/67/16/00/1060671600.db2.gz RBPDYLVLFCPBEE-YVMONPNESA-N 2 1 315.436 4.010 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001560834677 1060690959 /nfs/dbraw/zinc/69/09/59/1060690959.db2.gz ABZGNDVBJQZUTA-JYAXBFRTSA-N 2 1 312.501 4.236 20 0 DIADMP CC(C)[C@@H]1C[C@H]1C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001560834677 1060690964 /nfs/dbraw/zinc/69/09/64/1060690964.db2.gz ABZGNDVBJQZUTA-JYAXBFRTSA-N 2 1 312.501 4.236 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)Cc1ccccc1Cl ZINC001560845179 1060702358 /nfs/dbraw/zinc/70/23/58/1060702358.db2.gz IDRMFMDPMQUGGA-AEFFLSMTSA-N 2 1 322.924 4.371 20 0 DIADMP CC[C@H]1CCCC[C@@H]1C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560901145 1060765347 /nfs/dbraw/zinc/76/53/47/1060765347.db2.gz MEVDVEMKMNWOFD-KCLUMXDGSA-N 2 1 314.517 4.138 20 0 DIADMP Cc1cccc(CC[C@@H](C)[NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)c1 ZINC001560937272 1060798486 /nfs/dbraw/zinc/79/84/86/1060798486.db2.gz ACVJFQNRJFQDGJ-UYAOXDASSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(CC[C@@H](C)[NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)c1 ZINC001560937272 1060798499 /nfs/dbraw/zinc/79/84/99/1060798499.db2.gz ACVJFQNRJFQDGJ-UYAOXDASSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938196 1060801658 /nfs/dbraw/zinc/80/16/58/1060801658.db2.gz YBIUIGIQNUKQSC-GOEBONIOSA-N 2 1 314.464 4.197 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938196 1060801680 /nfs/dbraw/zinc/80/16/80/1060801680.db2.gz YBIUIGIQNUKQSC-GOEBONIOSA-N 2 1 314.464 4.197 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938195 1060801721 /nfs/dbraw/zinc/80/17/21/1060801721.db2.gz YBIUIGIQNUKQSC-GDBMZVCRSA-N 2 1 314.464 4.197 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)C1CCC(F)(F)CC1 ZINC001560938195 1060801732 /nfs/dbraw/zinc/80/17/32/1060801732.db2.gz YBIUIGIQNUKQSC-GDBMZVCRSA-N 2 1 314.464 4.197 20 0 DIADMP CC[C@@H](Cc1ccc(C)cc1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001560950858 1060816421 /nfs/dbraw/zinc/81/64/21/1060816421.db2.gz PTKGSQUZQNKKMA-RTWAWAEBSA-N 2 1 314.517 4.028 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001560950857 1060816789 /nfs/dbraw/zinc/81/67/89/1060816789.db2.gz PTKGSQUZQNKKMA-NHCUHLMSSA-N 2 1 314.517 4.028 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972963 1060838172 /nfs/dbraw/zinc/83/81/72/1060838172.db2.gz DOWCHRWFLZFXIF-UZLBHIALSA-N 2 1 318.480 4.316 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972963 1060838179 /nfs/dbraw/zinc/83/81/79/1060838179.db2.gz DOWCHRWFLZFXIF-UZLBHIALSA-N 2 1 318.480 4.316 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@H]1CCCc2ccc(F)cc21 ZINC001473191007 1060945013 /nfs/dbraw/zinc/94/50/13/1060945013.db2.gz CYWKTMRBVXNBPW-MJGOQNOKSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@H]1CCCc2ccc(F)cc21 ZINC001473191007 1060945034 /nfs/dbraw/zinc/94/50/34/1060945034.db2.gz CYWKTMRBVXNBPW-MJGOQNOKSA-N 2 1 304.453 4.009 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@H]1CCCc2ccc(F)cc21 ZINC001473191007 1060945056 /nfs/dbraw/zinc/94/50/56/1060945056.db2.gz CYWKTMRBVXNBPW-MJGOQNOKSA-N 2 1 304.453 4.009 20 0 DIADMP C[N@@H+](C/C=C\c1ccc(Cl)cc1)CC[C@H]1CCCC[NH+]1C ZINC001473191496 1060948729 /nfs/dbraw/zinc/94/87/29/1060948729.db2.gz GULRAUCVGNDIND-OOFWQKGWSA-N 2 1 306.881 4.159 20 0 DIADMP C[N@H+](C/C=C\c1ccc(Cl)cc1)CC[C@H]1CCCC[NH+]1C ZINC001473191496 1060948750 /nfs/dbraw/zinc/94/87/50/1060948750.db2.gz GULRAUCVGNDIND-OOFWQKGWSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C\c1ccc(Cl)cc1)CC[C@H]1CCCC[N@@H+]1C ZINC001473191496 1060948774 /nfs/dbraw/zinc/94/87/74/1060948774.db2.gz GULRAUCVGNDIND-OOFWQKGWSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C\c1ccc(Cl)cc1)CC[C@H]1CCCC[N@H+]1C ZINC001473191496 1060948796 /nfs/dbraw/zinc/94/87/96/1060948796.db2.gz GULRAUCVGNDIND-OOFWQKGWSA-N 2 1 306.881 4.159 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H]3C[NH+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220229 1060993492 /nfs/dbraw/zinc/99/34/92/1060993492.db2.gz SGHGRISCKYMWRR-QHAWAJNXSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]3C[NH+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220229 1060993509 /nfs/dbraw/zinc/99/35/09/1060993509.db2.gz SGHGRISCKYMWRR-QHAWAJNXSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@@H+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220229 1060993526 /nfs/dbraw/zinc/99/35/26/1060993526.db2.gz SGHGRISCKYMWRR-QHAWAJNXSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220229 1060993534 /nfs/dbraw/zinc/99/35/34/1060993534.db2.gz SGHGRISCKYMWRR-QHAWAJNXSA-N 2 1 310.485 4.082 20 0 DIADMP CC(C)=CCC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001473219763 1060993717 /nfs/dbraw/zinc/99/37/17/1060993717.db2.gz MUXJAXSHZUVXBY-NHCUHLMSSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001473219763 1060993733 /nfs/dbraw/zinc/99/37/33/1060993733.db2.gz MUXJAXSHZUVXBY-NHCUHLMSSA-N 2 1 312.501 4.329 20 0 DIADMP CC(C)=CCC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001473219763 1060993750 /nfs/dbraw/zinc/99/37/50/1060993750.db2.gz MUXJAXSHZUVXBY-NHCUHLMSSA-N 2 1 312.501 4.329 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220227 1060995055 /nfs/dbraw/zinc/99/50/55/1060995055.db2.gz SGHGRISCKYMWRR-PCCBWWKXSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220227 1060995078 /nfs/dbraw/zinc/99/50/78/1060995078.db2.gz SGHGRISCKYMWRR-PCCBWWKXSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220227 1060995101 /nfs/dbraw/zinc/99/51/01/1060995101.db2.gz SGHGRISCKYMWRR-PCCBWWKXSA-N 2 1 310.485 4.082 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@H+]([C@H]4C=CCCC4)CC[C@H]32)cc1 ZINC001473220227 1060995126 /nfs/dbraw/zinc/99/51/26/1060995126.db2.gz SGHGRISCKYMWRR-PCCBWWKXSA-N 2 1 310.485 4.082 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1 ZINC001473219444 1060997367 /nfs/dbraw/zinc/99/73/67/1060997367.db2.gz HHFFIBDZTBYHTG-VDGAXYAQSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1 ZINC001473219444 1060997382 /nfs/dbraw/zinc/99/73/82/1060997382.db2.gz HHFFIBDZTBYHTG-VDGAXYAQSA-N 2 1 300.490 4.287 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC001473219444 1060997392 /nfs/dbraw/zinc/99/73/92/1060997392.db2.gz HHFFIBDZTBYHTG-VDGAXYAQSA-N 2 1 300.490 4.287 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl ZINC001462189501 1061012093 /nfs/dbraw/zinc/01/20/93/1061012093.db2.gz IUXKXKSCGUZCHX-UWWQBHOKSA-N 2 1 308.897 4.296 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl ZINC001462223436 1061039373 /nfs/dbraw/zinc/03/93/73/1061039373.db2.gz PLTPGIKVEJYQIY-WDYCEAGBSA-N 2 1 320.908 4.440 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl ZINC001462223436 1061039388 /nfs/dbraw/zinc/03/93/88/1061039388.db2.gz PLTPGIKVEJYQIY-WDYCEAGBSA-N 2 1 320.908 4.440 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC001473290200 1061063587 /nfs/dbraw/zinc/06/35/87/1061063587.db2.gz XGSYHGXNCSJBOR-UHFFFAOYSA-N 2 1 311.473 4.371 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(C2CCCC2)cc1 ZINC001473290200 1061063601 /nfs/dbraw/zinc/06/36/01/1061063601.db2.gz XGSYHGXNCSJBOR-UHFFFAOYSA-N 2 1 311.473 4.371 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462301048 1061088102 /nfs/dbraw/zinc/08/81/02/1061088102.db2.gz YOUMUNDMYKTCJQ-MISYRCLQSA-N 2 1 302.506 4.341 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001462301048 1061088114 /nfs/dbraw/zinc/08/81/14/1061088114.db2.gz YOUMUNDMYKTCJQ-MISYRCLQSA-N 2 1 302.506 4.341 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC001462307665 1061094115 /nfs/dbraw/zinc/09/41/15/1061094115.db2.gz AEZFRONIHASYQP-QGZVFWFLSA-N 2 1 308.897 4.125 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cccc(F)c2Cl)cc1 ZINC001473341587 1061099967 /nfs/dbraw/zinc/09/99/67/1061099967.db2.gz DNDOTSOPJLYVAB-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(F)c2Cl)cc1 ZINC001473341587 1061099982 /nfs/dbraw/zinc/09/99/82/1061099982.db2.gz DNDOTSOPJLYVAB-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c(C)c1C ZINC001473379999 1061121600 /nfs/dbraw/zinc/12/16/00/1061121600.db2.gz OEBBURSNSWQIMU-IBGZPJMESA-N 2 1 302.506 4.145 20 0 DIADMP CC(C)C[N@H+](C)CCC[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC001462408305 1061153859 /nfs/dbraw/zinc/15/38/59/1061153859.db2.gz ZQCPRSIDHUFPJB-DZGCQCFKSA-N 2 1 312.548 4.241 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC001462408305 1061153862 /nfs/dbraw/zinc/15/38/62/1061153862.db2.gz ZQCPRSIDHUFPJB-DZGCQCFKSA-N 2 1 312.548 4.241 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1 ZINC001462407363 1061154305 /nfs/dbraw/zinc/15/43/05/1061154305.db2.gz WNRYULFWNYBILY-PMACEKPBSA-N 2 1 302.506 4.064 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1 ZINC001462437827 1061172390 /nfs/dbraw/zinc/17/23/90/1061172390.db2.gz NMFAYMAKYXCDQD-AYBZRNKSSA-N 2 1 320.908 4.298 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444765 1061177373 /nfs/dbraw/zinc/17/73/73/1061177373.db2.gz TXVFICCQUSLYTE-MAUKXSAKSA-N 2 1 320.908 4.440 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)c1cccc(Cl)c1 ZINC001462444765 1061177382 /nfs/dbraw/zinc/17/73/82/1061177382.db2.gz TXVFICCQUSLYTE-MAUKXSAKSA-N 2 1 320.908 4.440 20 0 DIADMP C[N@H+]1CCC[C@]2(CC[NH+](CCCCc3cccc(Cl)c3)C2)C1 ZINC001473502294 1061196915 /nfs/dbraw/zinc/19/69/15/1061196915.db2.gz VCPJIALPVDOYFK-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@H+](CCCCc3cccc(Cl)c3)C2)C1 ZINC001473502294 1061196927 /nfs/dbraw/zinc/19/69/27/1061196927.db2.gz VCPJIALPVDOYFK-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@@H+](CCCCc3cccc(Cl)c3)C2)C1 ZINC001473502294 1061196940 /nfs/dbraw/zinc/19/69/40/1061196940.db2.gz VCPJIALPVDOYFK-IBGZPJMESA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+]1CCC[C@@]2(CC[NH+](CC3CCC(C(C)(C)C)CC3)C2)C1 ZINC001473501259 1061197073 /nfs/dbraw/zinc/19/70/73/1061197073.db2.gz CLLXASYEYPIOCN-AFMYVXGZSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@H+](CC3CCC(C(C)(C)C)CC3)C2)C1 ZINC001473501259 1061197085 /nfs/dbraw/zinc/19/70/85/1061197085.db2.gz CLLXASYEYPIOCN-AFMYVXGZSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](CC3CCC(C(C)(C)C)CC3)C2)C1 ZINC001473501259 1061197095 /nfs/dbraw/zinc/19/70/95/1061197095.db2.gz CLLXASYEYPIOCN-AFMYVXGZSA-N 2 1 306.538 4.257 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462485282 1061203388 /nfs/dbraw/zinc/20/33/88/1061203388.db2.gz HURHGZXNCBLZFQ-IJXRJRJASA-N 2 1 316.464 4.225 20 0 DIADMP F[C@H]1CCCC[C@H]1N[C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC001462485282 1061203408 /nfs/dbraw/zinc/20/34/08/1061203408.db2.gz HURHGZXNCBLZFQ-IJXRJRJASA-N 2 1 316.464 4.225 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2cccc3ccoc32)CC1 ZINC001462563389 1061266804 /nfs/dbraw/zinc/26/68/04/1061266804.db2.gz HVFJCXBWFNFRMZ-UHFFFAOYSA-N 2 1 312.457 4.273 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@@H](C)[C@H]1CCCCO1)c1ccccc1 ZINC001462674221 1061332570 /nfs/dbraw/zinc/33/25/70/1061332570.db2.gz KIOSOGLYYZUHDJ-YSIASYRMSA-N 2 1 318.505 4.007 20 0 DIADMP C[C@H]1CC(F)(F)CC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001473695290 1061355434 /nfs/dbraw/zinc/35/54/34/1061355434.db2.gz KMBAOQFOLBMMAZ-INIZCTEOSA-N 2 1 322.443 4.292 20 0 DIADMP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2Cc2ccc(CF)cc2)CC1 ZINC001473716737 1061368930 /nfs/dbraw/zinc/36/89/30/1061368930.db2.gz KNDDGQDCDAYNQP-FQEVSTJZSA-N 2 1 318.480 4.243 20 0 DIADMP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724607 1061372071 /nfs/dbraw/zinc/37/20/71/1061372071.db2.gz DLFXBCCMHXVWKA-BEFAXECRSA-N 2 1 314.860 4.019 20 0 DIADMP C[N@H+]1CC[C@@H]2C[NH+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724607 1061372091 /nfs/dbraw/zinc/37/20/91/1061372091.db2.gz DLFXBCCMHXVWKA-BEFAXECRSA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@H+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724607 1061372111 /nfs/dbraw/zinc/37/21/11/1061372111.db2.gz DLFXBCCMHXVWKA-BEFAXECRSA-N 2 1 314.860 4.019 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccc(Cl)c4ccccc34)CC[C@@H]21 ZINC001473724607 1061372131 /nfs/dbraw/zinc/37/21/31/1061372131.db2.gz DLFXBCCMHXVWKA-BEFAXECRSA-N 2 1 314.860 4.019 20 0 DIADMP CC(C)C[N@H+](Cc1cccc(C(F)F)c1)CC1CC[NH+](C)CC1 ZINC001473738908 1061382477 /nfs/dbraw/zinc/38/24/77/1061382477.db2.gz ATXJGAJCQDTVFH-UHFFFAOYSA-N 2 1 324.459 4.424 20 0 DIADMP Cc1ccccc1CCC[N@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001473738943 1061383576 /nfs/dbraw/zinc/38/35/76/1061383576.db2.gz CMPHEUWVHWVTFG-UHFFFAOYSA-N 2 1 316.533 4.227 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CCN(c2cc[nH+]cc2)[C@H](C)C1 ZINC001473759936 1061395404 /nfs/dbraw/zinc/39/54/04/1061395404.db2.gz SJANJUWOHPZHDN-CABCVRRESA-N 2 1 315.848 4.007 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC001473957196 1061499958 /nfs/dbraw/zinc/49/99/58/1061499958.db2.gz MMOHXRPQVHGQQM-SFHVURJKSA-N 2 1 300.490 4.166 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)CC1(C)C ZINC001473969398 1061512775 /nfs/dbraw/zinc/51/27/75/1061512775.db2.gz UGLOLDCEBBMIKT-DLBZAZTESA-N 2 1 306.469 4.375 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC001473980195 1061523002 /nfs/dbraw/zinc/52/30/02/1061523002.db2.gz RHPMBJQUQNFBLU-UXHICEINSA-N 2 1 314.517 4.109 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC001473980194 1061523998 /nfs/dbraw/zinc/52/39/98/1061523998.db2.gz RHPMBJQUQNFBLU-PMACEKPBSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@@H]1CCCc2ccccc2[C@H]1[NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1 ZINC001474104659 1061653831 /nfs/dbraw/zinc/65/38/31/1061653831.db2.gz YIGWSSPBWNFAHA-SUMDDJOVSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)C1(c2ccccc2)CCCC1 ZINC001474116441 1061666424 /nfs/dbraw/zinc/66/64/24/1061666424.db2.gz UJOPPKMMLOEJJJ-HKUYNNGSSA-N 2 1 314.517 4.349 20 0 DIADMP CC(C)(C[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1)c1ccccc1 ZINC001474128610 1061674002 /nfs/dbraw/zinc/67/40/02/1061674002.db2.gz YXRWUMGTVOTHMV-HXUWFJFHSA-N 2 1 314.517 4.351 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH2+]CCCC[N@H+](C)C2CC2)cc1C ZINC001474170098 1061715412 /nfs/dbraw/zinc/71/54/12/1061715412.db2.gz GYVUIUULVWOAML-FPLPWBNLSA-N 2 1 300.490 4.089 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC001474209902 1061767379 /nfs/dbraw/zinc/76/73/79/1061767379.db2.gz KKEUPYNNDSHQRD-HLAWJBBLSA-N 2 1 314.517 4.424 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001474217685 1061775111 /nfs/dbraw/zinc/77/51/11/1061775111.db2.gz ITRUUDVDFOAMJE-IEBWSBKVSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001474217685 1061775125 /nfs/dbraw/zinc/77/51/25/1061775125.db2.gz ITRUUDVDFOAMJE-IEBWSBKVSA-N 2 1 300.490 4.208 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC(C)(C)C1CC1 ZINC001474281670 1061849679 /nfs/dbraw/zinc/84/96/79/1061849679.db2.gz STAGTPAPFHGSTO-UHFFFAOYSA-N 2 1 302.506 4.170 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1ccc(SC(F)F)cc1 ZINC001474304495 1061874310 /nfs/dbraw/zinc/87/43/10/1061874310.db2.gz UIOYWIOFJBDCDU-CYBMUJFWSA-N 2 1 316.461 4.211 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001474314232 1061887758 /nfs/dbraw/zinc/88/77/58/1061887758.db2.gz KHERKUQAKUHYBF-QGZVFWFLSA-N 2 1 320.908 4.265 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001474314232 1061887778 /nfs/dbraw/zinc/88/77/78/1061887778.db2.gz KHERKUQAKUHYBF-QGZVFWFLSA-N 2 1 320.908 4.265 20 0 DIADMP CC[N@@H+](CC1CC[NH+](C)CC1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001474345313 1061953603 /nfs/dbraw/zinc/95/36/03/1061953603.db2.gz JGJORZIIPSUHHQ-HXUWFJFHSA-N 2 1 320.496 4.057 20 0 DIADMP C[N@@H+](C[C@@]1(C(C)(C)C)CC[NH+](Cc2ccccc2)C1)C1CCC1 ZINC001474355347 1061966939 /nfs/dbraw/zinc/96/69/39/1061966939.db2.gz KPRGLKLDRAKCKY-NRFANRHFSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1)C1CCC1 ZINC001474355347 1061966962 /nfs/dbraw/zinc/96/69/62/1061966962.db2.gz KPRGLKLDRAKCKY-NRFANRHFSA-N 2 1 314.517 4.409 20 0 DIADMP C[NH+](C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC001474355347 1061966987 /nfs/dbraw/zinc/96/69/87/1061966987.db2.gz KPRGLKLDRAKCKY-NRFANRHFSA-N 2 1 314.517 4.409 20 0 DIADMP CCCc1cccc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC001474359649 1061980184 /nfs/dbraw/zinc/98/01/84/1061980184.db2.gz AXLJKZUJXPNEAM-FQEVSTJZSA-N 2 1 300.490 4.089 20 0 DIADMP CC[NH+](CC)C1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC001254135847 1062031790 /nfs/dbraw/zinc/03/17/90/1062031790.db2.gz FAPBNHBZBSBRRX-UHFFFAOYSA-N 2 1 317.864 4.199 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CCC(F)(F)CC2)CC1 ZINC001254214215 1062049916 /nfs/dbraw/zinc/04/99/16/1062049916.db2.gz FFUFPTZGMPEXET-QAQDUYKDSA-N 2 1 322.443 4.336 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001474413752 1062082464 /nfs/dbraw/zinc/08/24/64/1062082464.db2.gz WVDMDXPBXPRTHE-KRWDZBQOSA-N 2 1 323.484 4.246 20 0 DIADMP CC[NH+](CC)C1CC[NH+](CCCCc2cccc(Cl)c2)CC1 ZINC001459332736 1062091233 /nfs/dbraw/zinc/09/12/33/1062091233.db2.gz HPTDSOBBWJSHIE-UHFFFAOYSA-N 2 1 322.924 4.469 20 0 DIADMP c1ccc(C[N@H+]2CC[C@]3(CC[NH+](C4CCC5(CC5)CC4)C3)C2)cc1 ZINC001254448082 1062106001 /nfs/dbraw/zinc/10/60/01/1062106001.db2.gz OJOBWUGWZPXRFO-QFIPXVFZSA-N 2 1 324.512 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](C4CCC5(CC5)CC4)C3)C2)cc1 ZINC001254448082 1062106010 /nfs/dbraw/zinc/10/60/10/1062106010.db2.gz OJOBWUGWZPXRFO-QFIPXVFZSA-N 2 1 324.512 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@]3(CC[N@H+](C4CCC5(CC5)CC4)C3)C2)cc1 ZINC001254448082 1062106014 /nfs/dbraw/zinc/10/60/14/1062106014.db2.gz OJOBWUGWZPXRFO-QFIPXVFZSA-N 2 1 324.512 4.307 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(CC[NH+](C4CCC5(CC5)CC4)C3)C2)cc1 ZINC001254448081 1062107851 /nfs/dbraw/zinc/10/78/51/1062107851.db2.gz OJOBWUGWZPXRFO-JOCHJYFZSA-N 2 1 324.512 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](C4CCC5(CC5)CC4)C3)C2)cc1 ZINC001254448081 1062107858 /nfs/dbraw/zinc/10/78/58/1062107858.db2.gz OJOBWUGWZPXRFO-JOCHJYFZSA-N 2 1 324.512 4.307 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@H+](C4CCC5(CC5)CC4)C3)C2)cc1 ZINC001254448081 1062107866 /nfs/dbraw/zinc/10/78/66/1062107866.db2.gz OJOBWUGWZPXRFO-JOCHJYFZSA-N 2 1 324.512 4.307 20 0 DIADMP CC(C)[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001474435991 1062112631 /nfs/dbraw/zinc/11/26/31/1062112631.db2.gz RYDLXPLHYIOHRV-YRXWBPOGSA-N 2 1 306.538 4.444 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC001254486235 1062128251 /nfs/dbraw/zinc/12/82/51/1062128251.db2.gz WMLRKIJRTOOAQG-UXHICEINSA-N 2 1 302.506 4.109 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001254500029 1062140985 /nfs/dbraw/zinc/14/09/85/1062140985.db2.gz SOZIDPFLSIGKMV-LJQANCHMSA-N 2 1 312.432 4.067 20 0 DIADMP C[C@H]1CC[N@H+](Cc2ccnn2-c2cc[nH+]cc2)CC12CCCCC2 ZINC001474462313 1062140861 /nfs/dbraw/zinc/14/08/61/1062140861.db2.gz FUSZLWUVFNIAAA-KRWDZBQOSA-N 2 1 324.472 4.060 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccnn2-c2cc[nH+]cc2)CC12CCCCC2 ZINC001474462313 1062140865 /nfs/dbraw/zinc/14/08/65/1062140865.db2.gz FUSZLWUVFNIAAA-KRWDZBQOSA-N 2 1 324.472 4.060 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C(C)(C)Cc2ccc3ccccc3c2)CC1 ZINC001254500487 1062141726 /nfs/dbraw/zinc/14/17/26/1062141726.db2.gz IDFYKRXAISXQTJ-HXUWFJFHSA-N 2 1 310.485 4.235 20 0 DIADMP C[N@H+]1CCC[C@@H](NCc2ccccc2Oc2ccccc2)CC1 ZINC001254500528 1062142364 /nfs/dbraw/zinc/14/23/64/1062142364.db2.gz JHIQZFWWFKMIGB-GOSISDBHSA-N 2 1 310.441 4.053 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC1 ZINC001254500528 1062142394 /nfs/dbraw/zinc/14/23/94/1062142394.db2.gz JHIQZFWWFKMIGB-GOSISDBHSA-N 2 1 310.441 4.053 20 0 DIADMP FC1(F)CC[C@H](C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC001459437241 1062146420 /nfs/dbraw/zinc/14/64/20/1062146420.db2.gz JESZKPGMSIZHER-IRXDYDNUSA-N 2 1 314.464 4.010 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001254510139 1062149297 /nfs/dbraw/zinc/14/92/97/1062149297.db2.gz LUQHDIMDDJECNA-HXUWFJFHSA-N 2 1 312.432 4.067 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C(C)(C)c2cc(Cl)cc(Cl)c2)CC1 ZINC001254506005 1062151101 /nfs/dbraw/zinc/15/11/01/1062151101.db2.gz NGLKICRIAAQVLZ-OAHLLOKOSA-N 2 1 315.288 4.302 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C2(c3cccc(F)c3)CCCCC2)CC1 ZINC001254510906 1062151274 /nfs/dbraw/zinc/15/12/74/1062151274.db2.gz ZBTDVIBCICDRIT-SFHVURJKSA-N 2 1 304.453 4.059 20 0 DIADMP Cc1ccc(Oc2ccc(C[NH2+][C@@H]3CCC[N@H+](C)CC3)cc2)cc1 ZINC001254512801 1062153485 /nfs/dbraw/zinc/15/34/85/1062153485.db2.gz SDGAHLQGDKTQAG-LJQANCHMSA-N 2 1 324.468 4.361 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CC(C)(C)CCc3ccccc32)CC1 ZINC001474475370 1062153834 /nfs/dbraw/zinc/15/38/34/1062153834.db2.gz AHYZZAJFOOHIES-LJQANCHMSA-N 2 1 300.490 4.164 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+]2CCC(CCCc3ccccc3)CC2)CC1 ZINC001254517618 1062155883 /nfs/dbraw/zinc/15/58/83/1062155883.db2.gz XEYJYGVQAMOUSK-OAQYLSRUSA-N 2 1 314.517 4.206 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+]2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001254520153 1062155973 /nfs/dbraw/zinc/15/59/73/1062155973.db2.gz MCGGEHWDIJSRFO-GOSISDBHSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CCC[NH+](C)CC1 ZINC001254529185 1062159972 /nfs/dbraw/zinc/15/99/72/1062159972.db2.gz FDDHHNWLMFLREO-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CCC[N@H+](C)CC1 ZINC001254529185 1062159976 /nfs/dbraw/zinc/15/99/76/1062159976.db2.gz FDDHHNWLMFLREO-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP C[NH+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CCC[N@@H+](C)CC1 ZINC001254529185 1062159983 /nfs/dbraw/zinc/15/99/83/1062159983.db2.gz FDDHHNWLMFLREO-IBGZPJMESA-N 2 1 324.468 4.395 20 0 DIADMP c1ccc2c(c1)CC[C@H]2C[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001474481098 1062162351 /nfs/dbraw/zinc/16/23/51/1062162351.db2.gz VYEIGDRDFXKSKX-ICSRJNTNSA-N 2 1 312.501 4.103 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CCC[NH+](C)CC1 ZINC001254531011 1062163765 /nfs/dbraw/zinc/16/37/65/1062163765.db2.gz IPUOQCHIKYLQDY-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CCC[N@H+](C)CC1 ZINC001254531011 1062163773 /nfs/dbraw/zinc/16/37/73/1062163773.db2.gz IPUOQCHIKYLQDY-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP CC[NH+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CCC[N@@H+](C)CC1 ZINC001254531011 1062163781 /nfs/dbraw/zinc/16/37/81/1062163781.db2.gz IPUOQCHIKYLQDY-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc(C3CC3)c2)cc1 ZINC001474500233 1062179794 /nfs/dbraw/zinc/17/97/94/1062179794.db2.gz FATXFRDSEWGDOD-UHFFFAOYSA-N 2 1 308.469 4.258 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2ccc3oc4ccccc4c3c2)C1 ZINC001474499280 1062180664 /nfs/dbraw/zinc/18/06/64/1062180664.db2.gz PMPZRUBMKPPIKR-KRWDZBQOSA-N 2 1 322.452 4.406 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC001474503344 1062182936 /nfs/dbraw/zinc/18/29/36/1062182936.db2.gz KJCGNDHDVVNLDK-QGZVFWFLSA-N 2 1 320.908 4.121 20 0 DIADMP CCCOc1ccc(C[N@@H+](CC)CCC[NH+]2CCCC2)cc1C ZINC001474501604 1062184823 /nfs/dbraw/zinc/18/48/23/1062184823.db2.gz YRFRLVRSTWQXIL-UHFFFAOYSA-N 2 1 318.505 4.092 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505053 1062186876 /nfs/dbraw/zinc/18/68/76/1062186876.db2.gz NZBMABCXVFTUMB-UYAOXDASSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505053 1062186885 /nfs/dbraw/zinc/18/68/85/1062186885.db2.gz NZBMABCXVFTUMB-UYAOXDASSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]1CCCC[C@H]1C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505049 1062189075 /nfs/dbraw/zinc/18/90/75/1062189075.db2.gz NZBMABCXVFTUMB-ICSRJNTNSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]1CCCC[C@H]1C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505049 1062189088 /nfs/dbraw/zinc/18/90/88/1062189088.db2.gz NZBMABCXVFTUMB-ICSRJNTNSA-N 2 1 314.517 4.409 20 0 DIADMP CCC(C)(C)c1ccc(C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)cc1 ZINC001459548147 1062200197 /nfs/dbraw/zinc/20/01/97/1062200197.db2.gz ZYKLVQRNLKPTSQ-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)cc1 ZINC001459548147 1062200220 /nfs/dbraw/zinc/20/02/20/1062200220.db2.gz ZYKLVQRNLKPTSQ-SFHVURJKSA-N 2 1 302.506 4.148 20 0 DIADMP CC[N@@H+](CC[C@H]1CCC[NH+]1C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001459557234 1062209649 /nfs/dbraw/zinc/20/96/49/1062209649.db2.gz GBSHCMCSZGUPFB-WOJBJXKFSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@@H+]1C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001459557234 1062209665 /nfs/dbraw/zinc/20/96/65/1062209665.db2.gz GBSHCMCSZGUPFB-WOJBJXKFSA-N 2 1 320.496 4.199 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@H+]1C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001459557234 1062209681 /nfs/dbraw/zinc/20/96/81/1062209681.db2.gz GBSHCMCSZGUPFB-WOJBJXKFSA-N 2 1 320.496 4.199 20 0 DIADMP C[C@H](C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583517 1062225001 /nfs/dbraw/zinc/22/50/01/1062225001.db2.gz VLNQBBNELMFCLK-MJGOQNOKSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@H](C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583517 1062225019 /nfs/dbraw/zinc/22/50/19/1062225019.db2.gz VLNQBBNELMFCLK-MJGOQNOKSA-N 2 1 302.506 4.123 20 0 DIADMP C[C@H](C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC001459583517 1062225035 /nfs/dbraw/zinc/22/50/35/1062225035.db2.gz VLNQBBNELMFCLK-MJGOQNOKSA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)CCc1ccccc1F ZINC001474538289 1062226274 /nfs/dbraw/zinc/22/62/74/1062226274.db2.gz SUOOHERZODRWEX-HKUYNNGSSA-N 2 1 320.496 4.247 20 0 DIADMP CC(C)=CCC[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603185 1062238680 /nfs/dbraw/zinc/23/86/80/1062238680.db2.gz BVIHUFTZAAGAQV-AZUAARDMSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603185 1062238699 /nfs/dbraw/zinc/23/86/99/1062238699.db2.gz BVIHUFTZAAGAQV-AZUAARDMSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603185 1062238719 /nfs/dbraw/zinc/23/87/19/1062238719.db2.gz BVIHUFTZAAGAQV-AZUAARDMSA-N 2 1 300.490 4.328 20 0 DIADMP CC(C)=CCC[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001459603185 1062238739 /nfs/dbraw/zinc/23/87/39/1062238739.db2.gz BVIHUFTZAAGAQV-AZUAARDMSA-N 2 1 300.490 4.328 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCCC[C@@H]2C2CCCCC2)C1 ZINC001474573472 1062281622 /nfs/dbraw/zinc/28/16/22/1062281622.db2.gz ZPXLVVPHCDSWBC-RLLQIKCJSA-N 2 1 306.538 4.447 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001459668629 1062288206 /nfs/dbraw/zinc/28/82/06/1062288206.db2.gz LVNKDMUUCKRVEI-APWZRJJASA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001459668629 1062288229 /nfs/dbraw/zinc/28/82/29/1062288229.db2.gz LVNKDMUUCKRVEI-APWZRJJASA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001459668629 1062288255 /nfs/dbraw/zinc/28/82/55/1062288255.db2.gz LVNKDMUUCKRVEI-APWZRJJASA-N 2 1 302.506 4.146 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)C2CCSCC2)CC1 ZINC001255085885 1062310335 /nfs/dbraw/zinc/31/03/35/1062310335.db2.gz TZLQCDNVZNTSMS-QAQDUYKDSA-N 2 1 310.551 4.034 20 0 DIADMP CSCC[C@@H](C)[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001459699624 1062317441 /nfs/dbraw/zinc/31/74/41/1062317441.db2.gz NNSZNKSKZOTYFJ-QGZVFWFLSA-N 2 1 320.546 4.246 20 0 DIADMP C[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129898 1062322095 /nfs/dbraw/zinc/32/20/95/1062322095.db2.gz NCWAYSYTEHBHBI-GEALJGNFSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129898 1062322116 /nfs/dbraw/zinc/32/21/16/1062322116.db2.gz NCWAYSYTEHBHBI-GEALJGNFSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129898 1062322138 /nfs/dbraw/zinc/32/21/38/1062322138.db2.gz NCWAYSYTEHBHBI-GEALJGNFSA-N 2 1 310.441 4.126 20 0 DIADMP FC1CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255122213 1062323321 /nfs/dbraw/zinc/32/33/21/1062323321.db2.gz MWYMWCVOXLVURE-DAKUTMNPSA-N 2 1 316.464 4.052 20 0 DIADMP C[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129901 1062324363 /nfs/dbraw/zinc/32/43/63/1062324363.db2.gz NCWAYSYTEHBHBI-XLNTUCKNSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129901 1062324385 /nfs/dbraw/zinc/32/43/85/1062324385.db2.gz NCWAYSYTEHBHBI-XLNTUCKNSA-N 2 1 310.441 4.126 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccoc1 ZINC001255129901 1062324404 /nfs/dbraw/zinc/32/44/04/1062324404.db2.gz NCWAYSYTEHBHBI-XLNTUCKNSA-N 2 1 310.441 4.126 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255136869 1062325202 /nfs/dbraw/zinc/32/52/02/1062325202.db2.gz OGZSPOQFYZNKQN-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136869 1062325225 /nfs/dbraw/zinc/32/52/25/1062325225.db2.gz OGZSPOQFYZNKQN-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP CCC[NH+](CC1CC1)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136869 1062325248 /nfs/dbraw/zinc/32/52/48/1062325248.db2.gz OGZSPOQFYZNKQN-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CC[C@@H](C)C1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255135358 1062325898 /nfs/dbraw/zinc/32/58/98/1062325898.db2.gz JHVVJXZCNYOSPH-CVYSASLGSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255136976 1062326789 /nfs/dbraw/zinc/32/67/89/1062326789.db2.gz OOZIILOUIUACIM-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255136976 1062326808 /nfs/dbraw/zinc/32/68/08/1062326808.db2.gz OOZIILOUIUACIM-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255136976 1062326825 /nfs/dbraw/zinc/32/68/25/1062326825.db2.gz OOZIILOUIUACIM-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255135362 1062327816 /nfs/dbraw/zinc/32/78/16/1062327816.db2.gz ALKNQHLLJLNFIK-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255135362 1062327833 /nfs/dbraw/zinc/32/78/33/1062327833.db2.gz ALKNQHLLJLNFIK-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255135362 1062327858 /nfs/dbraw/zinc/32/78/58/1062327858.db2.gz ALKNQHLLJLNFIK-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP F[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255135938 1062328503 /nfs/dbraw/zinc/32/85/03/1062328503.db2.gz GJDTXFAFEDUFJQ-YSTOQKLRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255135938 1062328525 /nfs/dbraw/zinc/32/85/25/1062328525.db2.gz GJDTXFAFEDUFJQ-YSTOQKLRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255135938 1062328550 /nfs/dbraw/zinc/32/85/50/1062328550.db2.gz GJDTXFAFEDUFJQ-YSTOQKLRSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[N@@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137436 1062329829 /nfs/dbraw/zinc/32/98/29/1062329829.db2.gz RVBHBZSFBCSNFC-FUMNGEBKSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255137436 1062329848 /nfs/dbraw/zinc/32/98/48/1062329848.db2.gz RVBHBZSFBCSNFC-FUMNGEBKSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255137436 1062329868 /nfs/dbraw/zinc/32/98/68/1062329868.db2.gz RVBHBZSFBCSNFC-FUMNGEBKSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@]1(F)CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255137436 1062329878 /nfs/dbraw/zinc/32/98/78/1062329878.db2.gz RVBHBZSFBCSNFC-FUMNGEBKSA-N 2 1 316.464 4.006 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2C[C@@H]4CCCC[C@@H]4C2)C3)cc1 ZINC001255135339 1062330838 /nfs/dbraw/zinc/33/08/38/1062330838.db2.gz AEULEPCFIPSFTJ-ANWOVWILSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2C[C@@H]4CCCC[C@@H]4C2)C3)cc1 ZINC001255135339 1062330857 /nfs/dbraw/zinc/33/08/57/1062330857.db2.gz AEULEPCFIPSFTJ-ANWOVWILSA-N 2 1 324.512 4.304 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2C[C@@H]4CCCC[C@@H]4C2)C3)cc1 ZINC001255135339 1062330879 /nfs/dbraw/zinc/33/08/79/1062330879.db2.gz AEULEPCFIPSFTJ-ANWOVWILSA-N 2 1 324.512 4.304 20 0 DIADMP C[C@H]1CCC[N@H+]([C@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255136971 1062331682 /nfs/dbraw/zinc/33/16/82/1062331682.db2.gz OOZIILOUIUACIM-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255136971 1062331703 /nfs/dbraw/zinc/33/17/03/1062331703.db2.gz OOZIILOUIUACIM-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255136971 1062331729 /nfs/dbraw/zinc/33/17/29/1062331729.db2.gz OOZIILOUIUACIM-MJUUVYJYSA-N 2 1 312.501 4.304 20 0 DIADMP CC[N@@H+](CCC[NH2+]C[C@@H]1C[C@H]1c1ccccc1)C1CCCCC1 ZINC001474615259 1062334470 /nfs/dbraw/zinc/33/44/70/1062334470.db2.gz SQWXWOKHLZKNFD-FPOVZHCZSA-N 2 1 314.517 4.424 20 0 DIADMP CC1(C)CC[NH+]([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255145985 1062339175 /nfs/dbraw/zinc/33/91/75/1062339175.db2.gz YHJVRCYOCMEZRR-PMOLBWCYSA-N 2 1 312.501 4.304 20 0 DIADMP C[N@@H+](CC(C)(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001255142287 1062339367 /nfs/dbraw/zinc/33/93/67/1062339367.db2.gz BRKORYNUUDMBPE-REPLKXPHSA-N 2 1 300.490 4.160 20 0 DIADMP C[NH+](CC(C)(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255142287 1062339390 /nfs/dbraw/zinc/33/93/90/1062339390.db2.gz BRKORYNUUDMBPE-REPLKXPHSA-N 2 1 300.490 4.160 20 0 DIADMP C[NH+](CC(C)(C)C)[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255142287 1062339409 /nfs/dbraw/zinc/33/94/09/1062339409.db2.gz BRKORYNUUDMBPE-REPLKXPHSA-N 2 1 300.490 4.160 20 0 DIADMP CC[C@@H](C)c1ccc([C@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC001459730093 1062341178 /nfs/dbraw/zinc/34/11/78/1062341178.db2.gz KDAJQJHPDCGVAP-OXQOHEQNSA-N 2 1 313.489 4.463 20 0 DIADMP C1CC(=C2CCC([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)CC2)C1 ZINC001474633584 1062356660 /nfs/dbraw/zinc/35/66/60/1062356660.db2.gz GRRSMWAZQKIPAU-LJQANCHMSA-N 2 1 302.506 4.406 20 0 DIADMP C1CC(=C2CCC([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)CC2)C1 ZINC001474633584 1062356683 /nfs/dbraw/zinc/35/66/83/1062356683.db2.gz GRRSMWAZQKIPAU-LJQANCHMSA-N 2 1 302.506 4.406 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC[C@@H]1C ZINC001459762674 1062371009 /nfs/dbraw/zinc/37/10/09/1062371009.db2.gz IIXQCWGWEDNJFD-ROUUACIJSA-N 2 1 300.490 4.150 20 0 DIADMP CC(C)c1cccc(C[N@@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)c1 ZINC001474646497 1062371803 /nfs/dbraw/zinc/37/18/03/1062371803.db2.gz FCSDZBFJXCISHA-YLJYHZDGSA-N 2 1 302.506 4.362 20 0 DIADMP FC1(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCCCC1 ZINC001255381551 1062420817 /nfs/dbraw/zinc/42/08/17/1062420817.db2.gz QCEGLAKQOLCMHN-IBGZPJMESA-N 2 1 318.480 4.303 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+]C3CCCCCC3)CC2)cc1 ZINC001255378218 1062421700 /nfs/dbraw/zinc/42/17/00/1062421700.db2.gz NCTKUERQUKXPFJ-HXUWFJFHSA-N 2 1 300.490 4.354 20 0 DIADMP CC1CCC([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255378955 1062422647 /nfs/dbraw/zinc/42/26/47/1062422647.db2.gz QGKHYGQNVDNMCX-SKINQDTJSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@@H]3CCc4ccccc43)CC2)cc1 ZINC001255383289 1062423622 /nfs/dbraw/zinc/42/36/22/1062423622.db2.gz HAMWHZPAMDRACT-RBBKRZOGSA-N 2 1 320.480 4.318 20 0 DIADMP CC(C)(C[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)CC1CC1 ZINC001255392253 1062426913 /nfs/dbraw/zinc/42/69/13/1062426913.db2.gz HSJXNORPVXZLOF-FQEVSTJZSA-N 2 1 314.517 4.457 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CCC[N@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393223 1062427394 /nfs/dbraw/zinc/42/73/94/1062427394.db2.gz MMQCMHYOQUMUPL-WOJBJXKFSA-N 2 1 323.484 4.177 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393223 1062427406 /nfs/dbraw/zinc/42/74/06/1062427406.db2.gz MMQCMHYOQUMUPL-WOJBJXKFSA-N 2 1 323.484 4.177 20 0 DIADMP C[N@@H+](C1CCCCC1)[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255395417 1062427710 /nfs/dbraw/zinc/42/77/10/1062427710.db2.gz ADPSAZDHNIPVDJ-HXUWFJFHSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+](C1CCCCC1)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255395417 1062427719 /nfs/dbraw/zinc/42/77/19/1062427719.db2.gz ADPSAZDHNIPVDJ-HXUWFJFHSA-N 2 1 300.490 4.306 20 0 DIADMP C[NH+](C1CCCCC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255395417 1062427727 /nfs/dbraw/zinc/42/77/27/1062427727.db2.gz ADPSAZDHNIPVDJ-HXUWFJFHSA-N 2 1 300.490 4.306 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@@H]3CC34CCCCC4)CC2)cc1 ZINC001255391969 1062428510 /nfs/dbraw/zinc/42/85/10/1062428510.db2.gz WLSBTHVQYNAQNQ-WOJBJXKFSA-N 2 1 312.501 4.354 20 0 DIADMP CC(C)(CC1CC1)[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255393673 1062429513 /nfs/dbraw/zinc/42/95/13/1062429513.db2.gz SXKTWSDTTCKUAO-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)CC1CC1 ZINC001255392254 1062430114 /nfs/dbraw/zinc/43/01/14/1062430114.db2.gz HSJXNORPVXZLOF-HXUWFJFHSA-N 2 1 314.517 4.457 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@@H]1CCC[NH+](Cc3ccccc3)CC1)C2 ZINC001255398960 1062431825 /nfs/dbraw/zinc/43/18/25/1062431825.db2.gz NKPZIQGIIMSPLD-OAQYLSRUSA-N 2 1 320.480 4.365 20 0 DIADMP Cc1cccc2c1C[NH+]([C@@H]1CCC[N@H+](Cc3ccccc3)CC1)C2 ZINC001255398960 1062431832 /nfs/dbraw/zinc/43/18/32/1062431832.db2.gz NKPZIQGIIMSPLD-OAQYLSRUSA-N 2 1 320.480 4.365 20 0 DIADMP Cc1cccc2c1C[NH+]([C@@H]1CCC[N@@H+](Cc3ccccc3)CC1)C2 ZINC001255398960 1062431841 /nfs/dbraw/zinc/43/18/41/1062431841.db2.gz NKPZIQGIIMSPLD-OAQYLSRUSA-N 2 1 320.480 4.365 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400043 1062432481 /nfs/dbraw/zinc/43/24/81/1062432481.db2.gz DCPSMGCIIXEOBV-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400043 1062432495 /nfs/dbraw/zinc/43/24/95/1062432495.db2.gz DCPSMGCIIXEOBV-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400043 1062432509 /nfs/dbraw/zinc/43/25/09/1062432509.db2.gz DCPSMGCIIXEOBV-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC001255400043 1062432516 /nfs/dbraw/zinc/43/25/16/1062432516.db2.gz DCPSMGCIIXEOBV-NJYVYQBISA-N 2 1 312.501 4.163 20 0 DIADMP C[C@H]1C[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398664 1062435524 /nfs/dbraw/zinc/43/55/24/1062435524.db2.gz LXKFRRBIYLIZPC-FUHWJXTLSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398664 1062435533 /nfs/dbraw/zinc/43/55/33/1062435533.db2.gz LXKFRRBIYLIZPC-FUHWJXTLSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CCC1(F)F ZINC001255398664 1062435543 /nfs/dbraw/zinc/43/55/43/1062435543.db2.gz LXKFRRBIYLIZPC-FUHWJXTLSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@]1(F)CCC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)CC1 ZINC001255399798 1062435870 /nfs/dbraw/zinc/43/58/70/1062435870.db2.gz ZWCBRJUBSIFQTC-UXHICEINSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)CC1 ZINC001255399798 1062435876 /nfs/dbraw/zinc/43/58/76/1062435876.db2.gz ZWCBRJUBSIFQTC-UXHICEINSA-N 2 1 318.480 4.255 20 0 DIADMP C[C@]1(F)CCC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255399798 1062435885 /nfs/dbraw/zinc/43/58/85/1062435885.db2.gz ZWCBRJUBSIFQTC-UXHICEINSA-N 2 1 318.480 4.255 20 0 DIADMP c1coc(C[N@H+](C2CC2)[C@H]2CCC[NH+](Cc3ccccc3)CC2)c1 ZINC001255409370 1062437884 /nfs/dbraw/zinc/43/78/84/1062437884.db2.gz WNVVMBZRMNFFSR-IBGZPJMESA-N 2 1 324.468 4.299 20 0 DIADMP c1coc(C[N@@H+](C2CC2)[C@H]2CCC[NH+](Cc3ccccc3)CC2)c1 ZINC001255409370 1062437892 /nfs/dbraw/zinc/43/78/92/1062437892.db2.gz WNVVMBZRMNFFSR-IBGZPJMESA-N 2 1 324.468 4.299 20 0 DIADMP c1coc(C[NH+](C2CC2)[C@H]2CCC[N@H+](Cc3ccccc3)CC2)c1 ZINC001255409370 1062437900 /nfs/dbraw/zinc/43/79/00/1062437900.db2.gz WNVVMBZRMNFFSR-IBGZPJMESA-N 2 1 324.468 4.299 20 0 DIADMP c1coc(C[NH+](C2CC2)[C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255409370 1062437910 /nfs/dbraw/zinc/43/79/10/1062437910.db2.gz WNVVMBZRMNFFSR-IBGZPJMESA-N 2 1 324.468 4.299 20 0 DIADMP FC(F)C1CC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255406430 1062439310 /nfs/dbraw/zinc/43/93/10/1062439310.db2.gz SFEZTBUQKRRDAZ-GOSISDBHSA-N 2 1 322.443 4.018 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CC(c4ccccc4)C3)CC2)cc1 ZINC001255408517 1062439827 /nfs/dbraw/zinc/43/98/27/1062439827.db2.gz MYPFYADVJXFCOJ-QFIPXVFZSA-N 2 1 320.480 4.141 20 0 DIADMP c1cc(C[NH+]2CCC([NH2+]C3CCC3)CC2)cc(C2CCCC2)c1 ZINC001474740211 1062455207 /nfs/dbraw/zinc/45/52/07/1062455207.db2.gz JUQHANKWQHYTSM-UHFFFAOYSA-N 2 1 312.501 4.451 20 0 DIADMP Cc1cccnc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC001474747385 1062462214 /nfs/dbraw/zinc/46/22/14/1062462214.db2.gz BQMQKTDZVOKMOT-AYBZRNKSSA-N 2 1 315.505 4.084 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)C2CCC(C(F)(F)F)CC2)CC1 ZINC001255519368 1062474047 /nfs/dbraw/zinc/47/40/47/1062474047.db2.gz WITIINULWAVDGP-UHFFFAOYSA-N 2 1 320.443 4.160 20 0 DIADMP C[C@@H](CC(F)(F)F)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255643306 1062494507 /nfs/dbraw/zinc/49/45/07/1062494507.db2.gz OSWOEVFAHYITQU-YDHLFZDLSA-N 2 1 306.416 4.232 20 0 DIADMP C[C@@H](CC(F)(F)F)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255643584 1062494750 /nfs/dbraw/zinc/49/47/50/1062494750.db2.gz RKIUYINMIZYBDM-BPUTZDHNSA-N 2 1 314.395 4.099 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001459925795 1062502037 /nfs/dbraw/zinc/50/20/37/1062502037.db2.gz SXJPUGXUPJGFBK-DOTOQJQBSA-N 2 1 320.908 4.391 20 0 DIADMP C[C@@H](CC(F)(F)F)[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001255662127 1062505750 /nfs/dbraw/zinc/50/57/50/1062505750.db2.gz FUSDVVXZLXUUCB-ZDUSSCGKSA-N 2 1 306.416 4.056 20 0 DIADMP C[C@@H](CC(F)(F)F)[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001255662127 1062505766 /nfs/dbraw/zinc/50/57/66/1062505766.db2.gz FUSDVVXZLXUUCB-ZDUSSCGKSA-N 2 1 306.416 4.056 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1Cl ZINC001255668716 1062508481 /nfs/dbraw/zinc/50/84/81/1062508481.db2.gz JRVNFUPAAMOYJX-MUSFGAPCSA-N 2 1 306.881 4.396 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1Cl ZINC001255677813 1062509585 /nfs/dbraw/zinc/50/95/85/1062509585.db2.gz XXEKXBTXQBBEQD-RLAWYHOSSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1Cl ZINC001255677813 1062509608 /nfs/dbraw/zinc/50/96/08/1062509608.db2.gz XXEKXBTXQBBEQD-RLAWYHOSSA-N 2 1 310.844 4.145 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001255670365 1062510116 /nfs/dbraw/zinc/51/01/16/1062510116.db2.gz QKRZEFKLZPIEJJ-XVLXNVKGSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001255670365 1062510136 /nfs/dbraw/zinc/51/01/36/1062510136.db2.gz QKRZEFKLZPIEJJ-XVLXNVKGSA-N 2 1 304.453 4.272 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255684233 1062513399 /nfs/dbraw/zinc/51/33/99/1062513399.db2.gz UWTBAPNXPYXKQV-LSVZVQIISA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255684233 1062513415 /nfs/dbraw/zinc/51/34/15/1062513415.db2.gz UWTBAPNXPYXKQV-LSVZVQIISA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255684233 1062513436 /nfs/dbraw/zinc/51/34/36/1062513436.db2.gz UWTBAPNXPYXKQV-LSVZVQIISA-N 2 1 306.881 4.348 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255684233 1062513457 /nfs/dbraw/zinc/51/34/57/1062513457.db2.gz UWTBAPNXPYXKQV-LSVZVQIISA-N 2 1 306.881 4.348 20 0 DIADMP FC(F)(F)[C@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)C1 ZINC001255696747 1062523439 /nfs/dbraw/zinc/52/34/39/1062523439.db2.gz HUXKJJCVSZVIBI-SOUVJXGZSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)[C@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)C1 ZINC001255696747 1062523456 /nfs/dbraw/zinc/52/34/56/1062523456.db2.gz HUXKJJCVSZVIBI-SOUVJXGZSA-N 2 1 318.427 4.104 20 0 DIADMP CC(C)[N@@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC001255701293 1062527598 /nfs/dbraw/zinc/52/75/98/1062527598.db2.gz UHUUZATWMHFEPB-TUVASFSCSA-N 2 1 306.416 4.088 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC001459981324 1062542714 /nfs/dbraw/zinc/54/27/14/1062542714.db2.gz YDVZEDKAMIIOQB-PWRODBHTSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](CSc1ccc(F)cc1)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC001255727851 1062547404 /nfs/dbraw/zinc/54/74/04/1062547404.db2.gz IFRBEKVDQYYIAO-CVEARBPZSA-N 2 1 324.509 4.160 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001255759449 1062581908 /nfs/dbraw/zinc/58/19/08/1062581908.db2.gz WCOWLBCXKWVEOK-ZJPYXAASSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(SC[C@@H](C)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001255759449 1062581936 /nfs/dbraw/zinc/58/19/36/1062581936.db2.gz WCOWLBCXKWVEOK-ZJPYXAASSA-N 2 1 318.530 4.081 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001255772785 1062597038 /nfs/dbraw/zinc/59/70/38/1062597038.db2.gz KIMRKBCUHGUEJH-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)cc1 ZINC001255793137 1062609125 /nfs/dbraw/zinc/60/91/25/1062609125.db2.gz AYQVIEZCAPUZFC-HLAWJBBLSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001255793137 1062609135 /nfs/dbraw/zinc/60/91/35/1062609135.db2.gz AYQVIEZCAPUZFC-HLAWJBBLSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001255793137 1062609147 /nfs/dbraw/zinc/60/91/47/1062609147.db2.gz AYQVIEZCAPUZFC-HLAWJBBLSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@H](C)CC(C)C)C2)s1 ZINC001460073703 1062617125 /nfs/dbraw/zinc/61/71/25/1062617125.db2.gz PILGGVAEXCRNPB-SJLPKXTDSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@H](C)CC(C)C)C2)s1 ZINC001460073703 1062617138 /nfs/dbraw/zinc/61/71/38/1062617138.db2.gz PILGGVAEXCRNPB-SJLPKXTDSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C[C@H](C)CC(C)C)C2)s1 ZINC001460073703 1062617155 /nfs/dbraw/zinc/61/71/55/1062617155.db2.gz PILGGVAEXCRNPB-SJLPKXTDSA-N 2 1 322.562 4.492 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255837106 1062621145 /nfs/dbraw/zinc/62/11/45/1062621145.db2.gz AYGUDOXZVAFNHJ-KBAYOESNSA-N 2 1 320.496 4.375 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100449 1062636615 /nfs/dbraw/zinc/63/66/15/1062636615.db2.gz SMORZWBIFDDFRO-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC001460100449 1062636624 /nfs/dbraw/zinc/63/66/24/1062636624.db2.gz SMORZWBIFDDFRO-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP CC(C)(C)SCCC[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC001460129300 1062652068 /nfs/dbraw/zinc/65/20/68/1062652068.db2.gz LTLDBUHKQZTMBL-UHFFFAOYSA-N 2 1 320.546 4.162 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cnc(-c2ccccc2)s1 ZINC001255944806 1062666034 /nfs/dbraw/zinc/66/60/34/1062666034.db2.gz ZKZOTTFRIUXRRR-OAHLLOKOSA-N 2 1 317.502 4.020 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255954758 1062668144 /nfs/dbraw/zinc/66/81/44/1062668144.db2.gz ZLSHFZWIIPXJCO-QWFCFKBJSA-N 2 1 323.569 4.011 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cccc(OC(C)(C)C)c1 ZINC001255953357 1062669144 /nfs/dbraw/zinc/66/91/44/1062669144.db2.gz ZXQMGWOTJVUTMR-MRXNPFEDSA-N 2 1 306.494 4.074 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](CC1CC1)c1ccccc1F ZINC001255952652 1062670390 /nfs/dbraw/zinc/67/03/90/1062670390.db2.gz GGNPNTBBGXCYHX-HNAYVOBHSA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC001255948965 1062670933 /nfs/dbraw/zinc/67/09/33/1062670933.db2.gz SKLVCZKUCDXTIJ-KGLIPLIRSA-N 2 1 316.411 4.476 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC001256109021 1062709423 /nfs/dbraw/zinc/70/94/23/1062709423.db2.gz RWWGHSMMCPISLI-MUGJNUQGSA-N 2 1 300.490 4.175 20 0 DIADMP C[NH+]1CCC2(CC[N@H+]([C@@H]3CCC[C@H](c4ccccc4)C3)C2)CC1 ZINC001256120607 1062721351 /nfs/dbraw/zinc/72/13/51/1062721351.db2.gz HKZVCQCZOQWHGX-VQTJNVASSA-N 2 1 312.501 4.131 20 0 DIADMP Cc1cccc(C2([NH2+]C3CC[NH+](C)CC3)CCC(F)(F)CC2)c1 ZINC001256199685 1062745327 /nfs/dbraw/zinc/74/53/27/1062745327.db2.gz USYWJOHXBNPYLK-UHFFFAOYSA-N 2 1 322.443 4.083 20 0 DIADMP CCOC1CCC([N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001256433058 1062818421 /nfs/dbraw/zinc/81/84/21/1062818421.db2.gz GDUILBYNHNRADY-CAAWEGIDSA-N 2 1 322.537 4.239 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256519704 1062842636 /nfs/dbraw/zinc/84/26/36/1062842636.db2.gz CJONQGWOGAIFFP-HKUYNNGSSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256519704 1062842657 /nfs/dbraw/zinc/84/26/57/1062842657.db2.gz CJONQGWOGAIFFP-HKUYNNGSSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528216 1062844706 /nfs/dbraw/zinc/84/47/06/1062844706.db2.gz CMHKPILGQYXBEX-PIKOESSRSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256528216 1062844722 /nfs/dbraw/zinc/84/47/22/1062844722.db2.gz CMHKPILGQYXBEX-PIKOESSRSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C2CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536857 1062853120 /nfs/dbraw/zinc/85/31/20/1062853120.db2.gz JARYTXHSRNNQKD-XLIONFOSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C2CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256536857 1062853132 /nfs/dbraw/zinc/85/31/32/1062853132.db2.gz JARYTXHSRNNQKD-XLIONFOSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536857 1062853174 /nfs/dbraw/zinc/85/31/74/1062853174.db2.gz JARYTXHSRNNQKD-XLIONFOSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C2CCCCC2)CC[NH+]1Cc1ccccc1 ZINC001256536857 1062853193 /nfs/dbraw/zinc/85/31/93/1062853193.db2.gz JARYTXHSRNNQKD-XLIONFOSSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@](C)(F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256536779 1062854558 /nfs/dbraw/zinc/85/45/58/1062854558.db2.gz FUWSAOWHRUPILU-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@](C)(F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256536779 1062854578 /nfs/dbraw/zinc/85/45/78/1062854578.db2.gz FUWSAOWHRUPILU-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536779 1062854601 /nfs/dbraw/zinc/85/46/01/1062854601.db2.gz FUWSAOWHRUPILU-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@](C)(F)CC2)CC[NH+]1Cc1ccccc1 ZINC001256536779 1062854625 /nfs/dbraw/zinc/85/46/25/1062854625.db2.gz FUWSAOWHRUPILU-HOJAQTOUSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256528411 1062855416 /nfs/dbraw/zinc/85/54/16/1062855416.db2.gz FBDVJWMAZBOWSF-RAUXBKROSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256528411 1062855439 /nfs/dbraw/zinc/85/54/39/1062855439.db2.gz FBDVJWMAZBOWSF-RAUXBKROSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC3(CCC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256542951 1062861999 /nfs/dbraw/zinc/86/19/99/1062861999.db2.gz RHMHJROQOYYMQB-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([NH+]2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256539868 1062863749 /nfs/dbraw/zinc/86/37/49/1062863749.db2.gz YNNIAIQDAFXWKQ-LAUBAEHRSA-N 2 1 306.453 4.055 20 0 DIADMP C[C@H]1C[C@H]([NH+]2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001256539868 1062863770 /nfs/dbraw/zinc/86/37/70/1062863770.db2.gz YNNIAIQDAFXWKQ-LAUBAEHRSA-N 2 1 306.453 4.055 20 0 DIADMP Cc1cccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538669 1062864262 /nfs/dbraw/zinc/86/42/62/1062864262.db2.gz UZQKEQNVACIMAO-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538669 1062864281 /nfs/dbraw/zinc/86/42/81/1062864281.db2.gz UZQKEQNVACIMAO-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538669 1062864305 /nfs/dbraw/zinc/86/43/05/1062864305.db2.gz UZQKEQNVACIMAO-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001256538669 1062864329 /nfs/dbraw/zinc/86/43/29/1062864329.db2.gz UZQKEQNVACIMAO-UGKGYDQZSA-N 2 1 322.496 4.480 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256550762 1062866603 /nfs/dbraw/zinc/86/66/03/1062866603.db2.gz NPTUYUPDWOPAOE-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256550762 1062866621 /nfs/dbraw/zinc/86/66/21/1062866621.db2.gz NPTUYUPDWOPAOE-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550762 1062866643 /nfs/dbraw/zinc/86/66/43/1062866643.db2.gz NPTUYUPDWOPAOE-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550762 1062866665 /nfs/dbraw/zinc/86/66/65/1062866665.db2.gz NPTUYUPDWOPAOE-ICSRJNTNSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@H]1C ZINC001256549503 1062867976 /nfs/dbraw/zinc/86/79/76/1062867976.db2.gz HTCVIANLOTYUBY-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@@H](C)C2)[C@H]1C ZINC001256549503 1062868003 /nfs/dbraw/zinc/86/80/03/1062868003.db2.gz HTCVIANLOTYUBY-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)[C@H]1C ZINC001256549503 1062868030 /nfs/dbraw/zinc/86/80/30/1062868030.db2.gz HTCVIANLOTYUBY-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)[C@H]1C ZINC001256549503 1062868055 /nfs/dbraw/zinc/86/80/55/1062868055.db2.gz HTCVIANLOTYUBY-DOADOZAASA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@@H]1C ZINC001256549505 1062868997 /nfs/dbraw/zinc/86/89/97/1062868997.db2.gz HTCVIANLOTYUBY-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)[C@@H]1C ZINC001256549505 1062869015 /nfs/dbraw/zinc/86/90/15/1062869015.db2.gz HTCVIANLOTYUBY-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)[C@@H]1C ZINC001256549505 1062869034 /nfs/dbraw/zinc/86/90/34/1062869034.db2.gz HTCVIANLOTYUBY-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)[C@@H]1C ZINC001256549505 1062869044 /nfs/dbraw/zinc/86/90/44/1062869044.db2.gz HTCVIANLOTYUBY-SOAMZJECSA-N 2 1 300.490 4.160 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548948 1062870270 /nfs/dbraw/zinc/87/02/70/1062870270.db2.gz CSUAKBICHMBMCY-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548948 1062870286 /nfs/dbraw/zinc/87/02/86/1062870286.db2.gz CSUAKBICHMBMCY-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548948 1062870305 /nfs/dbraw/zinc/87/03/05/1062870305.db2.gz CSUAKBICHMBMCY-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256548948 1062870309 /nfs/dbraw/zinc/87/03/09/1062870309.db2.gz CSUAKBICHMBMCY-SIKLNZKXSA-N 2 1 322.496 4.480 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256552488 1062873690 /nfs/dbraw/zinc/87/36/90/1062873690.db2.gz BECPXIWIMKIQMP-RLLQIKCJSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256552488 1062873708 /nfs/dbraw/zinc/87/37/08/1062873708.db2.gz BECPXIWIMKIQMP-RLLQIKCJSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256552488 1062873731 /nfs/dbraw/zinc/87/37/31/1062873731.db2.gz BECPXIWIMKIQMP-RLLQIKCJSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256552488 1062873755 /nfs/dbraw/zinc/87/37/55/1062873755.db2.gz BECPXIWIMKIQMP-RLLQIKCJSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256556117 1062886479 /nfs/dbraw/zinc/88/64/79/1062886479.db2.gz XFBYDWRSJYOQJG-GHTZIAJQSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256556117 1062886505 /nfs/dbraw/zinc/88/65/05/1062886505.db2.gz XFBYDWRSJYOQJG-GHTZIAJQSA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(-c3cccnc3)cc2)CC1 ZINC001256564990 1062890461 /nfs/dbraw/zinc/89/04/61/1062890461.db2.gz ZMEUNSPMSGFEDA-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CCCC[C@@H]2c2ccccc2)CC1 ZINC001256569018 1062895014 /nfs/dbraw/zinc/89/50/14/1062895014.db2.gz NVWKKVCGXANANQ-LJQANCHMSA-N 2 1 300.490 4.477 20 0 DIADMP C[N@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)C[C@H]1CC1(C)C ZINC001460520864 1062896528 /nfs/dbraw/zinc/89/65/28/1062896528.db2.gz WFYIBYRPKGZNRP-LJQANCHMSA-N 2 1 300.490 4.150 20 0 DIADMP COc1cccc([C@H]2CCC[N@H+]2C2CC[NH+](C(C)(C)C)CC2)c1 ZINC001256575332 1062898461 /nfs/dbraw/zinc/89/84/61/1062898461.db2.gz LUKBEPAMFDZTSY-LJQANCHMSA-N 2 1 316.489 4.095 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)CC1 ZINC001256577241 1062898725 /nfs/dbraw/zinc/89/87/25/1062898725.db2.gz FWMLWGXBWILHHI-LJQANCHMSA-N 2 1 318.480 4.096 20 0 DIADMP CC(C)C1CC[NH+](C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001256608854 1062913508 /nfs/dbraw/zinc/91/35/08/1062913508.db2.gz HMXAEBKMEISUIQ-UHFFFAOYSA-N 2 1 300.490 4.019 20 0 DIADMP CC1(C)CC[C@@H](C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001256601876 1062913851 /nfs/dbraw/zinc/91/38/51/1062913851.db2.gz ITUPGEPAIVNREB-GOSISDBHSA-N 2 1 300.490 4.067 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CCC(C)([NH+](C)C)CC2)cc1 ZINC001460632768 1062949616 /nfs/dbraw/zinc/94/96/16/1062949616.db2.gz IEDIAVOIOHREEP-UHFFFAOYSA-N 2 1 302.506 4.290 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)c1 ZINC001460672729 1062978045 /nfs/dbraw/zinc/97/80/45/1062978045.db2.gz UYINHHJQZQIFTN-UHFFFAOYSA-N 2 1 302.506 4.103 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1ccccc1C1CC1 ZINC001460693753 1062992581 /nfs/dbraw/zinc/99/25/81/1062992581.db2.gz SMUYRFDLUPWGTP-UHFFFAOYSA-N 2 1 300.490 4.262 20 0 DIADMP [NH2+]=C(N[C@@H]1CCC[N@H+](C2CCCC2)C1)c1cccc2ccccc21 ZINC001256908294 1063041610 /nfs/dbraw/zinc/04/16/10/1063041610.db2.gz MDMVBVSPMMEBBZ-QGZVFWFLSA-N 2 1 321.468 4.162 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+]([C@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001460795313 1063062590 /nfs/dbraw/zinc/06/25/90/1063062590.db2.gz OZFUAFFJONHZEO-QGZVFWFLSA-N 2 1 312.501 4.187 20 0 DIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(-c3ccsc3)cc2)CC1 ZINC001257207928 1063137960 /nfs/dbraw/zinc/13/79/60/1063137960.db2.gz ASFGPURNCCZKJL-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H](CC2CC2)c2ccccc2F)CC1 ZINC001257211245 1063145023 /nfs/dbraw/zinc/14/50/23/1063145023.db2.gz CPLSKNBPYRKSIZ-IBGZPJMESA-N 2 1 304.453 4.129 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC001257221648 1063148528 /nfs/dbraw/zinc/14/85/28/1063148528.db2.gz BJTAIHUDPDRCLU-INIZCTEOSA-N 2 1 306.881 4.002 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257252201 1063159828 /nfs/dbraw/zinc/15/98/28/1063159828.db2.gz ATWZHFFAZXLKGW-KZNAEPCWSA-N 2 1 306.469 4.476 20 0 DIADMP CCC[C@@H](CC)[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001257263349 1063166360 /nfs/dbraw/zinc/16/63/60/1063166360.db2.gz QUWQCEHIBDICDZ-GOSISDBHSA-N 2 1 304.478 4.146 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC001257292893 1063184515 /nfs/dbraw/zinc/18/45/15/1063184515.db2.gz XRBSBRDGQGUJCM-ROUUACIJSA-N 2 1 318.505 4.248 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257301510 1063190962 /nfs/dbraw/zinc/19/09/62/1063190962.db2.gz HVEJDROKYVRCMI-RBUKOAKNSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257301510 1063190974 /nfs/dbraw/zinc/19/09/74/1063190974.db2.gz HVEJDROKYVRCMI-RBUKOAKNSA-N 2 1 300.490 4.019 20 0 DIADMP CCC(CC)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257301510 1063190984 /nfs/dbraw/zinc/19/09/84/1063190984.db2.gz HVEJDROKYVRCMI-RBUKOAKNSA-N 2 1 300.490 4.019 20 0 DIADMP CC[NH+](CC)[C@@H](C[NH2+][C@H]1CCOC2(CCCCC2)C1)CC(C)C ZINC001461029118 1063198948 /nfs/dbraw/zinc/19/89/48/1063198948.db2.gz IZCMFSFRMFBSQJ-RBUKOAKNSA-N 2 1 324.553 4.214 20 0 DIADMP CCC[C@@H](C)[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257324572 1063205371 /nfs/dbraw/zinc/20/53/71/1063205371.db2.gz PMXGCSLTMCDJGO-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001257324572 1063205395 /nfs/dbraw/zinc/20/53/95/1063205395.db2.gz PMXGCSLTMCDJGO-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001257324572 1063205416 /nfs/dbraw/zinc/20/54/16/1063205416.db2.gz PMXGCSLTMCDJGO-QUCCMNQESA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257328687 1063211235 /nfs/dbraw/zinc/21/12/35/1063211235.db2.gz SPSZWCFZHCAHFF-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257328687 1063211256 /nfs/dbraw/zinc/21/12/56/1063211256.db2.gz SPSZWCFZHCAHFF-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001257328687 1063211279 /nfs/dbraw/zinc/21/12/79/1063211279.db2.gz SPSZWCFZHCAHFF-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1C ZINC001461049565 1063216744 /nfs/dbraw/zinc/21/67/44/1063216744.db2.gz GLJOUTCXNDPQSG-IBGZPJMESA-N 2 1 302.506 4.356 20 0 DIADMP CC[C@H](C[NH2+]C[C@H](C1CCCCC1)[NH+](C)C)c1ccccc1 ZINC001461050737 1063219973 /nfs/dbraw/zinc/21/99/73/1063219973.db2.gz MLAJEXVIKOJQJQ-YLJYHZDGSA-N 2 1 302.506 4.280 20 0 DIADMP Cc1ccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)c2)cc1 ZINC001461057581 1063225150 /nfs/dbraw/zinc/22/51/50/1063225150.db2.gz HDYVUDSUHLLNMX-YADHBBJMSA-N 2 1 320.480 4.378 20 0 DIADMP CCCCCC[C@@H](C)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001257362134 1063232034 /nfs/dbraw/zinc/23/20/34/1063232034.db2.gz WGQMUADFODQVJR-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP CCCCCC[C@@H](C)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001257365335 1063233039 /nfs/dbraw/zinc/23/30/39/1063233039.db2.gz KSXXOGSXCLVZIU-MSOLQXFVSA-N 2 1 324.553 4.357 20 0 DIADMP CCCC[C@H](CC)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257416843 1063265895 /nfs/dbraw/zinc/26/58/95/1063265895.db2.gz SJPPNLIESYIFHU-FHWLQOOXSA-N 2 1 303.494 4.122 20 0 DIADMP [NH3+]C1CCC([N@@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCCCC2)CC1 ZINC001257451810 1063283688 /nfs/dbraw/zinc/28/36/88/1063283688.db2.gz VSVKFQXDSYWMAB-NLDTVIPQSA-N 2 1 312.501 4.447 20 0 DIADMP CCC[C@H](C)CC[C@@H](C)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001257480295 1063300241 /nfs/dbraw/zinc/30/02/41/1063300241.db2.gz CZGZCGKCVCQPAV-NSHGMRRFSA-N 2 1 324.553 4.167 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001461173086 1063307224 /nfs/dbraw/zinc/30/72/24/1063307224.db2.gz WBZCMQSLPTWCGB-LEWJYISDSA-N 2 1 314.517 4.178 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001461173086 1063307251 /nfs/dbraw/zinc/30/72/51/1063307251.db2.gz WBZCMQSLPTWCGB-LEWJYISDSA-N 2 1 314.517 4.178 20 0 DIADMP C[NH+](C)CC[C@H]([NH2+]Cc1cnc(C2CCCC2)s1)C(C)(C)C ZINC001461192975 1063323814 /nfs/dbraw/zinc/32/38/14/1063323814.db2.gz NGOVHVGDDPTJMO-INIZCTEOSA-N 2 1 323.550 4.257 20 0 DIADMP CCCCC[C@@H](C)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001257517059 1063325171 /nfs/dbraw/zinc/32/51/71/1063325171.db2.gz QQXRPYZQKQELDB-GOSISDBHSA-N 2 1 314.517 4.478 20 0 DIADMP CCCCC[C@@H](C)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001257517059 1063325190 /nfs/dbraw/zinc/32/51/90/1063325190.db2.gz QQXRPYZQKQELDB-GOSISDBHSA-N 2 1 314.517 4.478 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@@H]2CCCSC2)CC1 ZINC001257667156 1063362975 /nfs/dbraw/zinc/36/29/75/1063362975.db2.gz VUIUGHNNZXVVQQ-KZNAEPCWSA-N 2 1 310.551 4.034 20 0 DIADMP CC(C)OC1CCC([N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)CC1 ZINC001257883006 1063422549 /nfs/dbraw/zinc/42/25/49/1063422549.db2.gz KXPRHNHMSLXKST-NUVZVAJJSA-N 2 1 322.537 4.061 20 0 DIADMP CC(C)OC1CCC([NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)CC1 ZINC001257883006 1063422560 /nfs/dbraw/zinc/42/25/60/1063422560.db2.gz KXPRHNHMSLXKST-NUVZVAJJSA-N 2 1 322.537 4.061 20 0 DIADMP CC(C)OC1CCC([NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)CC1 ZINC001257883006 1063422576 /nfs/dbraw/zinc/42/25/76/1063422576.db2.gz KXPRHNHMSLXKST-NUVZVAJJSA-N 2 1 322.537 4.061 20 0 DIADMP C[NH+]1CCC2(CC[N@H+](C3CCC(c4ccccc4)CC3)C2)CC1 ZINC001257998344 1063456443 /nfs/dbraw/zinc/45/64/43/1063456443.db2.gz CFRQBHLMMOEVCD-UHFFFAOYSA-N 2 1 312.501 4.131 20 0 DIADMP Cc1cc(C)cc(-c2ccc(C[NH2+]CC3=CC[N@@H+](C)CC3)cc2)c1 ZINC001461379404 1063459220 /nfs/dbraw/zinc/45/92/20/1063459220.db2.gz GIMSDYRPVLHIIJ-UHFFFAOYSA-N 2 1 320.480 4.322 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccc(Cl)c(F)c2)CC1 ZINC001258002733 1063459371 /nfs/dbraw/zinc/45/93/71/1063459371.db2.gz AWHNDDMENJXYRN-CYBMUJFWSA-N 2 1 312.860 4.250 20 0 DIADMP c1[nH+]cn(C2CCC(c3ccccc3)CC2)c1C1CC[NH2+]CC1 ZINC001257998771 1063459743 /nfs/dbraw/zinc/45/97/43/1063459743.db2.gz RDRNGTSDELPHMT-UHFFFAOYSA-N 2 1 309.457 4.249 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccc(F)c(Cl)c2)CC1 ZINC001258002981 1063459998 /nfs/dbraw/zinc/45/99/98/1063459998.db2.gz RPCBUWSPFJRFFD-CYBMUJFWSA-N 2 1 312.860 4.250 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccccc1F ZINC001258006698 1063463764 /nfs/dbraw/zinc/46/37/64/1063463764.db2.gz LVGLSNQPJFKOEU-IBGZPJMESA-N 2 1 306.469 4.377 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](CCc1ccc(Cl)cc1)CC1CC1 ZINC001473160131 1063466308 /nfs/dbraw/zinc/46/63/08/1063466308.db2.gz GCFPZEKQNQVKBY-LJQANCHMSA-N 2 1 320.908 4.079 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC001473160131 1063466314 /nfs/dbraw/zinc/46/63/14/1063466314.db2.gz GCFPZEKQNQVKBY-LJQANCHMSA-N 2 1 320.908 4.079 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC001473160131 1063466320 /nfs/dbraw/zinc/46/63/20/1063466320.db2.gz GCFPZEKQNQVKBY-LJQANCHMSA-N 2 1 320.908 4.079 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC001473169721 1063471368 /nfs/dbraw/zinc/47/13/68/1063471368.db2.gz FJSQAVQCCCCXSU-LTFPLMDUSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC001473169721 1063471379 /nfs/dbraw/zinc/47/13/79/1063471379.db2.gz FJSQAVQCCCCXSU-LTFPLMDUSA-N 2 1 304.522 4.009 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@@H]2CC[C@H]3C[C@H]3C2)C1 ZINC001473169721 1063471392 /nfs/dbraw/zinc/47/13/92/1063471392.db2.gz FJSQAVQCCCCXSU-LTFPLMDUSA-N 2 1 304.522 4.009 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001473169869 1063472610 /nfs/dbraw/zinc/47/26/10/1063472610.db2.gz HXYLIHAFACVFAX-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001473169869 1063472619 /nfs/dbraw/zinc/47/26/19/1063472619.db2.gz HXYLIHAFACVFAX-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001473169869 1063472628 /nfs/dbraw/zinc/47/26/28/1063472628.db2.gz HXYLIHAFACVFAX-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001473169864 1063472894 /nfs/dbraw/zinc/47/28/94/1063472894.db2.gz HXYLIHAFACVFAX-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001473169864 1063472907 /nfs/dbraw/zinc/47/29/07/1063472907.db2.gz HXYLIHAFACVFAX-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001473169864 1063472915 /nfs/dbraw/zinc/47/29/15/1063472915.db2.gz HXYLIHAFACVFAX-PMACEKPBSA-N 2 1 314.517 4.390 20 0 DIADMP c1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)ccc1C[NH+]1CCCCC1 ZINC001473171628 1063476168 /nfs/dbraw/zinc/47/61/68/1063476168.db2.gz DENUMBHWFYNKJC-SFTDATJTSA-N 2 1 312.501 4.437 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)CCC[NH+]2CCCCC2)cc1 ZINC001473186907 1063497179 /nfs/dbraw/zinc/49/71/79/1063497179.db2.gz NLYBVJJROCUDDT-LEWJYISDSA-N 2 1 314.517 4.439 20 0 DIADMP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+]([C@H](C)C[C@@H](C)CC(C)C)CC1 ZINC001258075255 1063502561 /nfs/dbraw/zinc/50/25/61/1063502561.db2.gz TXKWKJCLWDYXPS-NLWGTHIKSA-N 2 1 324.553 4.022 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258093615 1063514963 /nfs/dbraw/zinc/51/49/63/1063514963.db2.gz SIEQYLXFCLTKGP-MSOLQXFVSA-N 2 1 322.537 4.133 20 0 DIADMP CC(C)=CCC[C@H](C)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258097895 1063518680 /nfs/dbraw/zinc/51/86/80/1063518680.db2.gz QDXXIDDMFPXXLY-KRWDZBQOSA-N 2 1 301.478 4.083 20 0 DIADMP Cc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1C ZINC001258133816 1063528423 /nfs/dbraw/zinc/52/84/23/1063528423.db2.gz RFUZKRMHTXTXHJ-UHFFFAOYSA-N 2 1 322.496 4.100 20 0 DIADMP Cc1ccc(C[N@@H+](C)C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC001258145811 1063532311 /nfs/dbraw/zinc/53/23/11/1063532311.db2.gz LPUFEKDTTKHFSY-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP Cc1ccc(C[N@H+](C)C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC001258145811 1063532324 /nfs/dbraw/zinc/53/23/24/1063532324.db2.gz LPUFEKDTTKHFSY-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001461488537 1063534660 /nfs/dbraw/zinc/53/46/60/1063534660.db2.gz SLCYUJZZBBBGON-ZWKOTPCHSA-N 2 1 318.549 4.481 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001461488537 1063534674 /nfs/dbraw/zinc/53/46/74/1063534674.db2.gz SLCYUJZZBBBGON-ZWKOTPCHSA-N 2 1 318.549 4.481 20 0 DIADMP CCCc1ccc(C[NH2+][C@@H](CC(C)C)C[NH+]2CCCC2)cc1 ZINC001461523529 1063557632 /nfs/dbraw/zinc/55/76/32/1063557632.db2.gz VMULEEWHDCLLEJ-FQEVSTJZSA-N 2 1 302.506 4.239 20 0 DIADMP CSCC[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001258209926 1063562648 /nfs/dbraw/zinc/56/26/48/1063562648.db2.gz XAMSGIVKZUYFPZ-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP CSCC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001258209926 1063562665 /nfs/dbraw/zinc/56/26/65/1063562665.db2.gz XAMSGIVKZUYFPZ-FUHWJXTLSA-N 2 1 320.546 4.018 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](C2CCCCCCC2)CC1 ZINC001258240364 1063577312 /nfs/dbraw/zinc/57/73/12/1063577312.db2.gz QMKAWBUWWGYQDE-UHFFFAOYSA-N 2 1 301.478 4.042 20 0 DIADMP CC1(C)CCC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3F)CC2)C1 ZINC001258279695 1063584585 /nfs/dbraw/zinc/58/45/85/1063584585.db2.gz NOKNGENRLQXCQO-OAHLLOKOSA-N 2 1 304.453 4.044 20 0 DIADMP CCC[N@@H+](CCC[NH3+])[C@@H](C)CC(C)(C)SCc1ccco1 ZINC001258293971 1063592230 /nfs/dbraw/zinc/59/22/30/1063592230.db2.gz FBULJRVNCNPDRD-HNNXBMFYSA-N 2 1 312.523 4.131 20 0 DIADMP C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)CC(C)(C)SCc1ccco1 ZINC001258295843 1063592691 /nfs/dbraw/zinc/59/26/91/1063592691.db2.gz QYIZBRBZBBDKEI-HOTGVXAUSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC001258293987 1063593918 /nfs/dbraw/zinc/59/39/18/1063593918.db2.gz FLNICGACZFEULP-CVEARBPZSA-N 2 1 324.534 4.001 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)CC1 ZINC001461591228 1063599591 /nfs/dbraw/zinc/59/95/91/1063599591.db2.gz YCEFSEZZWHWPFG-WLRLJWMZSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001258303690 1063600725 /nfs/dbraw/zinc/60/07/25/1063600725.db2.gz WKABKDHSMNCXQO-HOTGVXAUSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001258303692 1063600832 /nfs/dbraw/zinc/60/08/32/1063600832.db2.gz WKABKDHSMNCXQO-HZPDHXFCSA-N 2 1 324.534 4.144 20 0 DIADMP CC[C@@H](C)CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622294 1063619345 /nfs/dbraw/zinc/61/93/45/1063619345.db2.gz OGCRXHGIPQDYAA-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H](C)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001461622294 1063619351 /nfs/dbraw/zinc/61/93/51/1063619351.db2.gz OGCRXHGIPQDYAA-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H](CC1CC1)[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001258453628 1063661243 /nfs/dbraw/zinc/66/12/43/1063661243.db2.gz BVLFRFOZFWFYRR-JPRXFOQLSA-N 2 1 312.501 4.303 20 0 DIADMP Cc1ccc(C[N@H+]([C@@H](C)CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001258456880 1063663130 /nfs/dbraw/zinc/66/31/30/1063663130.db2.gz RHGSWXBDMUPTTG-VDGAXYAQSA-N 2 1 300.490 4.256 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001258460633 1063663233 /nfs/dbraw/zinc/66/32/33/1063663233.db2.gz JPJLMKUVJOUAQI-VQIMIIECSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@@H](CC1CC1)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001258460632 1063663585 /nfs/dbraw/zinc/66/35/85/1063663585.db2.gz JPJLMKUVJOUAQI-QFBILLFUSA-N 2 1 316.489 4.145 20 0 DIADMP C[C@H](CC1CC1)[N@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001258471754 1063669793 /nfs/dbraw/zinc/66/97/93/1063669793.db2.gz FBGWALMFGZWBTD-JRGCBEDISA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001258471754 1063669800 /nfs/dbraw/zinc/66/98/00/1063669800.db2.gz FBGWALMFGZWBTD-JRGCBEDISA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001258471754 1063669809 /nfs/dbraw/zinc/66/98/09/1063669809.db2.gz FBGWALMFGZWBTD-JRGCBEDISA-N 2 1 312.501 4.019 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001258597200 1063700912 /nfs/dbraw/zinc/70/09/12/1063700912.db2.gz FECPIYJWCYLVFN-CQSZACIVSA-N 2 1 306.881 4.169 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258598580 1063702925 /nfs/dbraw/zinc/70/29/25/1063702925.db2.gz UZPAYRXQMDGZAL-GUDVDZBRSA-N 2 1 318.480 4.476 20 0 DIADMP CC1(C)CC[C@H]([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258604938 1063703980 /nfs/dbraw/zinc/70/39/80/1063703980.db2.gz MHQLTEQCKAJWAU-FPOVZHCZSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604938 1063703992 /nfs/dbraw/zinc/70/39/92/1063703992.db2.gz MHQLTEQCKAJWAU-FPOVZHCZSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@H]([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604938 1063704000 /nfs/dbraw/zinc/70/40/00/1063704000.db2.gz MHQLTEQCKAJWAU-FPOVZHCZSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)C1 ZINC001258608662 1063709349 /nfs/dbraw/zinc/70/93/49/1063709349.db2.gz MUJXHBZHMKWBNH-AABGKKOBSA-N 2 1 312.501 4.019 20 0 DIADMP CCC1CCC(C2CCC(n3c[nH+]cc3CC[NH3+])CC2)CC1 ZINC001258633744 1063720003 /nfs/dbraw/zinc/72/00/03/1063720003.db2.gz ZQRLGJVCFVJXHY-UHFFFAOYSA-N 2 1 303.494 4.332 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC([NH3+])(c3cccc(F)c3)CC2)CC(C)(C)C1 ZINC001258693246 1063755327 /nfs/dbraw/zinc/75/53/27/1063755327.db2.gz VPUDQJOMVKNLTP-YJBOKZPZSA-N 2 1 318.480 4.290 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC001461864110 1063756130 /nfs/dbraw/zinc/75/61/30/1063756130.db2.gz KAWOSKHUIWHSFQ-XLIONFOSSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC001461864110 1063756140 /nfs/dbraw/zinc/75/61/40/1063756140.db2.gz KAWOSKHUIWHSFQ-XLIONFOSSA-N 2 1 302.506 4.015 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC001461864110 1063756151 /nfs/dbraw/zinc/75/61/51/1063756151.db2.gz KAWOSKHUIWHSFQ-XLIONFOSSA-N 2 1 302.506 4.015 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001258714516 1063770633 /nfs/dbraw/zinc/77/06/33/1063770633.db2.gz QGYUGCJESSINAI-NRFANRHFSA-N 2 1 314.517 4.347 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+](C)C1CC[NH+](CC)CC1 ZINC001258714715 1063771619 /nfs/dbraw/zinc/77/16/19/1063771619.db2.gz RNYYYDBHJRKRCL-FQEVSTJZSA-N 2 1 302.506 4.204 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](C)C1CC[NH+](CC)CC1 ZINC001258714715 1063771627 /nfs/dbraw/zinc/77/16/27/1063771627.db2.gz RNYYYDBHJRKRCL-FQEVSTJZSA-N 2 1 302.506 4.204 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2cccc(Cl)c2)C1 ZINC001258741188 1063790684 /nfs/dbraw/zinc/79/06/84/1063790684.db2.gz GULPHXUCDTYAGH-PBHICJAKSA-N 2 1 308.897 4.124 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2cccc(Cl)c2)C1 ZINC001258741188 1063790696 /nfs/dbraw/zinc/79/06/96/1063790696.db2.gz GULPHXUCDTYAGH-PBHICJAKSA-N 2 1 308.897 4.124 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H](C)Cc2cccc(Cl)c2)CC1 ZINC001258748232 1063794453 /nfs/dbraw/zinc/79/44/53/1063794453.db2.gz APFXOFLJDHOCNO-MRXNPFEDSA-N 2 1 322.924 4.323 20 0 DIADMP CCCC[C@@H](CCC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258756356 1063803290 /nfs/dbraw/zinc/80/32/90/1063803290.db2.gz OXVVGASSDDMICI-MRXNPFEDSA-N 2 1 306.469 4.434 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H](CC(C)C)c2ccccc2F)CC1 ZINC001258768259 1063814039 /nfs/dbraw/zinc/81/40/39/1063814039.db2.gz GFOBIJSDCQWMOD-LJQANCHMSA-N 2 1 306.469 4.377 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001258775781 1063815015 /nfs/dbraw/zinc/81/50/15/1063815015.db2.gz DGCUXAJIGWLQPY-SFHVURJKSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001258775781 1063815040 /nfs/dbraw/zinc/81/50/40/1063815040.db2.gz DGCUXAJIGWLQPY-SFHVURJKSA-N 2 1 306.881 4.351 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 ZINC001258775520 1063816938 /nfs/dbraw/zinc/81/69/38/1063816938.db2.gz RPYCGYLDHIQPJE-INIZCTEOSA-N 2 1 306.881 4.004 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258786156 1063823220 /nfs/dbraw/zinc/82/32/20/1063823220.db2.gz KTTWKYSVBFZGOM-JKSUJKDBSA-N 2 1 306.469 4.290 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786144 1063824278 /nfs/dbraw/zinc/82/42/78/1063824278.db2.gz KPYAZFUIQRELCU-ZULIPRJHSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258786891 1063826587 /nfs/dbraw/zinc/82/65/87/1063826587.db2.gz PSGMXCFKGDAOQV-FFGOWVMKSA-N 2 1 317.521 4.368 20 0 DIADMP CC[C@H](C[C@@H](C)CC)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258799770 1063833254 /nfs/dbraw/zinc/83/32/54/1063833254.db2.gz IDDDPEXLZKZXSS-DOTOQJQBSA-N 2 1 303.494 4.163 20 0 DIADMP CC[C@@H](C)C[C@H](CC)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258799435 1063834947 /nfs/dbraw/zinc/83/49/47/1063834947.db2.gz FDJYVLDBEBIBDZ-WBVHZDCISA-N 2 1 303.494 4.163 20 0 DIADMP Cc1cccc(N(C2CC[NH2+]CC2)C2CCC(C(C)C)CC2)[nH+]1 ZINC001258806343 1063838836 /nfs/dbraw/zinc/83/88/36/1063838836.db2.gz UKASKIRKSDQUTH-UHFFFAOYSA-N 2 1 315.505 4.163 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001258813988 1063843091 /nfs/dbraw/zinc/84/30/91/1063843091.db2.gz SRJMWEACVRRFRK-MJGOQNOKSA-N 2 1 300.490 4.209 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)CC1CC[NH+](C)CC1 ZINC001461969360 1063847814 /nfs/dbraw/zinc/84/78/14/1063847814.db2.gz QAKJKLJSSZLTPX-OAQYLSRUSA-N 2 1 316.533 4.452 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258826999 1063850201 /nfs/dbraw/zinc/85/02/01/1063850201.db2.gz NYOOVQVMFBEHNT-LAUBAEHRSA-N 2 1 312.501 4.088 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)C1 ZINC001258826999 1063850210 /nfs/dbraw/zinc/85/02/10/1063850210.db2.gz NYOOVQVMFBEHNT-LAUBAEHRSA-N 2 1 312.501 4.088 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+]C(CC(C)C)CC(C)C)CC1 ZINC001258831195 1063853718 /nfs/dbraw/zinc/85/37/18/1063853718.db2.gz CFSWKFVVHAINQI-UHFFFAOYSA-N 2 1 317.521 4.409 20 0 DIADMP CC[C@H](Cc1ccccc1)[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258844028 1063865289 /nfs/dbraw/zinc/86/52/89/1063865289.db2.gz LSOJOUCRTXMBIL-VAMGGRTRSA-N 2 1 302.506 4.236 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](C)[C@@H](C)c2cc3ccccc3o2)CC1 ZINC001462036304 1063893760 /nfs/dbraw/zinc/89/37/60/1063893760.db2.gz MBVPJOJKTHDKJL-HNNXBMFYSA-N 2 1 300.446 4.158 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@H]3CCC[C@@H]4C[C@@H]43)C2)cc1 ZINC000378965522 1063983263 /nfs/dbraw/zinc/98/32/63/1063983263.db2.gz UERFFAUBMPZUJW-CGXNFDGLSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1cccc(C)c1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379628062 1063984796 /nfs/dbraw/zinc/98/47/96/1063984796.db2.gz IOFGYHZQIVKXKW-TZIWHRDSSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379632649 1063986271 /nfs/dbraw/zinc/98/62/71/1063986271.db2.gz NUODOBAHRSWFBC-DENIHFKCSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1cc(C)cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000379632649 1063986277 /nfs/dbraw/zinc/98/62/77/1063986277.db2.gz NUODOBAHRSWFBC-DENIHFKCSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC000379654964 1063987170 /nfs/dbraw/zinc/98/71/70/1063987170.db2.gz KKZFJMZLDJOABJ-KNQAVFIVSA-N 2 1 322.496 4.446 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1C ZINC000379654964 1063987184 /nfs/dbraw/zinc/98/71/84/1063987184.db2.gz KKZFJMZLDJOABJ-KNQAVFIVSA-N 2 1 322.496 4.446 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658818 1063987334 /nfs/dbraw/zinc/98/73/34/1063987334.db2.gz XLIPMQFQJNZBOI-ZIFCJYIRSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H](CC(C)(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379658818 1063987344 /nfs/dbraw/zinc/98/73/44/1063987344.db2.gz XLIPMQFQJNZBOI-ZIFCJYIRSA-N 2 1 302.506 4.454 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381819081 1063994720 /nfs/dbraw/zinc/99/47/20/1063994720.db2.gz DZVZOVGHGGCQJG-BJLQDIEVSA-N 2 1 302.506 4.455 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517335 1064161395 /nfs/dbraw/zinc/16/13/95/1064161395.db2.gz ARXGCIACZBYXNK-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390517335 1064161400 /nfs/dbraw/zinc/16/14/00/1064161400.db2.gz ARXGCIACZBYXNK-MISYRCLQSA-N 2 1 314.517 4.455 20 0 DIADMP CCCCCC[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390773880 1064169242 /nfs/dbraw/zinc/16/92/42/1064169242.db2.gz LOZJVFABEGQPSE-ICSRJNTNSA-N 2 1 302.506 4.457 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000390811816 1064170447 /nfs/dbraw/zinc/17/04/47/1064170447.db2.gz WHNMPOJXTWOHBH-OBJCFNGXSA-N 2 1 312.501 4.065 20 0 DIADMP Fc1ccc(C[NH+]2CCC3(CC[N@H+](C4CCCC4)C3)CC2)cc1 ZINC001279144671 1064335075 /nfs/dbraw/zinc/33/50/75/1064335075.db2.gz LIQPRAXOJDLHCS-UHFFFAOYSA-N 2 1 316.464 4.056 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC001279496030 1064353564 /nfs/dbraw/zinc/35/35/64/1064353564.db2.gz ZJLGFRQPIAHELM-ICSRJNTNSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001279496030 1064353568 /nfs/dbraw/zinc/35/35/68/1064353568.db2.gz ZJLGFRQPIAHELM-ICSRJNTNSA-N 2 1 324.553 4.026 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[NH+]1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC001279496030 1064353570 /nfs/dbraw/zinc/35/35/70/1064353570.db2.gz ZJLGFRQPIAHELM-ICSRJNTNSA-N 2 1 324.553 4.026 20 0 DIADMP C[N@H+]1CCCC2(CC[NH+](Cc3ccc(F)c(C4CC4)c3)CC2)C1 ZINC001280345352 1064395476 /nfs/dbraw/zinc/39/54/76/1064395476.db2.gz AREVTNWNAPTKBM-UHFFFAOYSA-N 2 1 316.464 4.011 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1CCC[C@@H]1Cc1ccccc1Cl ZINC001307431215 1065390261 /nfs/dbraw/zinc/39/02/61/1065390261.db2.gz GOPTUMQGZCTTIJ-QGZVFWFLSA-N 2 1 308.897 4.079 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@H]1Cc1ccccc1Cl ZINC001307431215 1065390274 /nfs/dbraw/zinc/39/02/74/1065390274.db2.gz GOPTUMQGZCTTIJ-QGZVFWFLSA-N 2 1 308.897 4.079 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCC3=CCCCC3)C2)CC1 ZINC001307439897 1065400174 /nfs/dbraw/zinc/40/01/74/1065400174.db2.gz CEAIFGPMYYIRTD-HXUWFJFHSA-N 2 1 304.522 4.321 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)C[C@@H]2CCC3(CCCCCC3)O2)CC1 ZINC001307450655 1065409018 /nfs/dbraw/zinc/40/90/18/1065409018.db2.gz RBQZCNMTYNTJAJ-IBGZPJMESA-N 2 1 322.537 4.063 20 0 DIADMP C[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001307492531 1065437887 /nfs/dbraw/zinc/43/78/87/1065437887.db2.gz MABDBRIEZHKATH-ROUUACIJSA-N 2 1 300.490 4.293 20 0 DIADMP CC[C@H](C)C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001307523980 1065462161 /nfs/dbraw/zinc/46/21/61/1065462161.db2.gz QYPGHDRIUSVMLT-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001307523980 1065462169 /nfs/dbraw/zinc/46/21/69/1065462169.db2.gz QYPGHDRIUSVMLT-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001307523980 1065462177 /nfs/dbraw/zinc/46/21/77/1065462177.db2.gz QYPGHDRIUSVMLT-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[N@@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)[C@H]1C ZINC001307524423 1065462793 /nfs/dbraw/zinc/46/27/93/1065462793.db2.gz UFXLNAUTUWEIFD-MOPGFXCFSA-N 2 1 314.517 4.062 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC001307559544 1065481710 /nfs/dbraw/zinc/48/17/10/1065481710.db2.gz NYCVIYSZZUIMJL-GOSISDBHSA-N 2 1 313.489 4.079 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CC/C=C\c2ccccc2)cc1 ZINC001307644793 1065538720 /nfs/dbraw/zinc/53/87/20/1065538720.db2.gz SUPIKVOEYVNHJN-XFFZJAGNSA-N 2 1 308.469 4.284 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC001307785564 1065619950 /nfs/dbraw/zinc/61/99/50/1065619950.db2.gz NCDAQEXJZCVDFA-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC001307785564 1065619953 /nfs/dbraw/zinc/61/99/53/1065619953.db2.gz NCDAQEXJZCVDFA-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC001307785564 1065619958 /nfs/dbraw/zinc/61/99/58/1065619958.db2.gz NCDAQEXJZCVDFA-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP FC1(F)CCC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001307937260 1065691247 /nfs/dbraw/zinc/69/12/47/1065691247.db2.gz WUTLPQKCWSNOQE-UHFFFAOYSA-N 2 1 322.443 4.294 20 0 DIADMP CCCC[N@@H+](CCOCC(C)C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001307967141 1065701598 /nfs/dbraw/zinc/70/15/98/1065701598.db2.gz NFIKSIGWGFTWKW-UHFFFAOYSA-N 2 1 312.542 4.070 20 0 DIADMP CC[C@@H](c1ccc(F)cc1)[NH+]1CCC(C)([NH+]2CCCC2)CC1 ZINC001307981385 1065713212 /nfs/dbraw/zinc/71/32/12/1065713212.db2.gz HUGKBQWTPQFRRV-SFHVURJKSA-N 2 1 304.453 4.227 20 0 DIADMP CC[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC001308182140 1065794096 /nfs/dbraw/zinc/79/40/96/1065794096.db2.gz ORINSSKXXGIPHU-HXUWFJFHSA-N 2 1 322.496 4.434 20 0 DIADMP CCC(CC)C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC001308198746 1065807940 /nfs/dbraw/zinc/80/79/40/1065807940.db2.gz BAXNBJPIFYHKFD-QGZVFWFLSA-N 2 1 302.506 4.444 20 0 DIADMP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC001308200028 1065808575 /nfs/dbraw/zinc/80/85/75/1065808575.db2.gz RSACAFIUDPNPDR-UWVAXJGDSA-N 2 1 300.490 4.197 20 0 DIADMP Cc1cc(C)c(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)c1 ZINC001308202467 1065810285 /nfs/dbraw/zinc/81/02/85/1065810285.db2.gz DGSDKOPPKNQHMT-CALCHBBNSA-N 2 1 302.506 4.069 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC001308203164 1065812247 /nfs/dbraw/zinc/81/22/47/1065812247.db2.gz MBLVTEFCIIBPKP-MRXNPFEDSA-N 2 1 320.521 4.487 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+]C[C@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001308208945 1065817681 /nfs/dbraw/zinc/81/76/81/1065817681.db2.gz JLZJUXTXHUHLMA-IEBWSBKVSA-N 2 1 316.533 4.094 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C/C=C/c1cc(C)c(C)cc1C ZINC001308283021 1065880031 /nfs/dbraw/zinc/88/00/31/1065880031.db2.gz QZFOWADPNARUKZ-BQYQJAHWSA-N 2 1 311.473 4.200 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CC(C)(C)C[C@H]2C)c1 ZINC001308281694 1065880274 /nfs/dbraw/zinc/88/02/74/1065880274.db2.gz VXYISMYHVDTUTC-APWZRJJASA-N 2 1 302.506 4.441 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)cc1 ZINC001308283013 1065881459 /nfs/dbraw/zinc/88/14/59/1065881459.db2.gz QVXCVPLRIFOERQ-IEBWSBKVSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc1 ZINC001308283013 1065881465 /nfs/dbraw/zinc/88/14/65/1065881465.db2.gz QVXCVPLRIFOERQ-IEBWSBKVSA-N 2 1 314.498 4.229 20 0 DIADMP CC(C)(C)C1CCC([NH2+][C@@H]2CC[N@H+](CC3CCCC3)C2)CC1 ZINC001308293925 1065891096 /nfs/dbraw/zinc/89/10/96/1065891096.db2.gz ZAYNSHJLYKOAHR-CTWPCTMYSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)(C)C1CCC([NH2+][C@@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC001308293925 1065891110 /nfs/dbraw/zinc/89/11/10/1065891110.db2.gz ZAYNSHJLYKOAHR-CTWPCTMYSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)(C)C1CCC([NH2+][C@H]2CC[N@H+](CC3CCCC3)C2)CC1 ZINC001308293924 1065891157 /nfs/dbraw/zinc/89/11/57/1065891157.db2.gz ZAYNSHJLYKOAHR-ACBHZAAOSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)(C)C1CCC([NH2+][C@H]2CC[N@@H+](CC3CCCC3)C2)CC1 ZINC001308293924 1065891160 /nfs/dbraw/zinc/89/11/60/1065891160.db2.gz ZAYNSHJLYKOAHR-ACBHZAAOSA-N 2 1 306.538 4.445 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CCCC2)CC1(C)C ZINC001308351491 1065932828 /nfs/dbraw/zinc/93/28/28/1065932828.db2.gz TXDNLDHYVQXIKU-IBGZPJMESA-N 2 1 314.517 4.252 20 0 DIADMP CN(C)c1cc[nH+]cc1C[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC001308351607 1065933146 /nfs/dbraw/zinc/93/31/46/1065933146.db2.gz USSUQFPOMYPPQA-UHFFFAOYSA-N 2 1 323.484 4.040 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)c1 ZINC001308360605 1065939411 /nfs/dbraw/zinc/93/94/11/1065939411.db2.gz OMMNNHYIYHSLGP-UHFFFAOYSA-N 2 1 320.908 4.393 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001308455624 1066000604 /nfs/dbraw/zinc/00/06/04/1066000604.db2.gz AYHAHKFNNLXNDD-GSEOLPGOSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC001308455624 1066000613 /nfs/dbraw/zinc/00/06/13/1066000613.db2.gz AYHAHKFNNLXNDD-GSEOLPGOSA-N 2 1 314.517 4.454 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC[C@]1(C)CC1(F)F ZINC001308469191 1066009013 /nfs/dbraw/zinc/00/90/13/1066009013.db2.gz QTEFQQYSJZZWPC-GOSISDBHSA-N 2 1 324.459 4.170 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001308469701 1066009325 /nfs/dbraw/zinc/00/93/25/1066009325.db2.gz RVDZWQYYKWFNHH-UYAOXDASSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001308469701 1066009336 /nfs/dbraw/zinc/00/93/36/1066009336.db2.gz RVDZWQYYKWFNHH-UYAOXDASSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCS1 ZINC001308539242 1066055606 /nfs/dbraw/zinc/05/56/06/1066055606.db2.gz CJQKVVMNQGOJAB-AEFFLSMTSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001308547961 1066062810 /nfs/dbraw/zinc/06/28/10/1066062810.db2.gz JLOVFKAJWPWVIL-RQXATKFSSA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)CC1CC[NH+](CC)CC1 ZINC001308565636 1066076020 /nfs/dbraw/zinc/07/60/20/1066076020.db2.gz TVIIBUVPXWNMAI-OAQYLSRUSA-N 2 1 316.533 4.370 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2ccccc2)[C@H]2CCCC2(C)C)CC1 ZINC001308583139 1066100055 /nfs/dbraw/zinc/10/00/55/1066100055.db2.gz SKKBHKVWBCLQPZ-FQEVSTJZSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@H]2CC=CCC2)CC[N@@H+]1Cc1ccccc1 ZINC001308633618 1066128839 /nfs/dbraw/zinc/12/88/39/1066128839.db2.gz KNFVWRYWXOSCKJ-DYXWJJEUSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)C[C@H]2CC=CCC2)CC[N@H+]1Cc1ccccc1 ZINC001308633618 1066128843 /nfs/dbraw/zinc/12/88/43/1066128843.db2.gz KNFVWRYWXOSCKJ-DYXWJJEUSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)C[C@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633618 1066128844 /nfs/dbraw/zinc/12/88/44/1066128844.db2.gz KNFVWRYWXOSCKJ-DYXWJJEUSA-N 2 1 312.501 4.328 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C[C@H]2CC=CCC2)CC[NH+]1Cc1ccccc1 ZINC001308633618 1066128848 /nfs/dbraw/zinc/12/88/48/1066128848.db2.gz KNFVWRYWXOSCKJ-DYXWJJEUSA-N 2 1 312.501 4.328 20 0 DIADMP CC1=CC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC001308636139 1066130005 /nfs/dbraw/zinc/13/00/05/1066130005.db2.gz UGQHBTQYYXCXFM-CLAROIROSA-N 2 1 324.512 4.376 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747182 1066221554 /nfs/dbraw/zinc/22/15/54/1066221554.db2.gz WDOGUABVXHTWCL-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747182 1066221568 /nfs/dbraw/zinc/22/15/68/1066221568.db2.gz WDOGUABVXHTWCL-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747182 1066221577 /nfs/dbraw/zinc/22/15/77/1066221577.db2.gz WDOGUABVXHTWCL-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747182 1066221582 /nfs/dbraw/zinc/22/15/82/1066221582.db2.gz WDOGUABVXHTWCL-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)Cc1ccccc1SCC ZINC001308750276 1066226007 /nfs/dbraw/zinc/22/60/07/1066226007.db2.gz KBDABHKWKRRENH-WMZOPIPTSA-N 2 1 320.546 4.194 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)Cc1ccccc1SCC ZINC001308750276 1066226015 /nfs/dbraw/zinc/22/60/15/1066226015.db2.gz KBDABHKWKRRENH-WMZOPIPTSA-N 2 1 320.546 4.194 20 0 DIADMP C[C@H]1C[C@H](N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccsc2S1 ZINC001308759403 1066231110 /nfs/dbraw/zinc/23/11/10/1066231110.db2.gz CLSWGVOUBVGFLZ-RBZWTCKCSA-N 2 1 322.543 4.231 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccsc2S1 ZINC001308759403 1066231168 /nfs/dbraw/zinc/23/11/68/1066231168.db2.gz CLSWGVOUBVGFLZ-RBZWTCKCSA-N 2 1 322.543 4.231 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccsc2S1 ZINC001308759403 1066231185 /nfs/dbraw/zinc/23/11/85/1066231185.db2.gz CLSWGVOUBVGFLZ-RBZWTCKCSA-N 2 1 322.543 4.231 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC001308790831 1066266617 /nfs/dbraw/zinc/26/66/17/1066266617.db2.gz AYFNEWVMRVILBX-HOJAQTOUSA-N 2 1 302.506 4.423 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC001308790831 1066266632 /nfs/dbraw/zinc/26/66/32/1066266632.db2.gz AYFNEWVMRVILBX-HOJAQTOUSA-N 2 1 302.506 4.423 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+][C@@H]3CC[C@@H]3C3CC3)C2)cc1 ZINC001308803497 1066279763 /nfs/dbraw/zinc/27/97/63/1066279763.db2.gz VXMJHOJVYDNSKX-HMXCVIKNSA-N 2 1 312.501 4.067 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC001308823343 1066297750 /nfs/dbraw/zinc/29/77/50/1066297750.db2.gz NXWVMIUEPCWYTK-APWZRJJASA-N 2 1 320.908 4.440 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCC[N@H+](C)CC(C)C)cc1 ZINC001308847611 1066323291 /nfs/dbraw/zinc/32/32/91/1066323291.db2.gz LLMOYEBKMVXULX-PMACEKPBSA-N 2 1 302.506 4.199 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)C1 ZINC001308863900 1066343400 /nfs/dbraw/zinc/34/34/00/1066343400.db2.gz ODCOYFDWBVPELX-MISYRCLQSA-N 2 1 300.490 4.034 20 0 DIADMP Cc1ccc(C2CC([NH2+][C@H]3CC[N@@H+](C4CCCCC4)C3)C2)cc1 ZINC001308869625 1066350072 /nfs/dbraw/zinc/35/00/72/1066350072.db2.gz QGNMRNQQADJOCP-GPJFCIFZSA-N 2 1 312.501 4.238 20 0 DIADMP Cc1ccc(C2CC([NH2+][C@H]3CC[N@H+](C4CCCCC4)C3)C2)cc1 ZINC001308869625 1066350086 /nfs/dbraw/zinc/35/00/86/1066350086.db2.gz QGNMRNQQADJOCP-GPJFCIFZSA-N 2 1 312.501 4.238 20 0 DIADMP Cc1ccc(C2CC([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)C2)cc1 ZINC001308869627 1066351591 /nfs/dbraw/zinc/35/15/91/1066351591.db2.gz QGNMRNQQADJOCP-IOJLRTSASA-N 2 1 312.501 4.238 20 0 DIADMP Cc1ccc(C2CC([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)C2)cc1 ZINC001308869627 1066351600 /nfs/dbraw/zinc/35/16/00/1066351600.db2.gz QGNMRNQQADJOCP-IOJLRTSASA-N 2 1 312.501 4.238 20 0 DIADMP CC[C@H](CC1CCCCC1)[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308882899 1066364161 /nfs/dbraw/zinc/36/41/61/1066364161.db2.gz BYPGSOJFPFLPPS-WOJBJXKFSA-N 2 1 306.538 4.447 20 0 DIADMP CC1CC[NH+](CCC[NH2+]Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000020018755 182179072 /nfs/dbraw/zinc/17/90/72/182179072.db2.gz CURVJKBJPQGRFZ-UHFFFAOYSA-N 2 1 315.288 4.205 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H]1CCCN(C)C1 ZINC000152382659 335043498 /nfs/dbraw/zinc/04/34/98/335043498.db2.gz FRQWAPDAIXZARS-ZIAGYGMSSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000152382659 335043500 /nfs/dbraw/zinc/04/35/00/335043500.db2.gz FRQWAPDAIXZARS-ZIAGYGMSSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000152382659 335043501 /nfs/dbraw/zinc/04/35/01/335043501.db2.gz FRQWAPDAIXZARS-ZIAGYGMSSA-N 2 1 314.395 4.040 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000152382659 335043504 /nfs/dbraw/zinc/04/35/04/335043504.db2.gz FRQWAPDAIXZARS-ZIAGYGMSSA-N 2 1 314.395 4.040 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)oc2cc1C ZINC000152399036 335056556 /nfs/dbraw/zinc/05/65/56/335056556.db2.gz YRZWUYVOQHRULU-CVEARBPZSA-N 2 1 312.457 4.185 20 0 DIADMP Cc1cc2cc([C@@H](C)[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)oc2cc1C ZINC000152399036 335056558 /nfs/dbraw/zinc/05/65/58/335056558.db2.gz YRZWUYVOQHRULU-CVEARBPZSA-N 2 1 312.457 4.185 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000289273446 131370139 /nfs/dbraw/zinc/37/01/39/131370139.db2.gz PKMNSQFPGDIGLF-IBGZPJMESA-N 2 1 322.456 4.039 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2nccc3ccccc32)CC1 ZINC000289552043 131395562 /nfs/dbraw/zinc/39/55/62/131395562.db2.gz CFOLWTFUUXTPLR-INIZCTEOSA-N 2 1 311.473 4.006 20 0 DIADMP Fc1ccc(C2CCC([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000297727636 132030624 /nfs/dbraw/zinc/03/06/24/132030624.db2.gz SGCDALHLXHUUBJ-UHFFFAOYSA-N 2 1 316.464 4.068 20 0 DIADMP Cc1c2ccccc2oc1[C@H]([NH2+]CCc1c[nH+]cn1C)C(C)C ZINC000298594254 132069679 /nfs/dbraw/zinc/06/96/79/132069679.db2.gz YPPTXEHALKSFOO-GOSISDBHSA-N 2 1 311.429 4.004 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000119713530 132135240 /nfs/dbraw/zinc/13/52/40/132135240.db2.gz KUQDRPOIGOWTQL-QGZVFWFLSA-N 2 1 324.468 4.010 20 0 DIADMP CCC[NH+]1CCC(Nc2cc[nH+]c3cc(Cl)ccc23)CC1 ZINC000042297358 132151182 /nfs/dbraw/zinc/15/11/82/132151182.db2.gz GHKSZFLKKPNYME-UHFFFAOYSA-N 2 1 303.837 4.175 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCCc3sc(Cl)cc32)CC1 ZINC000127469101 332002641 /nfs/dbraw/zinc/00/26/41/332002641.db2.gz KYMPFCZWIJGXTK-CQSZACIVSA-N 2 1 312.910 4.243 20 0 DIADMP CCCC[NH+]1CCC([NH2+]Cc2ccc(OCC(C)C)cc2)CC1 ZINC000518276845 332004886 /nfs/dbraw/zinc/00/48/86/332004886.db2.gz WJFODFHBAUORHD-UHFFFAOYSA-N 2 1 318.505 4.076 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000559295255 332018339 /nfs/dbraw/zinc/01/83/39/332018339.db2.gz VAGWXJZOHCSHBG-RDJZCZTQSA-N 2 1 320.908 4.391 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000394272446 332207524 /nfs/dbraw/zinc/20/75/24/332207524.db2.gz AILNCKUMBOROOZ-HKUYNNGSSA-N 2 1 314.498 4.311 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc3ccccc3c2)C1 ZINC000531101729 332262389 /nfs/dbraw/zinc/26/23/89/332262389.db2.gz YBSPUYFUNAOTMC-LJQANCHMSA-N 2 1 308.469 4.004 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2)C1 ZINC000531101729 332262390 /nfs/dbraw/zinc/26/23/90/332262390.db2.gz YBSPUYFUNAOTMC-LJQANCHMSA-N 2 1 308.469 4.004 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2)C1 ZINC000531101729 332262391 /nfs/dbraw/zinc/26/23/91/332262391.db2.gz YBSPUYFUNAOTMC-LJQANCHMSA-N 2 1 308.469 4.004 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000559740471 332278442 /nfs/dbraw/zinc/27/84/42/332278442.db2.gz FXDXYYDPTCHRPU-FCHUYYIVSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000559740471 332278443 /nfs/dbraw/zinc/27/84/43/332278443.db2.gz FXDXYYDPTCHRPU-FCHUYYIVSA-N 2 1 322.496 4.271 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559845828 332284856 /nfs/dbraw/zinc/28/48/56/332284856.db2.gz VMJKZLVBLWFWJN-MDNKFWRPSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CC1 ZINC000559845828 332284858 /nfs/dbraw/zinc/28/48/58/332284858.db2.gz VMJKZLVBLWFWJN-MDNKFWRPSA-N 2 1 300.490 4.380 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@H]3CC[N@@H+](C(C)C)C3)o2)cc1 ZINC000559864956 332285973 /nfs/dbraw/zinc/28/59/73/332285973.db2.gz QZYFTJLVUMHBIV-QGZVFWFLSA-N 2 1 312.457 4.075 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]C[C@H]3CC[N@H+](C(C)C)C3)o2)cc1 ZINC000559864956 332285974 /nfs/dbraw/zinc/28/59/74/332285974.db2.gz QZYFTJLVUMHBIV-QGZVFWFLSA-N 2 1 312.457 4.075 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCC2(C)C)C[N@H+]1Cc1ccccc1 ZINC000560244834 332322634 /nfs/dbraw/zinc/32/26/34/332322634.db2.gz OYSKWAIXCGXWGP-BHIYHBOVSA-N 2 1 300.490 4.065 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OC(C)C)c(Cl)c2)C1 ZINC000560247872 332323388 /nfs/dbraw/zinc/32/33/88/332323388.db2.gz GIOANAMGFGYWLA-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP CCOc1ccc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1Cl ZINC000560270176 332326051 /nfs/dbraw/zinc/32/60/51/332326051.db2.gz JUOKDEJBAHXPSQ-UHFFFAOYSA-N 2 1 324.896 4.091 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccccc2C(F)(F)F)CC1 ZINC000205243418 333008644 /nfs/dbraw/zinc/00/86/44/333008644.db2.gz AASGQDNCHQHVSF-UHFFFAOYSA-N 2 1 314.395 4.058 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245605 333040322 /nfs/dbraw/zinc/04/03/22/333040322.db2.gz WKTMGCYSUDKIMQ-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245605 333040323 /nfs/dbraw/zinc/04/03/23/333040323.db2.gz WKTMGCYSUDKIMQ-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245605 333040324 /nfs/dbraw/zinc/04/03/24/333040324.db2.gz WKTMGCYSUDKIMQ-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245605 333040325 /nfs/dbraw/zinc/04/03/25/333040325.db2.gz WKTMGCYSUDKIMQ-LAUBAEHRSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245604 333040400 /nfs/dbraw/zinc/04/04/00/333040400.db2.gz WKTMGCYSUDKIMQ-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245604 333040401 /nfs/dbraw/zinc/04/04/01/333040401.db2.gz WKTMGCYSUDKIMQ-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245604 333040402 /nfs/dbraw/zinc/04/04/02/333040402.db2.gz WKTMGCYSUDKIMQ-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)cc1 ZINC000580245604 333040404 /nfs/dbraw/zinc/04/04/04/333040404.db2.gz WKTMGCYSUDKIMQ-DYESRHJHSA-N 2 1 308.469 4.126 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)c2)cc1 ZINC000378905045 333062343 /nfs/dbraw/zinc/06/23/43/333062343.db2.gz YQOWHYFYFKIZEU-OALUTQOASA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2cccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)c2)cc1 ZINC000378905045 333062345 /nfs/dbraw/zinc/06/23/45/333062345.db2.gz YQOWHYFYFKIZEU-OALUTQOASA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(C[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000378922291 333064928 /nfs/dbraw/zinc/06/49/28/333064928.db2.gz QBBLDKPBXWYPMK-FKBYEOEOSA-N 2 1 320.480 4.187 20 0 DIADMP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056696 333096552 /nfs/dbraw/zinc/09/65/52/333096552.db2.gz QXVFWRSPQIPELH-KVLZDYKBSA-N 2 1 318.892 4.017 20 0 DIADMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056696 333096553 /nfs/dbraw/zinc/09/65/53/333096553.db2.gz QXVFWRSPQIPELH-KVLZDYKBSA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056696 333096554 /nfs/dbraw/zinc/09/65/54/333096554.db2.gz QXVFWRSPQIPELH-KVLZDYKBSA-N 2 1 318.892 4.017 20 0 DIADMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](C/C=C\c2ccc(Cl)cc2)C1 ZINC000526056696 333096556 /nfs/dbraw/zinc/09/65/56/333096556.db2.gz QXVFWRSPQIPELH-KVLZDYKBSA-N 2 1 318.892 4.017 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccsc2)c1 ZINC000177979682 333133865 /nfs/dbraw/zinc/13/38/65/333133865.db2.gz WEHAUUOVBDJBRS-HNNXBMFYSA-N 2 1 302.487 4.439 20 0 DIADMP Cc1ccncc1CCC[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463030049 333141570 /nfs/dbraw/zinc/14/15/70/333141570.db2.gz UXUZNYOWQKTDEU-CVEARBPZSA-N 2 1 314.395 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497518135 333258915 /nfs/dbraw/zinc/25/89/15/333258915.db2.gz KTIHRCOYVSPXGD-JXFKEZNVSA-N 2 1 316.464 4.083 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594418 333305142 /nfs/dbraw/zinc/30/51/42/333305142.db2.gz HAIOQRIHOJEBKE-RBUKOAKNSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CC1 ZINC000390594418 333305143 /nfs/dbraw/zinc/30/51/43/333305143.db2.gz HAIOQRIHOJEBKE-RBUKOAKNSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390685945 333314910 /nfs/dbraw/zinc/31/49/10/333314910.db2.gz XXIVDAPZEZFRSY-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H](CC1CC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390685945 333314912 /nfs/dbraw/zinc/31/49/12/333314912.db2.gz XXIVDAPZEZFRSY-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccccc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390744239 333322855 /nfs/dbraw/zinc/32/28/55/333322855.db2.gz OPZOMDAFODOUSB-UYAOXDASSA-N 2 1 308.469 4.168 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2c3ccccc3C[C@@H]2C)c1 ZINC000123927488 333337670 /nfs/dbraw/zinc/33/76/70/333337670.db2.gz LPLUBLXATRLMDA-HRAATJIYSA-N 2 1 308.469 4.161 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H](C)c2c(F)cccc2F)CC1 ZINC000521428559 333382338 /nfs/dbraw/zinc/38/23/38/333382338.db2.gz DFUPRNMCJSIMQK-OAHLLOKOSA-N 2 1 324.459 4.470 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+]CCC[N@@H+](C)C(C)C)ccc2c1 ZINC000323550593 333388459 /nfs/dbraw/zinc/38/84/59/333388459.db2.gz GUEIGMFXZNRBEJ-INIZCTEOSA-N 2 1 314.473 4.229 20 0 DIADMP C1=C(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000563121002 333392772 /nfs/dbraw/zinc/39/27/72/333392772.db2.gz WAODBHPJIMQHSU-HXUWFJFHSA-N 2 1 310.485 4.274 20 0 DIADMP C1=C(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC000563121002 333392773 /nfs/dbraw/zinc/39/27/73/333392773.db2.gz WAODBHPJIMQHSU-HXUWFJFHSA-N 2 1 310.485 4.274 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCC1(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390794905 333393991 /nfs/dbraw/zinc/39/39/91/333393991.db2.gz HRWCHUNBZAMPIY-UHOSZYNNSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H](C[NH2+]C(c1ccccc1)c1ccccc1)C[NH+]1CCCC1 ZINC000391017216 333415311 /nfs/dbraw/zinc/41/53/11/333415311.db2.gz YZUSVRDNPYLEEB-SFHVURJKSA-N 2 1 308.469 4.098 20 0 DIADMP CC[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000391364616 333458194 /nfs/dbraw/zinc/45/81/94/333458194.db2.gz METCCEOOONCXTI-GHTZIAJQSA-N 2 1 314.517 4.252 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]CCCn2cc[nH+]c2C)cc1 ZINC000338021614 333467966 /nfs/dbraw/zinc/46/79/66/333467966.db2.gz WSLMIEYLRRXANW-CQSZACIVSA-N 2 1 303.475 4.044 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000237532453 333520817 /nfs/dbraw/zinc/52/08/17/333520817.db2.gz OHJRUKOBRDTQPG-SFHVURJKSA-N 2 1 308.469 4.310 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000343422745 335163610 /nfs/dbraw/zinc/16/36/10/335163610.db2.gz QIYXIGYKCMFYPN-MRXNPFEDSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1ccncc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000271369329 334021674 /nfs/dbraw/zinc/02/16/74/334021674.db2.gz GJDHJYMHFZEKGV-QGZVFWFLSA-N 2 1 311.473 4.081 20 0 DIADMP C[C@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000414658057 334059754 /nfs/dbraw/zinc/05/97/54/334059754.db2.gz IXTPBTAIPYJHPO-DOTOQJQBSA-N 2 1 312.482 4.007 20 0 DIADMP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414672785 334065368 /nfs/dbraw/zinc/06/53/68/334065368.db2.gz HXZTXCDPNZJAPI-MGPQQGTHSA-N 2 1 314.395 4.086 20 0 DIADMP Cc1cc(F)c(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(Cl)c1 ZINC000414808364 334105002 /nfs/dbraw/zinc/10/50/02/334105002.db2.gz FFQPNRTYJUVMOG-LBPRGKRZSA-N 2 1 306.812 4.097 20 0 DIADMP [NH3+]C1(C[NH2+]Cc2cnc(-c3cccs3)s2)CCCCCC1 ZINC000414860908 334132643 /nfs/dbraw/zinc/13/26/43/334132643.db2.gz QQFHNOWQAYXSNK-UHFFFAOYSA-N 2 1 321.515 4.013 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)[C@H](C)c1ccc(Cl)cc1 ZINC000295116596 334218907 /nfs/dbraw/zinc/21/89/07/334218907.db2.gz WVUIAPUABFIGIA-SEGFFJMWSA-N 2 1 306.881 4.047 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000471761599 334265750 /nfs/dbraw/zinc/26/57/50/334265750.db2.gz UDWZTQVVWCWCFF-QGZVFWFLSA-N 2 1 319.880 4.383 20 0 DIADMP Clc1ccc(CC[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC000415088094 334276399 /nfs/dbraw/zinc/27/63/99/334276399.db2.gz UQWNSOHJASOFAL-HOCLYGCPSA-N 2 1 320.889 4.027 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1-c1ccccc1 ZINC000187749982 334271683 /nfs/dbraw/zinc/27/16/83/334271683.db2.gz WFRCRUOLXXZLDS-LEWJYISDSA-N 2 1 320.480 4.378 20 0 DIADMP Clc1cccc([C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000415094086 334280763 /nfs/dbraw/zinc/28/07/63/334280763.db2.gz WNKRBHOCIJVBBC-BEFAXECRSA-N 2 1 314.860 4.019 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc(F)c(Cl)cc1Cl ZINC000415097303 334280933 /nfs/dbraw/zinc/28/09/33/334280933.db2.gz CRBVSKDEXZRETL-DCAQKATOSA-N 2 1 319.251 4.171 20 0 DIADMP Clc1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000415104254 334282905 /nfs/dbraw/zinc/28/29/05/334282905.db2.gz KYEIAMHQBWKUSE-VNQPRFMTSA-N 2 1 313.272 4.004 20 0 DIADMP CC[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2C)CC1 ZINC000531955083 334306515 /nfs/dbraw/zinc/30/65/15/334306515.db2.gz CXQNLCBQRLPEER-XLIONFOSSA-N 2 1 300.490 4.128 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC000531957756 334313997 /nfs/dbraw/zinc/31/39/97/334313997.db2.gz FDXDLQVMZOMESF-ICSRJNTNSA-N 2 1 300.490 4.238 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](C3CC3)C1)CCC2 ZINC000534908389 334345469 /nfs/dbraw/zinc/34/54/69/334345469.db2.gz JIMXKEDKEJMDNU-KKSFZXQISA-N 2 1 312.501 4.261 20 0 DIADMP c1ccc(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000534967879 334350684 /nfs/dbraw/zinc/35/06/84/334350684.db2.gz NHOWEOBZDQKSSG-UHFFFAOYSA-N 2 1 320.480 4.175 20 0 DIADMP c1ccc(C[N@H+]2CCC3(C2)CC[NH+]([C@@H]2C=CCCC2)CC3)cc1 ZINC000534966843 334350812 /nfs/dbraw/zinc/35/08/12/334350812.db2.gz HATZKFQWOVTKSE-HXUWFJFHSA-N 2 1 310.485 4.083 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1csc2ccccc12 ZINC000049943317 334359662 /nfs/dbraw/zinc/35/96/62/334359662.db2.gz FWJLUERQNFVTEU-OAHLLOKOSA-N 2 1 302.487 4.255 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000535228794 334380996 /nfs/dbraw/zinc/38/09/96/334380996.db2.gz DUEBKOSPBIHNNS-WBAXXEDZSA-N 2 1 304.503 4.076 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000535228794 334380997 /nfs/dbraw/zinc/38/09/97/334380997.db2.gz DUEBKOSPBIHNNS-WBAXXEDZSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](CCc1ccccc1)c1ccccc1 ZINC000341593117 334459966 /nfs/dbraw/zinc/45/99/66/334459966.db2.gz YPAAMPGDBYDQOL-OAQYLSRUSA-N 2 1 319.452 4.155 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000341767739 334479441 /nfs/dbraw/zinc/47/94/41/334479441.db2.gz NOWUJIOVJKBMDU-LBPRGKRZSA-N 2 1 317.820 4.017 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1c2cccc(F)c2CC[C@@H]1C ZINC000164593239 334614226 /nfs/dbraw/zinc/61/42/26/334614226.db2.gz FPDWNWNUFIYUEC-IFXJQAMLSA-N 2 1 315.436 4.024 20 0 DIADMP Clc1ccc([C@H](CC2CC2)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000345682961 335341408 /nfs/dbraw/zinc/34/14/08/335341408.db2.gz NYAGBTZIDFBSLZ-KXBFYZLASA-N 2 1 318.892 4.255 20 0 DIADMP Cc1nccn1CC[N@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000346314600 335399234 /nfs/dbraw/zinc/39/92/34/335399234.db2.gz SBZGJQUHKDMILF-KRWDZBQOSA-N 2 1 305.853 4.174 20 0 DIADMP Cc1[nH+]ccn1CC[N@@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000346314600 335399235 /nfs/dbraw/zinc/39/92/35/335399235.db2.gz SBZGJQUHKDMILF-KRWDZBQOSA-N 2 1 305.853 4.174 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2Cc3ccccc32)cc1 ZINC000346979029 335461084 /nfs/dbraw/zinc/46/10/84/335461084.db2.gz WXQBGKCSZNWRBI-HNAYVOBHSA-N 2 1 317.436 4.171 20 0 DIADMP CC(C)Cc1ccc([C@H]([NH2+]CCc2c[nH+]cn2C)C(C)C)cc1 ZINC000347758348 335527158 /nfs/dbraw/zinc/52/71/58/335527158.db2.gz QFKZCXIFCYQJHV-HXUWFJFHSA-N 2 1 313.489 4.148 20 0 DIADMP Cc1cscc1C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000348409770 335584852 /nfs/dbraw/zinc/58/48/52/335584852.db2.gz TZPNIPNFGZEKKI-AWEZNQCLSA-N 2 1 311.454 4.401 20 0 DIADMP CC[C@H](c1ccccc1)[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000352365564 336214468 /nfs/dbraw/zinc/21/44/68/336214468.db2.gz TXSKFZUXIPWXEN-LJQANCHMSA-N 2 1 310.441 4.385 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3occc3c2)c1 ZINC000352757965 336235284 /nfs/dbraw/zinc/23/52/84/336235284.db2.gz WPKREDLXIKVSHK-UHFFFAOYSA-N 2 1 308.425 4.174 20 0 DIADMP CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000532509436 336252820 /nfs/dbraw/zinc/25/28/20/336252820.db2.gz VAORGPSTAYIFTR-PKOBYXMFSA-N 2 1 322.924 4.229 20 0 DIADMP CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000532509432 336252871 /nfs/dbraw/zinc/25/28/71/336252871.db2.gz VAORGPSTAYIFTR-IEBWSBKVSA-N 2 1 322.924 4.229 20 0 DIADMP CCC(CC)(C[NH2+][C@@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C)c1ccccc1 ZINC000532532235 336253926 /nfs/dbraw/zinc/25/39/26/336253926.db2.gz TZUIVFIDUKXLHK-ZHALLVOQSA-N 2 1 302.506 4.063 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC(C2CC2)C2CC2)cc1 ZINC000532537071 336255104 /nfs/dbraw/zinc/25/51/04/336255104.db2.gz SLFBXFUIUKAJLY-AWEZNQCLSA-N 2 1 309.457 4.268 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000192705856 336258954 /nfs/dbraw/zinc/25/89/54/336258954.db2.gz UTIRAUQWGIVIKY-YHWJGBFKSA-N 2 1 300.490 4.031 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cc2ccccc2o1 ZINC000580359886 336259563 /nfs/dbraw/zinc/25/95/63/336259563.db2.gz BQTRJIGMVPKOMF-OGWOLHLISA-N 2 1 300.446 4.202 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cc2ccccc2o1 ZINC000580359886 336259564 /nfs/dbraw/zinc/25/95/64/336259564.db2.gz BQTRJIGMVPKOMF-OGWOLHLISA-N 2 1 300.446 4.202 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cc2ccccc2o1 ZINC000580359884 336259607 /nfs/dbraw/zinc/25/96/07/336259607.db2.gz BQTRJIGMVPKOMF-ALKREAHSSA-N 2 1 300.446 4.202 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1cc2ccccc2o1 ZINC000580359884 336259608 /nfs/dbraw/zinc/25/96/08/336259608.db2.gz BQTRJIGMVPKOMF-ALKREAHSSA-N 2 1 300.446 4.202 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(F)F)cc2)C1 ZINC000526983746 336278040 /nfs/dbraw/zinc/27/80/40/336278040.db2.gz FKVSZTSWFJXQNE-MRXNPFEDSA-N 2 1 310.432 4.082 20 0 DIADMP Cc1cc2cc(C[NH+]3CCC(c4[nH]cc[nH+]4)CC3)oc2cc1C ZINC000352853003 336280144 /nfs/dbraw/zinc/28/01/44/336280144.db2.gz KGMDUDJPZOJICQ-UHFFFAOYSA-N 2 1 309.413 4.152 20 0 DIADMP CCC[N@H+](C)C[C@H]1CCN(c2cc[nH+]c3cc(Cl)ccc32)C1 ZINC000301463036 336308370 /nfs/dbraw/zinc/30/83/70/336308370.db2.gz JYDFCPGJQOKCDQ-CQSZACIVSA-N 2 1 317.864 4.056 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN(c2cc[nH+]c3cc(Cl)ccc32)C1 ZINC000301463036 336308371 /nfs/dbraw/zinc/30/83/71/336308371.db2.gz JYDFCPGJQOKCDQ-CQSZACIVSA-N 2 1 317.864 4.056 20 0 DIADMP C[N@H+]1CCC[C@H](CNc2cc[nH+]c3cc(C(F)(F)F)ccc23)C1 ZINC000301993306 336341926 /nfs/dbraw/zinc/34/19/26/336341926.db2.gz RCKLYTZBTXGOSK-GFCCVEGCSA-N 2 1 323.362 4.007 20 0 DIADMP CCc1c(C)[nH+]c2ccccc2c1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000302056403 336345935 /nfs/dbraw/zinc/34/59/35/336345935.db2.gz QRZXBLPBGIVMSP-OAHLLOKOSA-N 2 1 320.440 4.213 20 0 DIADMP Cc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)o1 ZINC000105459701 336387666 /nfs/dbraw/zinc/38/76/66/336387666.db2.gz VEKWUKSHLWSBDI-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1c[nH+]ccc1N(C)C)CCC2 ZINC000353136532 336404145 /nfs/dbraw/zinc/40/41/45/336404145.db2.gz BDIKTWCSLTXUCC-FQEVSTJZSA-N 2 1 323.484 4.438 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCSc3ccc(Cl)cc32)C1 ZINC000361973927 336780704 /nfs/dbraw/zinc/78/07/04/336780704.db2.gz ZOTMTXKJWDBXEG-FMKPAKJESA-N 2 1 324.921 4.339 20 0 DIADMP COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000121998947 336987765 /nfs/dbraw/zinc/98/77/65/336987765.db2.gz KOVJBUMNQRYCMZ-CABCVRRESA-N 2 1 315.461 4.035 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000193507877 337033129 /nfs/dbraw/zinc/03/31/29/337033129.db2.gz RDUWNCQZPVINSP-GJZGRUSLSA-N 2 1 312.457 4.130 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000193507877 337033130 /nfs/dbraw/zinc/03/31/30/337033130.db2.gz RDUWNCQZPVINSP-GJZGRUSLSA-N 2 1 312.457 4.130 20 0 DIADMP CC1(C)CC([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000395176863 337209004 /nfs/dbraw/zinc/20/90/04/337209004.db2.gz KLFZDWHHHLEMFS-SFHVURJKSA-N 2 1 300.490 4.067 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2ccc(Cl)s2)C1 ZINC000582991790 337223146 /nfs/dbraw/zinc/22/31/46/337223146.db2.gz FZSNVGUHWLNSJJ-KBPBESRZSA-N 2 1 314.926 4.043 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2ccc(Cl)s2)C1 ZINC000582991792 337223170 /nfs/dbraw/zinc/22/31/70/337223170.db2.gz FZSNVGUHWLNSJJ-UONOGXRCSA-N 2 1 314.926 4.043 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2ccc(Cl)s2)C1 ZINC000582991791 337223219 /nfs/dbraw/zinc/22/32/19/337223219.db2.gz FZSNVGUHWLNSJJ-KGLIPLIRSA-N 2 1 314.926 4.043 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1CN[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135701 337243206 /nfs/dbraw/zinc/24/32/06/337243206.db2.gz CLTNQQAVFVFMTO-UWJYYQICSA-N 2 1 323.484 4.274 20 0 DIADMP CCC[N@H+]1CCC[C@H]1CN[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135701 337243207 /nfs/dbraw/zinc/24/32/07/337243207.db2.gz CLTNQQAVFVFMTO-UWJYYQICSA-N 2 1 323.484 4.274 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135701 337243208 /nfs/dbraw/zinc/24/32/08/337243208.db2.gz CLTNQQAVFVFMTO-UWJYYQICSA-N 2 1 323.484 4.274 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000583135701 337243209 /nfs/dbraw/zinc/24/32/09/337243209.db2.gz CLTNQQAVFVFMTO-UWJYYQICSA-N 2 1 323.484 4.274 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000186185355 337254353 /nfs/dbraw/zinc/25/43/53/337254353.db2.gz NTYSGPOREKQSQH-AWEZNQCLSA-N 2 1 322.518 4.204 20 0 DIADMP C[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)s1)C[NH+]1CCCCC1 ZINC000038041952 337263787 /nfs/dbraw/zinc/26/37/87/337263787.db2.gz UVIYTWJTIWRZNC-STQMWFEESA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)s1)C[NH+]1CCCCC1 ZINC000038041953 337263814 /nfs/dbraw/zinc/26/38/14/337263814.db2.gz UVIYTWJTIWRZNC-OLZOCXBDSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000398017794 337303846 /nfs/dbraw/zinc/30/38/46/337303846.db2.gz IGCOJWUXCONTTL-YHYVQYDKSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCc2ccccc21 ZINC000398017794 337303847 /nfs/dbraw/zinc/30/38/47/337303847.db2.gz IGCOJWUXCONTTL-YHYVQYDKSA-N 2 1 320.480 4.174 20 0 DIADMP Cc1sccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000398020089 337304553 /nfs/dbraw/zinc/30/45/53/337304553.db2.gz JPKFGJFMNGBCPS-BEFAXECRSA-N 2 1 314.498 4.057 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000583782638 337332643 /nfs/dbraw/zinc/33/26/43/337332643.db2.gz VDUCYPWTNDEVLO-DNDYEEKYSA-N 2 1 308.432 4.062 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1 ZINC000583782638 337332644 /nfs/dbraw/zinc/33/26/44/337332644.db2.gz VDUCYPWTNDEVLO-DNDYEEKYSA-N 2 1 308.432 4.062 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccccc1 ZINC000128106796 337424022 /nfs/dbraw/zinc/42/40/22/337424022.db2.gz FZQOLXNWPRJPCU-IBGZPJMESA-N 2 1 309.457 4.100 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(SC2CCCC2)cc1 ZINC000161521739 337590933 /nfs/dbraw/zinc/59/09/33/337590933.db2.gz COJOCRUQSJRBPV-OAHLLOKOSA-N 2 1 318.530 4.466 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC000422714635 337683878 /nfs/dbraw/zinc/68/38/78/337683878.db2.gz RGHYHOIBAWXKFW-MLNNCEHLSA-N 2 1 320.480 4.406 20 0 DIADMP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](c1cc2ccccc2o1)c1ccccc1 ZINC000422930439 337692091 /nfs/dbraw/zinc/69/20/91/337692091.db2.gz UKFUPWPZQPZJDH-MDOVXXIYSA-N 2 1 308.425 4.238 20 0 DIADMP Cc1cc([C@H]([NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C2CC2)ccc1F ZINC000423018028 337695686 /nfs/dbraw/zinc/69/56/86/337695686.db2.gz XXZVGGNSDLLDNX-HSALFYBXSA-N 2 1 310.416 4.320 20 0 DIADMP [NH3+][C@@H]1C[C@H]([NH2+]C[C@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423063010 337697900 /nfs/dbraw/zinc/69/79/00/337697900.db2.gz OEDHYEXLQJJXTH-ZACQAIPSSA-N 2 1 320.358 4.067 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423189230 337703112 /nfs/dbraw/zinc/70/31/12/337703112.db2.gz QQFQBZMNYJTYGH-HNNXBMFYSA-N 2 1 301.261 4.176 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000423379790 337717514 /nfs/dbraw/zinc/71/75/14/337717514.db2.gz NGRWMERROBKXMR-GMXABZIVSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccccc1OCc1ccccc1 ZINC000423395365 337718780 /nfs/dbraw/zinc/71/87/80/337718780.db2.gz SPPHMRSWYSXWJH-AOIWGVFYSA-N 2 1 324.468 4.057 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC000527663167 337756964 /nfs/dbraw/zinc/75/69/64/337756964.db2.gz XUOWNEIOADTIDO-ALGWMNEGSA-N 2 1 312.501 4.236 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@H](C)c1oc2ccc(OC)cc2c1C ZINC000514245024 337967861 /nfs/dbraw/zinc/96/78/61/337967861.db2.gz QPUBLJASIHNVCC-OAHLLOKOSA-N 2 1 318.461 4.132 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)[C@H]1C ZINC000516198402 338007232 /nfs/dbraw/zinc/00/72/32/338007232.db2.gz QGGWMHPNRBEQOC-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)[C@H]1C ZINC000516198402 338007233 /nfs/dbraw/zinc/00/72/33/338007233.db2.gz QGGWMHPNRBEQOC-PPLKHSGQSA-N 2 1 300.490 4.236 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1ccc(C(F)(F)F)s1)C(C)C ZINC000428865957 338063179 /nfs/dbraw/zinc/06/31/79/338063179.db2.gz IEKCIJZMPCPFIE-UHFFFAOYSA-N 2 1 322.440 4.365 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](CC)c1ccc(F)cc1 ZINC000429248274 338074641 /nfs/dbraw/zinc/07/46/41/338074641.db2.gz VOAHEBXIIBYVDZ-GOSISDBHSA-N 2 1 317.452 4.448 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](CC)c1ccc(F)cc1 ZINC000429248274 338074642 /nfs/dbraw/zinc/07/46/42/338074642.db2.gz VOAHEBXIIBYVDZ-GOSISDBHSA-N 2 1 317.452 4.448 20 0 DIADMP CC[NH2+]CC1CC[NH+](Cc2csc(C3CCCCC3)n2)CC1 ZINC000430565343 338108708 /nfs/dbraw/zinc/10/87/08/338108708.db2.gz PVMZSVDGRQIGJS-UHFFFAOYSA-N 2 1 321.534 4.012 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431609979 338134733 /nfs/dbraw/zinc/13/47/33/338134733.db2.gz PGJUNPAIDJMSQL-ZWKOTPCHSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431609979 338134734 /nfs/dbraw/zinc/13/47/34/338134734.db2.gz PGJUNPAIDJMSQL-ZWKOTPCHSA-N 2 1 320.546 4.221 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+]([C@@H](C)CCSc2ccccc2)C1 ZINC000431609979 338134735 /nfs/dbraw/zinc/13/47/35/338134735.db2.gz PGJUNPAIDJMSQL-ZWKOTPCHSA-N 2 1 320.546 4.221 20 0 DIADMP C[C@@H](CCSc1ccccc1)[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000431624827 338134934 /nfs/dbraw/zinc/13/49/34/338134934.db2.gz XLBLPOWUWVJPFS-HOTGVXAUSA-N 2 1 315.486 4.160 20 0 DIADMP CC(C)CCOc1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000432792136 338168116 /nfs/dbraw/zinc/16/81/16/338168116.db2.gz IYMFZZGLRFDNCL-LJQANCHMSA-N 2 1 318.505 4.028 20 0 DIADMP CC(C)CCOc1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000432792136 338168117 /nfs/dbraw/zinc/16/81/17/338168117.db2.gz IYMFZZGLRFDNCL-LJQANCHMSA-N 2 1 318.505 4.028 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433320755 338192065 /nfs/dbraw/zinc/19/20/65/338192065.db2.gz SWQJQHOFBBTCDW-KRWDZBQOSA-N 2 1 317.864 4.115 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433320755 338192066 /nfs/dbraw/zinc/19/20/66/338192066.db2.gz SWQJQHOFBBTCDW-KRWDZBQOSA-N 2 1 317.864 4.115 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436232943 338262738 /nfs/dbraw/zinc/26/27/38/338262738.db2.gz QLPYIFJPWRNFGN-RLLQIKCJSA-N 2 1 300.490 4.033 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000436267957 338264536 /nfs/dbraw/zinc/26/45/36/338264536.db2.gz FPWAGXNMGDPCCP-GIVPXCGWSA-N 2 1 314.517 4.424 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436312122 338268595 /nfs/dbraw/zinc/26/85/95/338268595.db2.gz JRERLDIJFHQYLA-HMXCVIKNSA-N 2 1 314.517 4.280 20 0 DIADMP CC[NH+](CC)CC1CC[NH+](Cc2ccc(Cl)cc2F)CC1 ZINC000437579296 338314244 /nfs/dbraw/zinc/31/42/44/338314244.db2.gz HVKDWCYMYJKPSW-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000437778913 338320994 /nfs/dbraw/zinc/32/09/94/338320994.db2.gz BGCHNJXCMDCXOK-RYRKJORJSA-N 2 1 318.480 4.172 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438198215 338336238 /nfs/dbraw/zinc/33/62/38/338336238.db2.gz GQOOFBYDMIBZDL-NRSPTQNISA-N 2 1 314.517 4.207 20 0 DIADMP C[NH+](C)C1(C[NH2+]C2CCC(OC3CCCC3)CC2)CCCCC1 ZINC000449059470 338589237 /nfs/dbraw/zinc/58/92/37/338589237.db2.gz PIQJLRMPISAAHU-UHFFFAOYSA-N 2 1 322.537 4.111 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC000449061596 338589368 /nfs/dbraw/zinc/58/93/68/338589368.db2.gz GSYMVIIFXZNEAR-CRAIPNDOSA-N 2 1 306.881 4.050 20 0 DIADMP Cc1ncc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)s1 ZINC000449131450 338595856 /nfs/dbraw/zinc/59/58/56/338595856.db2.gz MTFWSFPMOARVMW-UHFFFAOYSA-N 2 1 323.550 4.220 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2CCCCC2(F)F)CC1 ZINC000450865813 338709316 /nfs/dbraw/zinc/70/93/16/338709316.db2.gz DYZUAYYGTQNXHP-OAHLLOKOSA-N 2 1 324.415 4.059 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CC[C@@H](C)c2ccsc21 ZINC000453109761 338794880 /nfs/dbraw/zinc/79/48/80/338794880.db2.gz AQOAIPBBNYSARS-CZUORRHYSA-N 2 1 303.475 4.261 20 0 DIADMP CC[C@@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccsc1 ZINC000453118707 338796111 /nfs/dbraw/zinc/79/61/11/338796111.db2.gz JXXMSUBHVQYXGZ-QGZVFWFLSA-N 2 1 315.486 4.161 20 0 DIADMP C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(CC2CCC(F)(F)CC2)C1 ZINC000459373368 339025386 /nfs/dbraw/zinc/02/53/86/339025386.db2.gz RZTBAPFVRFALSJ-HLLBOEOZSA-N 2 1 314.464 4.149 20 0 DIADMP CCC(CC)[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccs1 ZINC000459387985 339026307 /nfs/dbraw/zinc/02/63/07/339026307.db2.gz DPCATIADHNIGFP-GOSISDBHSA-N 2 1 306.519 4.442 20 0 DIADMP CCC(CC)[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccs1 ZINC000459387992 339026423 /nfs/dbraw/zinc/02/64/23/339026423.db2.gz DPCATIADHNIGFP-SFHVURJKSA-N 2 1 306.519 4.442 20 0 DIADMP c1ccc(C[C@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459401944 339027183 /nfs/dbraw/zinc/02/71/83/339027183.db2.gz JKZFGSKCDMAIOG-NQIIRXRSSA-N 2 1 312.501 4.004 20 0 DIADMP Fc1cccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)c1 ZINC000459427166 339028528 /nfs/dbraw/zinc/02/85/28/339028528.db2.gz AJDDLXTWJSDSBE-HXUWFJFHSA-N 2 1 316.464 4.273 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](CC2CCC(F)(F)CC2)CC1 ZINC000459431095 339028829 /nfs/dbraw/zinc/02/88/29/339028829.db2.gz QVPNWGBWJGFVAP-UHFFFAOYSA-N 2 1 324.415 4.059 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462103409 339072150 /nfs/dbraw/zinc/07/21/50/339072150.db2.gz FINNFDVYSWNOHG-AYOQOUSVSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462103409 339072151 /nfs/dbraw/zinc/07/21/51/339072151.db2.gz FINNFDVYSWNOHG-AYOQOUSVSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462103410 339072184 /nfs/dbraw/zinc/07/21/84/339072184.db2.gz FINNFDVYSWNOHG-KFKAGJAMSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000462103410 339072185 /nfs/dbraw/zinc/07/21/85/339072185.db2.gz FINNFDVYSWNOHG-KFKAGJAMSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462103408 339072240 /nfs/dbraw/zinc/07/22/40/339072240.db2.gz FINNFDVYSWNOHG-ATZDWAIDSA-N 2 1 322.924 4.370 20 0 DIADMP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000462103408 339072241 /nfs/dbraw/zinc/07/22/41/339072241.db2.gz FINNFDVYSWNOHG-ATZDWAIDSA-N 2 1 322.924 4.370 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)C1 ZINC000462356023 339076457 /nfs/dbraw/zinc/07/64/57/339076457.db2.gz CNZRDQKRLOSIJD-WBVHZDCISA-N 2 1 315.436 4.378 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCCCNc1cc[nH+]c2ccsc21 ZINC000462793323 339089092 /nfs/dbraw/zinc/08/90/92/339089092.db2.gz ZQRXSFDOOZUYHD-AWEZNQCLSA-N 2 1 303.475 4.363 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCCNc1cc[nH+]c2ccsc21 ZINC000462793323 339089093 /nfs/dbraw/zinc/08/90/93/339089093.db2.gz ZQRXSFDOOZUYHD-AWEZNQCLSA-N 2 1 303.475 4.363 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(F)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000463133410 339106769 /nfs/dbraw/zinc/10/67/69/339106769.db2.gz YEKQRLQELKSBOK-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(F)cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000463133410 339106770 /nfs/dbraw/zinc/10/67/70/339106770.db2.gz YEKQRLQELKSBOK-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463138936 339106935 /nfs/dbraw/zinc/10/69/35/339106935.db2.gz FOYUSKKTYZNUMS-SIKLNZKXSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463138936 339106936 /nfs/dbraw/zinc/10/69/36/339106936.db2.gz FOYUSKKTYZNUMS-SIKLNZKXSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463146136 339107132 /nfs/dbraw/zinc/10/71/32/339107132.db2.gz FBDVJWMAZBOWSF-ZULIPRJHSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC000463146136 339107133 /nfs/dbraw/zinc/10/71/33/339107133.db2.gz FBDVJWMAZBOWSF-ZULIPRJHSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000463149551 339107341 /nfs/dbraw/zinc/10/73/41/339107341.db2.gz LQRSAJOEXKTDMR-RUCARUNLSA-N 2 1 318.480 4.001 20 0 DIADMP CC[C@@H]1CCC[C@H]1[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000463206957 339109432 /nfs/dbraw/zinc/10/94/32/339109432.db2.gz RIJWAKHAXHOXLW-YLJYHZDGSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC23CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000463235051 339110906 /nfs/dbraw/zinc/11/09/06/339110906.db2.gz FHSYNXMSPHSTCD-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC000463235051 339110907 /nfs/dbraw/zinc/11/09/07/339110907.db2.gz FHSYNXMSPHSTCD-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCC3(CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC000463248918 339112110 /nfs/dbraw/zinc/11/21/10/339112110.db2.gz CAYMBKDDXBIHKK-XLIONFOSSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CCC3(CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000463248918 339112111 /nfs/dbraw/zinc/11/21/11/339112111.db2.gz CAYMBKDDXBIHKK-XLIONFOSSA-N 2 1 312.501 4.352 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463278913 339112953 /nfs/dbraw/zinc/11/29/53/339112953.db2.gz DYSAXAFWPKBTTO-IEBWSBKVSA-N 2 1 320.546 4.162 20 0 DIADMP CSCCCCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463278913 339112954 /nfs/dbraw/zinc/11/29/54/339112954.db2.gz DYSAXAFWPKBTTO-IEBWSBKVSA-N 2 1 320.546 4.162 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](CCCc2cccc3ccccc32)C1 ZINC000464771288 339152278 /nfs/dbraw/zinc/15/22/78/339152278.db2.gz CTTJQIKFMHIRSN-LJQANCHMSA-N 2 1 324.512 4.436 20 0 DIADMP CCc1ccc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000464832246 339156006 /nfs/dbraw/zinc/15/60/06/339156006.db2.gz CUJBTZFDCUVLQW-QFIPXVFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000464832246 339156007 /nfs/dbraw/zinc/15/60/07/339156007.db2.gz CUJBTZFDCUVLQW-QFIPXVFZSA-N 2 1 322.496 4.203 20 0 DIADMP CCc1ccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000464832246 339156008 /nfs/dbraw/zinc/15/60/08/339156008.db2.gz CUJBTZFDCUVLQW-QFIPXVFZSA-N 2 1 322.496 4.203 20 0 DIADMP Cc1cc(C)cc(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000464836039 339156257 /nfs/dbraw/zinc/15/62/57/339156257.db2.gz JBFUTZYGVWWJOG-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cc(C)cc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000464836039 339156258 /nfs/dbraw/zinc/15/62/58/339156258.db2.gz JBFUTZYGVWWJOG-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1cc(C)cc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000464836039 339156259 /nfs/dbraw/zinc/15/62/59/339156259.db2.gz JBFUTZYGVWWJOG-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP C[C@H](C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841338 339156731 /nfs/dbraw/zinc/15/67/31/339156731.db2.gz YBVKYQIZMNFPTC-CTNGQTDRSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@H](C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841338 339156732 /nfs/dbraw/zinc/15/67/32/339156732.db2.gz YBVKYQIZMNFPTC-CTNGQTDRSA-N 2 1 322.496 4.244 20 0 DIADMP C[C@H](C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000464841338 339156733 /nfs/dbraw/zinc/15/67/33/339156733.db2.gz YBVKYQIZMNFPTC-CTNGQTDRSA-N 2 1 322.496 4.244 20 0 DIADMP Cc1ccc(C)c(C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000464842714 339157043 /nfs/dbraw/zinc/15/70/43/339157043.db2.gz KWUMRTCCDCOFBK-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C)c(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000464842714 339157044 /nfs/dbraw/zinc/15/70/44/339157044.db2.gz KWUMRTCCDCOFBK-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP Cc1ccc(C)c(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000464842714 339157045 /nfs/dbraw/zinc/15/70/45/339157045.db2.gz KWUMRTCCDCOFBK-OAQYLSRUSA-N 2 1 322.496 4.257 20 0 DIADMP C[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000467454659 339239681 /nfs/dbraw/zinc/23/96/81/339239681.db2.gz QAOJUVGHLWLXHC-MLZLACJZSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)[NH+](CCC[NH2+]Cc1ccc(Cl)c(F)c1)C(C)C ZINC000467766835 339246203 /nfs/dbraw/zinc/24/62/03/339246203.db2.gz VCGPJOVBMNBALD-UHFFFAOYSA-N 2 1 300.849 4.078 20 0 DIADMP C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000468229252 339256781 /nfs/dbraw/zinc/25/67/81/339256781.db2.gz FZLDQHWLWNORHU-UTKZUKDTSA-N 2 1 312.501 4.187 20 0 DIADMP CCCCOc1ccccc1CN(C)[C@H]1CC[N@@H+](CC)[C@@H](C)C1 ZINC000468393116 339261467 /nfs/dbraw/zinc/26/14/67/339261467.db2.gz RUPHDEMKOOSRAB-HKUYNNGSSA-N 2 1 318.505 4.170 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)CC2CCC(C(F)(F)F)CC2)CC1 ZINC000468392225 339261596 /nfs/dbraw/zinc/26/15/96/339261596.db2.gz KDVLQALHSCMVSK-UHFFFAOYSA-N 2 1 320.443 4.160 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)CC1CCC(C(F)(F)F)CC1 ZINC000468404243 339262031 /nfs/dbraw/zinc/26/20/31/339262031.db2.gz BVFCDHXBNGENBW-UYSNPLJNSA-N 2 1 320.443 4.161 20 0 DIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000469004696 339277196 /nfs/dbraw/zinc/27/71/96/339277196.db2.gz QPGDAGSPBKFGQF-KBPBESRZSA-N 2 1 314.926 4.420 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2csc(Cl)c2)C1 ZINC000469004696 339277197 /nfs/dbraw/zinc/27/71/97/339277197.db2.gz QPGDAGSPBKFGQF-KBPBESRZSA-N 2 1 314.926 4.420 20 0 DIADMP C[C@@H](c1cccs1)[N@H+](Cc1ccccc1)C[C@H]1CCC[NH2+]C1 ZINC000469876121 339303477 /nfs/dbraw/zinc/30/34/77/339303477.db2.gz QERHTLHTPJJYNW-WMZOPIPTSA-N 2 1 314.498 4.311 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000470000824 339307957 /nfs/dbraw/zinc/30/79/57/339307957.db2.gz UTPOCHFFRJNRBG-ZDUSSCGKSA-N 2 1 320.889 4.110 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C2c3ccccc3-c3ccccc32)C1 ZINC000471024746 339334826 /nfs/dbraw/zinc/33/48/26/339334826.db2.gz DBROTVVJUVITHF-QGZVFWFLSA-N 2 1 320.480 4.420 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000471024746 339334827 /nfs/dbraw/zinc/33/48/27/339334827.db2.gz DBROTVVJUVITHF-QGZVFWFLSA-N 2 1 320.480 4.420 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C2c3ccccc3-c3ccccc32)C1 ZINC000471024746 339334828 /nfs/dbraw/zinc/33/48/28/339334828.db2.gz DBROTVVJUVITHF-QGZVFWFLSA-N 2 1 320.480 4.420 20 0 DIADMP C[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Oc2ccccc2)cc1 ZINC000471758974 339353256 /nfs/dbraw/zinc/35/32/56/339353256.db2.gz MMFQLALDYLMEDB-INIZCTEOSA-N 2 1 321.424 4.106 20 0 DIADMP COc1ccsc1[C@@H](C)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000472157904 339364667 /nfs/dbraw/zinc/36/46/67/339364667.db2.gz PXGWOEXNOIAITL-CQSZACIVSA-N 2 1 310.507 4.062 20 0 DIADMP COc1ccsc1[C@@H](C)[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000472157904 339364668 /nfs/dbraw/zinc/36/46/68/339364668.db2.gz PXGWOEXNOIAITL-CQSZACIVSA-N 2 1 310.507 4.062 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000472157899 339364683 /nfs/dbraw/zinc/36/46/83/339364683.db2.gz NHVVGNDJBTUYFD-GJZGRUSLSA-N 2 1 310.507 4.062 20 0 DIADMP COc1ccsc1[C@H](C)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000472160333 339364831 /nfs/dbraw/zinc/36/48/31/339364831.db2.gz QQXDWQPRLOARCH-XHSDSOJGSA-N 2 1 324.534 4.165 20 0 DIADMP COc1ccsc1[C@@H](C)[NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000472160331 339364874 /nfs/dbraw/zinc/36/48/74/339364874.db2.gz QQXDWQPRLOARCH-OWCLPIDISA-N 2 1 324.534 4.165 20 0 DIADMP CCSc1cccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000473133560 339381834 /nfs/dbraw/zinc/38/18/34/339381834.db2.gz SCPFDAWRABZQBH-GOSISDBHSA-N 2 1 318.530 4.249 20 0 DIADMP CCSc1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000473133560 339381835 /nfs/dbraw/zinc/38/18/35/339381835.db2.gz SCPFDAWRABZQBH-GOSISDBHSA-N 2 1 318.530 4.249 20 0 DIADMP CCSc1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000473146492 339382745 /nfs/dbraw/zinc/38/27/45/339382745.db2.gz MMTZKMRWVWYRIJ-SFHVURJKSA-N 2 1 318.530 4.106 20 0 DIADMP CCSc1cccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000473146492 339382746 /nfs/dbraw/zinc/38/27/46/339382746.db2.gz MMTZKMRWVWYRIJ-SFHVURJKSA-N 2 1 318.530 4.106 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149862 339383058 /nfs/dbraw/zinc/38/30/58/339383058.db2.gz YJWOYDZULYEXMK-MAUKXSAKSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149862 339383059 /nfs/dbraw/zinc/38/30/59/339383059.db2.gz YJWOYDZULYEXMK-MAUKXSAKSA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149862 339383060 /nfs/dbraw/zinc/38/30/60/339383060.db2.gz YJWOYDZULYEXMK-MAUKXSAKSA-N 2 1 313.489 4.089 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C ZINC000473149862 339383061 /nfs/dbraw/zinc/38/30/61/339383061.db2.gz YJWOYDZULYEXMK-MAUKXSAKSA-N 2 1 313.489 4.089 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)C1CCC(F)(F)CC1 ZINC000474029955 339397709 /nfs/dbraw/zinc/39/77/09/339397709.db2.gz GRDJHMIQEXYLDF-CABCVRRESA-N 2 1 302.453 4.055 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)C1CCC(F)(F)CC1 ZINC000474047302 339399065 /nfs/dbraw/zinc/39/90/65/339399065.db2.gz PPHWZEHEEYPLOG-HZPDHXFCSA-N 2 1 316.480 4.445 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)C[NH+]1CCCCCC1)C1CCC(F)(F)CC1 ZINC000474056571 339399755 /nfs/dbraw/zinc/39/97/55/339399755.db2.gz LNJFVMTVPZZJPS-LSDHHAIUSA-N 2 1 302.453 4.055 20 0 DIADMP Cc1cc(C)cc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000483165484 339654791 /nfs/dbraw/zinc/65/47/91/339654791.db2.gz CDZWASCBYRZKSY-SFHVURJKSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000484486098 339687604 /nfs/dbraw/zinc/68/76/04/339687604.db2.gz FCRABZDRBBVSHN-HRCADAONSA-N 2 1 300.446 4.265 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)C1 ZINC000493279682 339921928 /nfs/dbraw/zinc/92/19/28/339921928.db2.gz ZMIGKCVDXBVKHG-VQTJNVASSA-N 2 1 308.469 4.238 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000494482462 339950922 /nfs/dbraw/zinc/95/09/22/339950922.db2.gz FLAMDMBONKAALO-KSSFIOAISA-N 2 1 306.519 4.189 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840345 340024290 /nfs/dbraw/zinc/02/42/90/340024290.db2.gz YKKYGMNWFQJMEK-MSOLQXFVSA-N 2 1 318.480 4.331 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC000498840345 340024291 /nfs/dbraw/zinc/02/42/91/340024291.db2.gz YKKYGMNWFQJMEK-MSOLQXFVSA-N 2 1 318.480 4.331 20 0 DIADMP CCCC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000499175055 340031742 /nfs/dbraw/zinc/03/17/42/340031742.db2.gz IWXBUQLRDVKMOU-OWZKRDHZSA-N 2 1 312.501 4.352 20 0 DIADMP CCC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CCC1 ZINC000499237060 340032956 /nfs/dbraw/zinc/03/29/56/340032956.db2.gz LHWMROCDEZEKKH-OWZKRDHZSA-N 2 1 312.501 4.352 20 0 DIADMP CC(C)[C@@H](C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499251317 340033289 /nfs/dbraw/zinc/03/32/89/340033289.db2.gz OAUNNPAOTAGWOU-FRYIKTPZSA-N 2 1 300.490 4.064 20 0 DIADMP CCC[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccccn1 ZINC000500615472 340063669 /nfs/dbraw/zinc/06/36/69/340063669.db2.gz BTLIMWQZGFAFOW-SFHVURJKSA-N 2 1 303.494 4.167 20 0 DIADMP CCC[C@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccccn1 ZINC000500615472 340063670 /nfs/dbraw/zinc/06/36/70/340063670.db2.gz BTLIMWQZGFAFOW-SFHVURJKSA-N 2 1 303.494 4.167 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1)[NH+](C)C ZINC000501470768 340081813 /nfs/dbraw/zinc/08/18/13/340081813.db2.gz YZTHASIQVYYYMG-IHPCNDPISA-N 2 1 317.521 4.064 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCC23CCC3)C[N@H+]1Cc1ccccc1 ZINC000502411996 340102454 /nfs/dbraw/zinc/10/24/54/340102454.db2.gz BFEDHWZFUBQHLH-HOJAQTOUSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1cc([C@H](C)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476755 340105311 /nfs/dbraw/zinc/10/53/11/340105311.db2.gz YUJSEDINBYZPEV-YQQAZPJKSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)oc1C ZINC000502476755 340105312 /nfs/dbraw/zinc/10/53/12/340105312.db2.gz YUJSEDINBYZPEV-YQQAZPJKSA-N 2 1 304.478 4.200 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)oc1C ZINC000502476755 340105313 /nfs/dbraw/zinc/10/53/13/340105313.db2.gz YUJSEDINBYZPEV-YQQAZPJKSA-N 2 1 304.478 4.200 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+]C(C)(C)c1cccc(C(F)(F)F)c1 ZINC000502692503 340110820 /nfs/dbraw/zinc/11/08/20/340110820.db2.gz OTIJELJRDBRRKZ-HNNXBMFYSA-N 2 1 314.395 4.014 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2ccccc2)CCCCC1 ZINC000503082653 340120702 /nfs/dbraw/zinc/12/07/02/340120702.db2.gz XKDTZTUFFKOBQN-UHFFFAOYSA-N 2 1 311.473 4.421 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@@H]3C[C@@H]3c3ccccc3)CC2)cc1 ZINC000503240232 340123807 /nfs/dbraw/zinc/12/38/07/340123807.db2.gz FTJPUGWSAQOBCK-RBBKRZOGSA-N 2 1 320.480 4.044 20 0 DIADMP CCc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)C(C)C)cc1 ZINC000506127770 340186457 /nfs/dbraw/zinc/18/64/57/340186457.db2.gz TYVNRGSLTHIOIL-VAMGGRTRSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476029 340195326 /nfs/dbraw/zinc/19/53/26/340195326.db2.gz ZXNWTSMERIFAPW-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506476029 340195327 /nfs/dbraw/zinc/19/53/27/340195327.db2.gz ZXNWTSMERIFAPW-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1cccc(F)c1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506476029 340195328 /nfs/dbraw/zinc/19/53/28/340195328.db2.gz ZXNWTSMERIFAPW-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@@H](c1cccc(F)c1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506476029 340195329 /nfs/dbraw/zinc/19/53/29/340195329.db2.gz ZXNWTSMERIFAPW-SQNIBIBYSA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483712 340195529 /nfs/dbraw/zinc/19/55/29/340195529.db2.gz WCTMRTKOWCJLLI-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000506483712 340195530 /nfs/dbraw/zinc/19/55/30/340195530.db2.gz WCTMRTKOWCJLLI-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000506483712 340195531 /nfs/dbraw/zinc/19/55/31/340195531.db2.gz WCTMRTKOWCJLLI-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP C[C@H](c1ccc(F)cc1)[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506483712 340195532 /nfs/dbraw/zinc/19/55/32/340195532.db2.gz WCTMRTKOWCJLLI-KURKYZTESA-N 2 1 318.480 4.473 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2cc(-c3ccccc3)cs2)CC1 ZINC000506664205 340198915 /nfs/dbraw/zinc/19/89/15/340198915.db2.gz ZPAWDDFSANQXQM-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2cc(-c3ccccc3)cs2)CC1 ZINC000506664205 340198916 /nfs/dbraw/zinc/19/89/16/340198916.db2.gz ZPAWDDFSANQXQM-UHFFFAOYSA-N 2 1 314.498 4.331 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000507360511 340217894 /nfs/dbraw/zinc/21/78/94/340217894.db2.gz NMAGUNCAWMGXEK-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000507360511 340217895 /nfs/dbraw/zinc/21/78/95/340217895.db2.gz NMAGUNCAWMGXEK-UHFFFAOYSA-N 2 1 315.288 4.298 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000508193229 340240299 /nfs/dbraw/zinc/24/02/99/340240299.db2.gz UKAZYZMIGVWQMG-QGZVFWFLSA-N 2 1 306.519 4.145 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000508193229 340240300 /nfs/dbraw/zinc/24/03/00/340240300.db2.gz UKAZYZMIGVWQMG-QGZVFWFLSA-N 2 1 306.519 4.145 20 0 DIADMP Cn1cc[nH+]c1CC1CC[NH+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000508326109 340242485 /nfs/dbraw/zinc/24/24/85/340242485.db2.gz RKAYOHIRXJVKHH-UHFFFAOYSA-N 2 1 323.484 4.142 20 0 DIADMP C[C@H]([NH2+]C1(c2ccccc2)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000508713113 340251395 /nfs/dbraw/zinc/25/13/95/340251395.db2.gz SCWUOILNHMHETL-ICSRJNTNSA-N 2 1 320.480 4.176 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508790000 340253102 /nfs/dbraw/zinc/25/31/02/340253102.db2.gz QHCHEMLJKWWXTC-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508790000 340253103 /nfs/dbraw/zinc/25/31/03/340253103.db2.gz QHCHEMLJKWWXTC-GOSISDBHSA-N 2 1 300.490 4.118 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC(C)(C)C1 ZINC000302796084 340282170 /nfs/dbraw/zinc/28/21/70/340282170.db2.gz UUTSSOHFFCVTHG-PXNSSMCTSA-N 2 1 314.517 4.455 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3)o2)CC1 ZINC000510467853 340300350 /nfs/dbraw/zinc/30/03/50/340300350.db2.gz SXCNUBZVHCPCQT-UHFFFAOYSA-N 2 1 312.457 4.253 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccccc3)o2)CC1 ZINC000510467853 340300351 /nfs/dbraw/zinc/30/03/51/340300351.db2.gz SXCNUBZVHCPCQT-UHFFFAOYSA-N 2 1 312.457 4.253 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@H]2CC[C@H]2C2CCC2)CC1 ZINC000510665142 340305646 /nfs/dbraw/zinc/30/56/46/340305646.db2.gz BOONOUODWJEZQK-CZAAIQMYSA-N 2 1 312.501 4.380 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCC[C@H]1CCCF)Cc1ccccc1 ZINC000510672986 340306105 /nfs/dbraw/zinc/30/61/05/340306105.db2.gz XRGBVNHINXEMNG-OALUTQOASA-N 2 1 306.469 4.017 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@@H]2CC[C@H]2C2CCC2)CC1 ZINC000510753972 340309802 /nfs/dbraw/zinc/30/98/02/340309802.db2.gz MVLHLFTYNIKODG-LEWJYISDSA-N 2 1 312.501 4.128 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000510958504 340316192 /nfs/dbraw/zinc/31/61/92/340316192.db2.gz LUOSNUUFMULHIR-ZIAGYGMSSA-N 2 1 305.853 4.017 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@@H](C)C2)cc1 ZINC000511149262 340322337 /nfs/dbraw/zinc/32/23/37/340322337.db2.gz FQNSVWKAHGALOL-RDJZCZTQSA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000511149262 340322338 /nfs/dbraw/zinc/32/23/38/340322338.db2.gz FQNSVWKAHGALOL-RDJZCZTQSA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)Sc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000511149262 340322339 /nfs/dbraw/zinc/32/23/39/340322339.db2.gz FQNSVWKAHGALOL-RDJZCZTQSA-N 2 1 306.519 4.102 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)CCc2ccc3ccccc3c2)CC1 ZINC000511615436 340332579 /nfs/dbraw/zinc/33/25/79/340332579.db2.gz HCVNCBPRWJBGNI-UHFFFAOYSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303557423 340333530 /nfs/dbraw/zinc/33/35/30/340333530.db2.gz HTLDVTCKISGURE-CEXWTWQISA-N 2 1 300.490 4.334 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303557423 340333531 /nfs/dbraw/zinc/33/35/31/340333531.db2.gz HTLDVTCKISGURE-CEXWTWQISA-N 2 1 300.490 4.334 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000303557423 340333532 /nfs/dbraw/zinc/33/35/32/340333532.db2.gz HTLDVTCKISGURE-CEXWTWQISA-N 2 1 300.490 4.334 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccc3occc3c2)C1 ZINC000512144352 340349635 /nfs/dbraw/zinc/34/96/35/340349635.db2.gz KBBWHTSGJIKEOO-INIZCTEOSA-N 2 1 300.446 4.035 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)s1 ZINC000512170633 340350785 /nfs/dbraw/zinc/35/07/85/340350785.db2.gz STDIXDYKYDSVSW-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)s1 ZINC000512170633 340350786 /nfs/dbraw/zinc/35/07/86/340350786.db2.gz STDIXDYKYDSVSW-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)s1 ZINC000512170633 340350787 /nfs/dbraw/zinc/35/07/87/340350787.db2.gz STDIXDYKYDSVSW-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)s1 ZINC000512170633 340350788 /nfs/dbraw/zinc/35/07/88/340350788.db2.gz STDIXDYKYDSVSW-RDJZCZTQSA-N 2 1 306.519 4.143 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)s1 ZINC000512184178 340351352 /nfs/dbraw/zinc/35/13/52/340351352.db2.gz XGGDWIVVTJQGTR-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)s1 ZINC000512184178 340351353 /nfs/dbraw/zinc/35/13/53/340351353.db2.gz XGGDWIVVTJQGTR-KRWDZBQOSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512313506 340356550 /nfs/dbraw/zinc/35/65/50/340356550.db2.gz JSLBNMJFEKYFDP-PMPSAXMXSA-N 2 1 306.519 4.360 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C3CCC3)C1)CC2 ZINC000512317532 340356686 /nfs/dbraw/zinc/35/66/86/340356686.db2.gz CPZPGAMVEBNJFP-YRISNDGFSA-N 2 1 312.501 4.225 20 0 DIADMP CCCOc1cccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000512830288 340379687 /nfs/dbraw/zinc/37/96/87/340379687.db2.gz XPYVGYUCJBCBJE-SFHVURJKSA-N 2 1 318.505 4.077 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2ccc(Cl)cc2)C1 ZINC000513003895 340387803 /nfs/dbraw/zinc/38/78/03/340387803.db2.gz LLVOUCVJOJJARX-JBXOJTMHSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC000309842214 340433842 /nfs/dbraw/zinc/43/38/42/340433842.db2.gz QDJNSQIRTOSBPF-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1csc(Cl)c1 ZINC000230407455 340620004 /nfs/dbraw/zinc/62/00/04/340620004.db2.gz IPNVRRIOQITRDQ-CYBMUJFWSA-N 2 1 300.899 4.174 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000236744994 340664561 /nfs/dbraw/zinc/66/45/61/340664561.db2.gz WSMSPWRQDAEACJ-IBGZPJMESA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000236744830 340664568 /nfs/dbraw/zinc/66/45/68/340664568.db2.gz WSMSPWRQDAEACJ-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000237410206 340670754 /nfs/dbraw/zinc/67/07/54/340670754.db2.gz OHJRUKOBRDTQPG-GOSISDBHSA-N 2 1 308.469 4.310 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000237499697 340671527 /nfs/dbraw/zinc/67/15/27/340671527.db2.gz LZAPXWNFDABRAV-IEBWSBKVSA-N 2 1 300.490 4.209 20 0 DIADMP CCC[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000037140798 340762878 /nfs/dbraw/zinc/76/28/78/340762878.db2.gz QDAAYTCEMRHUSG-SFHVURJKSA-N 2 1 306.881 4.398 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C ZINC000037211046 340773629 /nfs/dbraw/zinc/77/36/29/340773629.db2.gz HTRAAKACVIEMMS-CYBMUJFWSA-N 2 1 311.539 4.132 20 0 DIADMP Cc1cccc(N2CCC([NH2+][C@H](C)c3cccc(C)c3C)CC2)[nH+]1 ZINC000128098423 340860691 /nfs/dbraw/zinc/86/06/91/340860691.db2.gz NDXRXNMRLGMVJO-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000539069708 340870355 /nfs/dbraw/zinc/87/03/55/340870355.db2.gz SQIDUDDOSGKPGJ-XLIONFOSSA-N 2 1 313.489 4.219 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000539079077 340871176 /nfs/dbraw/zinc/87/11/76/340871176.db2.gz RQIUYQGLWZUYCW-KSSFIOAISA-N 2 1 317.502 4.410 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CCC2(CCC[N@H+]2C)CC1 ZINC000542268512 341002786 /nfs/dbraw/zinc/00/27/86/341002786.db2.gz STXZDXNHTQGQEA-QGZVFWFLSA-N 2 1 308.469 4.461 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1Cl ZINC000542488266 341009876 /nfs/dbraw/zinc/00/98/76/341009876.db2.gz GNIFFKYZVDJCCV-HUUCEWRRSA-N 2 1 324.896 4.264 20 0 DIADMP C[C@H](C[NH2+]C1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1 ZINC000542518651 341011803 /nfs/dbraw/zinc/01/18/03/341011803.db2.gz ZSMLDVFHNBRVBY-IBGZPJMESA-N 2 1 322.496 4.119 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@H](C)CCSc1ccccc1 ZINC000130827960 341048128 /nfs/dbraw/zinc/04/81/28/341048128.db2.gz ZOAYKTDQKUVBMU-MRXNPFEDSA-N 2 1 317.502 4.084 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@H](C)CCSc1ccccc1 ZINC000130827960 341048129 /nfs/dbraw/zinc/04/81/29/341048129.db2.gz ZOAYKTDQKUVBMU-MRXNPFEDSA-N 2 1 317.502 4.084 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000131173731 341063697 /nfs/dbraw/zinc/06/36/97/341063697.db2.gz OCCUKQZSTPHAQG-CQSZACIVSA-N 2 1 323.550 4.346 20 0 DIADMP Cc1ccc(CCC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000544423945 341081656 /nfs/dbraw/zinc/08/16/56/341081656.db2.gz IMTPTRXIUBIGIT-ICSRJNTNSA-N 2 1 314.517 4.170 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568770 341086220 /nfs/dbraw/zinc/08/62/20/341086220.db2.gz ANUFWQNBGDMCNA-QFBILLFUSA-N 2 1 304.478 4.141 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(C)o2)C2CCCC2)C1 ZINC000544568770 341086221 /nfs/dbraw/zinc/08/62/21/341086221.db2.gz ANUFWQNBGDMCNA-QFBILLFUSA-N 2 1 304.478 4.141 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)C1 ZINC000564319774 341211218 /nfs/dbraw/zinc/21/12/18/341211218.db2.gz YUTARVFEIUWENL-SUMDDJOVSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@H](CC[NH2+]Cc1cccc2[nH]ccc21)[N@@H+](C)Cc1ccccc1 ZINC000237464914 341214503 /nfs/dbraw/zinc/21/45/03/341214503.db2.gz VNNWPTUOBPVMEZ-QGZVFWFLSA-N 2 1 321.468 4.168 20 0 DIADMP C[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000237587883 341216276 /nfs/dbraw/zinc/21/62/76/341216276.db2.gz CPZQVZPGUOAQQD-JXFKEZNVSA-N 2 1 312.457 4.190 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481934 341263146 /nfs/dbraw/zinc/26/31/46/341263146.db2.gz VPYZXKJICQIKDI-JQHSSLGASA-N 2 1 322.443 4.065 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548483641 341263210 /nfs/dbraw/zinc/26/32/10/341263210.db2.gz CCQJDEWSZOLZER-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP C[C@@H]([NH2+]CC1(C2CC2)CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481911 341263214 /nfs/dbraw/zinc/26/32/14/341263214.db2.gz ODKADGBGCHLCJA-MJGOQNOKSA-N 2 1 312.501 4.067 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(F)cc(Cl)c2)CC1 ZINC000548587867 341266447 /nfs/dbraw/zinc/26/64/47/341266447.db2.gz OIVYULCAPJCWBE-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)C(c1ccccc1)c1ccccc1 ZINC000549140756 341287089 /nfs/dbraw/zinc/28/70/89/341287089.db2.gz PDQIKWUFDJIOSP-UHFFFAOYSA-N 2 1 319.452 4.303 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)C(c1ccccc1)c1ccccc1 ZINC000549140756 341287090 /nfs/dbraw/zinc/28/70/90/341287090.db2.gz PDQIKWUFDJIOSP-UHFFFAOYSA-N 2 1 319.452 4.303 20 0 DIADMP c1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000245764309 341314004 /nfs/dbraw/zinc/31/40/04/341314004.db2.gz WCKANMWKHUKZNI-KOUNCHBCSA-N 2 1 320.480 4.014 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550610750 341319413 /nfs/dbraw/zinc/31/94/13/341319413.db2.gz RLWOKSFYOFRFTD-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550610750 341319414 /nfs/dbraw/zinc/31/94/14/341319414.db2.gz RLWOKSFYOFRFTD-RBUKOAKNSA-N 2 1 314.860 4.265 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000550613007 341319482 /nfs/dbraw/zinc/31/94/82/341319482.db2.gz WCKFDZJJNJMZBA-AZUAARDMSA-N 2 1 312.432 4.059 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1F ZINC000550613007 341319483 /nfs/dbraw/zinc/31/94/83/341319483.db2.gz WCKFDZJJNJMZBA-AZUAARDMSA-N 2 1 312.432 4.059 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550619949 341319644 /nfs/dbraw/zinc/31/96/44/341319644.db2.gz RIRHYKSHPUFVPZ-LMCOJAPRSA-N 2 1 300.490 4.238 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550619949 341319645 /nfs/dbraw/zinc/31/96/45/341319645.db2.gz RIRHYKSHPUFVPZ-LMCOJAPRSA-N 2 1 300.490 4.238 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000550621476 341319799 /nfs/dbraw/zinc/31/97/99/341319799.db2.gz CBPNBLDFCUWAIS-LEWJYISDSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c(C)c1 ZINC000550621476 341319800 /nfs/dbraw/zinc/31/98/00/341319800.db2.gz CBPNBLDFCUWAIS-LEWJYISDSA-N 2 1 308.469 4.229 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000550624688 341319857 /nfs/dbraw/zinc/31/98/57/341319857.db2.gz XTRLYDFMHGNYTP-DZFGPLHGSA-N 2 1 308.469 4.481 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000550624688 341319858 /nfs/dbraw/zinc/31/98/58/341319858.db2.gz XTRLYDFMHGNYTP-DZFGPLHGSA-N 2 1 308.469 4.481 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000550644358 341320191 /nfs/dbraw/zinc/32/01/91/341320191.db2.gz SBIHGZMPWMMKCU-YPAWHYETSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000550644358 341320192 /nfs/dbraw/zinc/32/01/92/341320192.db2.gz SBIHGZMPWMMKCU-YPAWHYETSA-N 2 1 322.496 4.433 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550662010 341320849 /nfs/dbraw/zinc/32/08/49/341320849.db2.gz NBRWTKYWAZEIIN-YADHBBJMSA-N 2 1 322.496 4.271 20 0 DIADMP Cc1cc(C)cc(CC[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000550662010 341320850 /nfs/dbraw/zinc/32/08/50/341320850.db2.gz NBRWTKYWAZEIIN-YADHBBJMSA-N 2 1 322.496 4.271 20 0 DIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551010304 341329158 /nfs/dbraw/zinc/32/91/58/341329158.db2.gz ZRXOXWKIQNTPGD-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1 ZINC000551010304 341329159 /nfs/dbraw/zinc/32/91/59/341329159.db2.gz ZRXOXWKIQNTPGD-TZIWHRDSSA-N 2 1 324.468 4.010 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3c2cccc3F)C[C@H]1c1ccccc1 ZINC000551013898 341329265 /nfs/dbraw/zinc/32/92/65/341329265.db2.gz FWVJYMCBRAXJHM-DQLDELGASA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3c2cccc3F)C[C@H]1c1ccccc1 ZINC000551013898 341329266 /nfs/dbraw/zinc/32/92/66/341329266.db2.gz FWVJYMCBRAXJHM-DQLDELGASA-N 2 1 324.443 4.238 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000551062945 341330619 /nfs/dbraw/zinc/33/06/19/341330619.db2.gz GFNZPVUFXOAWPC-RTBURBONSA-N 2 1 300.490 4.382 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)CCCC1 ZINC000551062945 341330620 /nfs/dbraw/zinc/33/06/20/341330620.db2.gz GFNZPVUFXOAWPC-RTBURBONSA-N 2 1 300.490 4.382 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000551062938 341330623 /nfs/dbraw/zinc/33/06/23/341330623.db2.gz GFNZPVUFXOAWPC-MOPGFXCFSA-N 2 1 300.490 4.382 20 0 DIADMP CCC1(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)CCCC1 ZINC000551062938 341330624 /nfs/dbraw/zinc/33/06/24/341330624.db2.gz GFNZPVUFXOAWPC-MOPGFXCFSA-N 2 1 300.490 4.382 20 0 DIADMP CC[C@@H](C)[C@@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551268262 341336460 /nfs/dbraw/zinc/33/64/60/341336460.db2.gz TYDFSBATLSSSQN-NXMBOHNASA-N 2 1 302.506 4.454 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000551309934 341338173 /nfs/dbraw/zinc/33/81/73/341338173.db2.gz ZPCLHQQWQWAOKW-CMTQZCSUSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1ccccc1C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)C1CC1 ZINC000551530967 341344111 /nfs/dbraw/zinc/34/41/11/341344111.db2.gz ZNNFGKAWXFVOSO-RXVVDRJESA-N 2 1 314.517 4.026 20 0 DIADMP Cc1ccccc1C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)C1CC1 ZINC000551530968 341344157 /nfs/dbraw/zinc/34/41/57/341344157.db2.gz ZNNFGKAWXFVOSO-WIYYLYMNSA-N 2 1 314.517 4.026 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1F ZINC000246975129 341359285 /nfs/dbraw/zinc/35/92/85/341359285.db2.gz JRZIHEWPSXLLLB-CABCVRRESA-N 2 1 324.509 4.319 20 0 DIADMP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000247000796 341359681 /nfs/dbraw/zinc/35/96/81/341359681.db2.gz JWSOBSVBJVRDKN-AEGPPILISA-N 2 1 323.550 4.272 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cnc3ccsc3c2)C1 ZINC000247149028 341361493 /nfs/dbraw/zinc/36/14/93/341361493.db2.gz WXABMYMWGHVBJY-CABCVRRESA-N 2 1 317.502 4.067 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)C1 ZINC000247160807 341361647 /nfs/dbraw/zinc/36/16/47/341361647.db2.gz UDRKKVJUIDNSBI-HIFRSBDPSA-N 2 1 323.550 4.132 20 0 DIADMP CC(C)[C@@H]1CC[C@H]1[NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000552043364 341364321 /nfs/dbraw/zinc/36/43/21/341364321.db2.gz JXQHRKXDGAWYNZ-FFZOFVMBSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C)c1ccncc1 ZINC000247438621 341364991 /nfs/dbraw/zinc/36/49/91/341364991.db2.gz NAVJHPYJFLSDBU-QZTJIDSGSA-N 2 1 323.484 4.307 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000248408539 341376891 /nfs/dbraw/zinc/37/68/91/341376891.db2.gz VPHBYAIICHPPAD-SCTDSRPQSA-N 2 1 300.490 4.299 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248409010 341377032 /nfs/dbraw/zinc/37/70/32/341377032.db2.gz WDEBHFPJDZCJIY-UVFQYZLESA-N 2 1 316.464 4.056 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000552224342 341379469 /nfs/dbraw/zinc/37/94/69/341379469.db2.gz UGLJKCMMPNZHFQ-WMZOPIPTSA-N 2 1 300.490 4.020 20 0 DIADMP C[C@H](c1cccc(Cl)c1F)N1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000248551237 341379832 /nfs/dbraw/zinc/37/98/32/341379832.db2.gz INJANAXEMLKNSI-IOASZLSFSA-N 2 1 321.827 4.320 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CC23CCCC3)CC1 ZINC000552262453 341382262 /nfs/dbraw/zinc/38/22/62/341382262.db2.gz XGEPPDSPYZIIMA-MHJFOBGBSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cnn1C(C)C ZINC000248688238 341384323 /nfs/dbraw/zinc/38/43/23/341384323.db2.gz IDALMEHOLUUFND-SJORKVTESA-N 2 1 320.525 4.078 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCCC3)[C@H]1c1cccs1 ZINC000248968265 341390904 /nfs/dbraw/zinc/39/09/04/341390904.db2.gz CCRGOMZKZVPWHE-NJAFHUGGSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC23CCCC3)[C@H]1c1cccs1 ZINC000248968265 341390905 /nfs/dbraw/zinc/39/09/05/341390905.db2.gz CCRGOMZKZVPWHE-NJAFHUGGSA-N 2 1 318.530 4.443 20 0 DIADMP Cc1ccc2oc(C[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2c1 ZINC000553856089 341437029 /nfs/dbraw/zinc/43/70/29/341437029.db2.gz SUECIBBAUGOQPR-UHFFFAOYSA-N 2 1 312.457 4.238 20 0 DIADMP CC(C)(C[NH2+]C1CC(c2cc(F)cc(F)c2)C1)[NH+]1CCCCC1 ZINC000554857557 341466950 /nfs/dbraw/zinc/46/69/50/341466950.db2.gz ULENDNOSGQSYHC-UHFFFAOYSA-N 2 1 322.443 4.065 20 0 DIADMP CC[C@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)c(Cl)c1 ZINC000336842746 341678753 /nfs/dbraw/zinc/67/87/53/341678753.db2.gz VFOWEQWXKJTLTJ-HNNXBMFYSA-N 2 1 312.244 4.239 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1)c1ccccn1 ZINC000158643890 525439173 /nfs/dbraw/zinc/43/91/73/525439173.db2.gz CTUDNOZIDBIOAO-MSOLQXFVSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccncc1 ZINC000266423630 525461985 /nfs/dbraw/zinc/46/19/85/525461985.db2.gz BJHBSFUDZHRFDQ-MSOLQXFVSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1cccnc1 ZINC000264898271 525520534 /nfs/dbraw/zinc/52/05/34/525520534.db2.gz VGCXFVPZZFQMLI-ZWKOTPCHSA-N 2 1 323.484 4.307 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1)c1ccncc1 ZINC000266423637 525538449 /nfs/dbraw/zinc/53/84/49/525538449.db2.gz BJHBSFUDZHRFDQ-ZWKOTPCHSA-N 2 1 323.484 4.164 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)o1 ZINC000158143361 525941572 /nfs/dbraw/zinc/94/15/72/525941572.db2.gz DMYBHOXZQCZOQB-CABCVRRESA-N 2 1 309.413 4.494 20 0 DIADMP c1csc(C([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cccs2)c1 ZINC000128089803 526578006 /nfs/dbraw/zinc/57/80/06/526578006.db2.gz LJRWLUGKJRTZSQ-UONOGXRCSA-N 2 1 318.511 4.115 20 0 DIADMP c1csc(C([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2cccs2)c1 ZINC000128089803 526578012 /nfs/dbraw/zinc/57/80/12/526578012.db2.gz LJRWLUGKJRTZSQ-UONOGXRCSA-N 2 1 318.511 4.115 20 0 DIADMP Cc1sccc1C[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000339295793 526917321 /nfs/dbraw/zinc/91/73/21/526917321.db2.gz SGCULUMZPIRBSQ-ZDUSSCGKSA-N 2 1 311.454 4.401 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H]2CC[C@@H]2C2CCC2)cc1 ZINC000337985659 527381603 /nfs/dbraw/zinc/38/16/03/527381603.db2.gz AOLOVCXNLQWILD-KPOBHBOGSA-N 2 1 309.457 4.410 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000366002908 527421283 /nfs/dbraw/zinc/42/12/83/527421283.db2.gz VZYGNCISUOHGPR-FPMFFAJLSA-N 2 1 323.893 4.078 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000338011755 527421619 /nfs/dbraw/zinc/42/16/19/527421619.db2.gz OOIJBZRHOQDNGU-MRXNPFEDSA-N 2 1 324.255 4.166 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000338008732 527422824 /nfs/dbraw/zinc/42/28/24/527422824.db2.gz TYEJZRSEUCFJBV-OAHLLOKOSA-N 2 1 311.429 4.295 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000338027921 527422863 /nfs/dbraw/zinc/42/28/63/527422863.db2.gz MZVONRSSMZKQGX-SFHVURJKSA-N 2 1 317.452 4.488 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000338027853 527423213 /nfs/dbraw/zinc/42/32/13/527423213.db2.gz MZVONRSSMZKQGX-GOSISDBHSA-N 2 1 317.452 4.488 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc(Cl)sc1Cl ZINC000575060394 1050627655 /nfs/dbraw/zinc/62/76/55/1050627655.db2.gz XVXNEEQCRLXKPV-SECBINFHSA-N 2 1 315.269 4.364 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+]C3CCC4(CC4)CC3)C2)cc1 ZINC000683079280 1035512511 /nfs/dbraw/zinc/51/25/11/1035512511.db2.gz LXXVGOBZXAZRKA-IBGZPJMESA-N 2 1 312.501 4.211 20 0 DIADMP CC(C)C(C)(C)C[NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579722488 1035530548 /nfs/dbraw/zinc/53/05/48/1035530548.db2.gz LFUPYYLJZYGKLF-MJGOQNOKSA-N 2 1 302.506 4.169 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)ccc1OC ZINC000643546511 1035592601 /nfs/dbraw/zinc/59/26/01/1035592601.db2.gz PRJVGYHYVMNCAX-HOCLYGCPSA-N 2 1 322.880 4.064 20 0 DIADMP C[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)s1 ZINC000035285787 1035654519 /nfs/dbraw/zinc/65/45/19/1035654519.db2.gz RJUGKTVRKXSXES-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc(Cl)s1 ZINC000035285787 1035654525 /nfs/dbraw/zinc/65/45/25/1035654525.db2.gz RJUGKTVRKXSXES-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1ccc(Cl)s1 ZINC000035285787 1035654532 /nfs/dbraw/zinc/65/45/32/1035654532.db2.gz RJUGKTVRKXSXES-OLZOCXBDSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccs2)s1 ZINC001206768719 1035664309 /nfs/dbraw/zinc/66/43/09/1035664309.db2.gz LUNPRKUFZYNNFP-QWHCGFSZSA-N 2 1 306.500 4.036 20 0 DIADMP CC/C=C\CC[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001208729588 1035830585 /nfs/dbraw/zinc/83/05/85/1035830585.db2.gz DYUFRIJXBMRCPN-PLNGDYQASA-N 2 1 300.490 4.187 20 0 DIADMP C[C@@H](NCc1cccc(F)c1F)c1ccc(-n2ccnc2)cc1 ZINC000073617876 1035917338 /nfs/dbraw/zinc/91/73/38/1035917338.db2.gz KEVSIEBGPFKGLJ-CYBMUJFWSA-N 2 1 313.351 4.001 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H]2CCSc3ccccc32)CC1 ZINC000037150131 1035953721 /nfs/dbraw/zinc/95/37/21/1035953721.db2.gz VVVGZPAQGOYLQM-QGZVFWFLSA-N 2 1 304.503 4.078 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)CCC2 ZINC000535621440 1035978217 /nfs/dbraw/zinc/97/82/17/1035978217.db2.gz LRBSBKWVWZSXHQ-OXQOHEQNSA-N 2 1 300.490 4.119 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCS2 ZINC000037318632 1036017616 /nfs/dbraw/zinc/01/76/16/1036017616.db2.gz BUMGSEFYKBZCEG-MRXNPFEDSA-N 2 1 322.905 4.093 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]CC1(C)CCC1 ZINC001648791923 1036058719 /nfs/dbraw/zinc/05/87/19/1036058719.db2.gz FJWDCRWQHMXSIG-QGZVFWFLSA-N 2 1 300.490 4.341 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C[C@H]2CC=CCC2)C1 ZINC001648792534 1036080735 /nfs/dbraw/zinc/08/07/35/1036080735.db2.gz PTKDOYJVJYPDDU-MOPGFXCFSA-N 2 1 312.501 4.364 20 0 DIADMP C[C@H]1C[C@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@@H+]1C ZINC000443887439 1036158549 /nfs/dbraw/zinc/15/85/49/1036158549.db2.gz HCUIKQMKAQJAHY-WCQYABFASA-N 2 1 323.362 4.148 20 0 DIADMP C[C@H]1C[C@H](Nc2cc[nH+]c3cc(C(F)(F)F)ccc23)CC[N@H+]1C ZINC000443887439 1036158556 /nfs/dbraw/zinc/15/85/56/1036158556.db2.gz HCUIKQMKAQJAHY-WCQYABFASA-N 2 1 323.362 4.148 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@@H+]1C ZINC000120786092 1036241367 /nfs/dbraw/zinc/24/13/67/1036241367.db2.gz GNCQHCNZGCEFET-IFIJOSMWSA-N 2 1 310.432 4.124 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)CC[N@H+]1C ZINC000120786092 1036241382 /nfs/dbraw/zinc/24/13/82/1036241382.db2.gz GNCQHCNZGCEFET-IFIJOSMWSA-N 2 1 310.432 4.124 20 0 DIADMP C[C@@H](C1CC1)[N@@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CC1 ZINC001167262009 1036343226 /nfs/dbraw/zinc/34/32/26/1036343226.db2.gz UAYMTTVEPIYWDV-KRWDZBQOSA-N 2 1 312.501 4.435 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC001648802470 1036375392 /nfs/dbraw/zinc/37/53/92/1036375392.db2.gz JYUJPCVAWVJCLJ-MBOZVWFJSA-N 2 1 302.506 4.441 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@H](C)c2ccccc2)cc1F ZINC000237412673 1036375917 /nfs/dbraw/zinc/37/59/17/1036375917.db2.gz DZJDCYPXWKRRSM-HNNXBMFYSA-N 2 1 323.415 4.213 20 0 DIADMP CC(C)C[NH+]1CCC(Nc2cc[nH+]c3cc(Cl)ccc23)CC1 ZINC000302969087 1036415870 /nfs/dbraw/zinc/41/58/70/1036415870.db2.gz QNTSONGQPGYXLV-UHFFFAOYSA-N 2 1 317.864 4.421 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000324627461 1036427139 /nfs/dbraw/zinc/42/71/39/1036427139.db2.gz PSOPVDBIFBAKOW-HRAATJIYSA-N 2 1 318.464 4.220 20 0 DIADMP CS[C@@H]1CCC[C@@H]([NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC001648811702 1036493219 /nfs/dbraw/zinc/49/32/19/1036493219.db2.gz VWTFVMXAIDPDOC-XMTFNYHQSA-N 2 1 312.567 4.008 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CS1 ZINC000655715668 1036498620 /nfs/dbraw/zinc/49/86/20/1036498620.db2.gz NBNMGFFAJWHTOI-AESZEHBQSA-N 2 1 324.559 4.005 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CS1 ZINC000655715668 1036498633 /nfs/dbraw/zinc/49/86/33/1036498633.db2.gz NBNMGFFAJWHTOI-AESZEHBQSA-N 2 1 324.559 4.005 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)CS1 ZINC000655715669 1036500665 /nfs/dbraw/zinc/50/06/65/1036500665.db2.gz NBNMGFFAJWHTOI-AIANPOQGSA-N 2 1 324.559 4.005 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)CS1 ZINC000655715669 1036500652 /nfs/dbraw/zinc/50/06/52/1036500652.db2.gz NBNMGFFAJWHTOI-AIANPOQGSA-N 2 1 324.559 4.005 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000315580824 1036582343 /nfs/dbraw/zinc/58/23/43/1036582343.db2.gz QQCAXXOUVOZIRK-RHSMWYFYSA-N 2 1 322.493 4.217 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000315580824 1036582353 /nfs/dbraw/zinc/58/23/53/1036582353.db2.gz QQCAXXOUVOZIRK-RHSMWYFYSA-N 2 1 322.493 4.217 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](CCC2CCC2)CC1 ZINC001167307020 1036585491 /nfs/dbraw/zinc/58/54/91/1036585491.db2.gz OMQNCAHYBUKGHI-UHFFFAOYSA-N 2 1 300.490 4.021 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCCc1cncn1C ZINC000579974559 1036659966 /nfs/dbraw/zinc/65/99/66/1036659966.db2.gz MGRPNXKJDVPCHH-CABCVRRESA-N 2 1 319.880 4.130 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCCc1c[nH+]cn1C ZINC000579974559 1036659968 /nfs/dbraw/zinc/65/99/68/1036659968.db2.gz MGRPNXKJDVPCHH-CABCVRRESA-N 2 1 319.880 4.130 20 0 DIADMP C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCCc1c[nH+]cn1C ZINC000579974559 1036659974 /nfs/dbraw/zinc/65/99/74/1036659974.db2.gz MGRPNXKJDVPCHH-CABCVRRESA-N 2 1 319.880 4.130 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C[C@@H]2CCCC[C@@H]2C)cc1F ZINC001648902913 1036681486 /nfs/dbraw/zinc/68/14/86/1036681486.db2.gz ARMJPDDPMBGDNV-YOEHRIQHSA-N 2 1 315.436 4.236 20 0 DIADMP Cc1cccc(C)c1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001167326921 1036744332 /nfs/dbraw/zinc/74/43/32/1036744332.db2.gz YBCNTMYGSQCWTG-FQEVSTJZSA-N 2 1 314.517 4.391 20 0 DIADMP Cc1ccsc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379618893 1037044558 /nfs/dbraw/zinc/04/45/58/1037044558.db2.gz AVRPZFCLBXNNJN-WMZOPIPTSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccsc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379618893 1037044573 /nfs/dbraw/zinc/04/45/73/1037044573.db2.gz AVRPZFCLBXNNJN-WMZOPIPTSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379618890 1037045908 /nfs/dbraw/zinc/04/59/08/1037045908.db2.gz AVRPZFCLBXNNJN-FUHWJXTLSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccsc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379618890 1037045922 /nfs/dbraw/zinc/04/59/22/1037045922.db2.gz AVRPZFCLBXNNJN-FUHWJXTLSA-N 2 1 314.498 4.199 20 0 DIADMP CCCC(CCC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398022336 1037083765 /nfs/dbraw/zinc/08/37/65/1037083765.db2.gz KQBBNHXVXALLQB-PXNSSMCTSA-N 2 1 302.506 4.455 20 0 DIADMP CCCC(CCC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398022336 1037083780 /nfs/dbraw/zinc/08/37/80/1037083780.db2.gz KQBBNHXVXALLQB-PXNSSMCTSA-N 2 1 302.506 4.455 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398032524 1037097298 /nfs/dbraw/zinc/09/72/98/1037097298.db2.gz OAGFFBFTCRSADG-BJLQDIEVSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398032524 1037097317 /nfs/dbraw/zinc/09/73/17/1037097317.db2.gz OAGFFBFTCRSADG-BJLQDIEVSA-N 2 1 302.506 4.311 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccccc3[nH]2)c1 ZINC000683927471 1037112866 /nfs/dbraw/zinc/11/28/66/1037112866.db2.gz WRGZJDQADSAHOF-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398158524 1037246264 /nfs/dbraw/zinc/24/62/64/1037246264.db2.gz FLELBWBAXSOULH-PXNSSMCTSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCC(C)(C)CC1 ZINC000398158524 1037246272 /nfs/dbraw/zinc/24/62/72/1037246272.db2.gz FLELBWBAXSOULH-PXNSSMCTSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000090114908 1037709059 /nfs/dbraw/zinc/70/90/59/1037709059.db2.gz TUHAIVJRRXFYDH-QSGLGXSPSA-N 2 1 318.892 4.254 20 0 DIADMP CCOc1ccccc1[C@H](CC)[NH2+]CC[C@H]1CCCC[N@@H+]1C ZINC000341662857 1038213580 /nfs/dbraw/zinc/21/35/80/1038213580.db2.gz VYJLFAPHTYFCLL-AEFFLSMTSA-N 2 1 304.478 4.000 20 0 DIADMP CCOc1ccccc1[C@H](CC)[NH2+]CC[C@H]1CCCC[N@H+]1C ZINC000341662857 1038213595 /nfs/dbraw/zinc/21/35/95/1038213595.db2.gz VYJLFAPHTYFCLL-AEFFLSMTSA-N 2 1 304.478 4.000 20 0 DIADMP CCCC[C@@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(OC)cc1 ZINC000341796740 1038270440 /nfs/dbraw/zinc/27/04/40/1038270440.db2.gz JEKXZKZYGLUGAL-PKOBYXMFSA-N 2 1 304.478 4.000 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](CC(C)C)c1ccc(Cl)cc1 ZINC000341878230 1038306886 /nfs/dbraw/zinc/30/68/86/1038306886.db2.gz MJVJVVFTENZQJU-KRWDZBQOSA-N 2 1 305.853 4.222 20 0 DIADMP CC(C)[C@H](C[NH2+][C@H](C)C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914711 1038377651 /nfs/dbraw/zinc/37/76/51/1038377651.db2.gz YGOFVMRRDZXBEN-GGPKGHCWSA-N 2 1 302.506 4.136 20 0 DIADMP CC(C)[C@H](C[NH2+][C@H](C)C[N@H+]1CCC[C@@H](C)C1)c1ccccc1 ZINC001648914711 1038377664 /nfs/dbraw/zinc/37/76/64/1038377664.db2.gz YGOFVMRRDZXBEN-GGPKGHCWSA-N 2 1 302.506 4.136 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226939 1038379612 /nfs/dbraw/zinc/37/96/12/1038379612.db2.gz DUROSBDESLFWQZ-NVXWUHKLSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)CC(F)F ZINC000647226939 1038379627 /nfs/dbraw/zinc/37/96/27/1038379627.db2.gz DUROSBDESLFWQZ-NVXWUHKLSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1CCC[C@@H](C[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001167499255 1038452327 /nfs/dbraw/zinc/45/23/27/1038452327.db2.gz FGPYBRPJZIKENK-HMXCVIKNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@@H](C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001167499255 1038452330 /nfs/dbraw/zinc/45/23/30/1038452330.db2.gz FGPYBRPJZIKENK-HMXCVIKNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCC[C@@H](C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001167499255 1038452335 /nfs/dbraw/zinc/45/23/35/1038452335.db2.gz FGPYBRPJZIKENK-HMXCVIKNSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000604885062 1038462494 /nfs/dbraw/zinc/46/24/94/1038462494.db2.gz FFWWUABVLJJYNP-AQNXPRMDSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000604885062 1038462500 /nfs/dbraw/zinc/46/25/00/1038462500.db2.gz FFWWUABVLJJYNP-AQNXPRMDSA-N 2 1 314.517 4.377 20 0 DIADMP C[C@H](C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1)c1ccccc1 ZINC000604885062 1038462506 /nfs/dbraw/zinc/46/25/06/1038462506.db2.gz FFWWUABVLJJYNP-AQNXPRMDSA-N 2 1 314.517 4.377 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1 ZINC000707898410 1038498189 /nfs/dbraw/zinc/49/81/89/1038498189.db2.gz IPYHFWIPVATOLC-HSALFYBXSA-N 2 1 321.468 4.021 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102098 1038515130 /nfs/dbraw/zinc/51/51/30/1038515130.db2.gz CJDJYUZVCZAQCO-OCCSQVGLSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102098 1038515133 /nfs/dbraw/zinc/51/51/33/1038515133.db2.gz CJDJYUZVCZAQCO-OCCSQVGLSA-N 2 1 314.395 4.068 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102098 1038515138 /nfs/dbraw/zinc/51/51/38/1038515138.db2.gz CJDJYUZVCZAQCO-OCCSQVGLSA-N 2 1 314.395 4.068 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(C(F)F)c(F)c2)C[C@H]1C ZINC000892102098 1038515143 /nfs/dbraw/zinc/51/51/43/1038515143.db2.gz CJDJYUZVCZAQCO-OCCSQVGLSA-N 2 1 314.395 4.068 20 0 DIADMP Cc1ccc(CC[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000605575050 1038536686 /nfs/dbraw/zinc/53/66/86/1038536686.db2.gz GTLKNVQDONEKKQ-FPOVZHCZSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000605575050 1038536693 /nfs/dbraw/zinc/53/66/93/1038536693.db2.gz GTLKNVQDONEKKQ-FPOVZHCZSA-N 2 1 314.517 4.124 20 0 DIADMP Cc1ccc(CC[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cc1 ZINC000605575050 1038536699 /nfs/dbraw/zinc/53/66/99/1038536699.db2.gz GTLKNVQDONEKKQ-FPOVZHCZSA-N 2 1 314.517 4.124 20 0 DIADMP CC(C[NH+]([C@@H](C)C1CC1)C1CC1)C[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000605573352 1038537446 /nfs/dbraw/zinc/53/74/46/1038537446.db2.gz NWGKUJCSDBHDCF-HOTGVXAUSA-N 2 1 304.522 4.148 20 0 DIADMP CC(C)[NH2+]C1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000108369795 1038599452 /nfs/dbraw/zinc/59/94/52/1038599452.db2.gz FGLLSVZLRFMUDT-CYBMUJFWSA-N 2 1 314.395 4.229 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2CC(C)C)C1 ZINC001167557926 1038618515 /nfs/dbraw/zinc/61/85/15/1038618515.db2.gz ADIUOMDXLKJKKL-SFHVURJKSA-N 2 1 302.506 4.049 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2CC(C)C)C1 ZINC001167557926 1038618519 /nfs/dbraw/zinc/61/85/19/1038618519.db2.gz ADIUOMDXLKJKKL-SFHVURJKSA-N 2 1 302.506 4.049 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2CC(C)C)C1 ZINC001167557926 1038618521 /nfs/dbraw/zinc/61/85/21/1038618521.db2.gz ADIUOMDXLKJKKL-SFHVURJKSA-N 2 1 302.506 4.049 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557984 1038620194 /nfs/dbraw/zinc/62/01/94/1038620194.db2.gz BRRAQNLVVSCWJR-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557984 1038620200 /nfs/dbraw/zinc/62/02/00/1038620200.db2.gz BRRAQNLVVSCWJR-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557984 1038620204 /nfs/dbraw/zinc/62/02/04/1038620204.db2.gz BRRAQNLVVSCWJR-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cccc(C(C)(C)C)c2)C1 ZINC001167557984 1038620208 /nfs/dbraw/zinc/62/02/08/1038620208.db2.gz BRRAQNLVVSCWJR-GOSISDBHSA-N 2 1 302.506 4.148 20 0 DIADMP CC[C@@H](CC(F)F)C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000659973580 1038629213 /nfs/dbraw/zinc/62/92/13/1038629213.db2.gz RYUWXSJJEAJHNX-WMZOPIPTSA-N 2 1 324.459 4.122 20 0 DIADMP CC[C@@H](CC(F)F)C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000659973580 1038629217 /nfs/dbraw/zinc/62/92/17/1038629217.db2.gz RYUWXSJJEAJHNX-WMZOPIPTSA-N 2 1 324.459 4.122 20 0 DIADMP CC[C@@H](CC(F)F)C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000659973580 1038629223 /nfs/dbraw/zinc/62/92/23/1038629223.db2.gz RYUWXSJJEAJHNX-WMZOPIPTSA-N 2 1 324.459 4.122 20 0 DIADMP CSc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)s1 ZINC000582389469 1038651295 /nfs/dbraw/zinc/65/12/95/1038651295.db2.gz MVKIWIVIQDOURX-AWEZNQCLSA-N 2 1 312.548 4.214 20 0 DIADMP Cc1nccn1CC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000342571976 1038675098 /nfs/dbraw/zinc/67/50/98/1038675098.db2.gz FTSZYNURNJJTPS-HXUWFJFHSA-N 2 1 305.425 4.182 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC000608063171 1038763136 /nfs/dbraw/zinc/76/31/36/1038763136.db2.gz CDPQJHLESXKITO-IRFCIJBXSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C[C@@H](C)Cn2cc[nH+]c2C)C2CCCC2)o1 ZINC000342801236 1038805108 /nfs/dbraw/zinc/80/51/08/1038805108.db2.gz CKUAGWPMIATGFD-KUHUBIRLSA-N 2 1 315.461 4.250 20 0 DIADMP CCCOc1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1 ZINC000534347034 1039035196 /nfs/dbraw/zinc/03/51/96/1039035196.db2.gz XTMFGABABDGKDS-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167646821 1039078160 /nfs/dbraw/zinc/07/81/60/1039078160.db2.gz HKNZLPJSHUFMMF-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001167646821 1039078175 /nfs/dbraw/zinc/07/81/75/1039078175.db2.gz HKNZLPJSHUFMMF-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CCCCC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001167646821 1039078181 /nfs/dbraw/zinc/07/81/81/1039078181.db2.gz HKNZLPJSHUFMMF-UXHICEINSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)(C)[N@@H+](Cc1cc2c(s1)C[NH2+]CC2)Cc1ccccc1 ZINC001204604437 1039185690 /nfs/dbraw/zinc/18/56/90/1039185690.db2.gz OKKXPCFJLAKKLV-UHFFFAOYSA-N 2 1 314.498 4.195 20 0 DIADMP CO[C@@H](CC(C)C)C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC001167659865 1039206889 /nfs/dbraw/zinc/20/68/89/1039206889.db2.gz VYCQIWFGUHBNPQ-ICSRJNTNSA-N 2 1 324.553 4.024 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000539499529 1039272455 /nfs/dbraw/zinc/27/24/55/1039272455.db2.gz GVAXIUWQDQAHJV-QAPCUYQASA-N 2 1 306.469 4.234 20 0 DIADMP CC(C)Sc1ccc([C@H](C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000539506975 1039275874 /nfs/dbraw/zinc/27/58/74/1039275874.db2.gz IQIXGVKNSNBWQF-HNNXBMFYSA-N 2 1 304.503 4.100 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC000539508969 1039281330 /nfs/dbraw/zinc/28/13/30/1039281330.db2.gz DXEOLHFTVCTYEK-IRXDYDNUSA-N 2 1 313.489 4.174 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756768 1039308100 /nfs/dbraw/zinc/30/81/00/1039308100.db2.gz IIOVFXRCUQXRQD-PMACEKPBSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756768 1039308119 /nfs/dbraw/zinc/30/81/19/1039308119.db2.gz IIOVFXRCUQXRQD-PMACEKPBSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693465 1039322021 /nfs/dbraw/zinc/32/20/21/1039322021.db2.gz IPROWJPYKSGYFS-APWZRJJASA-N 2 1 317.436 4.482 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693465 1039322040 /nfs/dbraw/zinc/32/20/40/1039322040.db2.gz IPROWJPYKSGYFS-APWZRJJASA-N 2 1 317.436 4.482 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693614 1039323294 /nfs/dbraw/zinc/32/32/94/1039323294.db2.gz IPROWJPYKSGYFS-VQIMIIECSA-N 2 1 317.436 4.482 20 0 DIADMP C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000539693614 1039323309 /nfs/dbraw/zinc/32/33/09/1039323309.db2.gz IPROWJPYKSGYFS-VQIMIIECSA-N 2 1 317.436 4.482 20 0 DIADMP Cc1cnc([C@@H](C)[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000540052835 1039408589 /nfs/dbraw/zinc/40/85/89/1039408589.db2.gz KQKFQJRPQQTPCF-DOTOQJQBSA-N 2 1 319.493 4.021 20 0 DIADMP Cc1cnc([C@@H](C)[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000540052835 1039408606 /nfs/dbraw/zinc/40/86/06/1039408606.db2.gz KQKFQJRPQQTPCF-DOTOQJQBSA-N 2 1 319.493 4.021 20 0 DIADMP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540147524 1039427466 /nfs/dbraw/zinc/42/74/66/1039427466.db2.gz ADHDSBPTILNELM-QZTJIDSGSA-N 2 1 318.505 4.104 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(Cl)s2)C1 ZINC000151136498 1039451056 /nfs/dbraw/zinc/45/10/56/1039451056.db2.gz WMDGNJDRYXUOJU-OLZOCXBDSA-N 2 1 300.899 4.174 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]Cc3ccc(C[NH3+])cc3F)oc2c1 ZINC000650754284 1039460523 /nfs/dbraw/zinc/46/05/23/1039460523.db2.gz FOJYQBOZKFYQCZ-CYBMUJFWSA-N 2 1 312.388 4.190 20 0 DIADMP C[C@@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1Cl ZINC000278438874 1039471728 /nfs/dbraw/zinc/47/17/28/1039471728.db2.gz KEFNHAKEMFWBBT-XBFCOCLRSA-N 2 1 313.272 4.271 20 0 DIADMP C[C@@H](NCC[C@H]1CCC[N@H+]1C)c1cccc(Cl)c1Cl ZINC000540410991 1039488866 /nfs/dbraw/zinc/48/88/66/1039488866.db2.gz IVAVOKSYKXUVPY-VXGBXAGGSA-N 2 1 301.261 4.128 20 0 DIADMP C[C@H](NCC[C@H]1CCC[N@H+]1C)c1cccc(Cl)c1Cl ZINC000540410988 1039489057 /nfs/dbraw/zinc/48/90/57/1039489057.db2.gz IVAVOKSYKXUVPY-NWDGAFQWSA-N 2 1 301.261 4.128 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000540591697 1039521867 /nfs/dbraw/zinc/52/18/67/1039521867.db2.gz NKLJVEFBCTWQEW-CRAIPNDOSA-N 2 1 306.469 4.234 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)CC(F)F ZINC000647318963 1039554855 /nfs/dbraw/zinc/55/48/55/1039554855.db2.gz HDIULEBJBQWHKQ-DDBAPUKQSA-N 2 1 322.443 4.063 20 0 DIADMP C[C@H](CC[NH2+][C@H]1CCSc2c(F)cccc21)[NH+]1CCCCC1 ZINC000346872537 1039576645 /nfs/dbraw/zinc/57/66/45/1039576645.db2.gz NJLRNIHTVCPBPT-PBHICJAKSA-N 2 1 322.493 4.217 20 0 DIADMP CCc1ccc(CC[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC000541601814 1039715315 /nfs/dbraw/zinc/71/53/15/1039715315.db2.gz QJGCKEKIXSSDAV-YLJYHZDGSA-N 2 1 314.517 4.034 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccccc2F)cc1 ZINC000086279362 1039757671 /nfs/dbraw/zinc/75/76/71/1039757671.db2.gz LHHPOISTRHBZTF-AWEZNQCLSA-N 2 1 309.388 4.171 20 0 DIADMP C(=C/[C@H]1CCCCC[N@@H+]1CCC[NH+]1CCCC1)\c1cccs1 ZINC000542134547 1039797542 /nfs/dbraw/zinc/79/75/42/1039797542.db2.gz RSYYTUJEYVTNSI-DOJUMQAQSA-N 2 1 318.530 4.492 20 0 DIADMP C(=C\[C@@H]1CCCCC[N@@H+]1CCC[NH+]1CCCC1)\c1cccs1 ZINC000542134549 1039797692 /nfs/dbraw/zinc/79/76/92/1039797692.db2.gz RSYYTUJEYVTNSI-LENZSSGSSA-N 2 1 318.530 4.492 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000090974813 1039822417 /nfs/dbraw/zinc/82/24/17/1039822417.db2.gz DDIUWFQYMIUAAX-HNNXBMFYSA-N 2 1 312.432 4.238 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000090974814 1039825024 /nfs/dbraw/zinc/82/50/24/1039825024.db2.gz DDIUWFQYMIUAAX-OAHLLOKOSA-N 2 1 312.432 4.238 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1cccnc1 ZINC000091261551 1039837036 /nfs/dbraw/zinc/83/70/36/1039837036.db2.gz SGKVZNWSEWHGRZ-NRFANRHFSA-N 2 1 323.484 4.033 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccccc1Cl)C(C)C ZINC000091288163 1039843887 /nfs/dbraw/zinc/84/38/87/1039843887.db2.gz ZAGRSRXBNFKFRH-QGZVFWFLSA-N 2 1 305.853 4.222 20 0 DIADMP CC(C)(C[N@H+]1CCC[C@@H]([NH3+])CC1)Sc1ccc(Cl)cc1 ZINC001205087591 1039933187 /nfs/dbraw/zinc/93/31/87/1039933187.db2.gz GAYFUHRVJIFABL-CQSZACIVSA-N 2 1 312.910 4.024 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])c2ccccc21)c1cccc(OC(F)F)c1 ZINC000261883966 1039984987 /nfs/dbraw/zinc/98/49/87/1039984987.db2.gz MWSOBKLSHWOMFQ-GOPGUHFVSA-N 2 1 318.367 4.083 20 0 DIADMP Cc1ccc(CC[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000492602745 1039987100 /nfs/dbraw/zinc/98/71/00/1039987100.db2.gz QOGVQMYDYFGZPV-DENIHFKCSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000125476652 1040012228 /nfs/dbraw/zinc/01/22/28/1040012228.db2.gz LZZXUDAEFLQBMN-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000125476652 1040012248 /nfs/dbraw/zinc/01/22/48/1040012248.db2.gz LZZXUDAEFLQBMN-GOSISDBHSA-N 2 1 317.864 4.462 20 0 DIADMP c1ccc(C2CCC(C[NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000685420963 1040041840 /nfs/dbraw/zinc/04/18/40/1040041840.db2.gz JACNECOPNUQRHK-UHFFFAOYSA-N 2 1 312.501 4.177 20 0 DIADMP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836503 1040055145 /nfs/dbraw/zinc/05/51/45/1040055145.db2.gz GVEDODNBCCOHHB-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836503 1040055162 /nfs/dbraw/zinc/05/51/62/1040055162.db2.gz GVEDODNBCCOHHB-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836503 1040055181 /nfs/dbraw/zinc/05/51/81/1040055181.db2.gz GVEDODNBCCOHHB-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836503 1040055199 /nfs/dbraw/zinc/05/51/99/1040055199.db2.gz GVEDODNBCCOHHB-MRXNPFEDSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836502 1040056150 /nfs/dbraw/zinc/05/61/50/1040056150.db2.gz GVEDODNBCCOHHB-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836502 1040056166 /nfs/dbraw/zinc/05/61/66/1040056166.db2.gz GVEDODNBCCOHHB-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836502 1040056184 /nfs/dbraw/zinc/05/61/84/1040056184.db2.gz GVEDODNBCCOHHB-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(C(F)(F)F)cc1 ZINC000302836502 1040056198 /nfs/dbraw/zinc/05/61/98/1040056198.db2.gz GVEDODNBCCOHHB-INIZCTEOSA-N 2 1 314.395 4.012 20 0 DIADMP Cc1cccc(C)c1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000708563601 1040082901 /nfs/dbraw/zinc/08/29/01/1040082901.db2.gz ZSUWPEYTRVKGFK-PZJWPPBQSA-N 2 1 322.496 4.161 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000657893399 1040087759 /nfs/dbraw/zinc/08/77/59/1040087759.db2.gz RGIWQRRTSAGJCO-MVCQKVDPSA-N 2 1 320.908 4.266 20 0 DIADMP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000657893399 1040087777 /nfs/dbraw/zinc/08/77/77/1040087777.db2.gz RGIWQRRTSAGJCO-MVCQKVDPSA-N 2 1 320.908 4.266 20 0 DIADMP CC1(C)CCC([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309745418 1040090524 /nfs/dbraw/zinc/09/05/24/1040090524.db2.gz UBZBFBPAKRUZGH-SFHVURJKSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccsc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309704557 1040092026 /nfs/dbraw/zinc/09/20/26/1040092026.db2.gz HJSNZNVLWBTRDJ-SOLBZPMBSA-N 2 1 314.498 4.309 20 0 DIADMP CCC1CCC([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000309762763 1040093072 /nfs/dbraw/zinc/09/30/72/1040093072.db2.gz YPRVKQMAQLAZRV-SYYJFZTOSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC000309842215 1040096374 /nfs/dbraw/zinc/09/63/74/1040096374.db2.gz QDJNSQIRTOSBPF-MBOZVWFJSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901117 1040097184 /nfs/dbraw/zinc/09/71/84/1040097184.db2.gz NTMSVGBZAMDXAS-VYDXJSESSA-N 2 1 324.459 4.309 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901117 1040097198 /nfs/dbraw/zinc/09/71/98/1040097198.db2.gz NTMSVGBZAMDXAS-VYDXJSESSA-N 2 1 324.459 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000309928415 1040101030 /nfs/dbraw/zinc/10/10/30/1040101030.db2.gz UWIYTLPLJHMQRQ-ABSDTBQOSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCSCC2)cc1 ZINC000657903604 1040101162 /nfs/dbraw/zinc/10/11/62/1040101162.db2.gz NBNVUYWLDOUVDF-WMLDXEAASA-N 2 1 315.486 4.117 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@H](c3ccccc3)C3CC3)C2)cc1 ZINC000310101970 1040109978 /nfs/dbraw/zinc/10/99/78/1040109978.db2.gz YDNOYVGEEWFNBN-DENIHFKCSA-N 2 1 320.480 4.249 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C[NH2+][C@H]1CC[C@@H](C)[C@@H](C)C1 ZINC000708582329 1040132808 /nfs/dbraw/zinc/13/28/08/1040132808.db2.gz UGABDNRKWUASAI-QIYLELGZSA-N 2 1 314.517 4.169 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685024 1040398969 /nfs/dbraw/zinc/39/89/69/1040398969.db2.gz HPKOJLIGQXLRTJ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685024 1040398984 /nfs/dbraw/zinc/39/89/84/1040398984.db2.gz HPKOJLIGQXLRTJ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685024 1040398995 /nfs/dbraw/zinc/39/89/95/1040398995.db2.gz HPKOJLIGQXLRTJ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC001167685024 1040399010 /nfs/dbraw/zinc/39/90/10/1040399010.db2.gz HPKOJLIGQXLRTJ-MLGOLLRUSA-N 2 1 315.288 4.156 20 0 DIADMP CCCOc1ccc(CN(C)CC[C@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204616219 1040473584 /nfs/dbraw/zinc/47/35/84/1040473584.db2.gz QOJPXOFHUYCZGP-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001204616219 1040473607 /nfs/dbraw/zinc/47/36/07/1040473607.db2.gz QOJPXOFHUYCZGP-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001204616219 1040473617 /nfs/dbraw/zinc/47/36/17/1040473617.db2.gz QOJPXOFHUYCZGP-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001204616219 1040473630 /nfs/dbraw/zinc/47/36/30/1040473630.db2.gz QOJPXOFHUYCZGP-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP CCCOc1ccc(C[NH+](C)CC[C@H]2CCCC[N@H+]2C)c(C)c1 ZINC001204616219 1040473643 /nfs/dbraw/zinc/47/36/43/1040473643.db2.gz QOJPXOFHUYCZGP-LJQANCHMSA-N 2 1 318.505 4.090 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000280756453 1040721363 /nfs/dbraw/zinc/72/13/63/1040721363.db2.gz CEXRLOWLGZHXJC-NXHRZFHOSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000280756453 1040721372 /nfs/dbraw/zinc/72/13/72/1040721372.db2.gz CEXRLOWLGZHXJC-NXHRZFHOSA-N 2 1 322.443 4.065 20 0 DIADMP c1cc2c(o1)CCC[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310078673 1040750923 /nfs/dbraw/zinc/75/09/23/1040750923.db2.gz HPSMSGIKMHUURX-ICSRJNTNSA-N 2 1 324.468 4.159 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000414062736 1040807064 /nfs/dbraw/zinc/80/70/64/1040807064.db2.gz BZZSHQPKILQRFR-WMZOPIPTSA-N 2 1 317.864 4.161 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000414065916 1040812363 /nfs/dbraw/zinc/81/23/63/1040812363.db2.gz GQVXOVJTKWQEKN-FUHWJXTLSA-N 2 1 317.864 4.161 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299443 1040892090 /nfs/dbraw/zinc/89/20/90/1040892090.db2.gz CPOIOFIQNOTLEU-FXAWDEMLSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)c1ccncc1 ZINC000282299443 1040892108 /nfs/dbraw/zinc/89/21/08/1040892108.db2.gz CPOIOFIQNOTLEU-FXAWDEMLSA-N 2 1 323.484 4.033 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cc(Cl)sc1Cl ZINC000414168533 1040949655 /nfs/dbraw/zinc/94/96/55/1040949655.db2.gz AIUSIYLLICFEJC-MNOVXSKESA-N 2 1 321.317 4.437 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cc2ccccc2s1 ZINC000414173114 1040955412 /nfs/dbraw/zinc/95/54/12/1040955412.db2.gz FLDKPWJEINBQAQ-GJZGRUSLSA-N 2 1 302.487 4.284 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000414188369 1040972056 /nfs/dbraw/zinc/97/20/56/1040972056.db2.gz QPABJJCHHNGHIZ-HZPDHXFCSA-N 2 1 306.519 4.181 20 0 DIADMP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)s1 ZINC000414196785 1040985023 /nfs/dbraw/zinc/98/50/23/1040985023.db2.gz WBUZHPUROOENIV-QWHCGFSZSA-N 2 1 300.899 4.174 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)oc2c1 ZINC000414202405 1040993484 /nfs/dbraw/zinc/99/34/84/1040993484.db2.gz YNPLIOLZYNBXEE-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000613491444 1041004843 /nfs/dbraw/zinc/00/48/43/1041004843.db2.gz SAIVDQXWIKJUMI-UHFFFAOYSA-N 2 1 308.897 4.284 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)cc1 ZINC000414289097 1041085332 /nfs/dbraw/zinc/08/53/32/1041085332.db2.gz QZKCIKSRYLVZSM-FSPWUOQZSA-N 2 1 301.409 4.112 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cccc(Cl)c2Cl)[C@H](C)C1 ZINC000539838079 1041174756 /nfs/dbraw/zinc/17/47/56/1041174756.db2.gz GMYMHQBFQUYEAK-IUODEOHRSA-N 2 1 315.288 4.156 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cccc(Cl)c2Cl)[C@@H](C)C1 ZINC000539838081 1041175425 /nfs/dbraw/zinc/17/54/25/1041175425.db2.gz GMYMHQBFQUYEAK-WFASDCNBSA-N 2 1 315.288 4.156 20 0 DIADMP CSCCCCC[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000186780670 1041178809 /nfs/dbraw/zinc/17/88/09/1041178809.db2.gz LZOMQYFCECKEOK-OAHLLOKOSA-N 2 1 317.502 4.365 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1cc[nH+]cc1Cl ZINC000301527985 1041245427 /nfs/dbraw/zinc/24/54/27/1041245427.db2.gz GPCABOMIWSFPHQ-PBHICJAKSA-N 2 1 315.848 4.058 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1cc[nH+]cc1Cl ZINC000301527985 1041245446 /nfs/dbraw/zinc/24/54/46/1041245446.db2.gz GPCABOMIWSFPHQ-PBHICJAKSA-N 2 1 315.848 4.058 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1 ZINC001170594890 1041296869 /nfs/dbraw/zinc/29/68/69/1041296869.db2.gz YPOXSMFFTHONCO-NRFANRHFSA-N 2 1 314.517 4.292 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1 ZINC001170594890 1041296879 /nfs/dbraw/zinc/29/68/79/1041296879.db2.gz YPOXSMFFTHONCO-NRFANRHFSA-N 2 1 314.517 4.292 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC001170594890 1041296888 /nfs/dbraw/zinc/29/68/88/1041296888.db2.gz YPOXSMFFTHONCO-NRFANRHFSA-N 2 1 314.517 4.292 20 0 DIADMP CCCCCC[C@H](CC)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001170601980 1041367201 /nfs/dbraw/zinc/36/72/01/1041367201.db2.gz UXWMMBDIZKXCGL-ICSRJNTNSA-N 2 1 324.553 4.311 20 0 DIADMP Cc1nc(C)c([C@H](C)NCCC[N@@H+](C)C2CCCCC2)s1 ZINC000111361582 1041403504 /nfs/dbraw/zinc/40/35/04/1041403504.db2.gz YLSMOJXZQQHNRD-ZDUSSCGKSA-N 2 1 309.523 4.065 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+]CCC[N@H+](C)C2CCCCC2)s1 ZINC000111361582 1041403513 /nfs/dbraw/zinc/40/35/13/1041403513.db2.gz YLSMOJXZQQHNRD-ZDUSSCGKSA-N 2 1 309.523 4.065 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)s1 ZINC000111361582 1041403518 /nfs/dbraw/zinc/40/35/18/1041403518.db2.gz YLSMOJXZQQHNRD-ZDUSSCGKSA-N 2 1 309.523 4.065 20 0 DIADMP CSc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)s1 ZINC000811506656 1041533202 /nfs/dbraw/zinc/53/32/02/1041533202.db2.gz CECLGBJTVBZTNF-UHFFFAOYSA-N 2 1 320.527 4.164 20 0 DIADMP CC[C@@H](CC(F)F)C[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000659973578 1041565399 /nfs/dbraw/zinc/56/53/99/1041565399.db2.gz RYUWXSJJEAJHNX-FUHWJXTLSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000309766820 1041593822 /nfs/dbraw/zinc/59/38/22/1041593822.db2.gz ZQPVOOSZZOVWJE-YZGWKJHDSA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000660113670 1041620720 /nfs/dbraw/zinc/62/07/20/1041620720.db2.gz CNFUKYKNBIRQHE-XQBPLPMBSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000660113670 1041620725 /nfs/dbraw/zinc/62/07/25/1041620725.db2.gz CNFUKYKNBIRQHE-XQBPLPMBSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000660113670 1041620729 /nfs/dbraw/zinc/62/07/29/1041620729.db2.gz CNFUKYKNBIRQHE-XQBPLPMBSA-N 2 1 324.512 4.055 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000660113670 1041620732 /nfs/dbraw/zinc/62/07/32/1041620732.db2.gz CNFUKYKNBIRQHE-XQBPLPMBSA-N 2 1 324.512 4.055 20 0 DIADMP CC1(C)CC([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000813880249 1041742635 /nfs/dbraw/zinc/74/26/35/1041742635.db2.gz DJSDXRQXDNCIQW-CTXDPNEZSA-N 2 1 312.501 4.350 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398041103 1041756596 /nfs/dbraw/zinc/75/65/96/1041756596.db2.gz RWVJKFRAKGYXJQ-BJLQDIEVSA-N 2 1 302.506 4.455 20 0 DIADMP CCCCC[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398041103 1041756605 /nfs/dbraw/zinc/75/66/05/1041756605.db2.gz RWVJKFRAKGYXJQ-BJLQDIEVSA-N 2 1 302.506 4.455 20 0 DIADMP CCC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398228702 1041784147 /nfs/dbraw/zinc/78/41/47/1041784147.db2.gz YZBIVOYNUVDDRI-SDEKRAFDSA-N 2 1 314.517 4.455 20 0 DIADMP CCC1CCC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000398228702 1041784151 /nfs/dbraw/zinc/78/41/51/1041784151.db2.gz YZBIVOYNUVDDRI-SDEKRAFDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C[C@H]1C ZINC000398227126 1041785773 /nfs/dbraw/zinc/78/57/73/1041785773.db2.gz YIEOCDFQGJHQAK-FJWRRNOESA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C[C@H]1C ZINC000398227126 1041785780 /nfs/dbraw/zinc/78/57/80/1041785780.db2.gz YIEOCDFQGJHQAK-FJWRRNOESA-N 2 1 314.517 4.311 20 0 DIADMP C[N@@H+]([C@@H]1C[C@@H]2[C@H](C1)C2(C)C)C1CC[NH+](C2CCCCC2)CC1 ZINC001170768677 1041874110 /nfs/dbraw/zinc/87/41/10/1041874110.db2.gz ZPRZXXCBPHZDOS-LDLYASANSA-N 2 1 304.522 4.150 20 0 DIADMP C[N@@H+]([C@H]1C[C@@H]2[C@H](C1)C2(C)C)C1CC[NH+](C2CCCCC2)CC1 ZINC001170768678 1041874331 /nfs/dbraw/zinc/87/43/31/1041874331.db2.gz ZPRZXXCBPHZDOS-REPLKXPHSA-N 2 1 304.522 4.150 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692625 1041884723 /nfs/dbraw/zinc/88/47/23/1041884723.db2.gz MEHAKQVWSXFRNS-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692625 1041884734 /nfs/dbraw/zinc/88/47/34/1041884734.db2.gz MEHAKQVWSXFRNS-MSOLQXFVSA-N 2 1 323.484 4.131 20 0 DIADMP CN1CCC[C@@]2(CC[N@H+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143199 1041925816 /nfs/dbraw/zinc/92/58/16/1041925816.db2.gz GNGVVTBRPCGIPX-JOCHJYFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[N@@H+]1CCC[C@@]2(CC[NH+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143199 1041925829 /nfs/dbraw/zinc/92/58/29/1041925829.db2.gz GNGVVTBRPCGIPX-JOCHJYFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[N@H+]1CCC[C@@]2(CC[NH+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143199 1041925837 /nfs/dbraw/zinc/92/58/37/1041925837.db2.gz GNGVVTBRPCGIPX-JOCHJYFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@@H+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143199 1041925846 /nfs/dbraw/zinc/92/58/46/1041925846.db2.gz GNGVVTBRPCGIPX-JOCHJYFZSA-N 2 1 320.480 4.194 20 0 DIADMP C[NH+]1CCC[C@@]2(CC[N@H+](C(c3ccccc3)c3ccccc3)C2)C1 ZINC000815143199 1041925856 /nfs/dbraw/zinc/92/58/56/1041925856.db2.gz GNGVVTBRPCGIPX-JOCHJYFZSA-N 2 1 320.480 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccccc1F)C(C)C ZINC000661482747 1041943415 /nfs/dbraw/zinc/94/34/15/1041943415.db2.gz CIDVIGJLEBHXAM-GOSISDBHSA-N 2 1 303.425 4.098 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC000164654310 1042029863 /nfs/dbraw/zinc/02/98/63/1042029863.db2.gz KEDHEPCKLCKQFM-LBPRGKRZSA-N 2 1 309.816 4.115 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000161591580 1042111918 /nfs/dbraw/zinc/11/19/18/1042111918.db2.gz ZTIOFHKSJHKNNI-KRWDZBQOSA-N 2 1 322.880 4.018 20 0 DIADMP [NH3+]CCC[C@H]1CCCC[N@H+]([C@@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170918062 1042164945 /nfs/dbraw/zinc/16/49/45/1042164945.db2.gz SRHLVLFZVLGPEW-NVXWUHKLSA-N 2 1 320.908 4.038 20 0 DIADMP CCCCC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1 ZINC000314782818 1042169571 /nfs/dbraw/zinc/16/95/71/1042169571.db2.gz YIHIGGUXCYNDIF-PXNSSMCTSA-N 2 1 300.490 4.382 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC000663471803 1042184644 /nfs/dbraw/zinc/18/46/44/1042184644.db2.gz YKQUEFLJEFNRTA-GDBMZVCRSA-N 2 1 306.519 4.083 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001167824170 1042209962 /nfs/dbraw/zinc/20/99/62/1042209962.db2.gz CBUGBGQWNVNUFV-HKUYNNGSSA-N 2 1 320.546 4.287 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@H]1c1ccc(OC)cc1 ZINC001167824688 1042212850 /nfs/dbraw/zinc/21/28/50/1042212850.db2.gz FKLPNUNJFKCPHY-XLIONFOSSA-N 2 1 318.505 4.343 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]C[C@@H]1CCc2[nH+]ccn2C1 ZINC000278923907 1042215914 /nfs/dbraw/zinc/21/59/14/1042215914.db2.gz IEJUQEVJYDIELG-GJZGRUSLSA-N 2 1 323.440 4.105 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)C12CC3CC(CC(C3)C1)C2 ZINC001167827125 1042217143 /nfs/dbraw/zinc/21/71/43/1042217143.db2.gz TUFUCQAMEFQXSS-PISSXIKFSA-N 2 1 306.538 4.398 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001167826926 1042217508 /nfs/dbraw/zinc/21/75/08/1042217508.db2.gz RZZFHKPAFLYNGE-MJGOQNOKSA-N 2 1 303.494 4.119 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@H]1c1ccc(C)nc1 ZINC001167833619 1042235957 /nfs/dbraw/zinc/23/59/57/1042235957.db2.gz CXJGRXBOEZXPSW-HKUYNNGSSA-N 2 1 303.494 4.037 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)[C@@H](C)c1ccc(OC)cc1 ZINC001167838040 1042249861 /nfs/dbraw/zinc/24/98/61/1042249861.db2.gz PAIZIAFCNYUGAU-SJORKVTESA-N 2 1 306.494 4.199 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1Cl ZINC000279050882 1042265519 /nfs/dbraw/zinc/26/55/19/1042265519.db2.gz YAEAWSBXOBXEPQ-NWDGAFQWSA-N 2 1 324.255 4.103 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cccc(C(F)F)c1 ZINC000279418711 1042316689 /nfs/dbraw/zinc/31/66/89/1042316689.db2.gz WRHFLYASDSUFIK-UHFFFAOYSA-N 2 1 321.415 4.295 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000279418711 1042316694 /nfs/dbraw/zinc/31/66/94/1042316694.db2.gz WRHFLYASDSUFIK-UHFFFAOYSA-N 2 1 321.415 4.295 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2c(Cl)cccc2C1 ZINC001171018635 1042329129 /nfs/dbraw/zinc/32/91/29/1042329129.db2.gz UYVIPQYYCGZMEV-DOTOQJQBSA-N 2 1 320.908 4.051 20 0 DIADMP CC(C)Oc1cccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)c1 ZINC000320236486 1042331655 /nfs/dbraw/zinc/33/16/55/1042331655.db2.gz NJLJKAYJQBGMIV-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)Oc1cccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)c1 ZINC000320236486 1042331662 /nfs/dbraw/zinc/33/16/62/1042331662.db2.gz NJLJKAYJQBGMIV-UHFFFAOYSA-N 2 1 318.505 4.218 20 0 DIADMP C[C@@H]1C[C@H](CC[NH2+]Cc2cccs2)C[N@H+]1Cc1ccccc1 ZINC000513495933 1042546720 /nfs/dbraw/zinc/54/67/20/1042546720.db2.gz XGXGMVKGFKDLDB-AEFFLSMTSA-N 2 1 314.498 4.138 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccccc2)C[N@H+]1Cc1ccccc1 ZINC000513511156 1042549834 /nfs/dbraw/zinc/54/98/34/1042549834.db2.gz HTZKHNVVQVDPEE-WIYYLYMNSA-N 2 1 308.469 4.077 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]Cc2ccsc2)C[N@H+]1Cc1ccccc1 ZINC000513514267 1042550044 /nfs/dbraw/zinc/55/00/44/1042550044.db2.gz WUTMNPNKZBQONO-FUHWJXTLSA-N 2 1 314.498 4.138 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]C2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC000513545417 1042551892 /nfs/dbraw/zinc/55/18/92/1042551892.db2.gz QQGQINLDFJKZHC-HKUYNNGSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000420300108 1042599113 /nfs/dbraw/zinc/59/91/13/1042599113.db2.gz HEKMFQJTJQTZQD-UONOGXRCSA-N 2 1 314.395 4.088 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3C[C@@H]4CC[C@@H](C4)C3)C2)cc1 ZINC000711147226 1042687267 /nfs/dbraw/zinc/68/72/67/1042687267.db2.gz RMMYOZLSDDSAAD-MHTWAQMVSA-N 2 1 312.501 4.067 20 0 DIADMP [NH3+][C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)cc2)C2CCC2)c2ccccc21 ZINC000422716805 1042689312 /nfs/dbraw/zinc/68/93/12/1042689312.db2.gz NXAWRKCXHCVQNM-AQNXPRMDSA-N 2 1 310.416 4.401 20 0 DIADMP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000422922482 1042692065 /nfs/dbraw/zinc/69/20/65/1042692065.db2.gz SWHWFVCCRLJYQU-ZYHUDNBSSA-N 2 1 321.827 4.053 20 0 DIADMP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000422922479 1042692523 /nfs/dbraw/zinc/69/25/23/1042692523.db2.gz SWHWFVCCRLJYQU-CMPLNLGQSA-N 2 1 321.827 4.053 20 0 DIADMP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000422935218 1042693022 /nfs/dbraw/zinc/69/30/22/1042693022.db2.gz DJDQXPCQIZLXFJ-MQIPJXDCSA-N 2 1 308.878 4.206 20 0 DIADMP C[C@H](Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1)c1c[nH+]ccc1N ZINC000422921343 1042693902 /nfs/dbraw/zinc/69/39/02/1042693902.db2.gz NXKOSMIMALOXBH-HOTGVXAUSA-N 2 1 324.472 4.042 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(Cl)c(Cl)c1Cl ZINC000423210046 1042699663 /nfs/dbraw/zinc/69/96/63/1042699663.db2.gz JMNGMNXDDHJJGF-UWVGGRQHSA-N 2 1 321.679 4.297 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+][C@H](C[NH3+])CC(C)C)cs2)cs1 ZINC000423261492 1042703015 /nfs/dbraw/zinc/70/30/15/1042703015.db2.gz JWJDZFLNXYWVGH-RISCZKNCSA-N 2 1 323.531 4.204 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H](C[NH3+])C1CCCCC1 ZINC000423270882 1042705039 /nfs/dbraw/zinc/70/50/39/1042705039.db2.gz XDZICBYBHSPLTL-SWLSCSKDSA-N 2 1 309.523 4.133 20 0 DIADMP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(Cl)cc1Cl ZINC000423325856 1042706990 /nfs/dbraw/zinc/70/69/90/1042706990.db2.gz JWIWLIANJPDBFL-IAQYHMDHSA-N 2 1 301.261 4.034 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@H]2CC[NH2+][C@H](C)C2)c2ccccc2)c1 ZINC000423369413 1042708223 /nfs/dbraw/zinc/70/82/23/1042708223.db2.gz BYAYRPKKHWFPJS-SLYNCCJLSA-N 2 1 308.469 4.123 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(Cl)cc1Cl ZINC000423386445 1042709753 /nfs/dbraw/zinc/70/97/53/1042709753.db2.gz HFEBZWBTAHACKO-NZVBXONLSA-N 2 1 301.261 4.032 20 0 DIADMP C[C@@H]([NH2+][C@H](Cc1ccccc1Cl)c1cccs1)[C@H](C)[NH3+] ZINC000423465039 1042713983 /nfs/dbraw/zinc/71/39/83/1042713983.db2.gz MJJRTCMVGKFEKT-YWPYICTPSA-N 2 1 308.878 4.011 20 0 DIADMP C[C@H]1CC2(C[N@H+]1Cc1c(Cl)oc3ccccc31)CC[NH2+]CC2 ZINC000424372029 1042738730 /nfs/dbraw/zinc/73/87/30/1042738730.db2.gz FCLCESMKOHZICF-ZDUSSCGKSA-N 2 1 318.848 4.050 20 0 DIADMP Clc1cc2c(s1)CCC[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000515297032 1042815840 /nfs/dbraw/zinc/81/58/40/1042815840.db2.gz VWYHPKDDMSXBTM-OAHLLOKOSA-N 2 1 324.921 4.243 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+]C1CCC3(CCCC3)CC1)C2 ZINC001167961729 1042848613 /nfs/dbraw/zinc/84/86/13/1042848613.db2.gz OFHOIPBDCCONQZ-IHWFROFDSA-N 2 1 316.533 4.484 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)CC[N@@H+]1Cc1ccccc1 ZINC000516826784 1042856259 /nfs/dbraw/zinc/85/62/59/1042856259.db2.gz HLMZPQKVOMIABL-OXJNMPFZSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C2CC2)C2CC2)CC[N@H+]1Cc1ccccc1 ZINC000516826784 1042856264 /nfs/dbraw/zinc/85/62/64/1042856264.db2.gz HLMZPQKVOMIABL-OXJNMPFZSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H](Cc1ccsc1)[NH2+]C[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000517068690 1042866043 /nfs/dbraw/zinc/86/60/43/1042866043.db2.gz NTOXCGFIPIBQMY-CRAIPNDOSA-N 2 1 306.519 4.066 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934354 1042876493 /nfs/dbraw/zinc/87/64/93/1042876493.db2.gz BJQRKFQFQIOWSG-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)C1 ZINC000425934354 1042876497 /nfs/dbraw/zinc/87/64/97/1042876497.db2.gz BJQRKFQFQIOWSG-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C)cs2)cs1 ZINC000425947645 1042883228 /nfs/dbraw/zinc/88/32/28/1042883228.db2.gz VVMNKOMABQIBDM-VXGBXAGGSA-N 2 1 323.531 4.028 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+][C@H]1CCC[C@H]3CCCC[C@H]31)C2 ZINC001167968569 1042956331 /nfs/dbraw/zinc/95/63/31/1042956331.db2.gz RQHBLCBTIJDUTA-KPMIJUJFSA-N 2 1 316.533 4.340 20 0 DIADMP c1ccc(CCCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC001167972803 1042965329 /nfs/dbraw/zinc/96/53/29/1042965329.db2.gz BYQBGFCUOKVFTD-SEJPIABJSA-N 2 1 312.501 4.004 20 0 DIADMP CC(C)([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)C1CCCCC1 ZINC001167974342 1042967546 /nfs/dbraw/zinc/96/75/46/1042967546.db2.gz WYWGMICYSPKSBP-YQQQUEKLSA-N 2 1 304.522 4.340 20 0 DIADMP c1ccc2c(c1)CCC[C@H]2C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167978159 1042973557 /nfs/dbraw/zinc/97/35/57/1042973557.db2.gz KYZDONZOWQXSBP-UDEWTMQYSA-N 2 1 324.512 4.102 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1c2cccc(F)c2CC[C@H]1C ZINC000164593483 1043001739 /nfs/dbraw/zinc/00/17/39/1043001739.db2.gz FPDWNWNUFIYUEC-AUUYWEPGSA-N 2 1 315.436 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc2c(s1)CCCC2 ZINC000164630004 1043011252 /nfs/dbraw/zinc/01/12/52/1043011252.db2.gz SYGIAIBOESKNKC-AWEZNQCLSA-N 2 1 317.502 4.263 20 0 DIADMP Cc1ccc([C@@H]2CCCCC[N@@H+]2CCCn2cc[nH+]c2C)o1 ZINC000441310938 1043034549 /nfs/dbraw/zinc/03/45/49/1043034549.db2.gz MDROILWCEGOTBU-KRWDZBQOSA-N 2 1 301.434 4.100 20 0 DIADMP Cc1ccc([C@@H]2CCCCC[N@H+]2CCCn2cc[nH+]c2C)o1 ZINC000441310938 1043034553 /nfs/dbraw/zinc/03/45/53/1043034553.db2.gz MDROILWCEGOTBU-KRWDZBQOSA-N 2 1 301.434 4.100 20 0 DIADMP CC[C@H]1C[N@@H+](CCCn2ccnc2C)CC[C@@H]1c1ccccc1 ZINC000441319527 1043035623 /nfs/dbraw/zinc/03/56/23/1043035623.db2.gz VUALBAFZFHBQIT-ICSRJNTNSA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@H]1C[N@H+](CCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000441319527 1043035628 /nfs/dbraw/zinc/03/56/28/1043035628.db2.gz VUALBAFZFHBQIT-ICSRJNTNSA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@H]1C[N@@H+](CCCn2cc[nH+]c2C)CC[C@@H]1c1ccccc1 ZINC000441319527 1043035634 /nfs/dbraw/zinc/03/56/34/1043035634.db2.gz VUALBAFZFHBQIT-ICSRJNTNSA-N 2 1 311.473 4.097 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441411726 1043044419 /nfs/dbraw/zinc/04/44/19/1043044419.db2.gz HDWVUWASFNCXOC-NSISKUIASA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441411726 1043044424 /nfs/dbraw/zinc/04/44/24/1043044424.db2.gz HDWVUWASFNCXOC-NSISKUIASA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441411726 1043044430 /nfs/dbraw/zinc/04/44/30/1043044430.db2.gz HDWVUWASFNCXOC-NSISKUIASA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441411726 1043044437 /nfs/dbraw/zinc/04/44/37/1043044437.db2.gz HDWVUWASFNCXOC-NSISKUIASA-N 2 1 316.464 4.226 20 0 DIADMP c1ccc(C2=CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4CC3CC3)CC2)cc1 ZINC001167994759 1043067833 /nfs/dbraw/zinc/06/78/33/1043067833.db2.gz NLKLRCXSMSMCEL-CBQGHPETSA-N 2 1 322.496 4.181 20 0 DIADMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)nc1 ZINC000183191762 1043157007 /nfs/dbraw/zinc/15/70/07/1043157007.db2.gz LXZDGVNISDUFGM-IIAWOOMASA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(Cl)nc1 ZINC000183191762 1043157010 /nfs/dbraw/zinc/15/70/10/1043157010.db2.gz LXZDGVNISDUFGM-IIAWOOMASA-N 2 1 321.896 4.039 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](c2ccccn2)C(C)C)c1 ZINC000866260613 1043167126 /nfs/dbraw/zinc/16/71/26/1043167126.db2.gz VVYAEXCCZBVJNT-FQEVSTJZSA-N 2 1 311.473 4.020 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H]2CCSc3cc(C)c(C)cc32)CC1 ZINC000427585872 1043190443 /nfs/dbraw/zinc/19/04/43/1043190443.db2.gz BFOQZDXOTPWYSB-GOSISDBHSA-N 2 1 318.530 4.304 20 0 DIADMP CC[C@H]1c2ccccc2CC[NH+]1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001168003277 1043220679 /nfs/dbraw/zinc/22/06/79/1043220679.db2.gz MUPFMQPGEARTII-CZJMCEMMSA-N 2 1 324.512 4.401 20 0 DIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCS2 ZINC000186957813 1043237743 /nfs/dbraw/zinc/23/77/43/1043237743.db2.gz DOJOXTPWDHWPTB-SFHVURJKSA-N 2 1 316.514 4.057 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(C)cc2)C2CCC2)C1 ZINC000427610541 1043242405 /nfs/dbraw/zinc/24/24/05/1043242405.db2.gz VHSPOAGBURPGIW-YLJYHZDGSA-N 2 1 300.490 4.158 20 0 DIADMP C(C1CC1)[N@@H+]1[C@@H]2CC[C@H]1CC([NH+]1CCC3(C1)CCCCC3)C2 ZINC001168006294 1043255733 /nfs/dbraw/zinc/25/57/33/1043255733.db2.gz MTVXTKPRKPXNMT-DFNIBXOVSA-N 2 1 302.506 4.048 20 0 DIADMP C(C1CC1)[NH+]1[C@@H]2CC[C@H]1CC([N@@H+]1CCC3(C1)CCCCC3)C2 ZINC001168006294 1043255747 /nfs/dbraw/zinc/25/57/47/1043255747.db2.gz MTVXTKPRKPXNMT-DFNIBXOVSA-N 2 1 302.506 4.048 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001168007004 1043259808 /nfs/dbraw/zinc/25/98/08/1043259808.db2.gz QKSVCTOBDVDLRT-BMQTXXJKSA-N 2 1 323.484 4.174 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)c1cccnc1 ZINC001168007004 1043259813 /nfs/dbraw/zinc/25/98/13/1043259813.db2.gz QKSVCTOBDVDLRT-BMQTXXJKSA-N 2 1 323.484 4.174 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007434 1043260966 /nfs/dbraw/zinc/26/09/66/1043260966.db2.gz SDPBEDLPUHUPJM-HATOLVCRSA-N 2 1 322.496 4.260 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3occc32)c1 ZINC000192761621 1043275669 /nfs/dbraw/zinc/27/56/69/1043275669.db2.gz GYHOQXGMGPWGAV-LJQANCHMSA-N 2 1 312.457 4.287 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@@H+]1C ZINC000427691651 1043297717 /nfs/dbraw/zinc/29/77/17/1043297717.db2.gz VVVDOMPMKBIPCI-BUVFEPMLSA-N 2 1 320.480 4.413 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccc(-c4ccccc4)cc32)CC[N@H+]1C ZINC000427691651 1043297722 /nfs/dbraw/zinc/29/77/22/1043297722.db2.gz VVVDOMPMKBIPCI-BUVFEPMLSA-N 2 1 320.480 4.413 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000266163945 1043300868 /nfs/dbraw/zinc/30/08/68/1043300868.db2.gz OMBUILQZKSKFAI-UHFFFAOYSA-N 2 1 324.424 4.103 20 0 DIADMP Cc1cc(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)ccc1-c1ccccc1 ZINC000427862916 1043311541 /nfs/dbraw/zinc/31/15/41/1043311541.db2.gz IPDMOXWCQYXBHN-UWJYYQICSA-N 2 1 308.469 4.092 20 0 DIADMP FC1(CC[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)CCC1 ZINC000639181624 1043326162 /nfs/dbraw/zinc/32/61/62/1043326162.db2.gz VPZPZYPFEGZULD-MJGOQNOKSA-N 2 1 316.464 4.226 20 0 DIADMP FC1(CC[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)CCC1 ZINC000639181624 1043326169 /nfs/dbraw/zinc/32/61/69/1043326169.db2.gz VPZPZYPFEGZULD-MJGOQNOKSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(Cl)s1 ZINC000269039825 1043353542 /nfs/dbraw/zinc/35/35/42/1043353542.db2.gz TWHOBVSHFURYCW-CQSZACIVSA-N 2 1 312.910 4.459 20 0 DIADMP CC(C)[C@@H](C[NH2+]C1CCC(C(F)F)CC1)[NH+]1CCC(C)CC1 ZINC000442712429 1043408176 /nfs/dbraw/zinc/40/81/76/1043408176.db2.gz GLNHAVZQEAOCFP-OFLPRAFFSA-N 2 1 316.480 4.156 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(C)ccc1OC ZINC000271361245 1043411454 /nfs/dbraw/zinc/41/14/54/1043411454.db2.gz FMYQCOUVUUZDKZ-IBGZPJMESA-N 2 1 316.489 4.061 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(C)ccc1OC ZINC000271361248 1043411755 /nfs/dbraw/zinc/41/17/55/1043411755.db2.gz FMYQCOUVUUZDKZ-LJQANCHMSA-N 2 1 316.489 4.061 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2SC)CC1 ZINC000442786182 1043418659 /nfs/dbraw/zinc/41/86/59/1043418659.db2.gz SSVKIWGYIYAXKF-HNNXBMFYSA-N 2 1 306.519 4.324 20 0 DIADMP Fc1ccc(C2([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000558080045 1043434148 /nfs/dbraw/zinc/43/41/48/1043434148.db2.gz KAZGNSYJLKVBKX-UHFFFAOYSA-N 2 1 316.464 4.202 20 0 DIADMP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000872052199 1043436051 /nfs/dbraw/zinc/43/60/51/1043436051.db2.gz MGCWXPWOHZFVHA-CABCVRRESA-N 2 1 308.432 4.065 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000442859414 1043436430 /nfs/dbraw/zinc/43/64/30/1043436430.db2.gz VJERRVKSVUACHO-BXUZGUMPSA-N 2 1 322.905 4.435 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000442859414 1043436437 /nfs/dbraw/zinc/43/64/37/1043436437.db2.gz VJERRVKSVUACHO-BXUZGUMPSA-N 2 1 322.905 4.435 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000442875677 1043443821 /nfs/dbraw/zinc/44/38/21/1043443821.db2.gz UFQVZINBJAMIAS-DLBZAZTESA-N 2 1 320.546 4.427 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)c1 ZINC000123954919 1043457617 /nfs/dbraw/zinc/45/76/17/1043457617.db2.gz OPPDLTXRVAMVQM-AWEZNQCLSA-N 2 1 317.864 4.038 20 0 DIADMP COc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1C ZINC000925832436 1043479603 /nfs/dbraw/zinc/47/96/03/1043479603.db2.gz VTPLYGSFDMEIKO-PWIZWCRZSA-N 2 1 324.468 4.148 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000349403053 1043508319 /nfs/dbraw/zinc/50/83/19/1043508319.db2.gz BHHLKZBQQDEAGJ-WOJBJXKFSA-N 2 1 311.473 4.024 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000349403053 1043508331 /nfs/dbraw/zinc/50/83/31/1043508331.db2.gz BHHLKZBQQDEAGJ-WOJBJXKFSA-N 2 1 311.473 4.024 20 0 DIADMP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1csc(Cl)c1 ZINC000191127860 1043524198 /nfs/dbraw/zinc/52/41/98/1043524198.db2.gz DHYMPYJJGQSMEZ-JTQLQIEISA-N 2 1 300.899 4.361 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)c(-c3cccs3)c2)CC[N@H+]1C ZINC000388924971 1043544183 /nfs/dbraw/zinc/54/41/83/1043544183.db2.gz VWJSSWZODCTDES-HIFRSBDPSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CCC2CCC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168019752 1043570385 /nfs/dbraw/zinc/57/03/85/1043570385.db2.gz JWFRXLTVNJFWHV-XEMDLRDOSA-N 2 1 300.490 4.208 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@H+](C(c2ccccc2)c2ccccc2)CC1 ZINC000558741020 1043586045 /nfs/dbraw/zinc/58/60/45/1043586045.db2.gz IWUIENWFOQQYFW-FQEVSTJZSA-N 2 1 308.469 4.192 20 0 DIADMP CC(F)(F)CC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000926495832 1043587345 /nfs/dbraw/zinc/58/73/45/1043587345.db2.gz VCZPZLBKMZWSBJ-AYHJJNSGSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C(C2CC2)C2CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168021933 1043595336 /nfs/dbraw/zinc/59/53/36/1043595336.db2.gz RIEGAMUXLGAQKU-CWPLJXCYSA-N 2 1 312.501 4.206 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1csc2ccccc12 ZINC000926542202 1043597287 /nfs/dbraw/zinc/59/72/87/1043597287.db2.gz PYONKXMXBBUKPE-FFHGMXDLSA-N 2 1 300.471 4.177 20 0 DIADMP c1ccc(CC[NH+]2CCC(Nc3cc(C4CC4)cc[nH+]3)CC2)cc1 ZINC000353549534 1043615165 /nfs/dbraw/zinc/61/51/65/1043615165.db2.gz OQHSOIQNKFBYRZ-UHFFFAOYSA-N 2 1 321.468 4.078 20 0 DIADMP Cc1ccoc1CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000353543294 1043615655 /nfs/dbraw/zinc/61/56/55/1043615655.db2.gz NAXANLQKFSOLII-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1ccoc1C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000353543294 1043615662 /nfs/dbraw/zinc/61/56/62/1043615662.db2.gz NAXANLQKFSOLII-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1ccoc1C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC000353543294 1043615664 /nfs/dbraw/zinc/61/56/64/1043615664.db2.gz NAXANLQKFSOLII-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1ccoc1C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000353543294 1043615668 /nfs/dbraw/zinc/61/56/68/1043615668.db2.gz NAXANLQKFSOLII-NRFANRHFSA-N 2 1 324.468 4.076 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2cc3cccc(F)c3o2)CC1 ZINC000474107808 1043615784 /nfs/dbraw/zinc/61/57/84/1043615784.db2.gz UBYZALCDVDOSML-CYBMUJFWSA-N 2 1 304.409 4.095 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000443605247 1043618699 /nfs/dbraw/zinc/61/86/99/1043618699.db2.gz PTQQNFVDEAUHHR-BEFAXECRSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1cccc2c1CC[C@@H]2[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000443605247 1043618707 /nfs/dbraw/zinc/61/87/07/1043618707.db2.gz PTQQNFVDEAUHHR-BEFAXECRSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000443605251 1043618747 /nfs/dbraw/zinc/61/87/47/1043618747.db2.gz PTQQNFVDEAUHHR-DNVCBOLYSA-N 2 1 318.892 4.135 20 0 DIADMP Clc1cccc2c1CC[C@H]2[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000443605251 1043618751 /nfs/dbraw/zinc/61/87/51/1043618751.db2.gz PTQQNFVDEAUHHR-DNVCBOLYSA-N 2 1 318.892 4.135 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754861 1043625958 /nfs/dbraw/zinc/62/59/58/1043625958.db2.gz SQNRTRWUZGQADN-NWDGAFQWSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754861 1043625966 /nfs/dbraw/zinc/62/59/66/1043625966.db2.gz SQNRTRWUZGQADN-NWDGAFQWSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754868 1043626225 /nfs/dbraw/zinc/62/62/25/1043626225.db2.gz SQNRTRWUZGQADN-VXGBXAGGSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1csc(C(F)(F)F)c1 ZINC000926754868 1043626227 /nfs/dbraw/zinc/62/62/27/1043626227.db2.gz SQNRTRWUZGQADN-VXGBXAGGSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)[C@@H]1C[C@H]1c1ccccc1 ZINC000558919412 1043638494 /nfs/dbraw/zinc/63/84/94/1043638494.db2.gz LMVOOBOSXZPZEW-QCFAMHMHSA-N 2 1 314.517 4.423 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cnc(C3CCCC3)s2)C[C@@H]1C ZINC000353747997 1043639458 /nfs/dbraw/zinc/63/94/58/1043639458.db2.gz BZSGADMNRAVMHG-HOCLYGCPSA-N 2 1 321.534 4.105 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000191492340 1043647008 /nfs/dbraw/zinc/64/70/08/1043647008.db2.gz UNRZBDYTIIJYRQ-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000191492340 1043647015 /nfs/dbraw/zinc/64/70/15/1043647015.db2.gz UNRZBDYTIIJYRQ-HNNXBMFYSA-N 2 1 303.425 4.058 20 0 DIADMP CC(C)(F)CC[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639314952 1043647945 /nfs/dbraw/zinc/64/79/45/1043647945.db2.gz AMVLXZFKAFPLGW-WMZOPIPTSA-N 2 1 304.453 4.082 20 0 DIADMP CC(C)(F)CC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000639314952 1043647956 /nfs/dbraw/zinc/64/79/56/1043647956.db2.gz AMVLXZFKAFPLGW-WMZOPIPTSA-N 2 1 304.453 4.082 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)cc1 ZINC000926949214 1043662444 /nfs/dbraw/zinc/66/24/44/1043662444.db2.gz LOIYLEYAHDZZIN-HZUKXOBISA-N 2 1 323.362 4.030 20 0 DIADMP CC(C)C[C@H](C[NH+](C)C[C@@H]1CCC[N@@H+](C)C1)c1ccccc1 ZINC000474152420 1043663520 /nfs/dbraw/zinc/66/35/20/1043663520.db2.gz HHLMHRMXYXRODX-UYAOXDASSA-N 2 1 302.506 4.090 20 0 DIADMP Cc1ccoc1C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000354025606 1043674150 /nfs/dbraw/zinc/67/41/50/1043674150.db2.gz GPWGUBVELJMSBS-UHFFFAOYSA-N 2 1 324.468 4.076 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@H](C)c2cncc(F)c2)cc1 ZINC000166690704 1043678153 /nfs/dbraw/zinc/67/81/53/1043678153.db2.gz QVDUPSLVRQEAKK-UONOGXRCSA-N 2 1 324.403 4.127 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)c2cncc(F)c2)cc1 ZINC000166690586 1043678621 /nfs/dbraw/zinc/67/86/21/1043678621.db2.gz QVDUPSLVRQEAKK-ZIAGYGMSSA-N 2 1 324.403 4.127 20 0 DIADMP Cc1occc1C[NH+](C)CCCCC[N@H+](C)Cc1ccoc1C ZINC000354244814 1043688392 /nfs/dbraw/zinc/68/83/92/1043688392.db2.gz RLHWBYYRNYCEIR-UHFFFAOYSA-N 2 1 318.461 4.224 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[NH2+]C1CC[NH+](C)CC1 ZINC000559232053 1043712933 /nfs/dbraw/zinc/71/29/33/1043712933.db2.gz GAXMTXJINUDDFZ-UHFFFAOYSA-N 2 1 308.878 4.047 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000474270212 1043718871 /nfs/dbraw/zinc/71/88/71/1043718871.db2.gz UGAHXCLZJNFOLS-UYAOXDASSA-N 2 1 302.506 4.090 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474269044 1043719549 /nfs/dbraw/zinc/71/95/49/1043719549.db2.gz YSOLGJLFVUQJRT-QUCCMNQESA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474269044 1043719551 /nfs/dbraw/zinc/71/95/51/1043719551.db2.gz YSOLGJLFVUQJRT-QUCCMNQESA-N 2 1 302.506 4.090 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@H](c2ccccc2)C(C)C)C1 ZINC000474269044 1043719555 /nfs/dbraw/zinc/71/95/55/1043719555.db2.gz YSOLGJLFVUQJRT-QUCCMNQESA-N 2 1 302.506 4.090 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@@H]3CC[C@H]2C3)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168031713 1043726229 /nfs/dbraw/zinc/72/62/29/1043726229.db2.gz BKQGYEUYPNIWRT-VKUJXVDISA-N 2 1 312.501 4.206 20 0 DIADMP CSCC[C@H](C)[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877056553 1043739781 /nfs/dbraw/zinc/73/97/81/1043739781.db2.gz VITGLXOHELSARE-IEZWGBDMSA-N 2 1 318.530 4.086 20 0 DIADMP CSCC[C@H](C)[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000877056553 1043739793 /nfs/dbraw/zinc/73/97/93/1043739793.db2.gz VITGLXOHELSARE-IEZWGBDMSA-N 2 1 318.530 4.086 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123948 1043746422 /nfs/dbraw/zinc/74/64/22/1043746422.db2.gz GSSNUOZRGQIBIN-XAUMDUMWSA-N 2 1 309.457 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123948 1043746435 /nfs/dbraw/zinc/74/64/35/1043746435.db2.gz GSSNUOZRGQIBIN-XAUMDUMWSA-N 2 1 309.457 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123947 1043747954 /nfs/dbraw/zinc/74/79/54/1043747954.db2.gz GSSNUOZRGQIBIN-VPWXQRGCSA-N 2 1 309.457 4.033 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1)c1ccc[nH]1 ZINC000877123947 1043747967 /nfs/dbraw/zinc/74/79/67/1043747967.db2.gz GSSNUOZRGQIBIN-VPWXQRGCSA-N 2 1 309.457 4.033 20 0 DIADMP CCC1([NH+]2CCCC2)CC[NH+](Cc2cncc3ccccc32)CC1 ZINC000877674627 1043788660 /nfs/dbraw/zinc/78/86/60/1043788660.db2.gz TWLTXAQPAPURQM-UHFFFAOYSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12)[C@@H](C)c1ccc(Cl)cc1 ZINC000474470062 1043793664 /nfs/dbraw/zinc/79/36/64/1043793664.db2.gz DKVSOTDOFPBLKP-LTCOOKNTSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12)[C@@H](C)c1ccc(Cl)cc1 ZINC000474470062 1043793674 /nfs/dbraw/zinc/79/36/74/1043793674.db2.gz DKVSOTDOFPBLKP-LTCOOKNTSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000474470059 1043794152 /nfs/dbraw/zinc/79/41/52/1043794152.db2.gz DKVSOTDOFPBLKP-LBTBCDHLSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000474470059 1043794160 /nfs/dbraw/zinc/79/41/60/1043794160.db2.gz DKVSOTDOFPBLKP-LBTBCDHLSA-N 2 1 306.881 4.048 20 0 DIADMP CC1([NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834843 1043805520 /nfs/dbraw/zinc/80/55/20/1043805520.db2.gz XUYRMSRXJIHDQB-DOTOQJQBSA-N 2 1 320.427 4.132 20 0 DIADMP CC1([NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000877834843 1043805535 /nfs/dbraw/zinc/80/55/35/1043805535.db2.gz XUYRMSRXJIHDQB-DOTOQJQBSA-N 2 1 320.427 4.132 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@H]2C)C[C@H](C)N1Cc1ccccc1 ZINC001168039446 1043859211 /nfs/dbraw/zinc/85/92/11/1043859211.db2.gz DXCSZUIHVDYIBG-FTEYMNFISA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCCC[C@H]2C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039446 1043859232 /nfs/dbraw/zinc/85/92/32/1043859232.db2.gz DXCSZUIHVDYIBG-FTEYMNFISA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCCC[C@H]2C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039446 1043859249 /nfs/dbraw/zinc/85/92/49/1043859249.db2.gz DXCSZUIHVDYIBG-FTEYMNFISA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168039446 1043859268 /nfs/dbraw/zinc/85/92/68/1043859268.db2.gz DXCSZUIHVDYIBG-FTEYMNFISA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168039446 1043859283 /nfs/dbraw/zinc/85/92/83/1043859283.db2.gz DXCSZUIHVDYIBG-FTEYMNFISA-N 2 1 300.490 4.302 20 0 DIADMP C[C@H]([NH2+]CC[C@H]1CCCC1(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412700 1043885205 /nfs/dbraw/zinc/88/52/05/1043885205.db2.gz ZODHWLYMFSPGCO-ARFHVFGLSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCCC1(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000878412702 1043885881 /nfs/dbraw/zinc/88/58/81/1043885881.db2.gz ZODHWLYMFSPGCO-JYJNAYRXSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(Cl)c1 ZINC000034958905 1043892577 /nfs/dbraw/zinc/89/25/77/1043892577.db2.gz YYCBATNHNWCKMI-HLVVYCRESA-N 2 1 313.272 4.269 20 0 DIADMP CC[C@@H](C)[N@H+](C)CC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709028 1043896880 /nfs/dbraw/zinc/89/68/80/1043896880.db2.gz NFBWAYMJLOTDRA-YIYPIFLZSA-N 2 1 314.926 4.213 20 0 DIADMP CC[C@@H](C)[N@@H+](C)CC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474709028 1043896892 /nfs/dbraw/zinc/89/68/92/1043896892.db2.gz NFBWAYMJLOTDRA-YIYPIFLZSA-N 2 1 314.926 4.213 20 0 DIADMP C[C@H]1CC([NH+]2CCC(C)(F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168041519 1043907896 /nfs/dbraw/zinc/90/78/96/1043907896.db2.gz SNTDTIPUJJQSLP-IRXDYDNUSA-N 2 1 318.480 4.252 20 0 DIADMP CC(C)OCC[NH+]1CCC([NH2+][C@H](C)[C@@H](C)C2CCCCC2)CC1 ZINC000474795851 1043918630 /nfs/dbraw/zinc/91/86/30/1043918630.db2.gz QSRMFURFWDWDCC-QZTJIDSGSA-N 2 1 324.553 4.070 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)C1CCSCC1)[N@@H+](C)Cc1ccccc1 ZINC000474811296 1043924359 /nfs/dbraw/zinc/92/43/59/1043924359.db2.gz VRYGSXYOJNZUOQ-SJORKVTESA-N 2 1 320.546 4.018 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[C@H](C)c1ccc(Cl)cc1 ZINC000474806637 1043926550 /nfs/dbraw/zinc/92/65/50/1043926550.db2.gz GDDRLUSOVJEQAA-PTGUVKCASA-N 2 1 320.908 4.437 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)[C@H](C)c1ccc(Cl)cc1 ZINC000474806637 1043926564 /nfs/dbraw/zinc/92/65/64/1043926564.db2.gz GDDRLUSOVJEQAA-PTGUVKCASA-N 2 1 320.908 4.437 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C[C@@H](CC(C)C)c1ccccc1 ZINC000474813438 1043928258 /nfs/dbraw/zinc/92/82/58/1043928258.db2.gz CMPPXGCVOSQQHF-HXUWFJFHSA-N 2 1 313.489 4.391 20 0 DIADMP C[C@@H]1CCC[N@H+](C2C[C@@H](C)N(Cc3ccccc3)[C@H](C)C2)C1 ZINC001168042315 1043933862 /nfs/dbraw/zinc/93/38/62/1043933862.db2.gz YUGUGIFCMTYARF-KZNAEPCWSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168042315 1043933866 /nfs/dbraw/zinc/93/38/66/1043933866.db2.gz YUGUGIFCMTYARF-KZNAEPCWSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]1CCC[N@H+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)C1 ZINC001168042315 1043933873 /nfs/dbraw/zinc/93/38/73/1043933873.db2.gz YUGUGIFCMTYARF-KZNAEPCWSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1nccc2ccccc21 ZINC000290703862 1043977690 /nfs/dbraw/zinc/97/76/90/1043977690.db2.gz NNUOVYSSPMZLRT-OAHLLOKOSA-N 2 1 311.473 4.148 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCOc3ccc(Cl)cc32)CC1 ZINC000358061589 1044015323 /nfs/dbraw/zinc/01/53/23/1044015323.db2.gz METKUUNPAVUTND-QGZVFWFLSA-N 2 1 322.880 4.016 20 0 DIADMP Cc1csc(C[N@H+](C)C2CCN(Cc3ccccc3)CC2)c1 ZINC001137153315 1044039966 /nfs/dbraw/zinc/03/99/66/1044039966.db2.gz TZROCMHUDBRVRO-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP Cc1csc(CN(C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001137153315 1044039982 /nfs/dbraw/zinc/03/99/82/1044039982.db2.gz TZROCMHUDBRVRO-UHFFFAOYSA-N 2 1 314.498 4.153 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000562042139 1044054023 /nfs/dbraw/zinc/05/40/23/1044054023.db2.gz USORTGXMNKERRN-OXQOHEQNSA-N 2 1 312.457 4.190 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc(C)c(Cl)c2)c1 ZINC000443963365 1044065192 /nfs/dbraw/zinc/06/51/92/1044065192.db2.gz HQIGFHRUHQPPNK-UHFFFAOYSA-N 2 1 316.876 4.390 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCc2sccc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000358474851 1044074207 /nfs/dbraw/zinc/07/42/07/1044074207.db2.gz VEXZQPGMAWWADP-HDMKZQKVSA-N 2 1 318.530 4.368 20 0 DIADMP C[C@@H](CCC1CC1)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000798934237 1044086830 /nfs/dbraw/zinc/08/68/30/1044086830.db2.gz CMEOUGMQRDYWBY-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](Cc2nc(C)cs2)CC1)CC(C)C ZINC000358738117 1044097333 /nfs/dbraw/zinc/09/73/33/1044097333.db2.gz BXPQCWKPWNBFAG-UHFFFAOYSA-N 2 1 323.550 4.032 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCS2)cc1 ZINC000346809555 1044143997 /nfs/dbraw/zinc/14/39/97/1044143997.db2.gz QATJVZSWJDKOQZ-KDOFPFPSSA-N 2 1 315.486 4.117 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cccnc1 ZINC000359298163 1044152343 /nfs/dbraw/zinc/15/23/43/1044152343.db2.gz YMWABMUXAKFMLQ-HKUYNNGSSA-N 2 1 303.494 4.023 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCCCOC(C)(C)C)C2)CC1 ZINC000475052653 1044169263 /nfs/dbraw/zinc/16/92/63/1044169263.db2.gz DZCPFTIKTOHCKW-IBGZPJMESA-N 2 1 324.553 4.026 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCSc3ccccc32)C1 ZINC000359935479 1044216821 /nfs/dbraw/zinc/21/68/21/1044216821.db2.gz POUJYMVNKSIPJP-AEFFLSMTSA-N 2 1 318.530 4.325 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCc2sccc21 ZINC000359949318 1044219056 /nfs/dbraw/zinc/21/90/56/1044219056.db2.gz IJVSNMMQKBAIPZ-NVXWUHKLSA-N 2 1 306.519 4.370 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCCOc3ccccc32)C1 ZINC000359943560 1044219550 /nfs/dbraw/zinc/21/95/50/1044219550.db2.gz QJJYQHOXMZCCNL-PKOBYXMFSA-N 2 1 316.489 4.002 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCc2sccc21 ZINC000359949320 1044220022 /nfs/dbraw/zinc/22/00/22/1044220022.db2.gz IJVSNMMQKBAIPZ-WBVHZDCISA-N 2 1 306.519 4.370 20 0 DIADMP Clc1sccc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000359975003 1044223120 /nfs/dbraw/zinc/22/31/20/1044223120.db2.gz IZRYTTGXLGOUEF-UHFFFAOYSA-N 2 1 320.889 4.287 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CC2(C)CC(F)(F)C2)cc1 ZINC000883255337 1044245753 /nfs/dbraw/zinc/24/57/53/1044245753.db2.gz SJSRIFGGSVYGEO-ZDUSSCGKSA-N 2 1 319.399 4.267 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC000563352973 1044251062 /nfs/dbraw/zinc/25/10/62/1044251062.db2.gz LRYVVCSVQWWTJR-IBGZPJMESA-N 2 1 315.436 4.013 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2ccsc2S1 ZINC000360442662 1044271679 /nfs/dbraw/zinc/27/16/79/1044271679.db2.gz KNIMAKFTAXKBPE-MLGOLLRUSA-N 2 1 322.543 4.138 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCC(C)(C)c2ccccc21 ZINC000360656781 1044296722 /nfs/dbraw/zinc/29/67/22/1044296722.db2.gz KSLSZUBYYFALTG-DNVCBOLYSA-N 2 1 311.473 4.230 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H](c1cccnc1)C1CCC1)C(C)C ZINC000360657175 1044297096 /nfs/dbraw/zinc/29/70/96/1044297096.db2.gz MMRMBESPVQAXDV-LJQANCHMSA-N 2 1 303.494 4.021 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H](c1cccnc1)C1CCC1)Cc1ccccc1 ZINC000360842498 1044317633 /nfs/dbraw/zinc/31/76/33/1044317633.db2.gz WXCVKJFACIHLBA-OAQYLSRUSA-N 2 1 323.484 4.035 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H]2CC(C)(C)Cc3occc32)CC1 ZINC000360854821 1044320871 /nfs/dbraw/zinc/32/08/71/1044320871.db2.gz CTYFSPMUWYXSEM-QGZVFWFLSA-N 2 1 304.478 4.147 20 0 DIADMP Clc1ccc(CC2([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)CCC2)cc1 ZINC000293780254 1044326526 /nfs/dbraw/zinc/32/65/26/1044326526.db2.gz TVTXDUSABDEVPV-ROUUACIJSA-N 2 1 318.892 4.022 20 0 DIADMP CC[C@@H](C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000475284448 1044343560 /nfs/dbraw/zinc/34/35/60/1044343560.db2.gz DINWXLQWUDYEAZ-SFTDATJTSA-N 2 1 322.496 4.292 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC(C)(C)C2)[C@H]1c1cccs1 ZINC000564125674 1044343602 /nfs/dbraw/zinc/34/36/02/1044343602.db2.gz IDHUHFAWUWNFHZ-VYDXJSESSA-N 2 1 306.519 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@H]2CCC(C)(C)C2)[C@H]1c1cccs1 ZINC000564125674 1044343619 /nfs/dbraw/zinc/34/36/19/1044343619.db2.gz IDHUHFAWUWNFHZ-VYDXJSESSA-N 2 1 306.519 4.299 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@@H]2CCC[N@H+]2C)CC1 ZINC000348265386 1044379098 /nfs/dbraw/zinc/37/90/98/1044379098.db2.gz OUQWIFYMNMLZCZ-SFHVURJKSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[NH+](CC[C@@H]2CCC[N@@H+]2C)CC1 ZINC000348265386 1044379115 /nfs/dbraw/zinc/37/91/15/1044379115.db2.gz OUQWIFYMNMLZCZ-SFHVURJKSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[N@H+](CC[C@@H]2CCC[NH+]2C)CC1 ZINC000348265386 1044379126 /nfs/dbraw/zinc/37/91/26/1044379126.db2.gz OUQWIFYMNMLZCZ-SFHVURJKSA-N 2 1 323.484 4.050 20 0 DIADMP Cc1[nH]c2ccccc2c1C1=CC[N@@H+](CC[C@@H]2CCC[NH+]2C)CC1 ZINC000348265386 1044379134 /nfs/dbraw/zinc/37/91/34/1044379134.db2.gz OUQWIFYMNMLZCZ-SFHVURJKSA-N 2 1 323.484 4.050 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3[C@H](C2)C3(C)C)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168063913 1044393767 /nfs/dbraw/zinc/39/37/67/1044393767.db2.gz OALMGDGIWZODFQ-LZKBNWESSA-N 2 1 312.501 4.016 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2C[C@@H]3[C@H](C2)C3(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168063913 1044393780 /nfs/dbraw/zinc/39/37/80/1044393780.db2.gz OALMGDGIWZODFQ-LZKBNWESSA-N 2 1 312.501 4.016 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168063913 1044393789 /nfs/dbraw/zinc/39/37/89/1044393789.db2.gz OALMGDGIWZODFQ-LZKBNWESSA-N 2 1 312.501 4.016 20 0 DIADMP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cnc(C3CCCCC3)s2)C1 ZINC000565271372 1044423676 /nfs/dbraw/zinc/42/36/76/1044423676.db2.gz ISYCDPPPYCTZOR-HNNXBMFYSA-N 2 1 321.534 4.011 20 0 DIADMP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cnc(C3CCCCC3)s2)C1 ZINC000565271372 1044423683 /nfs/dbraw/zinc/42/36/83/1044423683.db2.gz ISYCDPPPYCTZOR-HNNXBMFYSA-N 2 1 321.534 4.011 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1C[C@@H](C)Sc2sccc21 ZINC000361763426 1044440377 /nfs/dbraw/zinc/44/03/77/1044440377.db2.gz DPJDVJTYSLXBQH-DOMZBBRYSA-N 2 1 321.515 4.248 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCSc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753901 1044441726 /nfs/dbraw/zinc/44/17/26/1044441726.db2.gz LNUVJEBVTZDPMD-XNRPHZJLSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCSc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753901 1044441732 /nfs/dbraw/zinc/44/17/32/1044441732.db2.gz LNUVJEBVTZDPMD-XNRPHZJLSA-N 2 1 324.921 4.339 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCOc3ccc(Cl)cc32)C1 ZINC000361968184 1044465691 /nfs/dbraw/zinc/46/56/91/1044465691.db2.gz ZFKRFVQHFIMTAW-INMHGKMJSA-N 2 1 322.880 4.016 20 0 DIADMP CC[C@@H]1CC[C@H]1[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000566039414 1044471571 /nfs/dbraw/zinc/47/15/71/1044471571.db2.gz OVMONCXDCOGDLM-XUVXKRRUSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCSc2c(Cl)cccc21 ZINC000338010117 1044534057 /nfs/dbraw/zinc/53/40/57/1044534057.db2.gz DRWRCEKGWKWDIM-OAHLLOKOSA-N 2 1 321.877 4.062 20 0 DIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000567296124 1044556931 /nfs/dbraw/zinc/55/69/31/1044556931.db2.gz BFLYZQPFSCKTBK-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP CCOc1cccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000567296124 1044556944 /nfs/dbraw/zinc/55/69/44/1044556944.db2.gz BFLYZQPFSCKTBK-CTNGQTDRSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccsc3)cc2)C1 ZINC000444636336 1044577869 /nfs/dbraw/zinc/57/78/69/1044577869.db2.gz GDRPAGCWTUCGJE-QGZVFWFLSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccsc3)cc2)C1 ZINC000444636336 1044577877 /nfs/dbraw/zinc/57/78/77/1044577877.db2.gz GDRPAGCWTUCGJE-QGZVFWFLSA-N 2 1 314.498 4.189 20 0 DIADMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccsc3)cc2)C1 ZINC000444636336 1044577890 /nfs/dbraw/zinc/57/78/90/1044577890.db2.gz GDRPAGCWTUCGJE-QGZVFWFLSA-N 2 1 314.498 4.189 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C[C@H](C)CCc2ccccc2)c1 ZINC001649170707 1044586942 /nfs/dbraw/zinc/58/69/42/1044586942.db2.gz CJXVZSBTZJSCLP-LJQANCHMSA-N 2 1 324.512 4.497 20 0 DIADMP CCc1ccccc1CC[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000444669588 1044598595 /nfs/dbraw/zinc/59/85/95/1044598595.db2.gz GTJABBAYXQOIDA-YLJYHZDGSA-N 2 1 314.517 4.034 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000296256892 1044602965 /nfs/dbraw/zinc/60/29/65/1044602965.db2.gz DDDOZDOLCIAEFX-CIUFUOKISA-N 2 1 323.484 4.069 20 0 DIADMP Cc1[nH]c(C2CC[NH+]([C@@H](C)c3cccc(F)c3)CC2)[nH+]c1C ZINC000886666516 1044677717 /nfs/dbraw/zinc/67/77/17/1044677717.db2.gz ULIBFOBXPJGFIB-AWEZNQCLSA-N 2 1 301.409 4.106 20 0 DIADMP Cc1cc(C)[nH+]c(N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000569290979 1044692219 /nfs/dbraw/zinc/69/22/19/1044692219.db2.gz OPXLNYYBFZXXGU-HKUYNNGSSA-N 2 1 309.457 4.021 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCC[C@@H](F)C2)CC1 ZINC000570043119 1044727773 /nfs/dbraw/zinc/72/77/73/1044727773.db2.gz HWILGDARRXUWAD-ADEKHHIBSA-N 2 1 318.480 4.300 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCC[C@H](F)C2)CC1 ZINC000570043120 1044728014 /nfs/dbraw/zinc/72/80/14/1044728014.db2.gz HWILGDARRXUWAD-IQNGYNMSSA-N 2 1 318.480 4.300 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)cc1 ZINC000367601859 1044748138 /nfs/dbraw/zinc/74/81/38/1044748138.db2.gz QADRMQAZVHQKRW-HOTGVXAUSA-N 2 1 320.440 4.296 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000367997488 1044759487 /nfs/dbraw/zinc/75/94/87/1044759487.db2.gz LXIFBYMCRPTSBS-GUXCAODWSA-N 2 1 323.484 4.070 20 0 DIADMP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000367997487 1044760779 /nfs/dbraw/zinc/76/07/79/1044760779.db2.gz LXIFBYMCRPTSBS-FTRWYGJKSA-N 2 1 323.484 4.070 20 0 DIADMP CCCc1cc(N2CCC3(CCC[N@H+]3C)CC2)c2ccccc2[nH+]1 ZINC000445601825 1044766610 /nfs/dbraw/zinc/76/66/10/1044766610.db2.gz UJBQEIQACDXMNL-UHFFFAOYSA-N 2 1 323.484 4.252 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCS2 ZINC000368753954 1044787880 /nfs/dbraw/zinc/78/78/80/1044787880.db2.gz NWKXYHUMTWLKST-XYJFISCASA-N 2 1 316.514 4.057 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cnc3ccsc3c2)C1 ZINC000125928315 1044807456 /nfs/dbraw/zinc/80/74/56/1044807456.db2.gz WXABMYMWGHVBJY-LSDHHAIUSA-N 2 1 317.502 4.067 20 0 DIADMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(C3CCCC3)cc2)CC1 ZINC000571359521 1044812288 /nfs/dbraw/zinc/81/22/88/1044812288.db2.gz PALZGJHZGMTOFU-FQEVSTJZSA-N 2 1 300.490 4.260 20 0 DIADMP c1ccc(C2CCC(C[NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)CC2)cc1 ZINC000572408117 1044856196 /nfs/dbraw/zinc/85/61/96/1044856196.db2.gz NJJHHLRWPFQLRB-FDYSRKEFSA-N 2 1 312.501 4.034 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000573112788 1044892775 /nfs/dbraw/zinc/89/27/75/1044892775.db2.gz LHEQHEVEPFUIFZ-VXKWHMMOSA-N 2 1 320.480 4.297 20 0 DIADMP C=Cc1ccc(CC[NH2+][C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1 ZINC000573112788 1044892788 /nfs/dbraw/zinc/89/27/88/1044892788.db2.gz LHEQHEVEPFUIFZ-VXKWHMMOSA-N 2 1 320.480 4.297 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@H](C)c1cnn(C2CCCC2)c1)C(C)C ZINC000337485624 1044908153 /nfs/dbraw/zinc/90/81/53/1044908153.db2.gz SGERTUNDDGXFHD-QGZVFWFLSA-N 2 1 320.525 4.158 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000372524742 1044917544 /nfs/dbraw/zinc/91/75/44/1044917544.db2.gz VOEMRQZVFZJOBR-ACRUOGEOSA-N 2 1 323.484 4.158 20 0 DIADMP Cc1ccc2c(c1)C[NH+](CCCC[N@@H+]1Cc3ccc(C)cc3C1)C2 ZINC000573749027 1044919673 /nfs/dbraw/zinc/91/96/73/1044919673.db2.gz YWWGDIALYATLTR-UHFFFAOYSA-N 2 1 320.480 4.415 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@@H](C)c1ccccc1 ZINC000573846268 1044925993 /nfs/dbraw/zinc/92/59/93/1044925993.db2.gz ZBPDHLRGFMORGZ-GOSISDBHSA-N 2 1 313.489 4.351 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000573846268 1044926008 /nfs/dbraw/zinc/92/60/08/1044926008.db2.gz ZBPDHLRGFMORGZ-GOSISDBHSA-N 2 1 313.489 4.351 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC[C@H](C)c1ccccc1 ZINC000573846270 1044927100 /nfs/dbraw/zinc/92/71/00/1044927100.db2.gz ZBPDHLRGFMORGZ-SFHVURJKSA-N 2 1 313.489 4.351 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000573846270 1044927115 /nfs/dbraw/zinc/92/71/15/1044927115.db2.gz ZBPDHLRGFMORGZ-SFHVURJKSA-N 2 1 313.489 4.351 20 0 DIADMP F[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045814 1044984028 /nfs/dbraw/zinc/98/40/28/1044984028.db2.gz SHYJMICTZFVQNB-GUDVDZBRSA-N 2 1 316.464 4.054 20 0 DIADMP F[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC000575045814 1044984045 /nfs/dbraw/zinc/98/40/45/1044984045.db2.gz SHYJMICTZFVQNB-GUDVDZBRSA-N 2 1 316.464 4.054 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+]1C)c1ccc(F)c2ccccc21 ZINC000575213514 1044994160 /nfs/dbraw/zinc/99/41/60/1044994160.db2.gz FQAWGIADOMHKDV-HUUCEWRRSA-N 2 1 300.421 4.114 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000525274301 1045022993 /nfs/dbraw/zinc/02/29/93/1045022993.db2.gz PBMQMTZHEYJWEM-QZTJIDSGSA-N 2 1 308.469 4.319 20 0 DIADMP Cc1ccc([C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCCC2)cc1 ZINC000446749894 1045028774 /nfs/dbraw/zinc/02/87/74/1045028774.db2.gz CQBLDIBVSVSFIW-NRFANRHFSA-N 2 1 312.501 4.443 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3ccccc3s2)C1 ZINC000446745817 1045029351 /nfs/dbraw/zinc/02/93/51/1045029351.db2.gz QODODCCLVLIPED-CABCVRRESA-N 2 1 302.487 4.284 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CCCc3sccc32)C1 ZINC000359946343 1045054203 /nfs/dbraw/zinc/05/42/03/1045054203.db2.gz ZDXKONUUFUZHOG-RDJZCZTQSA-N 2 1 306.519 4.227 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H](c2ccccc2)C[C@H](C)C1)c1c[nH+]ccc1N ZINC000576576076 1045066343 /nfs/dbraw/zinc/06/63/43/1045066343.db2.gz GQWKZPTYWDWXMD-IDCNUPLLSA-N 2 1 309.457 4.117 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1c(F)cccc1CC ZINC000576789091 1045080523 /nfs/dbraw/zinc/08/05/23/1045080523.db2.gz AZXHVMUGHDVDCN-UHFFFAOYSA-N 2 1 317.452 4.059 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1c(F)cccc1CC ZINC000576789091 1045080535 /nfs/dbraw/zinc/08/05/35/1045080535.db2.gz AZXHVMUGHDVDCN-UHFFFAOYSA-N 2 1 317.452 4.059 20 0 DIADMP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000459796032 1045117739 /nfs/dbraw/zinc/11/77/39/1045117739.db2.gz VYDFQKPDGSTQHK-WXLSXGNJSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000459796029 1045118657 /nfs/dbraw/zinc/11/86/57/1045118657.db2.gz VYDFQKPDGSTQHK-FXQLRMTLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC000300531037 1045130189 /nfs/dbraw/zinc/13/01/89/1045130189.db2.gz QEUNIHSHRUAIRJ-HZPDHXFCSA-N 2 1 308.897 4.125 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000447527822 1045137123 /nfs/dbraw/zinc/13/71/23/1045137123.db2.gz GAQKBRRSFNCYAX-WOJBJXKFSA-N 2 1 311.473 4.446 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2CCC4(CC4)CC2)C3)cc1 ZINC000447590246 1045155648 /nfs/dbraw/zinc/15/56/48/1045155648.db2.gz BDPLNIFJSKRDFG-MZADTFQBSA-N 2 1 324.512 4.494 20 0 DIADMP C[C@H](CC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734236 1045172577 /nfs/dbraw/zinc/17/25/77/1045172577.db2.gz URUFGUPLLIFQRY-YFVAEKQCSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734236 1045172580 /nfs/dbraw/zinc/17/25/80/1045172580.db2.gz URUFGUPLLIFQRY-YFVAEKQCSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000447734236 1045172581 /nfs/dbraw/zinc/17/25/81/1045172581.db2.gz URUFGUPLLIFQRY-YFVAEKQCSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000447734236 1045172585 /nfs/dbraw/zinc/17/25/85/1045172585.db2.gz URUFGUPLLIFQRY-YFVAEKQCSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734234 1045172873 /nfs/dbraw/zinc/17/28/73/1045172873.db2.gz URUFGUPLLIFQRY-QFUCXCTJSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000447734234 1045172880 /nfs/dbraw/zinc/17/28/80/1045172880.db2.gz URUFGUPLLIFQRY-QFUCXCTJSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000447734234 1045172886 /nfs/dbraw/zinc/17/28/86/1045172886.db2.gz URUFGUPLLIFQRY-QFUCXCTJSA-N 2 1 312.501 4.129 20 0 DIADMP C[C@H](CC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000447734234 1045172891 /nfs/dbraw/zinc/17/28/91/1045172891.db2.gz URUFGUPLLIFQRY-QFUCXCTJSA-N 2 1 312.501 4.129 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000924657720 1045187870 /nfs/dbraw/zinc/18/78/70/1045187870.db2.gz NBPZVEUXBXQJDE-YQQQUEKLSA-N 2 1 318.530 4.043 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000577918031 1045188701 /nfs/dbraw/zinc/18/87/01/1045188701.db2.gz ANOYDITZMCABTO-AWEZNQCLSA-N 2 1 316.411 4.129 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000924684335 1045189516 /nfs/dbraw/zinc/18/95/16/1045189516.db2.gz DYMITFNFAMNGLV-FXAWDEMLSA-N 2 1 315.505 4.167 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447935257 1045192159 /nfs/dbraw/zinc/19/21/59/1045192159.db2.gz FSZWEUHQXPPNEM-OAHLLOKOSA-N 2 1 323.550 4.185 20 0 DIADMP COc1cc([C@@H](C)[NH2+]CCCn2cc[nH+]c2C)cc2ccccc21 ZINC000924711117 1045193453 /nfs/dbraw/zinc/19/34/53/1045193453.db2.gz AEFQKFGCWMRXFC-OAHLLOKOSA-N 2 1 323.440 4.094 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Cl)c2)[C@@H](C)C1 ZINC000527115715 1045198016 /nfs/dbraw/zinc/19/80/16/1045198016.db2.gz JSCRULSQIYPSPQ-MPGHIAIKSA-N 2 1 308.897 4.106 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)C[C@H](C)c2cccc(Cl)c2)C[C@@H]1C ZINC000527116508 1045198541 /nfs/dbraw/zinc/19/85/41/1045198541.db2.gz VGCQZROEWFMCPI-MPGHIAIKSA-N 2 1 308.897 4.248 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366418 1045218437 /nfs/dbraw/zinc/21/84/37/1045218437.db2.gz UYMHKFKQAZGLGH-CVEARBPZSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CCN(C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366418 1045218414 /nfs/dbraw/zinc/21/84/14/1045218414.db2.gz UYMHKFKQAZGLGH-CVEARBPZSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366418 1045218423 /nfs/dbraw/zinc/21/84/23/1045218423.db2.gz UYMHKFKQAZGLGH-CVEARBPZSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366418 1045218445 /nfs/dbraw/zinc/21/84/45/1045218445.db2.gz UYMHKFKQAZGLGH-CVEARBPZSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366418 1045218454 /nfs/dbraw/zinc/21/84/54/1045218454.db2.gz UYMHKFKQAZGLGH-CVEARBPZSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN(C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366420 1045219579 /nfs/dbraw/zinc/21/95/79/1045219579.db2.gz UYMHKFKQAZGLGH-HZPDHXFCSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366420 1045219591 /nfs/dbraw/zinc/21/95/91/1045219591.db2.gz UYMHKFKQAZGLGH-HZPDHXFCSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366420 1045219600 /nfs/dbraw/zinc/21/96/00/1045219600.db2.gz UYMHKFKQAZGLGH-HZPDHXFCSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366420 1045219608 /nfs/dbraw/zinc/21/96/08/1045219608.db2.gz UYMHKFKQAZGLGH-HZPDHXFCSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H](C)c2cccc(Cl)c2)C1 ZINC000527366420 1045219618 /nfs/dbraw/zinc/21/96/18/1045219618.db2.gz UYMHKFKQAZGLGH-HZPDHXFCSA-N 2 1 308.897 4.107 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([NH2+]C3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000527631949 1045242349 /nfs/dbraw/zinc/24/23/49/1045242349.db2.gz DRKJJJIIGLAFHW-RTBURBONSA-N 2 1 312.501 4.319 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000527641286 1045244982 /nfs/dbraw/zinc/24/49/82/1045244982.db2.gz SCJQONLITKNATO-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP CCC(F)(F)C(C)(C)C[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000527629325 1045246969 /nfs/dbraw/zinc/24/69/69/1045246969.db2.gz KOMFRAHPPCTFRO-UHFFFAOYSA-N 2 1 324.459 4.312 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)[C@H]1CC12CC2 ZINC000527897797 1045275413 /nfs/dbraw/zinc/27/54/13/1045275413.db2.gz HZQJQVGKDDWYAQ-UHOSZYNNSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)[C@H]1CC12CC2 ZINC000527897797 1045275416 /nfs/dbraw/zinc/27/54/16/1045275416.db2.gz HZQJQVGKDDWYAQ-UHOSZYNNSA-N 2 1 312.501 4.065 20 0 DIADMP CC[C@H](C)c1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000527905696 1045279684 /nfs/dbraw/zinc/27/96/84/1045279684.db2.gz RBHMBCIONDQXQM-BUYPBNIOSA-N 2 1 300.490 4.476 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(-c2ccccc2)c1 ZINC000579185986 1045299057 /nfs/dbraw/zinc/29/90/57/1045299057.db2.gz JESURXXFPPZSPA-ROUUACIJSA-N 2 1 308.469 4.346 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000449061119 1045337592 /nfs/dbraw/zinc/33/75/92/1045337592.db2.gz HMVSJYBTWLTMNM-PGYGNJIDSA-N 2 1 322.537 4.111 20 0 DIADMP Clc1ccc([C@H]2CC[C@@H]([NH2+]C3CC[NH+](C4CC4)CC3)C2)cc1 ZINC000449071736 1045344088 /nfs/dbraw/zinc/34/40/88/1045344088.db2.gz OLHXCYAEOURVNP-MAUKXSAKSA-N 2 1 318.892 4.193 20 0 DIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000449092876 1045348289 /nfs/dbraw/zinc/34/82/89/1045348289.db2.gz VNIIVKADQUJLSP-BVBHFADKSA-N 2 1 318.892 4.193 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000449093712 1045348965 /nfs/dbraw/zinc/34/89/65/1045348965.db2.gz XEQWXHLYOJEQPY-WMZOPIPTSA-N 2 1 317.864 4.161 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC1 ZINC000449449236 1045394765 /nfs/dbraw/zinc/39/47/65/1045394765.db2.gz KYGBRNKXTKDJIV-QGZVFWFLSA-N 2 1 310.844 4.004 20 0 DIADMP Cc1csc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000449478450 1045398534 /nfs/dbraw/zinc/39/85/34/1045398534.db2.gz KIIPPXJOQOBCAD-WMZOPIPTSA-N 2 1 314.498 4.057 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC2(F)F)cc1 ZINC000449505922 1045404711 /nfs/dbraw/zinc/40/47/11/1045404711.db2.gz ZQUFQTXSXIQFMO-CJNGLKHVSA-N 2 1 319.399 4.267 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2cnc(C)cc2C)cc1 ZINC000449734810 1045431891 /nfs/dbraw/zinc/43/18/91/1045431891.db2.gz OIOFIGQGKLAFAE-INIZCTEOSA-N 2 1 320.440 4.043 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)C1CC(F)(F)C1 ZINC000529547429 1045493316 /nfs/dbraw/zinc/49/33/16/1045493316.db2.gz YTRAUAJGRAVXBH-AWEZNQCLSA-N 2 1 310.432 4.050 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1 ZINC000628322163 1045569244 /nfs/dbraw/zinc/56/92/44/1045569244.db2.gz FZEWQWUQAQDISF-BWAGFHJFSA-N 2 1 322.496 4.034 20 0 DIADMP C[C@H]([NH2+][C@H]1CC2CCC1CC2)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381944222 1045585495 /nfs/dbraw/zinc/58/54/95/1045585495.db2.gz BLHYAWBEXOBBBX-ZOFISECESA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC000392287812 1045649219 /nfs/dbraw/zinc/64/92/19/1045649219.db2.gz YSQVZFBSQNATOX-GOSISDBHSA-N 2 1 320.480 4.059 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH2+][C@@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629556382 1045678547 /nfs/dbraw/zinc/67/85/47/1045678547.db2.gz OPBCKYGYQKRKOI-OTWHNJEPSA-N 2 1 312.844 4.452 20 0 DIADMP COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000121998354 1045692348 /nfs/dbraw/zinc/69/23/48/1045692348.db2.gz KOVJBUMNQRYCMZ-LSDHHAIUSA-N 2 1 315.461 4.035 20 0 DIADMP CC[C@@H](c1ccc(F)cc1F)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000530863913 1045742334 /nfs/dbraw/zinc/74/23/34/1045742334.db2.gz RGJFFMUMLPKHDG-BEFAXECRSA-N 2 1 322.443 4.080 20 0 DIADMP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1 ZINC000530914643 1045755097 /nfs/dbraw/zinc/75/50/97/1045755097.db2.gz CLBXGQWWIRAXLM-SJORKVTESA-N 2 1 316.420 4.048 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2CCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000530949723 1045759637 /nfs/dbraw/zinc/75/96/37/1045759637.db2.gz JHOJIAVVUQPWQQ-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CC2CCCC2)CC[N@H+]1Cc1ccccc1 ZINC000530949723 1045759648 /nfs/dbraw/zinc/75/96/48/1045759648.db2.gz JHOJIAVVUQPWQQ-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949723 1045759664 /nfs/dbraw/zinc/75/96/64/1045759664.db2.gz JHOJIAVVUQPWQQ-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CC2CCCC2)CC[NH+]1Cc1ccccc1 ZINC000530949723 1045759671 /nfs/dbraw/zinc/75/96/71/1045759671.db2.gz JHOJIAVVUQPWQQ-FXAWDEMLSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCSC(C)(C)C)C1 ZINC000801921413 1045842353 /nfs/dbraw/zinc/84/23/53/1045842353.db2.gz BYVAOZMLEMFYJP-IRXDYDNUSA-N 2 1 312.567 4.105 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCSC(C)(C)C)C1 ZINC000801921413 1045842380 /nfs/dbraw/zinc/84/23/80/1045842380.db2.gz BYVAOZMLEMFYJP-IRXDYDNUSA-N 2 1 312.567 4.105 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](CCSC(C)(C)C)C1 ZINC000801921413 1045842389 /nfs/dbraw/zinc/84/23/89/1045842389.db2.gz BYVAOZMLEMFYJP-IRXDYDNUSA-N 2 1 312.567 4.105 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)CCc1c[nH]c2ccccc12 ZINC000631582715 1045877526 /nfs/dbraw/zinc/87/75/26/1045877526.db2.gz NJEYGDKOVIZUAD-MRXNPFEDSA-N 2 1 324.472 4.064 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H](C)c2ccccc2)CC1 ZINC000531701002 1045899905 /nfs/dbraw/zinc/89/99/05/1045899905.db2.gz VULACSCLPUOSRZ-GOSISDBHSA-N 2 1 308.469 4.310 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000531707612 1045901715 /nfs/dbraw/zinc/90/17/15/1045901715.db2.gz NQAXVMZTYNNDTC-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1cccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000531707612 1045901731 /nfs/dbraw/zinc/90/17/31/1045901731.db2.gz NQAXVMZTYNNDTC-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000531704760 1045901975 /nfs/dbraw/zinc/90/19/75/1045901975.db2.gz JPMAPLXBOJZZKK-FPOVZHCZSA-N 2 1 314.517 4.276 20 0 DIADMP CCC[C@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000531724546 1045912801 /nfs/dbraw/zinc/91/28/01/1045912801.db2.gz OSQHITRYOSNVEL-INIZCTEOSA-N 2 1 300.446 4.190 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc2c(c1)CCCC2 ZINC000531725283 1045913695 /nfs/dbraw/zinc/91/36/95/1045913695.db2.gz WXABEDHTPCTNLJ-MRXNPFEDSA-N 2 1 311.473 4.201 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)CC1 ZINC001137653317 1045918536 /nfs/dbraw/zinc/91/85/36/1045918536.db2.gz IUUTZCOZABZXAR-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[C@H](CCCc1cccnc1)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000453057277 1045919712 /nfs/dbraw/zinc/91/97/12/1045919712.db2.gz HULLIYLIOHDRQZ-MOPGFXCFSA-N 2 1 317.521 4.037 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c(F)c2)CC1 ZINC001137655393 1045921406 /nfs/dbraw/zinc/92/14/06/1045921406.db2.gz LKCISOIMPFOLAD-UHFFFAOYSA-N 2 1 312.860 4.175 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c(F)c2)CC1 ZINC001137655393 1045921413 /nfs/dbraw/zinc/92/14/13/1045921413.db2.gz LKCISOIMPFOLAD-UHFFFAOYSA-N 2 1 312.860 4.175 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C2CC2)C2CCC2)CC1 ZINC000453131507 1045953908 /nfs/dbraw/zinc/95/39/08/1045953908.db2.gz VIANRYWGMZNMDO-IIBYNOLFSA-N 2 1 312.501 4.380 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cs1 ZINC000453193605 1045974096 /nfs/dbraw/zinc/97/40/96/1045974096.db2.gz FMKVCFIKWPOVIX-JYJNAYRXSA-N 2 1 306.519 4.360 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@@H+]1C ZINC000453308369 1046027753 /nfs/dbraw/zinc/02/77/53/1046027753.db2.gz DLRURMMQQLYQHB-JDSLSITLSA-N 2 1 310.844 4.003 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC[N@H+]1C ZINC000453308369 1046027757 /nfs/dbraw/zinc/02/77/57/1046027757.db2.gz DLRURMMQQLYQHB-JDSLSITLSA-N 2 1 310.844 4.003 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@H]1CCCc2c3ccccc3[nH]c21)C1CC1 ZINC000453387828 1046062590 /nfs/dbraw/zinc/06/25/90/1046062590.db2.gz BGZXYUOTZYWMIB-IBGZPJMESA-N 2 1 311.473 4.009 20 0 DIADMP CC(C)[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(F)c(F)c1 ZINC000453412768 1046080535 /nfs/dbraw/zinc/08/05/35/1046080535.db2.gz WKILZWIEXSXJOL-GOSISDBHSA-N 2 1 310.432 4.126 20 0 DIADMP CSc1ccc([C@@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)cc1F ZINC000453390027 1046081141 /nfs/dbraw/zinc/08/11/41/1046081141.db2.gz CSXCZCMQQQCCMD-CYBMUJFWSA-N 2 1 310.482 4.073 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC2CC(F)(F)C2)cc1 ZINC000453434958 1046084880 /nfs/dbraw/zinc/08/48/80/1046084880.db2.gz TXTYNHLYTMDCAS-ZDUSSCGKSA-N 2 1 319.399 4.267 20 0 DIADMP C[N@@H+](CCCC[NH2+][C@@H]1CCCOc2cc(Cl)ccc21)C1CC1 ZINC000453420560 1046086676 /nfs/dbraw/zinc/08/66/76/1046086676.db2.gz ZQZQJDNHBPKPRL-QGZVFWFLSA-N 2 1 322.880 4.018 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(C(F)(F)F)s2)CC1 ZINC000902850363 1046086575 /nfs/dbraw/zinc/08/65/75/1046086575.db2.gz MXRGAIZEUUXSAN-LLVKDONJSA-N 2 1 320.424 4.290 20 0 DIADMP C[C@H]([NH2+][C@@H](C1CC1)C1CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000453445010 1046087270 /nfs/dbraw/zinc/08/72/70/1046087270.db2.gz ZNGFGJFKUUKOCM-ORYQWCPZSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(C(F)(F)F)s1 ZINC000903017361 1046143535 /nfs/dbraw/zinc/14/35/35/1046143535.db2.gz SAGRLSXULHMYDC-LLVKDONJSA-N 2 1 320.424 4.292 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069629 1046155349 /nfs/dbraw/zinc/15/53/49/1046155349.db2.gz IPVYBLVPJGBSGD-NEPJUHHUSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(C(F)(F)F)s1 ZINC000903069629 1046155354 /nfs/dbraw/zinc/15/53/54/1046155354.db2.gz IPVYBLVPJGBSGD-NEPJUHHUSA-N 2 1 320.424 4.149 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1ccc(F)cc1Cl ZINC000903098440 1046163986 /nfs/dbraw/zinc/16/39/86/1046163986.db2.gz OZDACCWNSDFEKL-DITUJHHDSA-N 2 1 322.855 4.288 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1ccc(F)cc1Cl ZINC000903098440 1046163992 /nfs/dbraw/zinc/16/39/92/1046163992.db2.gz OZDACCWNSDFEKL-DITUJHHDSA-N 2 1 322.855 4.288 20 0 DIADMP Cc1c2ccccc2sc1C[NH+]1CCC([N@H+](C)C2CC2)CC1 ZINC001138464642 1046191337 /nfs/dbraw/zinc/19/13/37/1046191337.db2.gz YGQNBDIQYRZJPV-UHFFFAOYSA-N 2 1 314.498 4.268 20 0 DIADMP Cc1c2ccccc2sc1C[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001138464642 1046191344 /nfs/dbraw/zinc/19/13/44/1046191344.db2.gz YGQNBDIQYRZJPV-UHFFFAOYSA-N 2 1 314.498 4.268 20 0 DIADMP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2ncc(C(C)(C)C)o2)CC1 ZINC000475754720 1046201437 /nfs/dbraw/zinc/20/14/37/1046201437.db2.gz LDVRVGNCXCYKBD-OAHLLOKOSA-N 2 1 321.509 4.087 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CCc3c(C)cccc3C2)cc1 ZINC001138543350 1046220341 /nfs/dbraw/zinc/22/03/41/1046220341.db2.gz MAIFEWWQRRDKPI-UHFFFAOYSA-N 2 1 317.436 4.047 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CCc3c(C)cccc3C2)cc1 ZINC001138543350 1046220348 /nfs/dbraw/zinc/22/03/48/1046220348.db2.gz MAIFEWWQRRDKPI-UHFFFAOYSA-N 2 1 317.436 4.047 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)cc1 ZINC001138547605 1046222152 /nfs/dbraw/zinc/22/21/52/1046222152.db2.gz QMAPYRNLIVPCED-MOPGFXCFSA-N 2 1 309.457 4.193 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)cc1 ZINC001138547605 1046222167 /nfs/dbraw/zinc/22/21/67/1046222167.db2.gz QMAPYRNLIVPCED-MOPGFXCFSA-N 2 1 309.457 4.193 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@@H+](C)Cc2ccc(C)c(C)c2)cc1 ZINC001138550354 1046222745 /nfs/dbraw/zinc/22/27/45/1046222745.db2.gz QOHRRDFRWKWSBD-UHFFFAOYSA-N 2 1 319.452 4.430 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[N@H+](C)Cc2ccc(C)c(C)c2)cc1 ZINC001138550354 1046222761 /nfs/dbraw/zinc/22/27/61/1046222761.db2.gz QOHRRDFRWKWSBD-UHFFFAOYSA-N 2 1 319.452 4.430 20 0 DIADMP C[C@H](Cc1ccc(Cl)cc1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168167364 1046231487 /nfs/dbraw/zinc/23/14/87/1046231487.db2.gz OMZUFTAEWKTZLE-NIKGAXFTSA-N 2 1 320.908 4.253 20 0 DIADMP C[C@@H](Cc1ccc(Cl)cc1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001168172057 1046249652 /nfs/dbraw/zinc/24/96/52/1046249652.db2.gz ZMHJACDUOBDBGE-RDJZCZTQSA-N 2 1 308.897 4.112 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccc(F)cc4)cc3)C2)C1 ZINC001138684283 1046266235 /nfs/dbraw/zinc/26/62/35/1046266235.db2.gz DXCZAGIXGASPNB-OAQYLSRUSA-N 2 1 324.443 4.020 20 0 DIADMP c1cc2cc(C[N@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2o1 ZINC001138821573 1046301505 /nfs/dbraw/zinc/30/15/05/1046301505.db2.gz AXUOARWQAPPLBP-LJQANCHMSA-N 2 1 312.457 4.273 20 0 DIADMP c1cc2cc(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)ccc2o1 ZINC001138821573 1046301520 /nfs/dbraw/zinc/30/15/20/1046301520.db2.gz AXUOARWQAPPLBP-LJQANCHMSA-N 2 1 312.457 4.273 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]([NH3+])CC(F)F)c1cccc(C(F)(F)F)c1 ZINC000903924923 1046339389 /nfs/dbraw/zinc/33/93/89/1046339389.db2.gz KKNUGASOFGVBIA-QWHCGFSZSA-N 2 1 324.337 4.119 20 0 DIADMP CC(C)Oc1cccc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)c1 ZINC001138986284 1046350360 /nfs/dbraw/zinc/35/03/60/1046350360.db2.gz IBGQSTDMCDVFJV-UHFFFAOYSA-N 2 1 318.505 4.026 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639273783 1046377188 /nfs/dbraw/zinc/37/71/88/1046377188.db2.gz NOWQGEFQMAWYPT-NBYUQASBSA-N 2 1 322.452 4.093 20 0 DIADMP c1coc([C@@H]2C[C@H]2[NH2+][C@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000639273783 1046377201 /nfs/dbraw/zinc/37/72/01/1046377201.db2.gz NOWQGEFQMAWYPT-NBYUQASBSA-N 2 1 322.452 4.093 20 0 DIADMP c1coc(CCC[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639335727 1046383126 /nfs/dbraw/zinc/38/31/26/1046383126.db2.gz RFWLGWXIUYKRQW-GHTZIAJQSA-N 2 1 324.468 4.170 20 0 DIADMP c1coc(CCC[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)c1 ZINC000639335727 1046383138 /nfs/dbraw/zinc/38/31/38/1046383138.db2.gz RFWLGWXIUYKRQW-GHTZIAJQSA-N 2 1 324.468 4.170 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)Cc1ccc(-n2ccnc2)cc1 ZINC001139360698 1046436276 /nfs/dbraw/zinc/43/62/76/1046436276.db2.gz DKBMBRGGXCVUDB-UHFFFAOYSA-N 2 1 305.425 4.203 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(-n2ccnc2)cc1 ZINC001139360164 1046436754 /nfs/dbraw/zinc/43/67/54/1046436754.db2.gz JAELHJAEPCYRLP-FQEVSTJZSA-N 2 1 321.399 4.349 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(-c2ccccc2)s1 ZINC001139415590 1046446639 /nfs/dbraw/zinc/44/66/39/1046446639.db2.gz ABEKBVNAYPORKJ-UHFFFAOYSA-N 2 1 302.487 4.189 20 0 DIADMP CC(C)[C@H]1CCC[C@@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202938700 1046452779 /nfs/dbraw/zinc/45/27/79/1046452779.db2.gz JUQDTCVCMIGKRG-BQJUDKOJSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@@H+]2CCCCn2cc[nH+]c2C)s1 ZINC000124020695 1046452894 /nfs/dbraw/zinc/45/28/94/1046452894.db2.gz FRFUVAMLSZMMDM-INIZCTEOSA-N 2 1 303.475 4.179 20 0 DIADMP Cc1ccc([C@@H]2CCC[N@H+]2CCCCn2cc[nH+]c2C)s1 ZINC000124020695 1046452898 /nfs/dbraw/zinc/45/28/98/1046452898.db2.gz FRFUVAMLSZMMDM-INIZCTEOSA-N 2 1 303.475 4.179 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)C1 ZINC001202939852 1046454322 /nfs/dbraw/zinc/45/43/22/1046454322.db2.gz UJRLFDUQJHMKDP-JYRKZWEQSA-N 2 1 314.517 4.138 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000124479783 1046456039 /nfs/dbraw/zinc/45/60/39/1046456039.db2.gz YJWMYMPHOJQFNO-DNVCBOLYSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000124479783 1046456043 /nfs/dbraw/zinc/45/60/43/1046456043.db2.gz YJWMYMPHOJQFNO-DNVCBOLYSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000124521788 1046457030 /nfs/dbraw/zinc/45/70/30/1046457030.db2.gz RMUWAWIPDYQWRX-HNAYVOBHSA-N 2 1 315.436 4.194 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000124521788 1046457033 /nfs/dbraw/zinc/45/70/33/1046457033.db2.gz RMUWAWIPDYQWRX-HNAYVOBHSA-N 2 1 315.436 4.194 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cnc2ccccc2c1 ZINC001137282804 1046461501 /nfs/dbraw/zinc/46/15/01/1046461501.db2.gz MFBLZJIBLCXQJE-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cnc2ccccc2c1 ZINC001137282804 1046461511 /nfs/dbraw/zinc/46/15/11/1046461511.db2.gz MFBLZJIBLCXQJE-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cnc2ccccc2c1 ZINC001137282804 1046461519 /nfs/dbraw/zinc/46/15/19/1046461519.db2.gz MFBLZJIBLCXQJE-PMACEKPBSA-N 2 1 323.484 4.074 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1cc(F)cc2F ZINC000677129742 1046467129 /nfs/dbraw/zinc/46/71/29/1046467129.db2.gz OAEZNMWZBKVYAL-LIRRHRJNSA-N 2 1 322.443 4.196 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC000125436408 1046468668 /nfs/dbraw/zinc/46/86/68/1046468668.db2.gz TYMZZERPKJOBNO-UHFFFAOYSA-N 2 1 317.452 4.412 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC000125436408 1046468678 /nfs/dbraw/zinc/46/86/78/1046468678.db2.gz TYMZZERPKJOBNO-UHFFFAOYSA-N 2 1 317.452 4.412 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000677237399 1046475046 /nfs/dbraw/zinc/47/50/46/1046475046.db2.gz FUXXEUVFRXXHAN-MOPGFXCFSA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677237399 1046475049 /nfs/dbraw/zinc/47/50/49/1046475049.db2.gz FUXXEUVFRXXHAN-MOPGFXCFSA-N 2 1 322.452 4.195 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206606332 1046498089 /nfs/dbraw/zinc/49/80/89/1046498089.db2.gz LDHSKFWVTBTCAM-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1cc(F)cc(Cl)c1C[N@H+](C(C)C)[C@@H]1CCC[NH2+]CC1 ZINC001206606332 1046498091 /nfs/dbraw/zinc/49/80/91/1046498091.db2.gz LDHSKFWVTBTCAM-OAHLLOKOSA-N 2 1 312.860 4.140 20 0 DIADMP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCC2 ZINC000677753724 1046522648 /nfs/dbraw/zinc/52/26/48/1046522648.db2.gz PHFABJASGLKEAM-IRFCIJBXSA-N 2 1 312.501 4.404 20 0 DIADMP FC(F)c1ccccc1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001139801506 1046522768 /nfs/dbraw/zinc/52/27/68/1046522768.db2.gz VKANNYJHAAPFSV-QGZVFWFLSA-N 2 1 322.443 4.465 20 0 DIADMP FC(F)c1ccccc1C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001139801506 1046522777 /nfs/dbraw/zinc/52/27/77/1046522777.db2.gz VKANNYJHAAPFSV-QGZVFWFLSA-N 2 1 322.443 4.465 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3cccc4c5ccccc5oc43)C2)C1 ZINC001139858266 1046535655 /nfs/dbraw/zinc/53/56/55/1046535655.db2.gz BQLHEVZGIFCCPF-OAQYLSRUSA-N 2 1 320.436 4.114 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3cccc4c5ccccc5oc43)C2)C1 ZINC001139858266 1046535665 /nfs/dbraw/zinc/53/56/65/1046535665.db2.gz BQLHEVZGIFCCPF-OAQYLSRUSA-N 2 1 320.436 4.114 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)CC(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000694020655 1046535840 /nfs/dbraw/zinc/53/58/40/1046535840.db2.gz FCISDJPJDRKHQH-DOTOQJQBSA-N 2 1 324.459 4.168 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC001139880400 1046540349 /nfs/dbraw/zinc/54/03/49/1046540349.db2.gz KGTOEILMQMHIKI-UHFFFAOYSA-N 2 1 321.468 4.006 20 0 DIADMP c1ccc(-c2ccc(C[NH+]3CCC([NH+]4CCCC4)CC3)cc2)cc1 ZINC000097474423 1046560668 /nfs/dbraw/zinc/56/06/68/1046560668.db2.gz MBJYTNWHTFGBSC-UHFFFAOYSA-N 2 1 320.480 4.414 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)Cc1ccccc1C ZINC001140025531 1046571305 /nfs/dbraw/zinc/57/13/05/1046571305.db2.gz PMHIMTLWTMMMKT-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)Cc1ccccc1C ZINC001140025531 1046571315 /nfs/dbraw/zinc/57/13/15/1046571315.db2.gz PMHIMTLWTMMMKT-UHFFFAOYSA-N 2 1 305.425 4.121 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+](C)C/C=C/c1ccccc1 ZINC001140025919 1046573469 /nfs/dbraw/zinc/57/34/69/1046573469.db2.gz GHYDXHPYCHFQCN-DHZHZOJOSA-N 2 1 317.436 4.326 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+](C)C/C=C/c1ccccc1 ZINC001140025919 1046573482 /nfs/dbraw/zinc/57/34/82/1046573482.db2.gz GHYDXHPYCHFQCN-DHZHZOJOSA-N 2 1 317.436 4.326 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1ccccc1-c1ccccc1 ZINC000729681370 1046577441 /nfs/dbraw/zinc/57/74/41/1046577441.db2.gz WPUOZNLHSABCQE-QGZVFWFLSA-N 2 1 319.452 4.284 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139215 1046589254 /nfs/dbraw/zinc/58/92/54/1046589254.db2.gz BKKWRVHDXUVEQO-VQTJNVASSA-N 2 1 323.484 4.035 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000195139215 1046589270 /nfs/dbraw/zinc/58/92/70/1046589270.db2.gz BKKWRVHDXUVEQO-VQTJNVASSA-N 2 1 323.484 4.035 20 0 DIADMP C[C@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)C1 ZINC000237713064 1046597020 /nfs/dbraw/zinc/59/70/20/1046597020.db2.gz QRTOCTVONVNSNF-LPHOPBHVSA-N 2 1 312.457 4.190 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000642630971 1046625453 /nfs/dbraw/zinc/62/54/53/1046625453.db2.gz SWXQSGZUCOJHST-OALUTQOASA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000642630971 1046625461 /nfs/dbraw/zinc/62/54/61/1046625461.db2.gz SWXQSGZUCOJHST-OALUTQOASA-N 2 1 322.452 4.195 20 0 DIADMP CC[NH+](CC)CC1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000642643447 1046628016 /nfs/dbraw/zinc/62/80/16/1046628016.db2.gz MDXCGCFRJAFFOA-UHFFFAOYSA-N 2 1 312.860 4.033 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000532989344 1046635437 /nfs/dbraw/zinc/63/54/37/1046635437.db2.gz QMRKVQVQFTVTPV-AZUAARDMSA-N 2 1 308.469 4.202 20 0 DIADMP Cc1ccncc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000678425869 1046636567 /nfs/dbraw/zinc/63/65/67/1046636567.db2.gz DACNYBVDSIEUQI-ZWOKBUDYSA-N 2 1 315.505 4.084 20 0 DIADMP CSCC[C@H](C)[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000796771309 1046645245 /nfs/dbraw/zinc/64/52/45/1046645245.db2.gz INQUFCCIJNPWJW-IVMQYODDSA-N 2 1 320.546 4.161 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c2ccccc2)cc1 ZINC000643547324 1046670742 /nfs/dbraw/zinc/67/07/42/1046670742.db2.gz CUTOYNKPFBJPGU-LEWJYISDSA-N 2 1 320.480 4.349 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(-c2ccccc2)o1 ZINC000643546381 1046670814 /nfs/dbraw/zinc/67/08/14/1046670814.db2.gz NWARALHZFRESMD-WBVHZDCISA-N 2 1 310.441 4.272 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533288993 1046686533 /nfs/dbraw/zinc/68/65/33/1046686533.db2.gz MVWOHPYRYJPTDP-MAUKXSAKSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000533288993 1046686535 /nfs/dbraw/zinc/68/65/35/1046686535.db2.gz MVWOHPYRYJPTDP-MAUKXSAKSA-N 2 1 306.881 4.351 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000533307350 1046693614 /nfs/dbraw/zinc/69/36/14/1046693614.db2.gz CMNMXSOKGOSHCZ-JKALPCAWSA-N 2 1 300.490 4.048 20 0 DIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccc[nH]1 ZINC000796845850 1046745130 /nfs/dbraw/zinc/74/51/30/1046745130.db2.gz MDHZJPXDZNKOGO-IVMQYODDSA-N 2 1 311.473 4.109 20 0 DIADMP CC[NH+](CC)Cc1ccccc1Nc1cccc2[nH+]cn(C)c21 ZINC001211996420 1046764245 /nfs/dbraw/zinc/76/42/45/1046764245.db2.gz YYEZESXCFABSQV-UHFFFAOYSA-N 2 1 308.429 4.159 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1C(C)(C)C ZINC000533637930 1046770310 /nfs/dbraw/zinc/77/03/10/1046770310.db2.gz BMMJNOYUBGXCSO-HOTGVXAUSA-N 2 1 300.490 4.119 20 0 DIADMP c1cc(C2CCCCC2)ccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000645465507 1046793011 /nfs/dbraw/zinc/79/30/11/1046793011.db2.gz IGNMSPUUIYCLOY-NHCUHLMSSA-N 2 1 312.501 4.451 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc(O)cc1 ZINC000679395333 1046835646 /nfs/dbraw/zinc/83/56/46/1046835646.db2.gz UUESSNGUVZMJNI-KRWDZBQOSA-N 2 1 324.468 4.056 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000248400811 1046842082 /nfs/dbraw/zinc/84/20/82/1046842082.db2.gz LIQDORYVKOIOSF-WWGRRREGSA-N 2 1 321.534 4.064 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000248400813 1046843009 /nfs/dbraw/zinc/84/30/09/1046843009.db2.gz LIQDORYVKOIOSF-XEZPLFJOSA-N 2 1 321.534 4.064 20 0 DIADMP c1csc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC000249053878 1046857272 /nfs/dbraw/zinc/85/72/72/1046857272.db2.gz YFWUFGLJGSXTGX-BCDXTJNWSA-N 2 1 312.482 4.033 20 0 DIADMP CC(C)[N@@H+](CCCc1cccc(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC001206580548 1046864069 /nfs/dbraw/zinc/86/40/69/1046864069.db2.gz DQCACNAUOGRADJ-SFHVURJKSA-N 2 1 308.897 4.125 20 0 DIADMP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378103 1046873333 /nfs/dbraw/zinc/87/33/33/1046873333.db2.gz OZZCRCHPJVSTEH-ROUUACIJSA-N 2 1 317.521 4.151 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378103 1046873351 /nfs/dbraw/zinc/87/33/51/1046873351.db2.gz OZZCRCHPJVSTEH-ROUUACIJSA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378103 1046873368 /nfs/dbraw/zinc/87/33/68/1046873368.db2.gz OZZCRCHPJVSTEH-ROUUACIJSA-N 2 1 317.521 4.151 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1ccc(C(C)(C)C)[nH]1 ZINC001137378103 1046873386 /nfs/dbraw/zinc/87/33/86/1046873386.db2.gz OZZCRCHPJVSTEH-ROUUACIJSA-N 2 1 317.521 4.151 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)o1 ZINC000067668324 1046892953 /nfs/dbraw/zinc/89/29/53/1046892953.db2.gz MYQJRPVVIWRKKI-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001140781412 1046895291 /nfs/dbraw/zinc/89/52/91/1046895291.db2.gz SPOWMEGDBUFNSK-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP Cc1cc(F)ccc1C[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001140781412 1046895302 /nfs/dbraw/zinc/89/53/02/1046895302.db2.gz SPOWMEGDBUFNSK-UHFFFAOYSA-N 2 1 318.480 4.363 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(C)n1 ZINC000679722958 1046895746 /nfs/dbraw/zinc/89/57/46/1046895746.db2.gz IPHRXUDSQJXMLI-NJAFHUGGSA-N 2 1 315.505 4.002 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCOC(C)(C)C)cc1 ZINC000679824946 1046904201 /nfs/dbraw/zinc/90/42/01/1046904201.db2.gz OQWZTJDIJLTWHI-HNNXBMFYSA-N 2 1 315.461 4.037 20 0 DIADMP CC[N@H+](Cc1c[nH]c2cc[nH+]cc12)[C@H](C)Cc1ccc(OC)cc1 ZINC001140801069 1046907845 /nfs/dbraw/zinc/90/78/45/1046907845.db2.gz AWUROIPYOGQLQG-OAHLLOKOSA-N 2 1 323.440 4.025 20 0 DIADMP CC[N@@H+](Cc1c[nH]c2cc[nH+]cc12)[C@H](C)Cc1ccc(OC)cc1 ZINC001140801069 1046907848 /nfs/dbraw/zinc/90/78/48/1046907848.db2.gz AWUROIPYOGQLQG-OAHLLOKOSA-N 2 1 323.440 4.025 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+](Cc3c[nH]c4cc[nH+]cc34)C2)c1 ZINC001140805072 1046909440 /nfs/dbraw/zinc/90/94/40/1046909440.db2.gz QIJCELYOMBFKAG-CQSZACIVSA-N 2 1 311.816 4.206 20 0 DIADMP Clc1cccc([C@@H]2CC[N@@H+](Cc3c[nH]c4cc[nH+]cc34)C2)c1 ZINC001140805072 1046909449 /nfs/dbraw/zinc/90/94/49/1046909449.db2.gz QIJCELYOMBFKAG-CQSZACIVSA-N 2 1 311.816 4.206 20 0 DIADMP CCCN1CCC([NH2+][C@@H](C)c2sc(C(C)C)nc2C)CC1 ZINC000161599977 1046910118 /nfs/dbraw/zinc/91/01/18/1046910118.db2.gz BVAODPDWRDHNLE-ZDUSSCGKSA-N 2 1 309.523 4.100 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2sc(C(C)C)nc2C)CC1 ZINC000161599977 1046910130 /nfs/dbraw/zinc/91/01/30/1046910130.db2.gz BVAODPDWRDHNLE-ZDUSSCGKSA-N 2 1 309.523 4.100 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+](Cc2c[nH]c3cc[nH+]cc23)C1 ZINC001140807382 1046911091 /nfs/dbraw/zinc/91/10/91/1046911091.db2.gz XMVZAKFCQCHWGY-CYBMUJFWSA-N 2 1 311.816 4.206 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@@H+](Cc2c[nH]c3cc[nH+]cc23)C1 ZINC001140807382 1046911106 /nfs/dbraw/zinc/91/11/06/1046911106.db2.gz XMVZAKFCQCHWGY-CYBMUJFWSA-N 2 1 311.816 4.206 20 0 DIADMP C[C@@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000261624665 1046946536 /nfs/dbraw/zinc/94/65/36/1046946536.db2.gz DRUHJLZKHRPTQB-KRWDZBQOSA-N 2 1 320.889 4.239 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]CC(C3CC3)C3CC3)CC23CC3)cc1 ZINC000647188513 1046950871 /nfs/dbraw/zinc/95/08/71/1046950871.db2.gz VEJFZZUKJBIOQX-FQEVSTJZSA-N 2 1 324.512 4.209 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]CC(C3CC3)C3CC3)CC23CC3)cc1 ZINC000647188513 1046950879 /nfs/dbraw/zinc/95/08/79/1046950879.db2.gz VEJFZZUKJBIOQX-FQEVSTJZSA-N 2 1 324.512 4.209 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cs1 ZINC000647343724 1046984178 /nfs/dbraw/zinc/98/41/78/1046984178.db2.gz ATKNQWOIFIDUSV-LZQZEXGQSA-N 2 1 314.498 4.053 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CCCC2)o1 ZINC000680461178 1046984394 /nfs/dbraw/zinc/98/43/94/1046984394.db2.gz HHWGLGIGLKQPFQ-YQVWRLOYSA-N 2 1 302.462 4.036 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)o1 ZINC000680461178 1046984401 /nfs/dbraw/zinc/98/44/01/1046984401.db2.gz HHWGLGIGLKQPFQ-YQVWRLOYSA-N 2 1 302.462 4.036 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000680461822 1046985002 /nfs/dbraw/zinc/98/50/02/1046985002.db2.gz YFZIKMZLRLYJHP-HIRMHNASSA-N 2 1 318.892 4.193 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1ccsc1 ZINC000647344318 1046985362 /nfs/dbraw/zinc/98/53/62/1046985362.db2.gz NZDYXQNRDOZHRB-CEXWTWQISA-N 2 1 314.498 4.134 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)[C@@H](C)c1ccccc1 ZINC000647344629 1046986552 /nfs/dbraw/zinc/98/65/52/1046986552.db2.gz VTWBAUWJHWHVMD-YHBROIRLSA-N 2 1 322.496 4.114 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+](C/C=C\c3ccc(Cl)cc3)C2)CC1 ZINC000798956678 1046992116 /nfs/dbraw/zinc/99/21/16/1046992116.db2.gz JROCFHCNXPVXED-RQOWECAXSA-N 2 1 318.892 4.161 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]([C@H]3CCc4c3cccc4Cl)C2)CC1 ZINC000799178636 1047008477 /nfs/dbraw/zinc/00/84/77/1047008477.db2.gz ZSOQFRXKPDHMKJ-SFHVURJKSA-N 2 1 318.892 4.135 20 0 DIADMP CC[C@H](c1ccc(F)cc1F)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799178135 1047009788 /nfs/dbraw/zinc/00/97/88/1047009788.db2.gz MUUDIMSHDSBRNB-GOSISDBHSA-N 2 1 322.443 4.224 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661802 1047055129 /nfs/dbraw/zinc/05/51/29/1047055129.db2.gz FERIAAKVVDWDNI-WMZOPIPTSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661802 1047055147 /nfs/dbraw/zinc/05/51/47/1047055147.db2.gz FERIAAKVVDWDNI-WMZOPIPTSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661802 1047055161 /nfs/dbraw/zinc/05/51/61/1047055161.db2.gz FERIAAKVVDWDNI-WMZOPIPTSA-N 2 1 312.457 4.251 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)C[C@@H]1C ZINC000536661802 1047055173 /nfs/dbraw/zinc/05/51/73/1047055173.db2.gz FERIAAKVVDWDNI-WMZOPIPTSA-N 2 1 312.457 4.251 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665502 1047055771 /nfs/dbraw/zinc/05/57/71/1047055771.db2.gz MWHLAXPTIAQHKP-HNNXBMFYSA-N 2 1 308.535 4.209 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665502 1047055782 /nfs/dbraw/zinc/05/57/82/1047055782.db2.gz MWHLAXPTIAQHKP-HNNXBMFYSA-N 2 1 308.535 4.209 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665502 1047055798 /nfs/dbraw/zinc/05/57/98/1047055798.db2.gz MWHLAXPTIAQHKP-HNNXBMFYSA-N 2 1 308.535 4.209 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000536665502 1047055807 /nfs/dbraw/zinc/05/58/07/1047055807.db2.gz MWHLAXPTIAQHKP-HNNXBMFYSA-N 2 1 308.535 4.209 20 0 DIADMP Cc1oc2ccccc2c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000536695901 1047076198 /nfs/dbraw/zinc/07/61/98/1047076198.db2.gz DWLNMQBXHDUFRN-QGZVFWFLSA-N 2 1 312.457 4.049 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)s1 ZINC000379619970 1047081786 /nfs/dbraw/zinc/08/17/86/1047081786.db2.gz CFZZMKFYPMGHTG-YJBOKZPZSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)s1 ZINC000379619970 1047081798 /nfs/dbraw/zinc/08/17/98/1047081798.db2.gz CFZZMKFYPMGHTG-YJBOKZPZSA-N 2 1 314.498 4.199 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC2(F)F)CC[N@H+]1Cc1ccccc1 ZINC000379651550 1047090425 /nfs/dbraw/zinc/09/04/25/1047090425.db2.gz UVCVCKIRKQPCKV-KBAYOESNSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379644485 1047090986 /nfs/dbraw/zinc/09/09/86/1047090986.db2.gz CIYIMEKMYMOVCX-NZSAHSFTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000379644485 1047090992 /nfs/dbraw/zinc/09/09/92/1047090992.db2.gz CIYIMEKMYMOVCX-NZSAHSFTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC000379643919 1047091046 /nfs/dbraw/zinc/09/10/46/1047091046.db2.gz BPAQJPXLWRUNGE-PXNSSMCTSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2CCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC000379643919 1047091060 /nfs/dbraw/zinc/09/10/60/1047091060.db2.gz BPAQJPXLWRUNGE-PXNSSMCTSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000379657466 1047095660 /nfs/dbraw/zinc/09/56/60/1047095660.db2.gz SVFCJXXPPKTYAY-NZSAHSFTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC000379657466 1047095672 /nfs/dbraw/zinc/09/56/72/1047095672.db2.gz SVFCJXXPPKTYAY-NZSAHSFTSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC000379657467 1047096747 /nfs/dbraw/zinc/09/67/47/1047096747.db2.gz SVFCJXXPPKTYAY-QRQLOZEOSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC2(C)C)CC[N@H+]1Cc1ccccc1 ZINC000379657467 1047096761 /nfs/dbraw/zinc/09/67/61/1047096761.db2.gz SVFCJXXPPKTYAY-QRQLOZEOSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@H+](C)C[C@@H]1C)CCC2 ZINC000536835191 1047106080 /nfs/dbraw/zinc/10/60/80/1047106080.db2.gz UHKPUIPMKYEBCC-BEVDRBHNSA-N 2 1 300.490 4.117 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C[C@@H]1C)CCC2 ZINC000536835191 1047106083 /nfs/dbraw/zinc/10/60/83/1047106083.db2.gz UHKPUIPMKYEBCC-BEVDRBHNSA-N 2 1 300.490 4.117 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000536843435 1047108324 /nfs/dbraw/zinc/10/83/24/1047108324.db2.gz DATWJMODWQAHHW-MTGBTSFXSA-N 2 1 314.517 4.205 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1cccc(-c2ccsc2)c1 ZINC001141384549 1047112877 /nfs/dbraw/zinc/11/28/77/1047112877.db2.gz OATZYYALQBFLKB-UHFFFAOYSA-N 2 1 314.498 4.333 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCc3ccc(Cl)cc32)CC1 ZINC000536875393 1047118051 /nfs/dbraw/zinc/11/80/51/1047118051.db2.gz HTURNDFHGQYTOE-KRWDZBQOSA-N 2 1 306.881 4.180 20 0 DIADMP C[C@H]1C[C@H]([NH2+]CC(C)(C)CCCc2ccccc2)CC[N@H+]1C ZINC000536875745 1047118673 /nfs/dbraw/zinc/11/86/73/1047118673.db2.gz JVKHZHAXUXCRMD-PKOBYXMFSA-N 2 1 302.506 4.108 20 0 DIADMP CC[N@@H+](CCC1CC[NH+]([C@@H](C)c2ncc(C)o2)CC1)CC(C)C ZINC000536887860 1047120961 /nfs/dbraw/zinc/12/09/61/1047120961.db2.gz XWTXWUFLZUMJGH-KRWDZBQOSA-N 2 1 321.509 4.124 20 0 DIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)CCCC1CC[NH2+]CC1 ZINC000649411104 1047126204 /nfs/dbraw/zinc/12/62/04/1047126204.db2.gz RBYHHINWXZXKGM-CQSZACIVSA-N 2 1 317.502 4.069 20 0 DIADMP CC[N@H+]1CCC[C@H](CN[C@H](C)c2oc3ccccc3c2C)C1 ZINC001116293263 1047127364 /nfs/dbraw/zinc/12/73/64/1047127364.db2.gz LFIZHXXSMBVTHQ-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2oc3ccccc3c2C)C1 ZINC001116293263 1047127370 /nfs/dbraw/zinc/12/73/70/1047127370.db2.gz LFIZHXXSMBVTHQ-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](CN[C@@H](C)c2oc3ccccc3c2C)C1 ZINC001116293262 1047127804 /nfs/dbraw/zinc/12/78/04/1047127804.db2.gz LFIZHXXSMBVTHQ-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2oc3ccccc3c2C)C1 ZINC001116293262 1047127816 /nfs/dbraw/zinc/12/78/16/1047127816.db2.gz LFIZHXXSMBVTHQ-HOTGVXAUSA-N 2 1 300.446 4.124 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](CSc2ccccc2)C(C)C)C1 ZINC001116505802 1047150482 /nfs/dbraw/zinc/15/04/82/1047150482.db2.gz SSXYNVDBGUMAAE-HKUYNNGSSA-N 2 1 320.546 4.125 20 0 DIADMP CC[C@@H]([NH2+]CCCn1cc[nH+]c1C)c1cccc2ccccc21 ZINC000682131960 1047173520 /nfs/dbraw/zinc/17/35/20/1047173520.db2.gz OADMBPDTVWYLBJ-HXUWFJFHSA-N 2 1 307.441 4.476 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc2ccccc21 ZINC000682130202 1047174498 /nfs/dbraw/zinc/17/44/98/1047174498.db2.gz BXUPXIGWDOTACR-IIBYNOLFSA-N 2 1 308.469 4.365 20 0 DIADMP CC[C@H]([NH2+]CCCn1cc[nH+]c1C)c1cccc2ccccc21 ZINC000682131959 1047174536 /nfs/dbraw/zinc/17/45/36/1047174536.db2.gz OADMBPDTVWYLBJ-FQEVSTJZSA-N 2 1 307.441 4.476 20 0 DIADMP C[NH2+]Cc1ccccc1C[NH2+]Cc1csc(Cl)c1Cl ZINC000650720137 1047277401 /nfs/dbraw/zinc/27/74/01/1047277401.db2.gz GDBICBLKPJBJPN-UHFFFAOYSA-N 2 1 315.269 4.064 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390749247 1047299935 /nfs/dbraw/zinc/29/99/35/1047299935.db2.gz RMEMZJFWHYDYPY-QUCCMNQESA-N 2 1 300.490 4.067 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH2+][C@H]3CC4CCC3CC4)C2)cc1 ZINC000394353082 1047310662 /nfs/dbraw/zinc/31/06/62/1047310662.db2.gz IGAXIVSVYZTNEM-YXIVMFJDSA-N 2 1 312.501 4.067 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H]([NH2+]C3CC4(CCC4)C3)CC23CC3)cc1 ZINC000652042269 1047339738 /nfs/dbraw/zinc/33/97/38/1047339738.db2.gz VAJLTOIXDZMOPW-SFHVURJKSA-N 2 1 310.485 4.106 20 0 DIADMP c1ccc(C[N@H+]2CC[C@H]([NH2+]C3CC4(CCC4)C3)CC23CC3)cc1 ZINC000652042269 1047339745 /nfs/dbraw/zinc/33/97/45/1047339745.db2.gz VAJLTOIXDZMOPW-SFHVURJKSA-N 2 1 310.485 4.106 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](CC(C)C)c1ccc(F)cc1 ZINC000652141263 1047344299 /nfs/dbraw/zinc/34/42/99/1047344299.db2.gz KKIOVNRKXVQPQJ-GOSISDBHSA-N 2 1 303.425 4.098 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H](c2cccnc2)C2CCCCC2)C1 ZINC000652208760 1047345545 /nfs/dbraw/zinc/34/55/45/1047345545.db2.gz OHCBVOISXFUNIN-XLIONFOSSA-N 2 1 315.505 4.025 20 0 DIADMP C[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1cc(F)c(Cl)cc1Cl ZINC000044532760 1047345468 /nfs/dbraw/zinc/34/54/68/1047345468.db2.gz GRKFDIBUFBSHLL-GHMZBOCLSA-N 2 1 319.251 4.125 20 0 DIADMP CC[C@H](CSc1ccccc1)[NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000623470840 1047422243 /nfs/dbraw/zinc/42/22/43/1047422243.db2.gz DYMPHOBUQFFAFV-CVEARBPZSA-N 2 1 306.519 4.020 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2ccccc2C(F)(F)F)CC1 ZINC001168323817 1047448227 /nfs/dbraw/zinc/44/82/27/1047448227.db2.gz DAVSWJVTOYYWCS-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP C[NH+](C)C1CCC([N@@H+](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001168327361 1047455996 /nfs/dbraw/zinc/45/59/96/1047455996.db2.gz KTHHQKFTRZIVNX-UHFFFAOYSA-N 2 1 314.395 4.010 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC001168327629 1047457210 /nfs/dbraw/zinc/45/72/10/1047457210.db2.gz PXFSHDIPCALRIN-HDYDNRTBSA-N 2 1 300.490 4.129 20 0 DIADMP CC[N@@H+](Cc1c(F)cccc1Cl)C1CCC([NH+](C)C)CC1 ZINC001168328291 1047459202 /nfs/dbraw/zinc/45/92/02/1047459202.db2.gz DHUCBFAGEWXSCU-UHFFFAOYSA-N 2 1 312.860 4.174 20 0 DIADMP C[NH+](C)C1CCC([N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001168329237 1047463920 /nfs/dbraw/zinc/46/39/20/1047463920.db2.gz RCHRDBXNQOOJSI-ABHNRTSZSA-N 2 1 306.881 4.350 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc(Cl)cc(Cl)c1 ZINC000119721862 1047466429 /nfs/dbraw/zinc/46/64/29/1047466429.db2.gz FSZQBEMTOQAWAL-NSHDSACASA-N 2 1 313.272 4.271 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)C(c1ccccc1)c1ccccc1 ZINC000121224451 1047514438 /nfs/dbraw/zinc/51/44/38/1047514438.db2.gz VTCVFZRTGNJERZ-RBUKOAKNSA-N 2 1 322.496 4.138 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1oc2ccccc2c1C ZINC000121438674 1047519825 /nfs/dbraw/zinc/51/98/25/1047519825.db2.gz CCVMLQYBEAHQEL-DZGCQCFKSA-N 2 1 311.429 4.233 20 0 DIADMP C[C@@H](C[N@@H+](C)C1CCC([NH3+])CC1)c1ccc(C(F)(F)F)cc1 ZINC000843054884 1047526361 /nfs/dbraw/zinc/52/63/61/1047526361.db2.gz MEXPUKBOJMGCOM-JQRITLKVSA-N 2 1 314.395 4.011 20 0 DIADMP [NH3+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2CCCc1cccc2ccccc21 ZINC000843360777 1047543942 /nfs/dbraw/zinc/54/39/42/1047543942.db2.gz IZURBPSQXVLLHC-IHWFROFDSA-N 2 1 308.469 4.117 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCCC[C@H](C[NH3+])C3)cc2)c1 ZINC001206632029 1047568156 /nfs/dbraw/zinc/56/81/56/1047568156.db2.gz DWBLXHQCPRFOHG-LJQANCHMSA-N 2 1 308.469 4.223 20 0 DIADMP C[C@@H](c1cccnc1)[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000476976274 1047587298 /nfs/dbraw/zinc/58/72/98/1047587298.db2.gz WANXZWBVWHCHKX-MSOLQXFVSA-N 2 1 315.505 4.119 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCCC[C@H](C[NH3+])C1 ZINC001206639913 1047593871 /nfs/dbraw/zinc/59/38/71/1047593871.db2.gz GILQNQURKOMEIR-GOSISDBHSA-N 2 1 324.468 4.348 20 0 DIADMP COc1ccccc1[C@@H](C)[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000315077282 1047596407 /nfs/dbraw/zinc/59/64/07/1047596407.db2.gz JRXWHZYPGHJWIW-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP COc1ccccc1[C@@H](C)[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000315077282 1047596413 /nfs/dbraw/zinc/59/64/13/1047596413.db2.gz JRXWHZYPGHJWIW-MRXNPFEDSA-N 2 1 304.478 4.000 20 0 DIADMP CC[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)C1CC1 ZINC000537940631 1047644770 /nfs/dbraw/zinc/64/47/70/1047644770.db2.gz RAAIDAVFKVOBMW-POAQFYNOSA-N 2 1 300.490 4.065 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000537983235 1047650092 /nfs/dbraw/zinc/65/00/92/1047650092.db2.gz DCDXEAZDYTYYOF-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccc(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000537983235 1047650093 /nfs/dbraw/zinc/65/00/93/1047650093.db2.gz DCDXEAZDYTYYOF-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000538101079 1047657398 /nfs/dbraw/zinc/65/73/98/1047657398.db2.gz OPANEAWIXUSSJK-KDOFPFPSSA-N 2 1 306.881 4.113 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC000538101078 1047657516 /nfs/dbraw/zinc/65/75/16/1047657516.db2.gz OPANEAWIXUSSJK-KBXCAEBGSA-N 2 1 306.881 4.113 20 0 DIADMP Fc1ccc(C[N@@H+](CCCn2ccnc2)C2CCCCC2)cc1 ZINC000538273639 1047666295 /nfs/dbraw/zinc/66/62/95/1047666295.db2.gz SYUSHOPZIPLITQ-UHFFFAOYSA-N 2 1 315.436 4.247 20 0 DIADMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc2c(ccc3ccccc23)o1 ZINC000538406022 1047673170 /nfs/dbraw/zinc/67/31/70/1047673170.db2.gz MBLXPLCNYDFJHF-OAHLLOKOSA-N 2 1 320.436 4.499 20 0 DIADMP C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3ccccc3F)o2)CC[N@H+]1C ZINC000538720078 1047699949 /nfs/dbraw/zinc/69/99/49/1047699949.db2.gz FEJSJXRGJISVDD-CABCVRRESA-N 2 1 316.420 4.000 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720078 1047699953 /nfs/dbraw/zinc/69/99/53/1047699953.db2.gz FEJSJXRGJISVDD-CABCVRRESA-N 2 1 316.420 4.000 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3F)o2)CCN1C ZINC000538720078 1047699957 /nfs/dbraw/zinc/69/99/57/1047699957.db2.gz FEJSJXRGJISVDD-CABCVRRESA-N 2 1 316.420 4.000 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1cc(C)ccc1OC ZINC000538985569 1047722670 /nfs/dbraw/zinc/72/26/70/1047722670.db2.gz NLSGXYSFRAGNNW-MJGOQNOKSA-N 2 1 318.505 4.165 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccccn1 ZINC000539041662 1047726383 /nfs/dbraw/zinc/72/63/83/1047726383.db2.gz NXXMBUANDCRWDJ-CMKODMSKSA-N 2 1 323.484 4.033 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000539062560 1047730280 /nfs/dbraw/zinc/73/02/80/1047730280.db2.gz ZEFOGVLXBPKANR-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP CCCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000539062560 1047730287 /nfs/dbraw/zinc/73/02/87/1047730287.db2.gz ZEFOGVLXBPKANR-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C)CC[C@@H]([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)C1 ZINC000539067458 1047733864 /nfs/dbraw/zinc/73/38/64/1047733864.db2.gz UZURLELNTPXRSJ-LJQANCHMSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@H+]1C)c1ccc(-c2ccncc2)cc1 ZINC000539339020 1047748319 /nfs/dbraw/zinc/74/83/19/1047748319.db2.gz APDOVYKCUOQGOL-UTKZUKDTSA-N 2 1 323.484 4.274 20 0 DIADMP CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000643521341 1047749043 /nfs/dbraw/zinc/74/90/43/1047749043.db2.gz ADWPXAYODWZPTC-WFASDCNBSA-N 2 1 301.261 4.176 20 0 DIADMP Fc1ccccc1[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CCC1 ZINC001168360484 1047763143 /nfs/dbraw/zinc/76/31/43/1047763143.db2.gz QXYZJXFASIFRQI-FQEVSTJZSA-N 2 1 316.464 4.131 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000552923261 1047806670 /nfs/dbraw/zinc/80/66/70/1047806670.db2.gz KYFQSMNRVFURJV-NJAFHUGGSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000552923261 1047806677 /nfs/dbraw/zinc/80/66/77/1047806677.db2.gz KYFQSMNRVFURJV-NJAFHUGGSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000552923260 1047807306 /nfs/dbraw/zinc/80/73/06/1047807306.db2.gz KYFQSMNRVFURJV-KBAYOESNSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000552923260 1047807308 /nfs/dbraw/zinc/80/73/08/1047807308.db2.gz KYFQSMNRVFURJV-KBAYOESNSA-N 2 1 322.443 4.065 20 0 DIADMP c1ccc(-c2cc(Nc3ccc4c(c3)CC[NH2+]C4)cc[nH+]2)cc1 ZINC001159198054 1047819853 /nfs/dbraw/zinc/81/98/53/1047819853.db2.gz MRNRSEIIKISYMC-UHFFFAOYSA-N 2 1 301.393 4.138 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1cc(F)ccc1F)C(C)C ZINC000479080418 1047836817 /nfs/dbraw/zinc/83/68/17/1047836817.db2.gz RORLXAJANOXPCN-SCLBCKFNSA-N 2 1 321.415 4.093 20 0 DIADMP Cc1scc(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)c1C ZINC001183268164 1047914026 /nfs/dbraw/zinc/91/40/26/1047914026.db2.gz GFBSSHJLSSMZOO-AUUYWEPGSA-N 2 1 320.546 4.498 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000479510558 1047915367 /nfs/dbraw/zinc/91/53/67/1047915367.db2.gz JJNXZTZUNKDHJW-ALIKPJSESA-N 2 1 316.464 4.056 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479510558 1047915378 /nfs/dbraw/zinc/91/53/78/1047915378.db2.gz JJNXZTZUNKDHJW-ALIKPJSESA-N 2 1 316.464 4.056 20 0 DIADMP Clc1cccc2c1CCC[C@@H]2[NH2+]C1CC(N2CCCCC2)C1 ZINC000479524262 1047915473 /nfs/dbraw/zinc/91/54/73/1047915473.db2.gz HTIKHOJTJVLHIH-ZOJXTTQQSA-N 2 1 318.892 4.324 20 0 DIADMP Clc1cccc2c1CCC[C@@H]2[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479524262 1047915484 /nfs/dbraw/zinc/91/54/84/1047915484.db2.gz HTIKHOJTJVLHIH-ZOJXTTQQSA-N 2 1 318.892 4.324 20 0 DIADMP CCCc1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000479522924 1047916171 /nfs/dbraw/zinc/91/61/71/1047916171.db2.gz FBEIIEXNPPSSKR-DZIBYMRMSA-N 2 1 300.490 4.307 20 0 DIADMP Clc1ccc([C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)C2CC2)cc1 ZINC000479536477 1047921100 /nfs/dbraw/zinc/92/11/00/1047921100.db2.gz LTJOUEGKUSELLT-CTWPCTMYSA-N 2 1 318.892 4.398 20 0 DIADMP CC(C)[C@H]1C[C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2ccccc21 ZINC000479538104 1047921855 /nfs/dbraw/zinc/92/18/55/1047921855.db2.gz DLFPNOJOIDERMT-XRUXWCASSA-N 2 1 312.501 4.478 20 0 DIADMP Cc1cc([NH+]2CCCCC2)ccc1Nc1ccc2c(c1)C[NH2+]C2 ZINC001159818707 1047930486 /nfs/dbraw/zinc/93/04/86/1047930486.db2.gz VBLYWOWGHNXGRH-UHFFFAOYSA-N 2 1 307.441 4.332 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)cc1 ZINC001203315313 1047937078 /nfs/dbraw/zinc/93/70/78/1047937078.db2.gz YSPVJRJNUYTXSI-QFIPXVFZSA-N 2 1 320.480 4.175 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)cc1 ZINC001203315313 1047937086 /nfs/dbraw/zinc/93/70/86/1047937086.db2.gz YSPVJRJNUYTXSI-QFIPXVFZSA-N 2 1 320.480 4.175 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)cc1 ZINC001203315313 1047937094 /nfs/dbraw/zinc/93/70/94/1047937094.db2.gz YSPVJRJNUYTXSI-QFIPXVFZSA-N 2 1 320.480 4.175 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](C)CCCC[NH+]2CCCCC2)c1 ZINC001183510933 1047940845 /nfs/dbraw/zinc/94/08/45/1047940845.db2.gz INXBJHVRDPFCNI-UHFFFAOYSA-N 2 1 308.897 4.346 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1)[NH+](C)C ZINC001203269688 1047976953 /nfs/dbraw/zinc/97/69/53/1047976953.db2.gz BHJBBXKJOCIXQA-HNNXBMFYSA-N 2 1 316.420 4.048 20 0 DIADMP C[N@@H+](CCCF)C[C@]1(C(C)(C)C)CC[NH+](Cc2ccccc2)C1 ZINC001183896777 1047978010 /nfs/dbraw/zinc/97/80/10/1047978010.db2.gz IUKCUYVIRBPNSC-HXUWFJFHSA-N 2 1 320.496 4.216 20 0 DIADMP C[NH+](CCCF)C[C@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001183896777 1047978017 /nfs/dbraw/zinc/97/80/17/1047978017.db2.gz IUKCUYVIRBPNSC-HXUWFJFHSA-N 2 1 320.496 4.216 20 0 DIADMP C[NH+](CCCF)C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001183896777 1047978029 /nfs/dbraw/zinc/97/80/29/1047978029.db2.gz IUKCUYVIRBPNSC-HXUWFJFHSA-N 2 1 320.496 4.216 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCC[N@@H+]1CCCC[C@H]1C ZINC000479908501 1048002302 /nfs/dbraw/zinc/00/23/02/1048002302.db2.gz AKESXAAWLDERPH-HUUCEWRRSA-N 2 1 323.550 4.490 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC000479908501 1048002316 /nfs/dbraw/zinc/00/23/16/1048002316.db2.gz AKESXAAWLDERPH-HUUCEWRRSA-N 2 1 323.550 4.490 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000554089726 1048008005 /nfs/dbraw/zinc/00/80/05/1048008005.db2.gz YQMMQUJMXXZGLM-UFYCRDLUSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000554089726 1048008017 /nfs/dbraw/zinc/00/80/17/1048008017.db2.gz YQMMQUJMXXZGLM-UFYCRDLUSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)C[C@H](c2ccccc2)C(C)C)CC1 ZINC001204714507 1048014263 /nfs/dbraw/zinc/01/42/63/1048014263.db2.gz SHZNLCHIXPVPMZ-FQEVSTJZSA-N 2 1 302.506 4.232 20 0 DIADMP CCOc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)c(C)c1 ZINC001198917449 1048015926 /nfs/dbraw/zinc/01/59/26/1048015926.db2.gz AUHSIZCRRGPSDM-UHFFFAOYSA-N 2 1 318.505 4.138 20 0 DIADMP CCCc1cccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001198959105 1048019907 /nfs/dbraw/zinc/01/99/07/1048019907.db2.gz ISPAYMHFLFPQDL-UHFFFAOYSA-N 2 1 322.496 4.393 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)cc1 ZINC001184292408 1048025842 /nfs/dbraw/zinc/02/58/42/1048025842.db2.gz YOVISWCIIDSVPK-ACRUOGEOSA-N 2 1 314.517 4.015 20 0 DIADMP c1ccc(C[NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001203319505 1048046021 /nfs/dbraw/zinc/04/60/21/1048046021.db2.gz ZGFIUOLGRHBHMY-SZPZYZBQSA-N 2 1 320.480 4.031 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001203319505 1048046033 /nfs/dbraw/zinc/04/60/33/1048046033.db2.gz ZGFIUOLGRHBHMY-SZPZYZBQSA-N 2 1 320.480 4.031 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001203319505 1048046044 /nfs/dbraw/zinc/04/60/44/1048046044.db2.gz ZGFIUOLGRHBHMY-SZPZYZBQSA-N 2 1 320.480 4.031 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000480169172 1048076626 /nfs/dbraw/zinc/07/66/26/1048076626.db2.gz OOLNNSTVCIXYGL-HNNXBMFYSA-N 2 1 323.550 4.348 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000480189754 1048089526 /nfs/dbraw/zinc/08/95/26/1048089526.db2.gz COPZBGUSJKPXMG-QGZVFWFLSA-N 2 1 311.473 4.130 20 0 DIADMP CC[N@H+](Cc1sccc1Cl)Cc1ccc(C[NH+](C)C)cc1 ZINC001175063503 1048090744 /nfs/dbraw/zinc/09/07/44/1048090744.db2.gz ZUMZHUIGCQNNHU-UHFFFAOYSA-N 2 1 322.905 4.485 20 0 DIADMP CC[N@@H+](Cc1sccc1Cl)Cc1ccc(C[NH+](C)C)cc1 ZINC001175063503 1048090757 /nfs/dbraw/zinc/09/07/57/1048090757.db2.gz ZUMZHUIGCQNNHU-UHFFFAOYSA-N 2 1 322.905 4.485 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc3oc4ccccc4c3c2)C1 ZINC001199743654 1048095139 /nfs/dbraw/zinc/09/51/39/1048095139.db2.gz ZXKZTKXXJMABHX-KRWDZBQOSA-N 2 1 322.452 4.408 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC001199758763 1048097786 /nfs/dbraw/zinc/09/77/86/1048097786.db2.gz DAKWLGXFDJFPGU-HNJRGHQBSA-N 2 1 314.517 4.136 20 0 DIADMP Cc1cccc2c1cc[nH+]c2NCC1CC[NH+](CC2CCC2)CC1 ZINC001161233472 1048115613 /nfs/dbraw/zinc/11/56/13/1048115613.db2.gz QVPSDFURFWLPRQ-UHFFFAOYSA-N 2 1 323.484 4.467 20 0 DIADMP C[C@H](NCCC[N@@H+](C)C1CCCCC1)c1ccc(Cl)cn1 ZINC000480324592 1048122891 /nfs/dbraw/zinc/12/28/91/1048122891.db2.gz GHNPBMXVHQKBBA-AWEZNQCLSA-N 2 1 309.885 4.040 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC001200942371 1048166545 /nfs/dbraw/zinc/16/65/45/1048166545.db2.gz PCQAHXLSJBRGKD-IBGZPJMESA-N 2 1 312.501 4.354 20 0 DIADMP CCC1(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)CCC1 ZINC001200942371 1048166554 /nfs/dbraw/zinc/16/65/54/1048166554.db2.gz PCQAHXLSJBRGKD-IBGZPJMESA-N 2 1 312.501 4.354 20 0 DIADMP CC(C)C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000480606096 1048193348 /nfs/dbraw/zinc/19/33/48/1048193348.db2.gz DKRMPTUXWQOJJD-ICSRJNTNSA-N 2 1 317.521 4.413 20 0 DIADMP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1F ZINC000480620888 1048197429 /nfs/dbraw/zinc/19/74/29/1048197429.db2.gz BZSXUKDSPVDNPF-CVEARBPZSA-N 2 1 322.468 4.140 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc2c(c1)COC2 ZINC000480636944 1048203746 /nfs/dbraw/zinc/20/37/46/1048203746.db2.gz GGHDIEOXOKMINJ-IRXDYDNUSA-N 2 1 316.489 4.022 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)cc(Cl)c1 ZINC000480741945 1048234836 /nfs/dbraw/zinc/23/48/36/1048234836.db2.gz VBRNJYVTCYBRSQ-UVBJJODRSA-N 2 1 313.272 4.271 20 0 DIADMP CC[C@H](C[NH2+][C@H](C)c1cccc(-c2ccncc2)c1)[NH+]1CCCC1 ZINC000480803274 1048249038 /nfs/dbraw/zinc/24/90/38/1048249038.db2.gz IOLQWGKNVWMHCY-DYESRHJHSA-N 2 1 323.484 4.274 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CC[NH+](CC2CCCCC2)CC1 ZINC001201397624 1048249638 /nfs/dbraw/zinc/24/96/38/1048249638.db2.gz OJHLDPYMAFBFEQ-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP Clc1ccc2c(NC3CC([NH+]4CCCCC4)C3)cc[nH+]c2c1 ZINC000480844057 1048255092 /nfs/dbraw/zinc/25/50/92/1048255092.db2.gz WEHAHLJQJYFDLM-UHFFFAOYSA-N 2 1 315.848 4.317 20 0 DIADMP CC1CC[NH+](CC[C@H]2CCC[N@H+]2CCCc2ccccc2)CC1 ZINC001175350932 1048272473 /nfs/dbraw/zinc/27/24/73/1048272473.db2.gz KANSTRJOSLQQSW-OAQYLSRUSA-N 2 1 314.517 4.206 20 0 DIADMP CC[C@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201501760 1048289326 /nfs/dbraw/zinc/28/93/26/1048289326.db2.gz BCKOPSCUQNGEII-INIZCTEOSA-N 2 1 306.519 4.082 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCC(C)C)cc2)C1 ZINC000481029414 1048294680 /nfs/dbraw/zinc/29/46/80/1048294680.db2.gz YHEGRWSXJQKDGV-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP CC1(C)CCC[N@@H+]1CC[NH2+]C1CCC(c2ccccc2)CC1 ZINC001206247953 1048295559 /nfs/dbraw/zinc/29/55/59/1048295559.db2.gz OTDZCHNNSYMDET-UHFFFAOYSA-N 2 1 300.490 4.177 20 0 DIADMP CC1(C)CCC[N@H+]1CC[NH2+]C1CCC(c2ccccc2)CC1 ZINC001206247953 1048295571 /nfs/dbraw/zinc/29/55/71/1048295571.db2.gz OTDZCHNNSYMDET-UHFFFAOYSA-N 2 1 300.490 4.177 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026047 1048295526 /nfs/dbraw/zinc/29/55/26/1048295526.db2.gz RKJLQFNFZSXBHE-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)C1 ZINC000481026047 1048295542 /nfs/dbraw/zinc/29/55/42/1048295542.db2.gz RKJLQFNFZSXBHE-CHWSQXEVSA-N 2 1 315.288 4.376 20 0 DIADMP CN(C)c1cc[nH+]cc1C[NH2+]C[C@H]1CCC(C)(C)c2ccccc21 ZINC001201481558 1048299843 /nfs/dbraw/zinc/29/98/43/1048299843.db2.gz RMMLURMUASOCBF-MRXNPFEDSA-N 2 1 323.484 4.092 20 0 DIADMP C[C@@H]([NH2+]CCCCc1ccccc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000481051752 1048303397 /nfs/dbraw/zinc/30/33/97/1048303397.db2.gz CLZQACVAJDMNFH-QUCCMNQESA-N 2 1 314.517 4.252 20 0 DIADMP CCC(CC)C[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001201528390 1048311110 /nfs/dbraw/zinc/31/11/10/1048311110.db2.gz PLWWSJFKYVGKPO-UHFFFAOYSA-N 2 1 304.478 4.004 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(C)C)cc2)C1 ZINC001201557892 1048315091 /nfs/dbraw/zinc/31/50/91/1048315091.db2.gz NMWPZDCNSNZOAE-IBGZPJMESA-N 2 1 302.506 4.268 20 0 DIADMP CC(C)(C[N@@H+]1CCCC[C@H]([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001205923076 1048317035 /nfs/dbraw/zinc/31/70/35/1048317035.db2.gz HZZRYOWFPQBLBO-AWEZNQCLSA-N 2 1 312.910 4.024 20 0 DIADMP CC(C)(C[N@H+]1CCCC[C@H]([NH3+])C1)Sc1ccc(Cl)cc1 ZINC001205923076 1048317050 /nfs/dbraw/zinc/31/70/50/1048317050.db2.gz HZZRYOWFPQBLBO-AWEZNQCLSA-N 2 1 312.910 4.024 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000481307996 1048358919 /nfs/dbraw/zinc/35/89/19/1048358919.db2.gz ACMTVWYITUWBOK-KBXCAEBGSA-N 2 1 306.881 4.039 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H]2CCCCc3ccc(Cl)cc32)C1 ZINC000481308003 1048359706 /nfs/dbraw/zinc/35/97/06/1048359706.db2.gz ACMTVWYITUWBOK-KSSFIOAISA-N 2 1 306.881 4.039 20 0 DIADMP CCCCC[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001201744368 1048362256 /nfs/dbraw/zinc/36/22/56/1048362256.db2.gz JRHXAEFPIVZVKC-VQTJNVASSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001201744368 1048362272 /nfs/dbraw/zinc/36/22/72/1048362272.db2.gz JRHXAEFPIVZVKC-VQTJNVASSA-N 2 1 300.490 4.021 20 0 DIADMP CCCCC[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C1 ZINC001201744368 1048362285 /nfs/dbraw/zinc/36/22/85/1048362285.db2.gz JRHXAEFPIVZVKC-VQTJNVASSA-N 2 1 300.490 4.021 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCCC(C)C)cc2)C1 ZINC000481337691 1048372301 /nfs/dbraw/zinc/37/23/01/1048372301.db2.gz NLRPILRSEOIJRW-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP C[N@@H+](Cc1ccccc1NC1=CCC[NH+](C)C1)C1CCCCC1 ZINC001175579609 1048375788 /nfs/dbraw/zinc/37/57/88/1048375788.db2.gz YWXGDNUBMAIWIK-UHFFFAOYSA-N 2 1 313.489 4.082 20 0 DIADMP C[NH+](Cc1ccccc1NC1=CCC[N@H+](C)C1)C1CCCCC1 ZINC001175579609 1048375802 /nfs/dbraw/zinc/37/58/02/1048375802.db2.gz YWXGDNUBMAIWIK-UHFFFAOYSA-N 2 1 313.489 4.082 20 0 DIADMP C[NH+](Cc1ccccc1NC1=CCC[N@@H+](C)C1)C1CCCCC1 ZINC001175579609 1048375817 /nfs/dbraw/zinc/37/58/17/1048375817.db2.gz YWXGDNUBMAIWIK-UHFFFAOYSA-N 2 1 313.489 4.082 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2-c2ccc([C@H]3CC[N@@H+](C)C3)cc2)c1 ZINC001162913287 1048386100 /nfs/dbraw/zinc/38/61/00/1048386100.db2.gz DZCUBKGJAHZOEQ-BEFAXECRSA-N 2 1 319.452 4.069 20 0 DIADMP CC(C)(C)CC[NH+]1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1 ZINC001202078489 1048443064 /nfs/dbraw/zinc/44/30/64/1048443064.db2.gz RUSXDFHFMQLYAE-UHFFFAOYSA-N 2 1 304.478 4.004 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](CC3CCCC3)C[C@@H]21 ZINC001202167259 1048468489 /nfs/dbraw/zinc/46/84/89/1048468489.db2.gz NCVRHCKKLCSMRV-ACRUOGEOSA-N 2 1 312.501 4.287 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](CC3CCCC3)C[C@@H]21 ZINC001202167259 1048468496 /nfs/dbraw/zinc/46/84/96/1048468496.db2.gz NCVRHCKKLCSMRV-ACRUOGEOSA-N 2 1 312.501 4.287 20 0 DIADMP Clc1cccc(C2=CC[N@H+](CCC[NH+]3CCCCC3)CC2)c1 ZINC000481799508 1048490163 /nfs/dbraw/zinc/49/01/63/1048490163.db2.gz WVAVGULOUCFOCJ-UHFFFAOYSA-N 2 1 318.892 4.305 20 0 DIADMP Clc1cccc(C2=CC[N@@H+](CCC[NH+]3CCCCC3)CC2)c1 ZINC000481799508 1048490169 /nfs/dbraw/zinc/49/01/69/1048490169.db2.gz WVAVGULOUCFOCJ-UHFFFAOYSA-N 2 1 318.892 4.305 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C ZINC000481988731 1048540055 /nfs/dbraw/zinc/54/00/55/1048540055.db2.gz GIFFFFYSJKGLTO-AEFFLSMTSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C ZINC000481988731 1048540067 /nfs/dbraw/zinc/54/00/67/1048540067.db2.gz GIFFFFYSJKGLTO-AEFFLSMTSA-N 2 1 313.489 4.089 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C ZINC000481988731 1048540079 /nfs/dbraw/zinc/54/00/79/1048540079.db2.gz GIFFFFYSJKGLTO-AEFFLSMTSA-N 2 1 313.489 4.089 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@@H](CC)C2CCCCC2)[C@H](C)C1 ZINC000482017701 1048549207 /nfs/dbraw/zinc/54/92/07/1048549207.db2.gz PFWMZBIXFZWRBC-HOJAQTOUSA-N 2 1 324.553 4.072 20 0 DIADMP C[NH+](C)Cc1cccc(CNc2[nH+]ccc3cc(F)ccc32)c1 ZINC001163994259 1048568062 /nfs/dbraw/zinc/56/80/62/1048568062.db2.gz XRDHFJZLGUIKHF-UHFFFAOYSA-N 2 1 309.388 4.048 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc(C)c1F ZINC000482326097 1048587182 /nfs/dbraw/zinc/58/71/82/1048587182.db2.gz YEFKGTXTZIAJSR-IAGOWNOFSA-N 2 1 306.469 4.214 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000482339861 1048589861 /nfs/dbraw/zinc/58/98/61/1048589861.db2.gz XQIMPKMJACCLQF-KDOFPFPSSA-N 2 1 306.881 4.037 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC3)c1 ZINC000482342116 1048590708 /nfs/dbraw/zinc/59/07/08/1048590708.db2.gz CVDNLZSPLOJKCK-QGZVFWFLSA-N 2 1 322.496 4.478 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000482339863 1048591192 /nfs/dbraw/zinc/59/11/92/1048591192.db2.gz XQIMPKMJACCLQF-RDTXWAMCSA-N 2 1 306.881 4.037 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3c(s2)CCC3)C1 ZINC000482361454 1048592740 /nfs/dbraw/zinc/59/27/40/1048592740.db2.gz UERMLNNJTMUWLX-CABCVRRESA-N 2 1 306.519 4.008 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC001176282420 1048617284 /nfs/dbraw/zinc/61/72/84/1048617284.db2.gz XLZRGNUEWIFZKF-LSDHHAIUSA-N 2 1 315.848 4.007 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CCN(c2cc[nH+]cc2)C[C@@H]1C ZINC001176282420 1048617286 /nfs/dbraw/zinc/61/72/86/1048617286.db2.gz XLZRGNUEWIFZKF-LSDHHAIUSA-N 2 1 315.848 4.007 20 0 DIADMP Cc1cc[nH+]c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1C ZINC001164487831 1048633581 /nfs/dbraw/zinc/63/35/81/1048633581.db2.gz ZALPLPURTMGPJK-XUVXKRRUSA-N 2 1 321.468 4.021 20 0 DIADMP Cc1cccc2cc[nH+]c(N3CCC(C4CC[NH+](C)CC4)CC3)c12 ZINC001165067010 1048657149 /nfs/dbraw/zinc/65/71/49/1048657149.db2.gz LOMCPQMYWQMJNZ-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP Cc1ccc2cc[nH+]c(N3CCC(C4CC[NH+](C)CC4)CC3)c2c1 ZINC001165065779 1048657467 /nfs/dbraw/zinc/65/74/67/1048657467.db2.gz NAKPQAZFUKNTPN-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP COc1ccc2oc(C[NH2+]CCC[NH+](C(C)C)C(C)C)cc2c1 ZINC000482812729 1048682766 /nfs/dbraw/zinc/68/27/66/1048682766.db2.gz NQSZJKUJLBOYIJ-UHFFFAOYSA-N 2 1 318.461 4.040 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+](Cc1ccc2ccccc2c1)C1CC1 ZINC001190510799 1048745702 /nfs/dbraw/zinc/74/57/02/1048745702.db2.gz QAWTVSXOCDYEER-FQEVSTJZSA-N 2 1 308.469 4.289 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001190510799 1048745717 /nfs/dbraw/zinc/74/57/17/1048745717.db2.gz QAWTVSXOCDYEER-FQEVSTJZSA-N 2 1 308.469 4.289 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC001190510799 1048745729 /nfs/dbraw/zinc/74/57/29/1048745729.db2.gz QAWTVSXOCDYEER-FQEVSTJZSA-N 2 1 308.469 4.289 20 0 DIADMP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc2ccccc2n1 ZINC000483149796 1048748121 /nfs/dbraw/zinc/74/81/21/1048748121.db2.gz BNCOXWMRXMCHJA-KXBFYZLASA-N 2 1 313.489 4.252 20 0 DIADMP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1cc(F)c(F)c(F)c1 ZINC000483205033 1048755553 /nfs/dbraw/zinc/75/55/53/1048755553.db2.gz UDYRKXMIDFUSEF-ABAIWWIYSA-N 2 1 316.411 4.121 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1ccc(C(F)(F)F)cc1 ZINC001190597778 1048763028 /nfs/dbraw/zinc/76/30/28/1048763028.db2.gz VCDLURUIIIQUHK-UHFFFAOYSA-N 2 1 316.411 4.259 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1ccc(C(F)(F)F)cc1 ZINC001190597778 1048763038 /nfs/dbraw/zinc/76/30/38/1048763038.db2.gz VCDLURUIIIQUHK-UHFFFAOYSA-N 2 1 316.411 4.259 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CCC(C)(C)C3CC3)C2)CC1 ZINC001190650659 1048773244 /nfs/dbraw/zinc/77/32/44/1048773244.db2.gz DAEWYZUVWXVJPD-SFHVURJKSA-N 2 1 306.538 4.257 20 0 DIADMP CCC(C)(C)C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716653648 1048786291 /nfs/dbraw/zinc/78/62/91/1048786291.db2.gz BFNQYAHQMAIFJD-FHWLQOOXSA-N 2 1 300.490 4.065 20 0 DIADMP CCCc1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)s1 ZINC001177071123 1048823453 /nfs/dbraw/zinc/82/34/53/1048823453.db2.gz FCTLWBSDEDZEEG-UHFFFAOYSA-N 2 1 308.535 4.445 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001191068678 1048834441 /nfs/dbraw/zinc/83/44/41/1048834441.db2.gz CONBXWQSNJUHDK-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903168227 1048836564 /nfs/dbraw/zinc/83/65/64/1048836564.db2.gz UZGIAUWMBSXDGE-ZVRJUHEZSA-N 2 1 316.514 4.217 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000483700745 1048841809 /nfs/dbraw/zinc/84/18/09/1048841809.db2.gz KYVABEKGWSCREY-SCTDSRPQSA-N 2 1 318.505 4.245 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000483700745 1048841829 /nfs/dbraw/zinc/84/18/29/1048841829.db2.gz KYVABEKGWSCREY-SCTDSRPQSA-N 2 1 318.505 4.245 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000483700742 1048843068 /nfs/dbraw/zinc/84/30/68/1048843068.db2.gz KYVABEKGWSCREY-AOIWGVFYSA-N 2 1 318.505 4.245 20 0 DIADMP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000483700742 1048843091 /nfs/dbraw/zinc/84/30/91/1048843091.db2.gz KYVABEKGWSCREY-AOIWGVFYSA-N 2 1 318.505 4.245 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCC(C)(C)C2CC2)C1 ZINC001191048758 1048846186 /nfs/dbraw/zinc/84/61/86/1048846186.db2.gz TWKJTRGLNQBCPM-ZWKOTPCHSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCC(C)(C)C2CC2)C1 ZINC001191048758 1048846202 /nfs/dbraw/zinc/84/62/02/1048846202.db2.gz TWKJTRGLNQBCPM-ZWKOTPCHSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCC(C)(C)C2CC2)C1 ZINC001191048758 1048846213 /nfs/dbraw/zinc/84/62/13/1048846213.db2.gz TWKJTRGLNQBCPM-ZWKOTPCHSA-N 2 1 306.538 4.399 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734587 1048848773 /nfs/dbraw/zinc/84/87/73/1048848773.db2.gz WAMQYIHBFHJYFO-JRPNMDOOSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000483734587 1048848775 /nfs/dbraw/zinc/84/87/75/1048848775.db2.gz WAMQYIHBFHJYFO-JRPNMDOOSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3c4ccccc4sc32)CC[N@@H+]1C ZINC000483747991 1048856126 /nfs/dbraw/zinc/85/61/26/1048856126.db2.gz QARTVXOZCCZFJT-CPUCHLNUSA-N 2 1 314.498 4.351 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3c4ccccc4sc32)CC[N@H+]1C ZINC000483747991 1048856149 /nfs/dbraw/zinc/85/61/49/1048856149.db2.gz QARTVXOZCCZFJT-CPUCHLNUSA-N 2 1 314.498 4.351 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(C[NH2+]CC3(C)CC3)cc2)C1 ZINC001177290297 1048858555 /nfs/dbraw/zinc/85/85/55/1048858555.db2.gz QLYQKZJRAPRMLX-CALCHBBNSA-N 2 1 300.490 4.054 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC001177299534 1048862107 /nfs/dbraw/zinc/86/21/07/1048862107.db2.gz UKVKKVIKGQFQDE-PMACEKPBSA-N 2 1 316.533 4.500 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]21 ZINC001203309154 1048865994 /nfs/dbraw/zinc/86/59/94/1048865994.db2.gz MSBACCBVCUXNPR-FKBYEOEOSA-N 2 1 320.480 4.297 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001203309154 1048866006 /nfs/dbraw/zinc/86/60/06/1048866006.db2.gz MSBACCBVCUXNPR-FKBYEOEOSA-N 2 1 320.480 4.297 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001203309154 1048866025 /nfs/dbraw/zinc/86/60/25/1048866025.db2.gz MSBACCBVCUXNPR-FKBYEOEOSA-N 2 1 320.480 4.297 20 0 DIADMP CCC(CC)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC000853240426 1048890932 /nfs/dbraw/zinc/89/09/32/1048890932.db2.gz IRJQRFSPFUTORR-YQQQUEKLSA-N 2 1 318.480 4.098 20 0 DIADMP Cc1ccc(SCC[N@@H+](C)CC[C@H]2CCCC[NH+]2C)cc1C ZINC001191255163 1048897168 /nfs/dbraw/zinc/89/71/68/1048897168.db2.gz BNTZRGSKYLMSSU-GOSISDBHSA-N 2 1 320.546 4.202 20 0 DIADMP Cc1ccc(SCC[N@H+](C)CC[C@H]2CCCC[NH+]2C)cc1C ZINC001191255163 1048897177 /nfs/dbraw/zinc/89/71/77/1048897177.db2.gz BNTZRGSKYLMSSU-GOSISDBHSA-N 2 1 320.546 4.202 20 0 DIADMP Cc1ccc(SCC[NH+](C)CC[C@H]2CCCC[N@@H+]2C)cc1C ZINC001191255163 1048897187 /nfs/dbraw/zinc/89/71/87/1048897187.db2.gz BNTZRGSKYLMSSU-GOSISDBHSA-N 2 1 320.546 4.202 20 0 DIADMP Cc1ccc(SCC[NH+](C)CC[C@H]2CCCC[N@H+]2C)cc1C ZINC001191255163 1048897196 /nfs/dbraw/zinc/89/71/96/1048897196.db2.gz BNTZRGSKYLMSSU-GOSISDBHSA-N 2 1 320.546 4.202 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cccc(-c3ccc(C)cc3)c2)C1 ZINC001177483545 1048898108 /nfs/dbraw/zinc/89/81/08/1048898108.db2.gz WSKVRUPYLQCBGW-HXUWFJFHSA-N 2 1 322.496 4.484 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H]1CC=CCC1 ZINC001177541992 1048912188 /nfs/dbraw/zinc/91/21/88/1048912188.db2.gz IGYHODGRQWPELS-GOSISDBHSA-N 2 1 300.490 4.091 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001191382392 1048929696 /nfs/dbraw/zinc/92/96/96/1048929696.db2.gz WQVJDEBPIKLVTI-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001191382392 1048929711 /nfs/dbraw/zinc/92/97/11/1048929711.db2.gz WQVJDEBPIKLVTI-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382392 1048929727 /nfs/dbraw/zinc/92/97/27/1048929727.db2.gz WQVJDEBPIKLVTI-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382392 1048929743 /nfs/dbraw/zinc/92/97/43/1048929743.db2.gz WQVJDEBPIKLVTI-YLJYHZDGSA-N 2 1 300.490 4.162 20 0 DIADMP CCC[C@H](CC)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743793 1048938362 /nfs/dbraw/zinc/93/83/62/1048938362.db2.gz OFNWUMCBYMGACR-OALUTQOASA-N 2 1 300.490 4.352 20 0 DIADMP CCC[C@H](CC)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001177743793 1048938372 /nfs/dbraw/zinc/93/83/72/1048938372.db2.gz OFNWUMCBYMGACR-OALUTQOASA-N 2 1 300.490 4.352 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C/C=C/c1c(C)cc(C)cc1C ZINC001177911232 1048961155 /nfs/dbraw/zinc/96/11/55/1048961155.db2.gz HNBWIHBOSMWFGM-BQYQJAHWSA-N 2 1 311.473 4.200 20 0 DIADMP Cc1ccccc1C[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001203713590 1048972933 /nfs/dbraw/zinc/97/29/33/1048972933.db2.gz UKLBJWHJYBVKEV-UHFFFAOYSA-N 2 1 300.490 4.224 20 0 DIADMP Cc1ccc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c(C)c1 ZINC001203731712 1048984295 /nfs/dbraw/zinc/98/42/95/1048984295.db2.gz KIGHFRQCCLXJCI-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1ccc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c(C)c1 ZINC001203731712 1048984303 /nfs/dbraw/zinc/98/43/03/1048984303.db2.gz KIGHFRQCCLXJCI-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1cc(C)c(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c(C)c1 ZINC001203745938 1048988911 /nfs/dbraw/zinc/98/89/11/1048988911.db2.gz HPZLFVYWBVYTEL-UHFFFAOYSA-N 2 1 318.480 4.010 20 0 DIADMP C[NH+](C)C1CCN(c2ccc([NH2+]CC3CCCCC3)cc2)CC1 ZINC001178350166 1049019207 /nfs/dbraw/zinc/01/92/07/1049019207.db2.gz DCOBGLKEJYYJFH-UHFFFAOYSA-N 2 1 315.505 4.209 20 0 DIADMP Cc1cccc(C[NH+]2CCC([N@@H+]3CCc4ccccc4C3)CC2)c1 ZINC001203894031 1049025914 /nfs/dbraw/zinc/02/59/14/1049025914.db2.gz CCGVOFWNIQEYDG-UHFFFAOYSA-N 2 1 320.480 4.018 20 0 DIADMP Cc1cccc(C[NH+]2CCC([N@H+]3CCc4ccccc4C3)CC2)c1 ZINC001203894031 1049025921 /nfs/dbraw/zinc/02/59/21/1049025921.db2.gz CCGVOFWNIQEYDG-UHFFFAOYSA-N 2 1 320.480 4.018 20 0 DIADMP Cc1cccc(C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001203894970 1049026397 /nfs/dbraw/zinc/02/63/97/1049026397.db2.gz OZRACAPKDPURJP-UHFFFAOYSA-N 2 1 322.496 4.339 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000195133436 1049069591 /nfs/dbraw/zinc/06/95/91/1049069591.db2.gz CYCGYWGHUMUOAG-ROUUACIJSA-N 2 1 314.498 4.311 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000195133463 1049070476 /nfs/dbraw/zinc/07/04/76/1049070476.db2.gz CYCGYWGHUMUOAG-QZTJIDSGSA-N 2 1 314.498 4.311 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1c[nH]c2ccccc12 ZINC001204048654 1049073651 /nfs/dbraw/zinc/07/36/51/1049073651.db2.gz OFILRBVZZPPMPG-ZWKOTPCHSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1c[nH]c2ccccc12 ZINC001204048654 1049073664 /nfs/dbraw/zinc/07/36/64/1049073664.db2.gz OFILRBVZZPPMPG-ZWKOTPCHSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1c[nH]c2ccccc12 ZINC001204048654 1049073673 /nfs/dbraw/zinc/07/36/73/1049073673.db2.gz OFILRBVZZPPMPG-ZWKOTPCHSA-N 2 1 311.473 4.007 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@@H]1CC[C@@H](C)SC1)c1ccccc1 ZINC001204063340 1049076641 /nfs/dbraw/zinc/07/66/41/1049076641.db2.gz DKTPNPPSCQUJNM-QRQLOZEOSA-N 2 1 320.546 4.333 20 0 DIADMP C[C@@H]1CCC[C@H](CC[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)C1 ZINC001192325646 1049078800 /nfs/dbraw/zinc/07/88/00/1049078800.db2.gz ONYDWBAYCLLBIL-SOAMZJECSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)C1 ZINC001192325646 1049078812 /nfs/dbraw/zinc/07/88/12/1049078812.db2.gz ONYDWBAYCLLBIL-SOAMZJECSA-N 2 1 304.522 4.152 20 0 DIADMP C[C@@H]1CCC[C@H](CC[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)C1 ZINC001192325646 1049078818 /nfs/dbraw/zinc/07/88/18/1049078818.db2.gz ONYDWBAYCLLBIL-SOAMZJECSA-N 2 1 304.522 4.152 20 0 DIADMP CC[N@H+](C)C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001204139704 1049093326 /nfs/dbraw/zinc/09/33/26/1049093326.db2.gz QYAUSANTCCLHMZ-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CC[N@@H+](C)C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC001204139704 1049093341 /nfs/dbraw/zinc/09/33/41/1049093341.db2.gz QYAUSANTCCLHMZ-UHFFFAOYSA-N 2 1 308.469 4.270 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162777 1049100713 /nfs/dbraw/zinc/10/07/13/1049100713.db2.gz NXTPGFGVEXRMHW-LZWOXQAQSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162777 1049100717 /nfs/dbraw/zinc/10/07/17/1049100717.db2.gz NXTPGFGVEXRMHW-LZWOXQAQSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162777 1049100720 /nfs/dbraw/zinc/10/07/20/1049100720.db2.gz NXTPGFGVEXRMHW-LZWOXQAQSA-N 2 1 324.559 4.337 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+]([C@H]2C[C@H](C)Sc3sccc32)C1 ZINC001204162777 1049100721 /nfs/dbraw/zinc/10/07/21/1049100721.db2.gz NXTPGFGVEXRMHW-LZWOXQAQSA-N 2 1 324.559 4.337 20 0 DIADMP CCc1ccc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC001204179044 1049103943 /nfs/dbraw/zinc/10/39/43/1049103943.db2.gz GWLUUGXECIDXJL-UHFFFAOYSA-N 2 1 314.517 4.478 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCC[N@@H+](C)C2)C[C@@H](c2ccccc2)C1 ZINC001178917150 1049110065 /nfs/dbraw/zinc/11/00/65/1049110065.db2.gz UXAYZDNLVHUAMV-QIJZPMMNSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)CC(C)(C)C1 ZINC001179015838 1049122689 /nfs/dbraw/zinc/12/26/89/1049122689.db2.gz ONKXPMKVEQHDSV-NBYUQASBSA-N 2 1 314.517 4.136 20 0 DIADMP C[NH+](C)CCCOc1ccc(C[N@@H+](C)CC2CCCCC2)cc1 ZINC001204270386 1049124959 /nfs/dbraw/zinc/12/49/59/1049124959.db2.gz UCHHNFPLPGXTJC-UHFFFAOYSA-N 2 1 318.505 4.029 20 0 DIADMP CCC(CC)[N@@H+](CC)Cc1ccc(OCCC[NH+](C)C)cc1 ZINC001204269576 1049125821 /nfs/dbraw/zinc/12/58/21/1049125821.db2.gz FXMJQLLFJWXFCE-UHFFFAOYSA-N 2 1 306.494 4.028 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(F)c(Cl)c2)CC1 ZINC001204286298 1049128452 /nfs/dbraw/zinc/12/84/52/1049128452.db2.gz FDKJMITZZMXJGT-UHFFFAOYSA-N 2 1 312.860 4.175 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(F)c(Cl)c2)CC1 ZINC001204286298 1049128459 /nfs/dbraw/zinc/12/84/59/1049128459.db2.gz FDKJMITZZMXJGT-UHFFFAOYSA-N 2 1 312.860 4.175 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH2+]CCC[N@H+](C)CC(C)C)c(C)c1 ZINC001179081136 1049128661 /nfs/dbraw/zinc/12/86/61/1049128661.db2.gz ASPKQQOWNYOILV-CLFYSBASSA-N 2 1 302.506 4.193 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC001179081277 1049128776 /nfs/dbraw/zinc/12/87/76/1049128776.db2.gz CVGWTKBSXDMGTD-UHFFFAOYSA-N 2 1 316.514 4.483 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c(C)[nH]c3ccccc32)CC1 ZINC001204297382 1049131719 /nfs/dbraw/zinc/13/17/19/1049131719.db2.gz IKJQASBKERAKNF-UHFFFAOYSA-N 2 1 313.489 4.173 20 0 DIADMP CCCOc1ccc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001204308874 1049138187 /nfs/dbraw/zinc/13/81/87/1049138187.db2.gz KHOGZRJYAWRBLP-UHFFFAOYSA-N 2 1 318.505 4.028 20 0 DIADMP Cc1ccc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)cc1C ZINC001204350680 1049146338 /nfs/dbraw/zinc/14/63/38/1049146338.db2.gz FFGCURPNVONIOI-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1ccc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)cc1C ZINC001204350680 1049146350 /nfs/dbraw/zinc/14/63/50/1049146350.db2.gz FFGCURPNVONIOI-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001192909250 1049146452 /nfs/dbraw/zinc/14/64/52/1049146452.db2.gz GRWKRHUIAUYEDQ-HXUWFJFHSA-N 2 1 314.448 4.470 20 0 DIADMP Cc1c(Cl)ccc(CN(C)C[C@@H]2CCC[N@@H+](C)C2)c1Cl ZINC001204431300 1049162325 /nfs/dbraw/zinc/16/23/25/1049162325.db2.gz OHBATKGZTGBRNF-CYBMUJFWSA-N 2 1 315.288 4.075 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc(F)cc2Cl)CC1 ZINC001204438228 1049162850 /nfs/dbraw/zinc/16/28/50/1049162850.db2.gz SPXHICKJOANPTJ-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001179468887 1049168612 /nfs/dbraw/zinc/16/86/12/1049168612.db2.gz SDSMMGQJGJFSBL-CMKODMSKSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001179468887 1049168620 /nfs/dbraw/zinc/16/86/20/1049168620.db2.gz SDSMMGQJGJFSBL-CMKODMSKSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001179468886 1049168854 /nfs/dbraw/zinc/16/88/54/1049168854.db2.gz SDSMMGQJGJFSBL-BJLQDIEVSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001179468886 1049168859 /nfs/dbraw/zinc/16/88/59/1049168859.db2.gz SDSMMGQJGJFSBL-BJLQDIEVSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001179468889 1049169286 /nfs/dbraw/zinc/16/92/86/1049169286.db2.gz SDSMMGQJGJFSBL-NSHGMRRFSA-N 2 1 302.506 4.455 20 0 DIADMP CCC[C@H](C)CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001179468889 1049169289 /nfs/dbraw/zinc/16/92/89/1049169289.db2.gz SDSMMGQJGJFSBL-NSHGMRRFSA-N 2 1 302.506 4.455 20 0 DIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249991 1049190720 /nfs/dbraw/zinc/19/07/20/1049190720.db2.gz QEHRSKOUKLXZTQ-RDJZCZTQSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@H]([NH2+]Cc1cc2ccccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001193249991 1049190728 /nfs/dbraw/zinc/19/07/28/1049190728.db2.gz QEHRSKOUKLXZTQ-RDJZCZTQSA-N 2 1 312.457 4.175 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@@H+]1C ZINC001204608910 1049198280 /nfs/dbraw/zinc/19/82/80/1049198280.db2.gz LIGDXASZJRXRCP-HNAYVOBHSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[N@H+]1C ZINC001204608910 1049198290 /nfs/dbraw/zinc/19/82/90/1049198290.db2.gz LIGDXASZJRXRCP-HNAYVOBHSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608910 1049198300 /nfs/dbraw/zinc/19/83/00/1049198300.db2.gz LIGDXASZJRXRCP-HNAYVOBHSA-N 2 1 312.501 4.356 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(C3CC3)c(C3CC3)c2)CC[NH+]1C ZINC001204608910 1049198308 /nfs/dbraw/zinc/19/83/08/1049198308.db2.gz LIGDXASZJRXRCP-HNAYVOBHSA-N 2 1 312.501 4.356 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001204604454 1049198740 /nfs/dbraw/zinc/19/87/40/1049198740.db2.gz PKBMYVJIWFVLSH-UHFFFAOYSA-N 2 1 308.469 4.133 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH2+]1)C(c1ccccc1)c1ccccc1 ZINC001204645984 1049211218 /nfs/dbraw/zinc/21/12/18/1049211218.db2.gz DTAMSXYIOQTUFF-FQEVSTJZSA-N 2 1 308.469 4.240 20 0 DIADMP C[C@@H](c1nccc2ccccc21)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001179877733 1049225566 /nfs/dbraw/zinc/22/55/66/1049225566.db2.gz IKZUNAYEUXISBC-ZWKOTPCHSA-N 2 1 323.484 4.104 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCC1CCCC1 ZINC001193649285 1049240902 /nfs/dbraw/zinc/24/09/02/1049240902.db2.gz NRKWXDCZRGHSHL-NQIIRXRSSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCC1CCCC1 ZINC001193649285 1049240909 /nfs/dbraw/zinc/24/09/09/1049240909.db2.gz NRKWXDCZRGHSHL-NQIIRXRSSA-N 2 1 314.517 4.457 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCC1CCCC1 ZINC001193649286 1049241461 /nfs/dbraw/zinc/24/14/61/1049241461.db2.gz NRKWXDCZRGHSHL-RXVVDRJESA-N 2 1 314.517 4.457 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCC1CCCC1 ZINC001193649286 1049241474 /nfs/dbraw/zinc/24/14/74/1049241474.db2.gz NRKWXDCZRGHSHL-RXVVDRJESA-N 2 1 314.517 4.457 20 0 DIADMP c1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000195651600 1049244784 /nfs/dbraw/zinc/24/47/84/1049244784.db2.gz PDMUWXNQHQIYHH-LAUBAEHRSA-N 2 1 312.501 4.382 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(C)(C)C)cc1 ZINC000195651613 1049245578 /nfs/dbraw/zinc/24/55/78/1049245578.db2.gz BBENRTRHLUTFRK-HOTGVXAUSA-N 2 1 300.490 4.119 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000485439569 1049247129 /nfs/dbraw/zinc/24/71/29/1049247129.db2.gz OLKJVYPTJGJHFK-HOTGVXAUSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000485439569 1049247141 /nfs/dbraw/zinc/24/71/41/1049247141.db2.gz OLKJVYPTJGJHFK-HOTGVXAUSA-N 2 1 306.881 4.209 20 0 DIADMP CCc1cccc2cc(C[N@H+]3CC[C@@H](C[NH+](CC)CC)C3)oc21 ZINC001180059479 1049268948 /nfs/dbraw/zinc/26/89/48/1049268948.db2.gz YKGJVKZHMGSLDK-INIZCTEOSA-N 2 1 314.473 4.159 20 0 DIADMP CCc1cccc2cc(C[N@@H+]3CC[C@@H](C[NH+](CC)CC)C3)oc21 ZINC001180059479 1049268958 /nfs/dbraw/zinc/26/89/58/1049268958.db2.gz YKGJVKZHMGSLDK-INIZCTEOSA-N 2 1 314.473 4.159 20 0 DIADMP CCc1cccc2cc(C[N@H+]3CC[C@H](C[NH+](CC)CC)C3)oc21 ZINC001180059481 1049269025 /nfs/dbraw/zinc/26/90/25/1049269025.db2.gz YKGJVKZHMGSLDK-MRXNPFEDSA-N 2 1 314.473 4.159 20 0 DIADMP CCc1cccc2cc(C[N@@H+]3CC[C@H](C[NH+](CC)CC)C3)oc21 ZINC001180059481 1049269038 /nfs/dbraw/zinc/26/90/38/1049269038.db2.gz YKGJVKZHMGSLDK-MRXNPFEDSA-N 2 1 314.473 4.159 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2CCCC[C@H]2C)CC1 ZINC001193872531 1049275985 /nfs/dbraw/zinc/27/59/85/1049275985.db2.gz OJCJITOJDANZDI-NVXWUHKLSA-N 2 1 302.462 4.060 20 0 DIADMP Clc1ccc(C2=CC[N@@H+](Cc3ccc4c(c3)C[NH2+]C4)CC2)cc1 ZINC001204869992 1049291308 /nfs/dbraw/zinc/29/13/08/1049291308.db2.gz LAAAUPDTUYDPQC-UHFFFAOYSA-N 2 1 324.855 4.233 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@H]2C(C)=CCC[C@H]2C)CC1 ZINC001180125296 1049291706 /nfs/dbraw/zinc/29/17/06/1049291706.db2.gz XBNDWXROYYGJCP-QUCCMNQESA-N 2 1 306.538 4.423 20 0 DIADMP CC(C)[C@H](C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC001180147120 1049296756 /nfs/dbraw/zinc/29/67/56/1049296756.db2.gz DOCXVJOZSAANTL-SFTDATJTSA-N 2 1 314.517 4.377 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001204924883 1049313733 /nfs/dbraw/zinc/31/37/33/1049313733.db2.gz CRIUYICGBUCHDL-QGZVFWFLSA-N 2 1 319.452 4.148 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001204924883 1049313743 /nfs/dbraw/zinc/31/37/43/1049313743.db2.gz CRIUYICGBUCHDL-QGZVFWFLSA-N 2 1 319.452 4.148 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000485691397 1049314549 /nfs/dbraw/zinc/31/45/49/1049314549.db2.gz DPECFIIVMIBCAA-CQSZACIVSA-N 2 1 312.860 4.223 20 0 DIADMP CC[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001204937431 1049315299 /nfs/dbraw/zinc/31/52/99/1049315299.db2.gz JUYVYUIWLZIOFB-CRSSMBPESA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001204937582 1049315630 /nfs/dbraw/zinc/31/56/30/1049315630.db2.gz FKPGDNPBYWXKJM-LJQANCHMSA-N 2 1 314.860 4.320 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001204937582 1049315643 /nfs/dbraw/zinc/31/56/43/1049315643.db2.gz FKPGDNPBYWXKJM-LJQANCHMSA-N 2 1 314.860 4.320 20 0 DIADMP CCCC[N@@H+](CC1CC[NH+](CC)CC1)[C@H](C)c1ccc(C)o1 ZINC001180238845 1049319212 /nfs/dbraw/zinc/31/92/12/1049319212.db2.gz DCOTVYWHGYHEGX-QGZVFWFLSA-N 2 1 306.494 4.483 20 0 DIADMP C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000485698082 1049321032 /nfs/dbraw/zinc/32/10/32/1049321032.db2.gz XUBYLWHFHJICDG-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP C[C@H]([NH2+]Cc1cc(F)cc(Cl)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000485698082 1049321044 /nfs/dbraw/zinc/32/10/44/1049321044.db2.gz XUBYLWHFHJICDG-ZFWWWQNUSA-N 2 1 324.871 4.222 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@@]2(C)CCCS2)CC1)CC1CC1 ZINC001204968853 1049325749 /nfs/dbraw/zinc/32/57/49/1049325749.db2.gz LQRWFQCJNBHYSA-LJQANCHMSA-N 2 1 324.578 4.106 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)C[C@H](C)C(C)(C)C)C2)s1 ZINC001194152401 1049329422 /nfs/dbraw/zinc/32/94/22/1049329422.db2.gz AHAIHVHYWMVENF-DOTOQJQBSA-N 2 1 322.562 4.492 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)C[C@H](C)C(C)(C)C)C2)s1 ZINC001194152401 1049329436 /nfs/dbraw/zinc/32/94/36/1049329436.db2.gz AHAIHVHYWMVENF-DOTOQJQBSA-N 2 1 322.562 4.492 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](CC[C@@H]1CCC[NH+]1C)C1CCCC1 ZINC001194175713 1049334769 /nfs/dbraw/zinc/33/47/69/1049334769.db2.gz FKCGCRQAQVNKLY-HKUYNNGSSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@@H](c1ccccc1)[NH+](CC[C@@H]1CCC[N@@H+]1C)C1CCCC1 ZINC001194175713 1049334781 /nfs/dbraw/zinc/33/47/81/1049334781.db2.gz FKCGCRQAQVNKLY-HKUYNNGSSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@@H](c1ccccc1)[NH+](CC[C@@H]1CCC[N@H+]1C)C1CCCC1 ZINC001194175713 1049334795 /nfs/dbraw/zinc/33/47/95/1049334795.db2.gz FKCGCRQAQVNKLY-HKUYNNGSSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+](CC[C@@H]1CCC[NH+]1C)C1CCCC1 ZINC001194175715 1049335241 /nfs/dbraw/zinc/33/52/41/1049335241.db2.gz FKCGCRQAQVNKLY-MJGOQNOKSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@H](c1ccccc1)[NH+](CC[C@@H]1CCC[N@@H+]1C)C1CCCC1 ZINC001194175715 1049335252 /nfs/dbraw/zinc/33/52/52/1049335252.db2.gz FKCGCRQAQVNKLY-MJGOQNOKSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@H](c1ccccc1)[NH+](CC[C@@H]1CCC[N@H+]1C)C1CCCC1 ZINC001194175715 1049335260 /nfs/dbraw/zinc/33/52/60/1049335260.db2.gz FKCGCRQAQVNKLY-MJGOQNOKSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@H](c1ccccc1)[N@@H+](CC[C@H]1CCC[NH+]1C)C1CCCC1 ZINC001194175714 1049335565 /nfs/dbraw/zinc/33/55/65/1049335565.db2.gz FKCGCRQAQVNKLY-IEBWSBKVSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@H](c1ccccc1)[NH+](CC[C@H]1CCC[N@@H+]1C)C1CCCC1 ZINC001194175714 1049335581 /nfs/dbraw/zinc/33/55/81/1049335581.db2.gz FKCGCRQAQVNKLY-IEBWSBKVSA-N 2 1 300.490 4.477 20 0 DIADMP C[C@H](c1ccccc1)[NH+](CC[C@H]1CCC[N@H+]1C)C1CCCC1 ZINC001194175714 1049335598 /nfs/dbraw/zinc/33/55/98/1049335598.db2.gz FKCGCRQAQVNKLY-IEBWSBKVSA-N 2 1 300.490 4.477 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](C[C@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001205001329 1049337512 /nfs/dbraw/zinc/33/75/12/1049337512.db2.gz PYARBZXURACKQB-IEBWSBKVSA-N 2 1 316.533 4.094 20 0 DIADMP CC[NH+](CC)CCC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC001194231527 1049338181 /nfs/dbraw/zinc/33/81/81/1049338181.db2.gz MAWHWVDZQGUGAP-LJQANCHMSA-N 2 1 324.459 4.280 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+](Cc2cccc(Oc3ccc(C)cc3)c2)C1 ZINC001205009569 1049338853 /nfs/dbraw/zinc/33/88/53/1049338853.db2.gz XIOMADILBWDTKM-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccc(Oc3ccc(C)cc3)c2)C1 ZINC001205009569 1049338865 /nfs/dbraw/zinc/33/88/65/1049338865.db2.gz XIOMADILBWDTKM-LJQANCHMSA-N 2 1 324.468 4.219 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001205009578 1049339773 /nfs/dbraw/zinc/33/97/73/1049339773.db2.gz XSVDGFAUEMNRKA-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001205009578 1049339788 /nfs/dbraw/zinc/33/97/88/1049339788.db2.gz XSVDGFAUEMNRKA-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(C)cc3)cc2)C1 ZINC001205009642 1049340266 /nfs/dbraw/zinc/34/02/66/1049340266.db2.gz ZWBLRQTZCYABCH-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@H]2CC=CCC2)CC1)CC1CC1 ZINC001180322663 1049345294 /nfs/dbraw/zinc/34/52/94/1049345294.db2.gz LXJKUENDAKJEDG-IBGZPJMESA-N 2 1 304.522 4.177 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000777130157 1049357643 /nfs/dbraw/zinc/35/76/43/1049357643.db2.gz PTTPZECTUCXSOG-SQIBXOBRSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000777130157 1049357654 /nfs/dbraw/zinc/35/76/54/1049357654.db2.gz PTTPZECTUCXSOG-SQIBXOBRSA-N 2 1 300.490 4.064 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)CC1 ZINC001205102092 1049378897 /nfs/dbraw/zinc/37/88/97/1049378897.db2.gz OHYXDNVCFWFRNF-QGZVFWFLSA-N 2 1 319.452 4.148 20 0 DIADMP [NH3+][C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)CC1 ZINC001205109930 1049381988 /nfs/dbraw/zinc/38/19/88/1049381988.db2.gz NHFWJNDDQTZKJQ-QGZVFWFLSA-N 2 1 314.860 4.320 20 0 DIADMP CC(C)[C@](C)(Cc1ccc(Cl)cc1)[NH2+]CC[C@H]1CCC[N@H+]1C ZINC001194625026 1049397743 /nfs/dbraw/zinc/39/77/43/1049397743.db2.gz JNAFQTMPPZTOPV-MOPGFXCFSA-N 2 1 322.924 4.371 20 0 DIADMP c1c(C[N@H+]2CCCC[C@@H]2c2ccccc2)sc2c1C[NH2+]CC2 ZINC001205171440 1049402068 /nfs/dbraw/zinc/40/20/68/1049402068.db2.gz QQEOFFMXBIQXPK-GOSISDBHSA-N 2 1 312.482 4.121 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCC[C@](C)([NH3+])CC2)cc1 ZINC001205257246 1049417960 /nfs/dbraw/zinc/41/79/60/1049417960.db2.gz UUPMEPGBOUKYKH-XLIONFOSSA-N 2 1 302.506 4.192 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2cccc(-c3ccsc3)c2)CC1 ZINC001205272927 1049423864 /nfs/dbraw/zinc/42/38/64/1049423864.db2.gz AROLOZUJQCRYES-SFHVURJKSA-N 2 1 300.471 4.118 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@H+]3CCC[C@](C)([NH3+])CC3)ccc21 ZINC001205273020 1049423883 /nfs/dbraw/zinc/42/38/83/1049423883.db2.gz CIRORJJOVITJHR-NRFANRHFSA-N 2 1 321.468 4.035 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)c(C)c12 ZINC001205281310 1049427007 /nfs/dbraw/zinc/42/70/07/1049427007.db2.gz SCMHHSFVCUJBOS-MRXNPFEDSA-N 2 1 308.516 4.283 20 0 DIADMP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CC1 ZINC001205280854 1049427640 /nfs/dbraw/zinc/42/76/40/1049427640.db2.gz KENJJPZHLTTYTG-CQSZACIVSA-N 2 1 320.786 4.062 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(C(F)(F)F)c(Cl)c2)CC1 ZINC001205280854 1049427649 /nfs/dbraw/zinc/42/76/49/1049427649.db2.gz KENJJPZHLTTYTG-CQSZACIVSA-N 2 1 320.786 4.062 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C[C@@H]1C[NH3+] ZINC001205303652 1049432449 /nfs/dbraw/zinc/43/24/49/1049432449.db2.gz JBTBZNXMEMRIGA-HOCLYGCPSA-N 2 1 308.425 4.003 20 0 DIADMP C[C@@H]1CC[NH2+]CC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001205326254 1049439260 /nfs/dbraw/zinc/43/92/60/1049439260.db2.gz WYEIHJLROOMKEQ-CQSZACIVSA-N 2 1 310.466 4.238 20 0 DIADMP C[C@H]1CC[NH2+]CC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001205326253 1049439918 /nfs/dbraw/zinc/43/99/18/1049439918.db2.gz WYEIHJLROOMKEQ-AWEZNQCLSA-N 2 1 310.466 4.238 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc2ccccc2[nH]1 ZINC000775622467 1049457923 /nfs/dbraw/zinc/45/79/23/1049457923.db2.gz WCQNHCKDQWBHII-SJORKVTESA-N 2 1 313.489 4.473 20 0 DIADMP CC[C@]1(C)CCC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001181349053 1049470392 /nfs/dbraw/zinc/47/03/92/1049470392.db2.gz KGINFQQCHXBCCH-SLFFLAALSA-N 2 1 300.490 4.067 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CCc1cc(C)cc(C)c1 ZINC001181514227 1049485805 /nfs/dbraw/zinc/48/58/05/1049485805.db2.gz BJKVACNRUKVDBV-UHFFFAOYSA-N 2 1 313.489 4.017 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CCc1cc(C)cc(C)c1 ZINC001181514227 1049485815 /nfs/dbraw/zinc/48/58/15/1049485815.db2.gz BJKVACNRUKVDBV-UHFFFAOYSA-N 2 1 313.489 4.017 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC001181486681 1049486642 /nfs/dbraw/zinc/48/66/42/1049486642.db2.gz LUTLSCBVFJFHCG-FCHUYYIVSA-N 2 1 322.496 4.374 20 0 DIADMP CCC(C)(C)c1ccc(C[N@H+]2CCC[C@@](F)(C[NH3+])CC2)cc1 ZINC001205579469 1049502920 /nfs/dbraw/zinc/50/29/20/1049502920.db2.gz MWMFYSRDFZGMMA-IBGZPJMESA-N 2 1 306.469 4.027 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)CC[C@H]1C[NH3+] ZINC001205602693 1049510317 /nfs/dbraw/zinc/51/03/17/1049510317.db2.gz LOHRWYFZQORSEJ-UWJYYQICSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC[C@@H]1C[NH3+] ZINC001205617187 1049511419 /nfs/dbraw/zinc/51/14/19/1049511419.db2.gz ICDLXRAPYDWRIZ-DOTOQJQBSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2-c2cccs2)CC[C@H]1C[NH3+] ZINC001205628446 1049514537 /nfs/dbraw/zinc/51/45/37/1049514537.db2.gz VEYSDAPHILPFAR-CVEARBPZSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2sc(Cl)c3ccccc32)CC[C@H]1C[NH3+] ZINC001205651324 1049522049 /nfs/dbraw/zinc/52/20/49/1049522049.db2.gz CSIKQLLUQOOGQX-STQMWFEESA-N 2 1 322.905 4.362 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1 ZINC001205654161 1049522445 /nfs/dbraw/zinc/52/24/45/1049522445.db2.gz WOVJHUUCQTWPTN-DGCLKSJQSA-N 2 1 315.288 4.109 20 0 DIADMP CC[N@@H+](CCC[NH+]1CCCC1)CCc1ccc(C(C)C)cc1 ZINC001205692522 1049535350 /nfs/dbraw/zinc/53/53/50/1049535350.db2.gz FCDNTSVJECJSHW-UHFFFAOYSA-N 2 1 302.506 4.160 20 0 DIADMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc(C4CCC4)cc3)C2)CC1 ZINC001205696901 1049535785 /nfs/dbraw/zinc/53/57/85/1049535785.db2.gz QIOIMKWMKIEIHL-OAQYLSRUSA-N 2 1 312.501 4.118 20 0 DIADMP C[C@@H]1CCC[C@@H](C[N@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702947 1049539203 /nfs/dbraw/zinc/53/92/03/1049539203.db2.gz RYBIFXCSSIBDKO-UYAOXDASSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@@H]1CCC[C@@H](C[N@@H+](Cc2ccccc2)C2CC[NH+](C)CC2)C1 ZINC001205702947 1049539216 /nfs/dbraw/zinc/53/92/16/1049539216.db2.gz RYBIFXCSSIBDKO-UYAOXDASSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@H]1CC1(C)C ZINC000487270530 1049540397 /nfs/dbraw/zinc/54/03/97/1049540397.db2.gz PXKOXCBUWLAWMJ-MPTYRVRUSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@H]1CC1(C)C ZINC000487270530 1049540403 /nfs/dbraw/zinc/54/04/03/1049540403.db2.gz PXKOXCBUWLAWMJ-MPTYRVRUSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2CC2(C)C)CC1 ZINC000487278376 1049542372 /nfs/dbraw/zinc/54/23/72/1049542372.db2.gz SYYGMSCEKVLEAY-FCEWJHQRSA-N 2 1 300.490 4.236 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)CCCC(F)(F)F ZINC001181934757 1049552204 /nfs/dbraw/zinc/55/22/04/1049552204.db2.gz VARLVYAGBGNHCM-GJZGRUSLSA-N 2 1 308.432 4.208 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2cccc3c4ccccc4sc32)C[C@@H]1[NH3+] ZINC001205872540 1049590194 /nfs/dbraw/zinc/59/01/94/1049590194.db2.gz NOXGVEKMPHBTOE-DYVFJYSZSA-N 2 1 310.466 4.224 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2cccc3c4ccccc4sc32)C[C@@H]1[NH3+] ZINC001205872540 1049590208 /nfs/dbraw/zinc/59/02/08/1049590208.db2.gz NOXGVEKMPHBTOE-DYVFJYSZSA-N 2 1 310.466 4.224 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001205901241 1049594464 /nfs/dbraw/zinc/59/44/64/1049594464.db2.gz BZQKNARNCRBSCU-AEFFLSMTSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205904477 1049595801 /nfs/dbraw/zinc/59/58/01/1049595801.db2.gz VOYXVNLQQJFNKW-GJZGRUSLSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001205902205 1049596571 /nfs/dbraw/zinc/59/65/71/1049596571.db2.gz IQNXDPWALQBCQB-BEFAXECRSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001205903712 1049597628 /nfs/dbraw/zinc/59/76/28/1049597628.db2.gz QVJDAQGJEQHSEI-ZIAGYGMSSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001205903624 1049597943 /nfs/dbraw/zinc/59/79/43/1049597943.db2.gz QJKQSECGOOLPPL-DZGCQCFKSA-N 2 1 318.848 4.159 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@H](C[NH3+])[C@@H]1C ZINC001205902844 1049598288 /nfs/dbraw/zinc/59/82/88/1049598288.db2.gz LYBDFVRKINKUJY-ZWKOTPCHSA-N 2 1 318.505 4.205 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccccc1-c1ccc(F)cc1 ZINC001205913405 1049600288 /nfs/dbraw/zinc/60/02/88/1049600288.db2.gz ICCVEMMSVBUMIU-DOTOQJQBSA-N 2 1 312.432 4.052 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001205915140 1049601554 /nfs/dbraw/zinc/60/15/54/1049601554.db2.gz OONCVWORQORHMX-CHWSQXEVSA-N 2 1 306.500 4.036 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCCC[C@@H]([NH3+])C2)c1 ZINC001205937640 1049606122 /nfs/dbraw/zinc/60/61/22/1049606122.db2.gz BLMGKWNCOIALBA-HXUWFJFHSA-N 2 1 308.469 4.284 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCCC[C@@H]([NH3+])C2)c1 ZINC001205937640 1049606125 /nfs/dbraw/zinc/60/61/25/1049606125.db2.gz BLMGKWNCOIALBA-HXUWFJFHSA-N 2 1 308.469 4.284 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(Oc3ccccc3)cc2)CCC[C@@H]1C[NH3+] ZINC001205996318 1049624495 /nfs/dbraw/zinc/62/44/95/1049624495.db2.gz WBVVPCVRGVSPAK-PKOBYXMFSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc3c4ccccc4oc32)CCC[C@@H]1C[NH3+] ZINC001206003604 1049625864 /nfs/dbraw/zinc/62/58/64/1049625864.db2.gz KDNHJNPGQSTTHB-HZPDHXFCSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(-c3ccsc3)c2)CCC[C@@H]1C[NH3+] ZINC001206004982 1049626274 /nfs/dbraw/zinc/62/62/74/1049626274.db2.gz WFVAUBQSKDRPKF-CRAIPNDOSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2-c2cccs2)CCC[C@H]1C[NH3+] ZINC001206004787 1049626347 /nfs/dbraw/zinc/62/63/47/1049626347.db2.gz VKVOTWFHOYPYTQ-CVEARBPZSA-N 2 1 314.498 4.222 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@@H](C[NH3+])[C@@H](C)C3)cc2)o1 ZINC001206011276 1049627926 /nfs/dbraw/zinc/62/79/26/1049627926.db2.gz BETURMQMRDRHCU-KXBFYZLASA-N 2 1 312.457 4.062 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(Cc3ccccc3)cc2)CCC[C@@H]1C[NH3+] ZINC001206022092 1049632572 /nfs/dbraw/zinc/63/25/72/1049632572.db2.gz BEZKSNKKPNCPTD-PGRDOPGGSA-N 2 1 322.496 4.084 20 0 DIADMP Cc1cc(Cl)c(C[N@H+]2CCC[C@H](C[NH3+])[C@H](C)C2)c(Cl)c1 ZINC001206024604 1049632747 /nfs/dbraw/zinc/63/27/47/1049632747.db2.gz KSKGNSPZWLPUOE-CHWSQXEVSA-N 2 1 315.288 4.109 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)CS1 ZINC000488415155 1049647700 /nfs/dbraw/zinc/64/77/00/1049647700.db2.gz PDCZAEFUMGSPHX-OALUTQOASA-N 2 1 320.546 4.147 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001206084294 1049650589 /nfs/dbraw/zinc/65/05/89/1049650589.db2.gz GKJCCQVYIMUQGK-JXFKEZNVSA-N 2 1 318.480 4.472 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1 ZINC001206084294 1049650594 /nfs/dbraw/zinc/65/05/94/1049650594.db2.gz GKJCCQVYIMUQGK-JXFKEZNVSA-N 2 1 318.480 4.472 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)c1 ZINC000488433965 1049653663 /nfs/dbraw/zinc/65/36/63/1049653663.db2.gz RXDXZIGWWRJBFJ-ROUUACIJSA-N 2 1 320.546 4.148 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)CC1 ZINC001206154153 1049670820 /nfs/dbraw/zinc/67/08/20/1049670820.db2.gz GWOHPRDVWJHDKW-OTWHNJEPSA-N 2 1 308.485 4.221 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)CC1 ZINC001206154153 1049670851 /nfs/dbraw/zinc/67/08/51/1049670851.db2.gz GWOHPRDVWJHDKW-OTWHNJEPSA-N 2 1 308.485 4.221 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)CCC2 ZINC000339070337 1049672947 /nfs/dbraw/zinc/67/29/47/1049672947.db2.gz MNGQSUGDHADKPL-YLJYHZDGSA-N 2 1 300.490 4.082 20 0 DIADMP CC[N@@H+](CC1CC[NH+](C)CC1)C(c1ccccc1)c1ccccc1 ZINC001182555432 1049682184 /nfs/dbraw/zinc/68/21/84/1049682184.db2.gz PWXFZIQHYAIOAQ-UHFFFAOYSA-N 2 1 322.496 4.440 20 0 DIADMP CCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001182542783 1049685267 /nfs/dbraw/zinc/68/52/67/1049685267.db2.gz GAMOGGAVSVMPSU-CGXNFDGLSA-N 2 1 314.517 4.280 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001206225012 1049685572 /nfs/dbraw/zinc/68/55/72/1049685572.db2.gz XVTFKBSEHITAFB-UKAVVXHISA-N 2 1 312.501 4.379 20 0 DIADMP CC(C)C[C@@H]1C[C@H]1[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC001206225012 1049685579 /nfs/dbraw/zinc/68/55/79/1049685579.db2.gz XVTFKBSEHITAFB-UKAVVXHISA-N 2 1 312.501 4.379 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC001206263640 1049693015 /nfs/dbraw/zinc/69/30/15/1049693015.db2.gz POZCCAVAMNUPNM-YCEFEEMOSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC001206263640 1049693019 /nfs/dbraw/zinc/69/30/19/1049693019.db2.gz POZCCAVAMNUPNM-YCEFEEMOSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001206278170 1049698375 /nfs/dbraw/zinc/69/83/75/1049698375.db2.gz ZMZISSXDRXPZLH-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@@H]1C[NH2+]CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001206278170 1049698390 /nfs/dbraw/zinc/69/83/90/1049698390.db2.gz ZMZISSXDRXPZLH-OAHLLOKOSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)s2)CC1 ZINC001206304619 1049706334 /nfs/dbraw/zinc/70/63/34/1049706334.db2.gz NLDBEZGUOGMVMT-KRWDZBQOSA-N 2 1 320.527 4.428 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccccc2-c2cccs2)CC1 ZINC001206311967 1049707600 /nfs/dbraw/zinc/70/76/00/1049707600.db2.gz XMQCTGWNSVKHAO-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC001206310787 1049708407 /nfs/dbraw/zinc/70/84/07/1049708407.db2.gz CHEMFJJPWOKRPX-LJQANCHMSA-N 2 1 314.498 4.366 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC001206318068 1049710240 /nfs/dbraw/zinc/71/02/40/1049710240.db2.gz LYKMVHKAXDGYRO-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H](C)CCc1ccco1)C1CCCCC1 ZINC001182743745 1049710502 /nfs/dbraw/zinc/71/05/02/1049710502.db2.gz RTCLVGKILJAYIH-QGZVFWFLSA-N 2 1 306.494 4.235 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCC[C@@](C)(C[NH3+])CC1 ZINC001206318149 1049710732 /nfs/dbraw/zinc/71/07/32/1049710732.db2.gz NLEXBSXKVVHIRY-GOSISDBHSA-N 2 1 302.487 4.161 20 0 DIADMP Cc1cc(OC(C)C)cc(C)c1C[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001206324451 1049711839 /nfs/dbraw/zinc/71/18/39/1049711839.db2.gz BRHKHWQZGHXLPB-FQEVSTJZSA-N 2 1 318.505 4.042 20 0 DIADMP [NH3+]CCC1CC[NH+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC001206506831 1049747755 /nfs/dbraw/zinc/74/77/55/1049747755.db2.gz SABBFJTYHPAIFY-UHFFFAOYSA-N 2 1 321.679 4.208 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC001206537653 1049751289 /nfs/dbraw/zinc/75/12/89/1049751289.db2.gz LUYGGCVSAKKESQ-UHFFFAOYSA-N 2 1 304.522 4.094 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC001206580080 1049761731 /nfs/dbraw/zinc/76/17/31/1049761731.db2.gz CBCIYFUUQLXYOQ-AWEZNQCLSA-N 2 1 315.288 4.346 20 0 DIADMP Cc1csc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1Cl ZINC001206584204 1049762297 /nfs/dbraw/zinc/76/22/97/1049762297.db2.gz XNRRKDRQIRPTJH-ZDUSSCGKSA-N 2 1 300.899 4.062 20 0 DIADMP Cc1csc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c1Cl ZINC001206584204 1049762302 /nfs/dbraw/zinc/76/23/02/1049762302.db2.gz XNRRKDRQIRPTJH-ZDUSSCGKSA-N 2 1 300.899 4.062 20 0 DIADMP CC(C)[N@@H+](CC1(c2ccccc2)CCCC1)[C@H]1CCC[NH2+]CC1 ZINC001206580601 1049763040 /nfs/dbraw/zinc/76/30/40/1049763040.db2.gz GDVKBZSSOJQUHN-FQEVSTJZSA-N 2 1 314.517 4.351 20 0 DIADMP COc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1C(C)C ZINC001206592235 1049763330 /nfs/dbraw/zinc/76/33/30/1049763330.db2.gz ZAZWRIBJXYWOPN-SFHVURJKSA-N 2 1 318.505 4.171 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1-c1cccnc1)[C@@H]1CCC[NH2+]CC1 ZINC001206590020 1049763357 /nfs/dbraw/zinc/76/33/57/1049763357.db2.gz KQOSJPDKXNADBA-HXUWFJFHSA-N 2 1 323.484 4.101 20 0 DIADMP CC(C)[N@@H+](Cc1c[nH]c2cc(Cl)ccc12)[C@H]1CCC[NH2+]CC1 ZINC001206591539 1049763383 /nfs/dbraw/zinc/76/33/83/1049763383.db2.gz SNJYYIAFVHHKTA-INIZCTEOSA-N 2 1 319.880 4.174 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1-c1cccnc1)[C@H]1CCC[NH2+]CC1 ZINC001206590018 1049764710 /nfs/dbraw/zinc/76/47/10/1049764710.db2.gz KQOSJPDKXNADBA-FQEVSTJZSA-N 2 1 323.484 4.101 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2cccc(-c3ccc(F)cc3)c2)C1 ZINC001206616055 1049770271 /nfs/dbraw/zinc/77/02/71/1049770271.db2.gz MWJLBKMHSSLUKO-QGZVFWFLSA-N 2 1 312.432 4.054 20 0 DIADMP Cc1c(C[N@H+]2CCCC[C@H](C[NH3+])C2)cccc1-c1ccccc1 ZINC001206640986 1049773599 /nfs/dbraw/zinc/77/35/99/1049773599.db2.gz QPVBCTZZIPBWDD-GOSISDBHSA-N 2 1 308.469 4.223 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cccc(-c2ccc(F)cc2)c1 ZINC001206769053 1049795800 /nfs/dbraw/zinc/79/58/00/1049795800.db2.gz MZHGNELOLRGWSW-WBVHZDCISA-N 2 1 312.432 4.052 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC001206769259 1049795871 /nfs/dbraw/zinc/79/58/71/1049795871.db2.gz NUDNDGXNENABFP-KBPBESRZSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2cccc(Cl)c2)o1 ZINC001206771460 1049796249 /nfs/dbraw/zinc/79/62/49/1049796249.db2.gz WYZTYXXUVBTQNT-KGLIPLIRSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cccc2c3ccccc3oc21 ZINC001206771393 1049796567 /nfs/dbraw/zinc/79/65/67/1049796567.db2.gz WOFSRTUYHITINI-CABCVRRESA-N 2 1 308.425 4.145 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H](C[NH3+])CC[C@@H]1C ZINC001206772212 1049796591 /nfs/dbraw/zinc/79/65/91/1049796591.db2.gz ZHAXKSCAZVASRG-ROUUACIJSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccc(F)cc2)cc1 ZINC001206770640 1049796624 /nfs/dbraw/zinc/79/66/24/1049796624.db2.gz SXSDMGJZFVHKPM-NVXWUHKLSA-N 2 1 312.432 4.052 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@@H](C[NH3+])CC[C@H]1C ZINC001206772211 1049797082 /nfs/dbraw/zinc/79/70/82/1049797082.db2.gz ZHAXKSCAZVASRG-QZTJIDSGSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@H]3C)cc2)c1 ZINC001206809698 1049803340 /nfs/dbraw/zinc/80/33/40/1049803340.db2.gz MJLNSJOBBDCTKY-IEBWSBKVSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@@H](C[NH3+])CC[C@@H]2C)ccc1Oc1ccccc1 ZINC001206806215 1049803414 /nfs/dbraw/zinc/80/34/14/1049803414.db2.gz FZLPXXKZQJRKDS-PKOBYXMFSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001206807235 1049803466 /nfs/dbraw/zinc/80/34/66/1049803466.db2.gz HYIQBZUBWZMDSS-STQMWFEESA-N 2 1 306.500 4.036 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CSc2ccccc2)C(C)C)C1 ZINC000490171209 1049808506 /nfs/dbraw/zinc/80/85/06/1049808506.db2.gz AQBSDVDPTLWIGL-IEBWSBKVSA-N 2 1 320.546 4.125 20 0 DIADMP C[N@@H+]1CC[C@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174677 1049851700 /nfs/dbraw/zinc/85/17/00/1049851700.db2.gz NITZUYFURQVNGR-OALUTQOASA-N 2 1 304.522 4.153 20 0 DIADMP C[N@H+]1CC[C@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174677 1049851720 /nfs/dbraw/zinc/85/17/20/1049851720.db2.gz NITZUYFURQVNGR-OALUTQOASA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@H]2C[N@H+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174677 1049851738 /nfs/dbraw/zinc/85/17/38/1049851738.db2.gz NITZUYFURQVNGR-OALUTQOASA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@H]2C[N@@H+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174677 1049851751 /nfs/dbraw/zinc/85/17/51/1049851751.db2.gz NITZUYFURQVNGR-OALUTQOASA-N 2 1 304.522 4.153 20 0 DIADMP CC[NH+](CC)C1CC[NH+](C[C@H]2C[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001207182677 1049853892 /nfs/dbraw/zinc/85/38/92/1049853892.db2.gz ABRVGSFHLYLREY-VQIMIIECSA-N 2 1 320.908 4.250 20 0 DIADMP CC[NH+](CC)C1CC[NH+](C[C@@H]2C[C@@H]2c2ccc(Cl)cc2)CC1 ZINC001207182676 1049854669 /nfs/dbraw/zinc/85/46/69/1049854669.db2.gz ABRVGSFHLYLREY-QFBILLFUSA-N 2 1 320.908 4.250 20 0 DIADMP CC[NH+](CC)C1CC[NH+](C[C@H]2C[C@H]2c2ccc(Cl)cc2)CC1 ZINC001207182674 1049855075 /nfs/dbraw/zinc/85/50/75/1049855075.db2.gz ABRVGSFHLYLREY-APWZRJJASA-N 2 1 320.908 4.250 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)C[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001207189375 1049856356 /nfs/dbraw/zinc/85/63/56/1049856356.db2.gz AVMYOBRBDLFTHC-WMZOPIPTSA-N 2 1 308.897 4.107 20 0 DIADMP FC1(F)CCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001207285989 1049873927 /nfs/dbraw/zinc/87/39/27/1049873927.db2.gz AUHDPAMQVZROCK-UHFFFAOYSA-N 2 1 322.443 4.020 20 0 DIADMP CC[C@H]1CCCC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207292371 1049876782 /nfs/dbraw/zinc/87/67/82/1049876782.db2.gz QCDBDIDXKUFEKA-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207294815 1049877966 /nfs/dbraw/zinc/87/79/66/1049877966.db2.gz UWYQLFAVBRHJCM-FQEVSTJZSA-N 2 1 300.490 4.019 20 0 DIADMP FC1(F)CCC(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)CC1 ZINC001207347420 1049882134 /nfs/dbraw/zinc/88/21/34/1049882134.db2.gz UPIYLMZRCSNCEO-KRWDZBQOSA-N 2 1 314.464 4.152 20 0 DIADMP C(=C\c1ccccc1)\C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491056826 1049883156 /nfs/dbraw/zinc/88/31/56/1049883156.db2.gz JQFRCPPYPZQWSA-PRUHCIRGSA-N 2 1 312.501 4.288 20 0 DIADMP C(=C\c1ccccc1)\C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491056826 1049883159 /nfs/dbraw/zinc/88/31/59/1049883159.db2.gz JQFRCPPYPZQWSA-PRUHCIRGSA-N 2 1 312.501 4.288 20 0 DIADMP C[N@@H+](CCC(c1ccccc1)c1ccccc1)CC1CC[NH2+]CC1 ZINC001207441223 1049894495 /nfs/dbraw/zinc/89/44/95/1049894495.db2.gz YQBVGDIATHUBNM-UHFFFAOYSA-N 2 1 322.496 4.140 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001207485629 1049897518 /nfs/dbraw/zinc/89/75/18/1049897518.db2.gz YSHZPUCPZVRSHX-IBGZPJMESA-N 2 1 304.453 4.085 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+](Cc2ccc(C3CCC3)cc2)CC1 ZINC001207579466 1049911556 /nfs/dbraw/zinc/91/15/56/1049911556.db2.gz CBHBRENJSIDXLN-UHFFFAOYSA-N 2 1 312.501 4.404 20 0 DIADMP CCCc1cccc(C[NH+]2CCC(CC)([NH+]3CCC3)CC2)c1 ZINC001207581712 1049912019 /nfs/dbraw/zinc/91/20/19/1049912019.db2.gz PPIMBXNFKSDOGH-UHFFFAOYSA-N 2 1 300.490 4.089 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000571222464 1049927364 /nfs/dbraw/zinc/92/73/64/1049927364.db2.gz NKQWOXDSPKSTSR-KRWDZBQOSA-N 2 1 321.415 4.008 20 0 DIADMP C[N@H+]1C[C@@H]2CC[C@@H]([NH2+]CC3CCC4(CCCCC4)CC3)[C@H]2C1 ZINC001207836658 1049943701 /nfs/dbraw/zinc/94/37/01/1049943701.db2.gz KOFPLPLTOQIAMC-GBESFXJTSA-N 2 1 304.522 4.057 20 0 DIADMP C[C@@H](C[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1)c1ccccc1 ZINC001207910717 1049951950 /nfs/dbraw/zinc/95/19/50/1049951950.db2.gz XDEHKVCOINGKSS-IBGZPJMESA-N 2 1 322.496 4.387 20 0 DIADMP CC[N@@H+]1C[C@@H]2C[NH+](C[C@H]3CC=C(CCC=C(C)C)CC3)C[C@@H]2C1 ZINC001207936623 1049958906 /nfs/dbraw/zinc/95/89/06/1049958906.db2.gz AWJVDAMMIZCERR-PCCBWWKXSA-N 2 1 316.533 4.343 20 0 DIADMP CC[NH+]1C[C@@H]2C[N@@H+](C[C@H]3CC=C(CCC=C(C)C)CC3)C[C@@H]2C1 ZINC001207936623 1049958911 /nfs/dbraw/zinc/95/89/11/1049958911.db2.gz AWJVDAMMIZCERR-PCCBWWKXSA-N 2 1 316.533 4.343 20 0 DIADMP CC[NH+]1C[C@@H]2C[N@H+](C[C@H]3CC=C(CCC=C(C)C)CC3)C[C@@H]2C1 ZINC001207936623 1049958914 /nfs/dbraw/zinc/95/89/14/1049958914.db2.gz AWJVDAMMIZCERR-PCCBWWKXSA-N 2 1 316.533 4.343 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[NH+]2CCC([NH+]3CCC3)CC2)cc1 ZINC001207936306 1049959891 /nfs/dbraw/zinc/95/98/91/1049959891.db2.gz FGNUZFJBZFRJRU-GOSISDBHSA-N 2 1 314.517 4.159 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C/C=C/c2ccccc2)c1 ZINC000588178269 1049973748 /nfs/dbraw/zinc/97/37/48/1049973748.db2.gz AOBACHSPDXXYNU-MDWZMJQESA-N 2 1 308.469 4.330 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC001208107394 1049974100 /nfs/dbraw/zinc/97/41/00/1049974100.db2.gz SJVWIWLAHBGEJP-KRWDZBQOSA-N 2 1 306.881 4.209 20 0 DIADMP C[NH+]1CCC(C)(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)CC1 ZINC001208106244 1049974148 /nfs/dbraw/zinc/97/41/48/1049974148.db2.gz DDIXVHYCRSHYRH-UHFFFAOYSA-N 2 1 318.892 4.161 20 0 DIADMP C[NH+]1CCC(C)(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001208110839 1049974683 /nfs/dbraw/zinc/97/46/83/1049974683.db2.gz HGIYTOZGDVAFPK-QGZVFWFLSA-N 2 1 306.881 4.209 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)o1 ZINC001208170449 1049981536 /nfs/dbraw/zinc/98/15/36/1049981536.db2.gz XDSOCSHGOSKXRR-WDSOQIARSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@@H](C)CC[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)o1 ZINC001208170449 1049981538 /nfs/dbraw/zinc/98/15/38/1049981538.db2.gz XDSOCSHGOSKXRR-WDSOQIARSA-N 2 1 318.505 4.420 20 0 DIADMP Cc1ccc([C@@H](C)CC[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)o1 ZINC001208170449 1049981542 /nfs/dbraw/zinc/98/15/42/1049981542.db2.gz XDSOCSHGOSKXRR-WDSOQIARSA-N 2 1 318.505 4.420 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001208215668 1049986219 /nfs/dbraw/zinc/98/62/19/1049986219.db2.gz CZPHZALGBYPMSZ-SFHVURJKSA-N 2 1 324.553 4.026 20 0 DIADMP C[N@H+](Cc1ccc(F)cc1)C1CC[NH+](CCC2CCCC2)CC1 ZINC001208696570 1050003674 /nfs/dbraw/zinc/00/36/74/1050003674.db2.gz VZVJUYBMEFGLLH-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP C[N@@H+](Cc1ccc(F)cc1)C1CC[NH+](CCC2CCCC2)CC1 ZINC001208696570 1050003680 /nfs/dbraw/zinc/00/36/80/1050003680.db2.gz VZVJUYBMEFGLLH-UHFFFAOYSA-N 2 1 318.480 4.302 20 0 DIADMP CC(C)CCC[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001208735140 1050006964 /nfs/dbraw/zinc/00/69/64/1050006964.db2.gz URXWETLUQYBPMY-LJQANCHMSA-N 2 1 318.505 4.392 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)C1CC[NH+](CC2CC2)CC1 ZINC001168387402 1050022156 /nfs/dbraw/zinc/02/21/56/1050022156.db2.gz GZQBDEMLSYISNC-CQSZACIVSA-N 2 1 306.881 4.207 20 0 DIADMP CC[N@@H+](Cc1cccc(Cl)c1)C1CC[NH+](CC2CC2)CC1 ZINC001168388182 1050025226 /nfs/dbraw/zinc/02/52/26/1050025226.db2.gz CIRBJCGXSWNGCZ-UHFFFAOYSA-N 2 1 306.881 4.036 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3C[C@@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208932100 1050026053 /nfs/dbraw/zinc/02/60/53/1050026053.db2.gz OESTVQSDXSONIJ-PCCBWWKXSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3C[C@@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208932100 1050026059 /nfs/dbraw/zinc/02/60/59/1050026059.db2.gz OESTVQSDXSONIJ-PCCBWWKXSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)C2)cc1 ZINC001208932100 1050026064 /nfs/dbraw/zinc/02/60/64/1050026064.db2.gz OESTVQSDXSONIJ-PCCBWWKXSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CC[C@H]3c3ccccc3)C2)cc1 ZINC001208938723 1050026540 /nfs/dbraw/zinc/02/65/40/1050026540.db2.gz DLYMZZVQHMQBQO-IRLDBZIGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CC[C@H]3c3ccccc3)C2)cc1 ZINC001208938723 1050026545 /nfs/dbraw/zinc/02/65/45/1050026545.db2.gz DLYMZZVQHMQBQO-IRLDBZIGSA-N 2 1 320.480 4.346 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CC[C@H]3c3ccccc3)C2)cc1 ZINC001208938723 1050026551 /nfs/dbraw/zinc/02/65/51/1050026551.db2.gz DLYMZZVQHMQBQO-IRLDBZIGSA-N 2 1 320.480 4.346 20 0 DIADMP C[C@@H]1CC[N@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935419 1050026674 /nfs/dbraw/zinc/02/66/74/1050026674.db2.gz JARYDZVTSOWRRX-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935419 1050026678 /nfs/dbraw/zinc/02/66/78/1050026678.db2.gz JARYDZVTSOWRRX-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935419 1050026682 /nfs/dbraw/zinc/02/66/82/1050026682.db2.gz JARYDZVTSOWRRX-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)[C@@H](C)C1 ZINC001208935419 1050026685 /nfs/dbraw/zinc/02/66/85/1050026685.db2.gz JARYDZVTSOWRRX-HBFSDRIKSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@@H+](CC1CCCC1)C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208939113 1050027058 /nfs/dbraw/zinc/02/70/58/1050027058.db2.gz FHNGESAPRIVHCL-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CC1CCCC1)C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208939113 1050027061 /nfs/dbraw/zinc/02/70/61/1050027061.db2.gz FHNGESAPRIVHCL-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP C[NH+](CC1CCCC1)C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208939113 1050027064 /nfs/dbraw/zinc/02/70/64/1050027064.db2.gz FHNGESAPRIVHCL-HXUWFJFHSA-N 2 1 300.490 4.021 20 0 DIADMP CCC(CC)[N@H+](CC)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208941413 1050027141 /nfs/dbraw/zinc/02/71/41/1050027141.db2.gz ZNALBWBKYRUQLH-LJQANCHMSA-N 2 1 302.506 4.409 20 0 DIADMP CCC(CC)[N@@H+](CC)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208941413 1050027146 /nfs/dbraw/zinc/02/71/46/1050027146.db2.gz ZNALBWBKYRUQLH-LJQANCHMSA-N 2 1 302.506 4.409 20 0 DIADMP CCC(CC)[NH+](CC)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208941413 1050027150 /nfs/dbraw/zinc/02/71/50/1050027150.db2.gz ZNALBWBKYRUQLH-LJQANCHMSA-N 2 1 302.506 4.409 20 0 DIADMP CCC(CC)[NH+](CC)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208941413 1050027154 /nfs/dbraw/zinc/02/71/54/1050027154.db2.gz ZNALBWBKYRUQLH-LJQANCHMSA-N 2 1 302.506 4.409 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940078 1050028937 /nfs/dbraw/zinc/02/89/37/1050028937.db2.gz ONZVBBMPDIRCGQ-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208940078 1050028942 /nfs/dbraw/zinc/02/89/42/1050028942.db2.gz ONZVBBMPDIRCGQ-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208940078 1050028946 /nfs/dbraw/zinc/02/89/46/1050028946.db2.gz ONZVBBMPDIRCGQ-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208940078 1050028951 /nfs/dbraw/zinc/02/89/51/1050028951.db2.gz ONZVBBMPDIRCGQ-VQTJNVASSA-N 2 1 300.490 4.163 20 0 DIADMP CC[N@H+](Cc1ccc(C)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208951801 1050029177 /nfs/dbraw/zinc/02/91/77/1050029177.db2.gz BOAFFIKUTHRTMR-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccc(C)cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208951801 1050029183 /nfs/dbraw/zinc/02/91/83/1050029183.db2.gz BOAFFIKUTHRTMR-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP CC[NH+](Cc1ccc(C)cc1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208951801 1050029190 /nfs/dbraw/zinc/02/91/90/1050029190.db2.gz BOAFFIKUTHRTMR-QFIPXVFZSA-N 2 1 322.496 4.339 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CC[C@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208950318 1050030131 /nfs/dbraw/zinc/03/01/31/1050030131.db2.gz RXHQKRYBMCKDGH-HBMCJLEFSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@@H+]3CC[C@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208950318 1050030134 /nfs/dbraw/zinc/03/01/34/1050030134.db2.gz RXHQKRYBMCKDGH-HBMCJLEFSA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[NH+]2CC[C@H](C[N@H+]3CC[C@H]4CCCC[C@H]4C3)C2)cc1 ZINC001208950318 1050030138 /nfs/dbraw/zinc/03/01/38/1050030138.db2.gz RXHQKRYBMCKDGH-HBMCJLEFSA-N 2 1 312.501 4.021 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@@H+]1C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208949931 1050030452 /nfs/dbraw/zinc/03/04/52/1050030452.db2.gz ZPWAFVWLGNWVMX-QUCCMNQESA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1c2ccccc2CC[NH+]1C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208949931 1050030457 /nfs/dbraw/zinc/03/04/57/1050030457.db2.gz ZPWAFVWLGNWVMX-QUCCMNQESA-N 2 1 320.480 4.128 20 0 DIADMP C[C@@H]1c2ccccc2CC[NH+]1C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208949931 1050030463 /nfs/dbraw/zinc/03/04/63/1050030463.db2.gz ZPWAFVWLGNWVMX-QUCCMNQESA-N 2 1 320.480 4.128 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@@H+](C2CC[NH+](CC3CC3)CC2)C1 ZINC001168391827 1050042441 /nfs/dbraw/zinc/04/24/41/1050042441.db2.gz OKQJTRPNJLSGOT-MRXNPFEDSA-N 2 1 318.892 4.004 20 0 DIADMP Clc1ccccc1[C@@H]1CC[N@H+](C2CC[NH+](CC3CC3)CC2)C1 ZINC001168391827 1050042448 /nfs/dbraw/zinc/04/24/48/1050042448.db2.gz OKQJTRPNJLSGOT-MRXNPFEDSA-N 2 1 318.892 4.004 20 0 DIADMP CC[NH+](CC)Cc1ccc(Nc2cccc3[nH+]cn(C)c32)cc1 ZINC001209824217 1050090280 /nfs/dbraw/zinc/09/02/80/1050090280.db2.gz ITOJUFIMCULYBK-UHFFFAOYSA-N 2 1 308.429 4.159 20 0 DIADMP C[NH+]1CCC(c2ccc(Nc3ccc4[nH]c[nH+]c4c3)cc2)CC1 ZINC001209848156 1050094315 /nfs/dbraw/zinc/09/43/15/1050094315.db2.gz IVVJZOZQGCDHME-UHFFFAOYSA-N 2 1 306.413 4.116 20 0 DIADMP CSC1(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)CC1 ZINC000347931524 1050161930 /nfs/dbraw/zinc/16/19/30/1050161930.db2.gz ZHHDUVIMDPJGNF-INIZCTEOSA-N 2 1 318.530 4.046 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)Cc1ccc(Cl)cc1 ZINC000348043992 1050174653 /nfs/dbraw/zinc/17/46/53/1050174653.db2.gz KSSILIWXESVPHG-UHFFFAOYSA-N 2 1 305.853 4.147 20 0 DIADMP CC[N@@H+](CCCCn1cc[nH+]c1C)Cc1ccc(Cl)cc1 ZINC000348043992 1050174660 /nfs/dbraw/zinc/17/46/60/1050174660.db2.gz KSSILIWXESVPHG-UHFFFAOYSA-N 2 1 305.853 4.147 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1 ZINC000591695698 1050197541 /nfs/dbraw/zinc/19/75/41/1050197541.db2.gz UVURHKZLDNFIRW-NHCUHLMSSA-N 2 1 320.480 4.378 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CCc2cc(Cl)ccc2C1 ZINC001171096620 1050338064 /nfs/dbraw/zinc/33/80/64/1050338064.db2.gz UPUICNGJKDXDMN-DNVCBOLYSA-N 2 1 320.908 4.051 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(NC2=CC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC001210713967 1050344456 /nfs/dbraw/zinc/34/44/56/1050344456.db2.gz HTPHUGKDBKKAGX-IBGZPJMESA-N 2 1 322.456 4.125 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](C)C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480220710 1050350436 /nfs/dbraw/zinc/35/04/36/1050350436.db2.gz DKOSTAIMRGHIEX-XGUBFFRZSA-N 2 1 308.432 4.064 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480220710 1050350449 /nfs/dbraw/zinc/35/04/49/1050350449.db2.gz DKOSTAIMRGHIEX-XGUBFFRZSA-N 2 1 308.432 4.064 20 0 DIADMP C[C@H](c1nc2ccccc2s1)[N@@H+](C)CCCCCCC[NH3+] ZINC000844220300 1050373394 /nfs/dbraw/zinc/37/33/94/1050373394.db2.gz CSPQYXBGGYDWOX-CQSZACIVSA-N 2 1 305.491 4.198 20 0 DIADMP F[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000574452388 1050477533 /nfs/dbraw/zinc/47/75/33/1050477533.db2.gz FVECYSWYZGVAJJ-UJMXGEILSA-N 2 1 316.464 4.052 20 0 DIADMP CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1 ZINC000766223733 1050504482 /nfs/dbraw/zinc/50/44/82/1050504482.db2.gz LWIINITWCSIJBS-MZMPZRCHSA-N 2 1 315.486 4.115 20 0 DIADMP COc1ccccc1C1([NH3+])CC[NH+]([C@H](C)CCCC(C)C)CC1 ZINC001170070335 1050568657 /nfs/dbraw/zinc/56/86/57/1050568657.db2.gz DELIILJQHJNWOA-QGZVFWFLSA-N 2 1 318.505 4.160 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@@H+]1C ZINC000575171828 1050652619 /nfs/dbraw/zinc/65/26/19/1050652619.db2.gz JFXVCUOPEDQEQM-YLJYHZDGSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)CCCc2cccc3ccccc32)CC[N@H+]1C ZINC000575171828 1050652626 /nfs/dbraw/zinc/65/26/26/1050652626.db2.gz JFXVCUOPEDQEQM-YLJYHZDGSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171828 1050652633 /nfs/dbraw/zinc/65/26/33/1050652633.db2.gz JFXVCUOPEDQEQM-YLJYHZDGSA-N 2 1 310.485 4.187 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)CCCc2cccc3ccccc32)CC[NH+]1C ZINC000575171828 1050652640 /nfs/dbraw/zinc/65/26/40/1050652640.db2.gz JFXVCUOPEDQEQM-YLJYHZDGSA-N 2 1 310.485 4.187 20 0 DIADMP c1cc2cccc(C[NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)c2[nH]1 ZINC001144712227 1050664196 /nfs/dbraw/zinc/66/41/96/1050664196.db2.gz PJQGDROOQISMFE-UHFFFAOYSA-N 2 1 323.484 4.008 20 0 DIADMP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CCC3CCC3)C2)s1 ZINC001170086807 1050711348 /nfs/dbraw/zinc/71/13/48/1050711348.db2.gz XVPGXBSKJWYNMT-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@H+]2CC[C@H](C[NH+](C)CCC3CCC3)C2)s1 ZINC001170086807 1050711358 /nfs/dbraw/zinc/71/13/58/1050711358.db2.gz XVPGXBSKJWYNMT-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CCC3CCC3)C2)s1 ZINC001170086807 1050711365 /nfs/dbraw/zinc/71/13/65/1050711365.db2.gz XVPGXBSKJWYNMT-QGZVFWFLSA-N 2 1 306.519 4.000 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246609806 1050734658 /nfs/dbraw/zinc/73/46/58/1050734658.db2.gz NVSSYCWQCNDHAU-FUHWJXTLSA-N 2 1 312.567 4.152 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246609810 1050734696 /nfs/dbraw/zinc/73/46/96/1050734696.db2.gz NVSSYCWQCNDHAU-WMZOPIPTSA-N 2 1 312.567 4.152 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000788761334 1050739790 /nfs/dbraw/zinc/73/97/90/1050739790.db2.gz YXYQNNZKZSSGRY-IHJVYAAUSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@H]1CC[C@@H]([NH2+]C2CCC([N@@H+](C)Cc3ccccc3)CC2)C1 ZINC000788761338 1050740518 /nfs/dbraw/zinc/74/05/18/1050740518.db2.gz YXYQNNZKZSSGRY-OXHPOLQJSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]CCC[NH2+][C@H](C)c2cc(C)oc2C)c(C)o1 ZINC000348095988 1050986230 /nfs/dbraw/zinc/98/62/30/1050986230.db2.gz NPGUJGSHDBEBQK-HUUCEWRRSA-N 2 1 318.461 4.498 20 0 DIADMP CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+]([C@@H]3CC[C@@H](C)C3)C[C@@H]21 ZINC001170145905 1051005776 /nfs/dbraw/zinc/00/57/76/1051005776.db2.gz WVMXJYPONKVETJ-QANQIFJLSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C)C3)C[C@@H]21 ZINC001170145905 1051005783 /nfs/dbraw/zinc/00/57/83/1051005783.db2.gz WVMXJYPONKVETJ-QANQIFJLSA-N 2 1 312.501 4.286 20 0 DIADMP CC(C)[NH+](C)[C@H]1c2ccccc2[C@@H]2C[N@@H+]([C@@H]3CC[C@@H](C)C3)C[C@@H]21 ZINC001170145905 1051005796 /nfs/dbraw/zinc/00/57/96/1051005796.db2.gz WVMXJYPONKVETJ-QANQIFJLSA-N 2 1 312.501 4.286 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)C1 ZINC001170162992 1051119639 /nfs/dbraw/zinc/11/96/39/1051119639.db2.gz VSXOSXHDJSOKNI-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)C1 ZINC001170162992 1051119641 /nfs/dbraw/zinc/11/96/41/1051119641.db2.gz VSXOSXHDJSOKNI-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CC[C@H]3C[N@@H+](Cc4ccccc4)CC[C@@H]3C2)C1 ZINC001170162992 1051119651 /nfs/dbraw/zinc/11/96/51/1051119651.db2.gz VSXOSXHDJSOKNI-PMXSJFBMSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170196596 1051153131 /nfs/dbraw/zinc/15/31/31/1051153131.db2.gz SFIARYFSEVVOKI-LWYYNNOASA-N 2 1 322.537 4.096 20 0 DIADMP C(CC[N@H+]1CCC2(CCCC2)C1)C[NH+]1CCC2(CCCC2)C1 ZINC000744420262 1051172893 /nfs/dbraw/zinc/17/28/93/1051172893.db2.gz HNTROIBUTQBKNS-UHFFFAOYSA-N 2 1 304.522 4.299 20 0 DIADMP C[C@@H]1c2ccccc2CC[N@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171632179 1051174142 /nfs/dbraw/zinc/17/41/42/1051174142.db2.gz WFIOZYUGHHAVNJ-OAHLLOKOSA-N 2 1 300.490 4.257 20 0 DIADMP C[NH+]1C(C)(C)CC([NH2+]C2(c3cccc(F)c3)CC2)CC1(C)C ZINC001171623573 1051178789 /nfs/dbraw/zinc/17/87/89/1051178789.db2.gz CQIWRQWEKBXUMV-UHFFFAOYSA-N 2 1 304.453 4.056 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)CCO2 ZINC001171624351 1051179779 /nfs/dbraw/zinc/17/97/79/1051179779.db2.gz RKFQEUXZSFNDTR-QGZVFWFLSA-N 2 1 316.489 4.060 20 0 DIADMP COc1cc([C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)ccc1F ZINC001171623858 1051179880 /nfs/dbraw/zinc/17/98/80/1051179880.db2.gz HTDWNYZKHZAFJD-ZDUSSCGKSA-N 2 1 322.468 4.136 20 0 DIADMP Cc1ccc(Cl)c(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171625944 1051182030 /nfs/dbraw/zinc/18/20/30/1051182030.db2.gz PWJOMSCYNNEYBH-UHFFFAOYSA-N 2 1 308.897 4.389 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+]2CCc3c(Cl)cccc3C2)CC1(C)C ZINC001171639592 1051195007 /nfs/dbraw/zinc/19/50/07/1051195007.db2.gz PYHIVQROTLYVLS-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP C[NH+]1C(C)(C)CC([N@H+]2CCc3c(Cl)cccc3C2)CC1(C)C ZINC001171639592 1051195011 /nfs/dbraw/zinc/19/50/11/1051195011.db2.gz PYHIVQROTLYVLS-UHFFFAOYSA-N 2 1 320.908 4.350 20 0 DIADMP C[N@@H+](CCc1ccc(Cl)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171639268 1051195225 /nfs/dbraw/zinc/19/52/25/1051195225.db2.gz CAKDUMJNJMTXOH-UHFFFAOYSA-N 2 1 322.924 4.466 20 0 DIADMP CC[N@@H+](Cc1cccc(OC)c1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171643504 1051196464 /nfs/dbraw/zinc/19/64/64/1051196464.db2.gz WBNYWMPDHDPBDQ-UHFFFAOYSA-N 2 1 318.505 4.169 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+]2CC=C(c3ccccc3)CC2)CC1(C)C ZINC001171643000 1051196881 /nfs/dbraw/zinc/19/68/81/1051196881.db2.gz OYJKSEYEOPILQD-UHFFFAOYSA-N 2 1 312.501 4.427 20 0 DIADMP C[C@H]1Cc2ccccc2C[N@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171643943 1051198005 /nfs/dbraw/zinc/19/80/05/1051198005.db2.gz YQIBAFUHHTVTAO-HNNXBMFYSA-N 2 1 300.490 4.085 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@H]2CCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171963042 1051245470 /nfs/dbraw/zinc/24/54/70/1051245470.db2.gz GOKQBUKJHSDXPM-DLBZAZTESA-N 2 1 322.443 4.207 20 0 DIADMP CCC(CC)C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171962855 1051245804 /nfs/dbraw/zinc/24/58/04/1051245804.db2.gz FJEKNJGEADPPAJ-LJQANCHMSA-N 2 1 302.506 4.455 20 0 DIADMP CCC(CC)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171962836 1051246251 /nfs/dbraw/zinc/24/62/51/1051246251.db2.gz FJEKNJGEADPPAJ-IBGZPJMESA-N 2 1 302.506 4.455 20 0 DIADMP CC(C)([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C1CC1 ZINC001171967247 1051248248 /nfs/dbraw/zinc/24/82/48/1051248248.db2.gz YNRQWEINDBXFPV-SFHVURJKSA-N 2 1 300.490 4.208 20 0 DIADMP CC1(C)C[C@@H](Nc2cccc(C[NH3+])c2)CC[N@H+]1Cc1ccccc1 ZINC001171967725 1051248647 /nfs/dbraw/zinc/24/86/47/1051248647.db2.gz MXYRLSJFEYPEAD-FQEVSTJZSA-N 2 1 323.484 4.000 20 0 DIADMP C[C@H]1CCC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964158 1051250255 /nfs/dbraw/zinc/25/02/55/1051250255.db2.gz KRQJKIJKLXZPEP-YTQUADARSA-N 2 1 300.490 4.208 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001171989119 1051256786 /nfs/dbraw/zinc/25/67/86/1051256786.db2.gz YFIUPZSJRZUDOQ-IBGZPJMESA-N 2 1 312.501 4.306 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001171989119 1051256801 /nfs/dbraw/zinc/25/68/01/1051256801.db2.gz YFIUPZSJRZUDOQ-IBGZPJMESA-N 2 1 312.501 4.306 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001171989119 1051256815 /nfs/dbraw/zinc/25/68/15/1051256815.db2.gz YFIUPZSJRZUDOQ-IBGZPJMESA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C(C)(C)C ZINC001171970096 1051260027 /nfs/dbraw/zinc/26/00/27/1051260027.db2.gz YKERNCIOOVYOSJ-FUHWJXTLSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171971332 1051261302 /nfs/dbraw/zinc/26/13/02/1051261302.db2.gz GXQKKVFOIMTION-HKUYNNGSSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974593 1051263665 /nfs/dbraw/zinc/26/36/65/1051263665.db2.gz ADBMPHNEDRDPRY-NZSAHSFTSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974593 1051263672 /nfs/dbraw/zinc/26/36/72/1051263672.db2.gz ADBMPHNEDRDPRY-NZSAHSFTSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974593 1051263684 /nfs/dbraw/zinc/26/36/84/1051263684.db2.gz ADBMPHNEDRDPRY-NZSAHSFTSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974593 1051263693 /nfs/dbraw/zinc/26/36/93/1051263693.db2.gz ADBMPHNEDRDPRY-NZSAHSFTSA-N 2 1 318.480 4.110 20 0 DIADMP CC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CCC1 ZINC001171973455 1051264260 /nfs/dbraw/zinc/26/42/60/1051264260.db2.gz ZFGWGTHFOMAIBF-GOSISDBHSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCCC[C@@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976326 1051265174 /nfs/dbraw/zinc/26/51/74/1051265174.db2.gz KDZIJNTZCSDMQI-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH+]2CCCC[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976326 1051265185 /nfs/dbraw/zinc/26/51/85/1051265185.db2.gz KDZIJNTZCSDMQI-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@@H+]2CCCC[C@@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976326 1051265199 /nfs/dbraw/zinc/26/51/99/1051265199.db2.gz KDZIJNTZCSDMQI-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([N@H+]2CCCC[C@@H](F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976326 1051265207 /nfs/dbraw/zinc/26/52/07/1051265207.db2.gz KDZIJNTZCSDMQI-RTBURBONSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@@H](F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171978525 1051267115 /nfs/dbraw/zinc/26/71/15/1051267115.db2.gz ZBDZDTADZNWUGN-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@@H](F)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171978525 1051267123 /nfs/dbraw/zinc/26/71/23/1051267123.db2.gz ZBDZDTADZNWUGN-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978525 1051267132 /nfs/dbraw/zinc/26/71/32/1051267132.db2.gz ZBDZDTADZNWUGN-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@@H](F)CC2)CC[NH+]1Cc1ccccc1 ZINC001171978525 1051267140 /nfs/dbraw/zinc/26/71/40/1051267140.db2.gz ZBDZDTADZNWUGN-MOPGFXCFSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)CC[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984797 1051268857 /nfs/dbraw/zinc/26/88/57/1051268857.db2.gz OUSGALORQXPFQU-SFHVURJKSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984797 1051268871 /nfs/dbraw/zinc/26/88/71/1051268871.db2.gz OUSGALORQXPFQU-SFHVURJKSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984797 1051268883 /nfs/dbraw/zinc/26/88/83/1051268883.db2.gz OUSGALORQXPFQU-SFHVURJKSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984797 1051268896 /nfs/dbraw/zinc/26/88/96/1051268896.db2.gz OUSGALORQXPFQU-SFHVURJKSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171977913 1051268934 /nfs/dbraw/zinc/26/89/34/1051268934.db2.gz HUUKGTZUWARXIG-IBGZPJMESA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1)C1CCC1 ZINC001171981214 1051270193 /nfs/dbraw/zinc/27/01/93/1051270193.db2.gz ZSGCLMVDMLDZOV-LPHOPBHVSA-N 2 1 300.490 4.208 20 0 DIADMP C[Si](C)(C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172073186 1051275637 /nfs/dbraw/zinc/27/56/37/1051275637.db2.gz OZLKXBUKTZJBBC-REPLKXPHSA-N 2 1 316.565 4.039 20 0 DIADMP C[Si](C)(C)C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172073186 1051275647 /nfs/dbraw/zinc/27/56/47/1051275647.db2.gz OZLKXBUKTZJBBC-REPLKXPHSA-N 2 1 316.565 4.039 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2CC24CCCC4)C3)cc1 ZINC001172077619 1051276350 /nfs/dbraw/zinc/27/63/50/1051276350.db2.gz ULNIJQMXXPUDOB-BURNTYAHSA-N 2 1 324.512 4.494 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075626 1051276461 /nfs/dbraw/zinc/27/64/61/1051276461.db2.gz COKVPGUTYFPSGJ-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172075626 1051276467 /nfs/dbraw/zinc/27/64/67/1051276467.db2.gz COKVPGUTYFPSGJ-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172075626 1051276474 /nfs/dbraw/zinc/27/64/74/1051276474.db2.gz COKVPGUTYFPSGJ-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172075626 1051276481 /nfs/dbraw/zinc/27/64/81/1051276481.db2.gz COKVPGUTYFPSGJ-PBASOCQRSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076096 1051277032 /nfs/dbraw/zinc/27/70/32/1051277032.db2.gz VGKCQFNVDVSBOI-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076096 1051277048 /nfs/dbraw/zinc/27/70/48/1051277048.db2.gz VGKCQFNVDVSBOI-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076096 1051277060 /nfs/dbraw/zinc/27/70/60/1051277060.db2.gz VGKCQFNVDVSBOI-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@@H]1CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076096 1051277077 /nfs/dbraw/zinc/27/70/77/1051277077.db2.gz VGKCQFNVDVSBOI-CGXNFDGLSA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC[C@H]4C[C@H]42)C3)cc1 ZINC001172081350 1051277264 /nfs/dbraw/zinc/27/72/64/1051277264.db2.gz CBMRRWPKGULULD-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCC[C@H]4C[C@H]42)C3)cc1 ZINC001172081350 1051277274 /nfs/dbraw/zinc/27/72/74/1051277274.db2.gz CBMRRWPKGULULD-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@@H+]2CCC[C@H]4C[C@H]42)C3)cc1 ZINC001172081350 1051277291 /nfs/dbraw/zinc/27/72/91/1051277291.db2.gz CBMRRWPKGULULD-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@@H]([N@H+]2CCC[C@H]4C[C@H]42)C3)cc1 ZINC001172081350 1051277303 /nfs/dbraw/zinc/27/73/03/1051277303.db2.gz CBMRRWPKGULULD-WRTQPQOASA-N 2 1 310.485 4.056 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001172076263 1051277545 /nfs/dbraw/zinc/27/75/45/1051277545.db2.gz XJYGNBXSPUVLQM-UMOULQGESA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CC4CCC2CC4)C3)cc1 ZINC001172076263 1051277557 /nfs/dbraw/zinc/27/75/57/1051277557.db2.gz XJYGNBXSPUVLQM-UMOULQGESA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@@H+]2CC4CCC2CC4)C3)cc1 ZINC001172076263 1051277570 /nfs/dbraw/zinc/27/75/70/1051277570.db2.gz XJYGNBXSPUVLQM-UMOULQGESA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CCC[C@H]2C[C@H]([N@H+]2CC4CCC2CC4)C3)cc1 ZINC001172076263 1051277581 /nfs/dbraw/zinc/27/75/81/1051277581.db2.gz XJYGNBXSPUVLQM-UMOULQGESA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCCCCC2)C3)cc1 ZINC001172080039 1051278258 /nfs/dbraw/zinc/27/82/58/1051278258.db2.gz SJROLCXWRQIATD-AERCQKQUSA-N 2 1 312.501 4.448 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH+]2CCCCCC2)C3)cc1 ZINC001172080039 1051278263 /nfs/dbraw/zinc/27/82/63/1051278263.db2.gz SJROLCXWRQIATD-AERCQKQUSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@H]1C[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082434 1051279122 /nfs/dbraw/zinc/27/91/22/1051279122.db2.gz JYCMSDIWZSUNDN-AYWYSENESA-N 2 1 324.512 4.447 20 0 DIADMP C[C@H]1C[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082434 1051279130 /nfs/dbraw/zinc/27/91/30/1051279130.db2.gz JYCMSDIWZSUNDN-AYWYSENESA-N 2 1 324.512 4.447 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082434 1051279138 /nfs/dbraw/zinc/27/91/38/1051279138.db2.gz JYCMSDIWZSUNDN-AYWYSENESA-N 2 1 324.512 4.447 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082434 1051279149 /nfs/dbraw/zinc/27/91/49/1051279149.db2.gz JYCMSDIWZSUNDN-AYWYSENESA-N 2 1 324.512 4.447 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1 ZINC001172101633 1051282215 /nfs/dbraw/zinc/28/22/15/1051282215.db2.gz GOMWURPSWILHAD-XMTFNYHQSA-N 2 1 306.881 4.396 20 0 DIADMP CC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC001172101633 1051282226 /nfs/dbraw/zinc/28/22/26/1051282226.db2.gz GOMWURPSWILHAD-XMTFNYHQSA-N 2 1 306.881 4.396 20 0 DIADMP CC1(C)CCC[N@@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172067748 1051283799 /nfs/dbraw/zinc/28/37/99/1051283799.db2.gz FKQSHIPJJQWRFP-PMOLBWCYSA-N 2 1 312.501 4.447 20 0 DIADMP CC1(C)CCC[N@H+]1[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172067748 1051283812 /nfs/dbraw/zinc/28/38/12/1051283812.db2.gz FKQSHIPJJQWRFP-PMOLBWCYSA-N 2 1 312.501 4.447 20 0 DIADMP CC1(C)CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172067748 1051283823 /nfs/dbraw/zinc/28/38/23/1051283823.db2.gz FKQSHIPJJQWRFP-PMOLBWCYSA-N 2 1 312.501 4.447 20 0 DIADMP CC1(C)CCC[NH+]1[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172067748 1051283836 /nfs/dbraw/zinc/28/38/36/1051283836.db2.gz FKQSHIPJJQWRFP-PMOLBWCYSA-N 2 1 312.501 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2CC4(CCC4)C2)C3)cc1 ZINC001172065266 1051284079 /nfs/dbraw/zinc/28/40/79/1051284079.db2.gz JTXNOTIYASZIFI-NUZGMZIFSA-N 2 1 324.512 4.494 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172063664 1051284559 /nfs/dbraw/zinc/28/45/59/1051284559.db2.gz CJFIRPZGGDDJGC-MZADTFQBSA-N 2 1 324.468 4.263 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172063664 1051284568 /nfs/dbraw/zinc/28/45/68/1051284568.db2.gz CJFIRPZGGDDJGC-MZADTFQBSA-N 2 1 324.468 4.263 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)o1 ZINC001172063772 1051285045 /nfs/dbraw/zinc/28/50/45/1051285045.db2.gz CKSSQMBBUGQEJQ-ACDBMABISA-N 2 1 324.468 4.263 20 0 DIADMP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)o1 ZINC001172063772 1051285055 /nfs/dbraw/zinc/28/50/55/1051285055.db2.gz CKSSQMBBUGQEJQ-ACDBMABISA-N 2 1 324.468 4.263 20 0 DIADMP CC(C)[C@@H](C)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172065524 1051286271 /nfs/dbraw/zinc/28/62/71/1051286271.db2.gz OAIKSJJDHIUAKS-RSPOEFSDSA-N 2 1 300.490 4.206 20 0 DIADMP CC[C@H](C)[N@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069071 1051287618 /nfs/dbraw/zinc/28/76/18/1051287618.db2.gz NSVZKDXNPHQWBI-FFGOWVMKSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H](C)[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172069071 1051287633 /nfs/dbraw/zinc/28/76/33/1051287633.db2.gz NSVZKDXNPHQWBI-FFGOWVMKSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H](C)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069071 1051287643 /nfs/dbraw/zinc/28/76/43/1051287643.db2.gz NSVZKDXNPHQWBI-FFGOWVMKSA-N 2 1 300.490 4.302 20 0 DIADMP CC[C@H](C)[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172069071 1051287653 /nfs/dbraw/zinc/28/76/53/1051287653.db2.gz NSVZKDXNPHQWBI-FFGOWVMKSA-N 2 1 300.490 4.302 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2CCC4(CC4)CC2)C3)cc1 ZINC001172067904 1051288547 /nfs/dbraw/zinc/28/85/47/1051288547.db2.gz GILCBPRZHZUOAR-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2CCCCC2)C3)cc1 ZINC001172069189 1051289564 /nfs/dbraw/zinc/28/95/64/1051289564.db2.gz RWIAYUMGTRJBRW-MZADTFQBSA-N 2 1 312.501 4.494 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)c(F)c1 ZINC001172108132 1051297927 /nfs/dbraw/zinc/29/79/27/1051297927.db2.gz QECDEWNJMXMRTE-REBRKWNGSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(F)c1 ZINC001172108132 1051297938 /nfs/dbraw/zinc/29/79/38/1051297938.db2.gz QECDEWNJMXMRTE-REBRKWNGSA-N 2 1 310.844 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)C2 ZINC001172108721 1051298234 /nfs/dbraw/zinc/29/82/34/1051298234.db2.gz YMKLSWURPDRSCU-BTTYYORXSA-N 2 1 313.272 4.098 20 0 DIADMP CCC[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172110757 1051298892 /nfs/dbraw/zinc/29/88/92/1051298892.db2.gz OROMZSNEXHWZRT-YYAJDYIMSA-N 2 1 304.453 4.272 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172109694 1051299126 /nfs/dbraw/zinc/29/91/26/1051299126.db2.gz JZASRAQQGVMMMB-RDGPPVDQSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172109694 1051299141 /nfs/dbraw/zinc/29/91/41/1051299141.db2.gz JZASRAQQGVMMMB-RDGPPVDQSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CC1)c1ccccc1F)C2 ZINC001172110188 1051299408 /nfs/dbraw/zinc/29/94/08/1051299408.db2.gz ISNYQGCKKVKQPG-AXVVYFOYSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172109101 1051299531 /nfs/dbraw/zinc/29/95/31/1051299531.db2.gz AXSQBOFKUXUCPN-VIYGXFRKSA-N 2 1 312.501 4.318 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCC[C@@H](c3ccccc3)C1)C2 ZINC001172109101 1051299543 /nfs/dbraw/zinc/29/95/43/1051299543.db2.gz AXSQBOFKUXUCPN-VIYGXFRKSA-N 2 1 312.501 4.318 20 0 DIADMP CCC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001172111155 1051300074 /nfs/dbraw/zinc/30/00/74/1051300074.db2.gz QKRZEFKLZPIEJJ-RDGPPVDQSA-N 2 1 304.453 4.272 20 0 DIADMP CCC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001172111155 1051300088 /nfs/dbraw/zinc/30/00/88/1051300088.db2.gz QKRZEFKLZPIEJJ-RDGPPVDQSA-N 2 1 304.453 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccccc1F)C1CCC1)C2 ZINC001172111038 1051300296 /nfs/dbraw/zinc/30/02/96/1051300296.db2.gz PVVXJHLIUGLWRD-CLWJZODNSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccccc1F)C1CCC1)C2 ZINC001172111038 1051300307 /nfs/dbraw/zinc/30/03/07/1051300307.db2.gz PVVXJHLIUGLWRD-CLWJZODNSA-N 2 1 316.464 4.272 20 0 DIADMP CCc1ccc([C@@H](CC)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC001172111879 1051300540 /nfs/dbraw/zinc/30/05/40/1051300540.db2.gz XTMQMFBXYASQEA-IYWMVGAKSA-N 2 1 300.490 4.305 20 0 DIADMP CCc1ccc([C@@H](CC)[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172111879 1051300549 /nfs/dbraw/zinc/30/05/49/1051300549.db2.gz XTMQMFBXYASQEA-IYWMVGAKSA-N 2 1 300.490 4.305 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)cc(Cl)c1 ZINC001172110457 1051302558 /nfs/dbraw/zinc/30/25/58/1051302558.db2.gz MZUPKRKWVYVLAW-KLWIRTJPSA-N 2 1 310.844 4.145 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc3sccc31)C2 ZINC001172118276 1051304973 /nfs/dbraw/zinc/30/49/73/1051304973.db2.gz QVSLQWDXLNZPPE-PHZGNYQRSA-N 2 1 300.471 4.006 20 0 DIADMP Cc1cn2cc(Nc3ccc(C[NH2+]CC(C)C)cc3)ccc2[nH+]1 ZINC001215744833 1051339218 /nfs/dbraw/zinc/33/92/18/1051339218.db2.gz KKCZWYQDNKPTSI-UHFFFAOYSA-N 2 1 308.429 4.132 20 0 DIADMP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C[C@@H]1C ZINC001172370951 1051378912 /nfs/dbraw/zinc/37/89/12/1051378912.db2.gz RPUWECGCHPXJJN-OWCLPIDISA-N 2 1 320.908 4.415 20 0 DIADMP CC[C@@H](CC(C)C)[NH+]1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC001172405857 1051380526 /nfs/dbraw/zinc/38/05/26/1051380526.db2.gz DBAQARAFFFBUJC-IBGZPJMESA-N 2 1 302.506 4.408 20 0 DIADMP CC[C@@H](CC(C)C)[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001172387934 1051391963 /nfs/dbraw/zinc/39/19/63/1051391963.db2.gz ZJPIIJCYYUDFOE-UXHICEINSA-N 2 1 302.506 4.313 20 0 DIADMP CC[C@@H](CC(C)C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001172393522 1051394099 /nfs/dbraw/zinc/39/40/99/1051394099.db2.gz ZATVRRBMBPUOON-IBGZPJMESA-N 2 1 302.506 4.108 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172390609 1051394947 /nfs/dbraw/zinc/39/49/47/1051394947.db2.gz WHMFOMVCGCPMSF-SXLOBPIMSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001172390609 1051394956 /nfs/dbraw/zinc/39/49/56/1051394956.db2.gz WHMFOMVCGCPMSF-SXLOBPIMSA-N 2 1 302.506 4.454 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172554326 1051437276 /nfs/dbraw/zinc/43/72/76/1051437276.db2.gz XTIADIQNJJDYRT-WOJBJXKFSA-N 2 1 300.490 4.131 20 0 DIADMP CC(C)[N@H+]1CC[C@H]([NH2+][C@H]2CC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC001172557199 1051438140 /nfs/dbraw/zinc/43/81/40/1051438140.db2.gz PAKVHJNCQGJKMQ-LMCOJAPRSA-N 2 1 300.490 4.031 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001172538085 1051452157 /nfs/dbraw/zinc/45/21/57/1051452157.db2.gz LUEKXFJCVWUAQA-DFQSSKMNSA-N 2 1 300.490 4.034 20 0 DIADMP CC(C)(C)C[N@H+](C1CC(C)(C)OC(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172653996 1051472812 /nfs/dbraw/zinc/47/28/12/1051472812.db2.gz USCIGHYXLBJDDM-WKILWMFISA-N 2 1 324.553 4.341 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc(Cl)cc(Cl)c1 ZINC001169101482 1051511076 /nfs/dbraw/zinc/51/10/76/1051511076.db2.gz SQAPFDRKIXSPSS-HGGPSHQYSA-N 2 1 313.272 4.269 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1CCC(Cc3ccccc3)CC1)C2 ZINC001172818440 1051512110 /nfs/dbraw/zinc/51/21/10/1051512110.db2.gz LUYHASFGEYPSKK-ZHLPAPNQSA-N 2 1 312.501 4.003 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]Cc1ccc(-c3ccsc3)cc1)C2 ZINC001169100521 1051512416 /nfs/dbraw/zinc/51/24/16/1051512416.db2.gz KJPVKZOVSBGPFF-LDLYASANSA-N 2 1 312.482 4.130 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001169125286 1051522189 /nfs/dbraw/zinc/52/21/89/1051522189.db2.gz YHULBRNFUQCDNE-AKHDSKFASA-N 2 1 318.892 4.048 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(c3ccc(Cl)cc3)CC1)C2 ZINC001169126312 1051524719 /nfs/dbraw/zinc/52/47/19/1051524719.db2.gz RNQVAOXVJWUNEC-REPLKXPHSA-N 2 1 318.892 4.145 20 0 DIADMP Cc1cc([NH2+][C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)ccc1N(C)C ZINC001169150089 1051535739 /nfs/dbraw/zinc/53/57/39/1051535739.db2.gz ASBVLQRZFUMLCW-VQIMIIECSA-N 2 1 303.494 4.017 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)c(C(C)C)c1 ZINC001169178057 1051546967 /nfs/dbraw/zinc/54/69/67/1051546967.db2.gz OOGBUXBMOLYKQH-KRWDZBQOSA-N 2 1 302.506 4.317 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001169240890 1051561663 /nfs/dbraw/zinc/56/16/63/1051561663.db2.gz MSNQBPPHLLYDJH-LJQANCHMSA-N 2 1 304.453 4.131 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000178295936 1051566300 /nfs/dbraw/zinc/56/63/00/1051566300.db2.gz OERNLAHCDLKHCL-UHFFFAOYSA-N 2 1 318.464 4.220 20 0 DIADMP [NH3+][C@H]1CC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)CC[C@@H]1F ZINC001206185418 1051588894 /nfs/dbraw/zinc/58/88/94/1051588894.db2.gz NOFVMTCUUMSCMM-RHKQXDRASA-N 2 1 324.443 4.118 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@@H](C)C(F)(F)CC2)CC1 ZINC001173109953 1051610247 /nfs/dbraw/zinc/61/02/47/1051610247.db2.gz LZRNKKZLKUUWMB-QQFBHYJXSA-N 2 1 302.453 4.007 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)C/C=C/c2ccccc2)CC1 ZINC001173113046 1051611377 /nfs/dbraw/zinc/61/13/77/1051611377.db2.gz HDYWPSBRBSBFMI-FMIVXFBMSA-N 2 1 300.490 4.285 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2cccc(F)c2)CC1 ZINC001173113173 1051611763 /nfs/dbraw/zinc/61/17/63/1051611763.db2.gz KIGUPNVVQPGICA-UHFFFAOYSA-N 2 1 306.469 4.301 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@H](C)c2ccc(OC)cc2)CC1 ZINC001173114893 1051611832 /nfs/dbraw/zinc/61/18/32/1051611832.db2.gz VLSNCVKWOJFFNJ-IPJUCJBFSA-N 2 1 318.505 4.341 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2ccc(F)cc2F)CC1 ZINC001173113049 1051611941 /nfs/dbraw/zinc/61/19/41/1051611941.db2.gz HHCZMCIONQYOOJ-UHFFFAOYSA-N 2 1 310.432 4.050 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@H](C)c2ccccc2OC)CC1 ZINC001173113369 1051612004 /nfs/dbraw/zinc/61/20/04/1051612004.db2.gz OIFALQKAYSDOFI-WWDZGPRUSA-N 2 1 318.505 4.341 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2ccc(C)c(C)c2)CC1 ZINC001173113127 1051612217 /nfs/dbraw/zinc/61/22/17/1051612217.db2.gz HRLXOGOSEDROFH-UHFFFAOYSA-N 2 1 302.506 4.388 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2Cc3ccccc3C[C@H]2C)CC1 ZINC001173113508 1051612262 /nfs/dbraw/zinc/61/22/62/1051612262.db2.gz RNXCBGSMBGELDH-PBPGXSGUSA-N 2 1 300.490 4.086 20 0 DIADMP CC[NH+](CC)C1CCC([N@@H+](C)[C@@H]2CCc3ccccc32)CC1 ZINC001173117851 1051613747 /nfs/dbraw/zinc/61/37/47/1051613747.db2.gz ZVRSXBRHZNRFMG-AFMYVXGZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(Cl)c1 ZINC000256049220 1051618908 /nfs/dbraw/zinc/61/89/08/1051618908.db2.gz YYCBATNHNWCKMI-DEQVHRJGSA-N 2 1 313.272 4.269 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@@H]([NH3+])C1 ZINC001173204039 1051626777 /nfs/dbraw/zinc/62/67/77/1051626777.db2.gz BZGSZXKEQRJMQJ-YLJYHZDGSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H]([NH3+])C1 ZINC001173204039 1051626790 /nfs/dbraw/zinc/62/67/90/1051626790.db2.gz BZGSZXKEQRJMQJ-YLJYHZDGSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@@H]([NH3+])C1 ZINC001173204035 1051626947 /nfs/dbraw/zinc/62/69/47/1051626947.db2.gz BZGSZXKEQRJMQJ-FXAWDEMLSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H]([NH3+])C1 ZINC001173204035 1051626957 /nfs/dbraw/zinc/62/69/57/1051626957.db2.gz BZGSZXKEQRJMQJ-FXAWDEMLSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+]C1CC[NH+](C)CC1 ZINC001173208874 1051647582 /nfs/dbraw/zinc/64/75/82/1051647582.db2.gz UKJBYCMXLPEXJG-GOSISDBHSA-N 2 1 322.496 4.281 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173249181 1051653208 /nfs/dbraw/zinc/65/32/08/1051653208.db2.gz KBHNEPPVEVNNTF-YYWHXJBOSA-N 2 1 316.533 4.408 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001173250303 1051653333 /nfs/dbraw/zinc/65/33/33/1051653333.db2.gz RVNNBWVGOJBEQJ-LRQRDZAKSA-N 2 1 314.517 4.304 20 0 DIADMP CCCC[C@@H](CC(C)C)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001173254065 1051656803 /nfs/dbraw/zinc/65/68/03/1051656803.db2.gz BGDXXWCNTVGTIV-PMACEKPBSA-N 2 1 324.553 4.167 20 0 DIADMP CCCC[C@@H](CC(C)C)[NH+]1CCC([N@@H+](C)C2CCOCC2)CC1 ZINC001173257671 1051659518 /nfs/dbraw/zinc/65/95/18/1051659518.db2.gz BWVCQOPSNRYQJG-FQEVSTJZSA-N 2 1 324.553 4.167 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173268933 1051666997 /nfs/dbraw/zinc/66/69/97/1051666997.db2.gz FGBDJOIPOXOTPM-XLNTUCKNSA-N 2 1 318.480 4.476 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@H](C[NH3+])[C@@H](C)C1 ZINC001206014301 1051667145 /nfs/dbraw/zinc/66/71/45/1051667145.db2.gz WJERYCNUZIKRQB-RBUKOAKNSA-N 2 1 322.496 4.469 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001206014294 1051667312 /nfs/dbraw/zinc/66/73/12/1051667312.db2.gz WJERYCNUZIKRQB-MOPGFXCFSA-N 2 1 322.496 4.469 20 0 DIADMP CC[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001173271015 1051668874 /nfs/dbraw/zinc/66/88/74/1051668874.db2.gz OYIGDZFUXCYPRE-HUUCEWRRSA-N 2 1 306.881 4.169 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272246 1051668938 /nfs/dbraw/zinc/66/89/38/1051668938.db2.gz UIIAPSOZDPCPIU-LEAZDLGRSA-N 2 1 300.490 4.337 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272245 1051669143 /nfs/dbraw/zinc/66/91/43/1051669143.db2.gz UIIAPSOZDPCPIU-FRYIKTPZSA-N 2 1 300.490 4.337 20 0 DIADMP CC[C@H]1CC[C@H]([NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)C1 ZINC001173273491 1051671314 /nfs/dbraw/zinc/67/13/14/1051671314.db2.gz FGZBHDDODWKUKW-ZFMNYDKASA-N 2 1 314.517 4.313 20 0 DIADMP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1cc[nH+]cc1C(F)(F)F ZINC001169695600 1051675847 /nfs/dbraw/zinc/67/58/47/1051675847.db2.gz HUSBEICIXVJERE-AWEZNQCLSA-N 2 1 321.346 4.341 20 0 DIADMP Cc1[nH+]ccc(N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1Cl ZINC000494020515 1051680059 /nfs/dbraw/zinc/68/00/59/1051680059.db2.gz NGRKJSSKHTYIGZ-HOCLYGCPSA-N 2 1 321.896 4.134 20 0 DIADMP Cc1[nH+]ccc(N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1Cl ZINC000494020513 1051680836 /nfs/dbraw/zinc/68/08/36/1051680836.db2.gz NGRKJSSKHTYIGZ-GDBMZVCRSA-N 2 1 321.896 4.134 20 0 DIADMP C[NH+]1CCC2(CC[N@H+]([C@@H]3CCCC4(CCCCC4)C3)C2)CC1 ZINC001173342993 1051704065 /nfs/dbraw/zinc/70/40/65/1051704065.db2.gz FSWNHVMTEKEJKW-GOSISDBHSA-N 2 1 304.522 4.297 20 0 DIADMP CCC[N@@H+]1C[C@@H]2C[NH+]([C@@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173348697 1051706477 /nfs/dbraw/zinc/70/64/77/1051706477.db2.gz KRSIAAKNRNRAQG-CEXWTWQISA-N 2 1 304.522 4.153 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@H+]([C@@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173348697 1051706488 /nfs/dbraw/zinc/70/64/88/1051706488.db2.gz KRSIAAKNRNRAQG-CEXWTWQISA-N 2 1 304.522 4.153 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@@H+]([C@@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173348697 1051706499 /nfs/dbraw/zinc/70/64/99/1051706499.db2.gz KRSIAAKNRNRAQG-CEXWTWQISA-N 2 1 304.522 4.153 20 0 DIADMP C[N@@H+](C1CC1)C1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173347844 1051706645 /nfs/dbraw/zinc/70/66/45/1051706645.db2.gz BYBMZWULLBNUPZ-LJQANCHMSA-N 2 1 304.522 4.438 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822114 1051707464 /nfs/dbraw/zinc/70/74/64/1051707464.db2.gz RGJFYYOSZZISPO-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822114 1051707469 /nfs/dbraw/zinc/70/74/69/1051707469.db2.gz RGJFYYOSZZISPO-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822114 1051707473 /nfs/dbraw/zinc/70/74/73/1051707473.db2.gz RGJFYYOSZZISPO-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC001169822114 1051707480 /nfs/dbraw/zinc/70/74/80/1051707480.db2.gz RGJFYYOSZZISPO-QZTJIDSGSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183188853 1051710437 /nfs/dbraw/zinc/71/04/37/1051710437.db2.gz OTJCAUJIKPCPJO-ZMSDIMECSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H](C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1)CC(C)(C)C ZINC001169898912 1051726427 /nfs/dbraw/zinc/72/64/27/1051726427.db2.gz FYJUFMKQLDZNBM-YSIASYRMSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@H](C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)CC(C)(C)C ZINC001169898912 1051726438 /nfs/dbraw/zinc/72/64/38/1051726438.db2.gz FYJUFMKQLDZNBM-YSIASYRMSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@H](C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)CC(C)(C)C ZINC001169898912 1051726448 /nfs/dbraw/zinc/72/64/48/1051726448.db2.gz FYJUFMKQLDZNBM-YSIASYRMSA-N 2 1 314.517 4.123 20 0 DIADMP CC[C@@H]1CC[C@H]1Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000806158015 1051760722 /nfs/dbraw/zinc/76/07/22/1051760722.db2.gz VJXQVJQSBWJAEQ-YLJYHZDGSA-N 2 1 315.505 4.065 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C3(Cc4ccccc4)CC3)CC2)cc1 ZINC000186586416 1051823890 /nfs/dbraw/zinc/82/38/90/1051823890.db2.gz LVXAGWUSOMZSKA-UHFFFAOYSA-N 2 1 320.480 4.016 20 0 DIADMP c1ccc(C[NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000307315399 1051860969 /nfs/dbraw/zinc/86/09/69/1051860969.db2.gz IUJRBTMHBYXRIZ-NRFANRHFSA-N 2 1 308.469 4.079 20 0 DIADMP c1ccc(C[NH2+]C[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000307315671 1051861427 /nfs/dbraw/zinc/86/14/27/1051861427.db2.gz IUJRBTMHBYXRIZ-OAQYLSRUSA-N 2 1 308.469 4.079 20 0 DIADMP c1csc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3CCC34CCCC4)C2)c1 ZINC000189100290 1051878608 /nfs/dbraw/zinc/87/86/08/1051878608.db2.gz XYGZKLIXBIIINW-FUHWJXTLSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@@H](C[NH2+][C@@H]3CCC34CCCC4)C2)c1 ZINC000189100290 1051878613 /nfs/dbraw/zinc/87/86/13/1051878613.db2.gz XYGZKLIXBIIINW-FUHWJXTLSA-N 2 1 318.530 4.273 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2)cc1 ZINC000768170260 1051891946 /nfs/dbraw/zinc/89/19/46/1051891946.db2.gz NDHJRSJBBMBMGO-UHFFFAOYSA-N 2 1 302.849 4.034 20 0 DIADMP C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768267604 1051911678 /nfs/dbraw/zinc/91/16/78/1051911678.db2.gz VSUJWBNLKPMNHL-AWEZNQCLSA-N 2 1 318.411 4.219 20 0 DIADMP C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768267604 1051911685 /nfs/dbraw/zinc/91/16/85/1051911685.db2.gz VSUJWBNLKPMNHL-AWEZNQCLSA-N 2 1 318.411 4.219 20 0 DIADMP c1cn2cc(Nc3ccccc3C[NH+]3CCCCC3)ccc2[nH+]1 ZINC001174278732 1052086142 /nfs/dbraw/zinc/08/61/42/1052086142.db2.gz GPNLGYCMTNSONB-UHFFFAOYSA-N 2 1 306.413 4.064 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)cs2)CC1 ZINC000495076668 1052211578 /nfs/dbraw/zinc/21/15/78/1052211578.db2.gz BDQBODAOHRBIOF-UHFFFAOYSA-N 2 1 314.926 4.345 20 0 DIADMP CCC[C@H](Oc1ccccc1C[NH+]1CCC([NH3+])CC1)[C@@H](C)CC ZINC001218292779 1052217693 /nfs/dbraw/zinc/21/76/93/1052217693.db2.gz TVMMZRXCOLICAF-LPHOPBHVSA-N 2 1 318.505 4.203 20 0 DIADMP CC(C)CCC[C@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218312744 1052222913 /nfs/dbraw/zinc/22/29/13/1052222913.db2.gz YNYRMMCTAVGICI-KRWDZBQOSA-N 2 1 318.505 4.203 20 0 DIADMP CCCC/C=C/[C@H](C)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218354564 1052229430 /nfs/dbraw/zinc/22/94/30/1052229430.db2.gz GUQAEHPIZUTWMV-NADMHLTPSA-N 2 1 316.489 4.123 20 0 DIADMP C[C@H](C[NH2+][C@H](C)c1csc(Cl)c1)C[NH+]1CCCCC1 ZINC000230408196 1052267886 /nfs/dbraw/zinc/26/78/86/1052267886.db2.gz QVHCQNLKTJEZRO-CHWSQXEVSA-N 2 1 300.899 4.174 20 0 DIADMP C[N@@H+](CCC[NH2+]C1CCC(C(F)(F)F)CC1)C1CCCCC1 ZINC000237077131 1052434690 /nfs/dbraw/zinc/43/46/90/1052434690.db2.gz CXHLSMGJMSPTGG-UHFFFAOYSA-N 2 1 320.443 4.352 20 0 DIADMP C[C@H](C[N@H+]1CC[C@]2(C1)CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222141629 1052449342 /nfs/dbraw/zinc/44/93/42/1052449342.db2.gz PDQJWUXCFJIFPQ-DYESRHJHSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@@H](C[N@H+]1CC[C@]2(C1)CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222141630 1052449710 /nfs/dbraw/zinc/44/97/10/1052449710.db2.gz PDQJWUXCFJIFPQ-LAUBAEHRSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@]2(C1)CCC[NH2+]C2)c1cccc2ccccc21 ZINC001222141631 1052449763 /nfs/dbraw/zinc/44/97/63/1052449763.db2.gz PDQJWUXCFJIFPQ-UTKZUKDTSA-N 2 1 308.469 4.019 20 0 DIADMP C[C@@H](C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1)c1ccccc1 ZINC001222153912 1052451589 /nfs/dbraw/zinc/45/15/89/1052451589.db2.gz CNUUYWPEPBFTIR-ICSRJNTNSA-N 2 1 300.490 4.036 20 0 DIADMP Cc1c(C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222154667 1052453141 /nfs/dbraw/zinc/45/31/41/1052453141.db2.gz PHFJIRPJXWJLRF-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP Clc1ccccc1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222162131 1052453832 /nfs/dbraw/zinc/45/38/32/1052453832.db2.gz ZEYFHPGDWOSFFU-SFHVURJKSA-N 2 1 306.881 4.086 20 0 DIADMP Clc1ccccc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222162131 1052453837 /nfs/dbraw/zinc/45/38/37/1052453837.db2.gz ZEYFHPGDWOSFFU-SFHVURJKSA-N 2 1 306.881 4.086 20 0 DIADMP Cc1cc(C[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c(C)s1 ZINC001222162080 1052454202 /nfs/dbraw/zinc/45/42/02/1052454202.db2.gz XJADLAPTQGMAPX-GOSISDBHSA-N 2 1 306.519 4.111 20 0 DIADMP c1cc2cccc(C[N@H+]3CCCC[C@]4(CCCC[NH2+]C4)C3)c2o1 ZINC001222173533 1052457230 /nfs/dbraw/zinc/45/72/30/1052457230.db2.gz UNFPYTMEASGUPM-FQEVSTJZSA-N 2 1 312.457 4.179 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222248950 1052468940 /nfs/dbraw/zinc/46/89/40/1052468940.db2.gz OLCJFVUEWHMEOB-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001222248950 1052468943 /nfs/dbraw/zinc/46/89/43/1052468943.db2.gz OLCJFVUEWHMEOB-QFIPXVFZSA-N 2 1 320.480 4.380 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCC[C@]23CCC[NH2+]C3)cc1 ZINC001222248616 1052468985 /nfs/dbraw/zinc/46/89/85/1052468985.db2.gz LSAAZHDGWQPUAN-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@]23CCC[NH2+]C3)cc1 ZINC001222248616 1052468989 /nfs/dbraw/zinc/46/89/89/1052468989.db2.gz LSAAZHDGWQPUAN-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CCC[C@@]34CCC[NH2+]C4)cc2)c1 ZINC001222249836 1052469337 /nfs/dbraw/zinc/46/93/37/1052469337.db2.gz WYROGTFZLPTMIY-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]C4)cc2)c1 ZINC001222249836 1052469339 /nfs/dbraw/zinc/46/93/39/1052469339.db2.gz WYROGTFZLPTMIY-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP CCCCc1ccc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000316667335 1052471322 /nfs/dbraw/zinc/47/13/22/1052471322.db2.gz UTYKKBZLKLOJQE-FFZOFVMBSA-N 2 1 300.490 4.307 20 0 DIADMP C1C[C@H]2C[C@H]([NH2+][C@H]3CCCC[C@H]3C3CCCCC3)CC[N@H+]2C1 ZINC000316720165 1052471612 /nfs/dbraw/zinc/47/16/12/1052471612.db2.gz FISYUDXQHLSSMH-FYQPLNBISA-N 2 1 304.522 4.342 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CCC[C@@]3(CC[NH2+]3)C2)CC1 ZINC001222277646 1052472701 /nfs/dbraw/zinc/47/27/01/1052472701.db2.gz QCOVHRHAELKHNQ-VQTJNVASSA-N 2 1 302.506 4.287 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000316783433 1052472897 /nfs/dbraw/zinc/47/28/97/1052472897.db2.gz MXWHIDMSFVFRCC-ILXRZTDVSA-N 2 1 300.446 4.129 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000316783433 1052472902 /nfs/dbraw/zinc/47/29/02/1052472902.db2.gz MXWHIDMSFVFRCC-ILXRZTDVSA-N 2 1 300.446 4.129 20 0 DIADMP CCCCc1ccc(C[NH+]2CCC3(CCCC[NH2+]3)CC2)s1 ZINC001222292601 1052474934 /nfs/dbraw/zinc/47/49/34/1052474934.db2.gz HIDXLGYGIPWCSJ-UHFFFAOYSA-N 2 1 306.519 4.199 20 0 DIADMP c1cc2ccc(C[N@H+]3CCC[C@@]34CCC[NH2+]CC4)cc2s1 ZINC001222320590 1052481863 /nfs/dbraw/zinc/48/18/63/1052481863.db2.gz KVVGOYPMHWHRKH-GOSISDBHSA-N 2 1 300.471 4.009 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC001222471842 1052503499 /nfs/dbraw/zinc/50/34/99/1052503499.db2.gz ZQRTUUUOXFLKCT-FQEVSTJZSA-N 2 1 322.477 4.382 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC001222471842 1052503506 /nfs/dbraw/zinc/50/35/06/1052503506.db2.gz ZQRTUUUOXFLKCT-FQEVSTJZSA-N 2 1 322.477 4.382 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC001222471843 1052503798 /nfs/dbraw/zinc/50/37/98/1052503798.db2.gz ZQRTUUUOXFLKCT-HXUWFJFHSA-N 2 1 322.477 4.382 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC001222471843 1052503802 /nfs/dbraw/zinc/50/38/02/1052503802.db2.gz ZQRTUUUOXFLKCT-HXUWFJFHSA-N 2 1 322.477 4.382 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)cc2)c1 ZINC001222629167 1052520159 /nfs/dbraw/zinc/52/01/59/1052520159.db2.gz CVWYEEMDCIJULM-SZPZYZBQSA-N 2 1 320.480 4.093 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050978 1052563538 /nfs/dbraw/zinc/56/35/38/1052563538.db2.gz XOQITRKPQDLMHJ-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)C1CCCC1 ZINC000398050978 1052563548 /nfs/dbraw/zinc/56/35/48/1052563548.db2.gz XOQITRKPQDLMHJ-HLIPFELVSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000398052611 1052564629 /nfs/dbraw/zinc/56/46/29/1052564629.db2.gz YJEFYBNNRCEKEY-LCLWPZTBSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398052611 1052564635 /nfs/dbraw/zinc/56/46/35/1052564635.db2.gz YJEFYBNNRCEKEY-LCLWPZTBSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccs1 ZINC000398111285 1052565632 /nfs/dbraw/zinc/56/56/32/1052565632.db2.gz DEAYZMXQFAVABY-SOLBZPMBSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1cccs1 ZINC000398111285 1052565640 /nfs/dbraw/zinc/56/56/40/1052565640.db2.gz DEAYZMXQFAVABY-SOLBZPMBSA-N 2 1 314.498 4.309 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCc3sc(Cl)cc32)CC1 ZINC000123390262 1052604885 /nfs/dbraw/zinc/60/48/85/1052604885.db2.gz RYHHTRMZPZLJDF-ZDUSSCGKSA-N 2 1 312.910 4.241 20 0 DIADMP c1csc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCC2)c1 ZINC000037649475 1052627881 /nfs/dbraw/zinc/62/78/81/1052627881.db2.gz FOYAGXRYGRKXNG-KDOFPFPSSA-N 2 1 304.503 4.053 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2c3ccccc3C[C@@H]2C)c1 ZINC000123927251 1052636476 /nfs/dbraw/zinc/63/64/76/1052636476.db2.gz LPLUBLXATRLMDA-KKSFZXQISA-N 2 1 308.469 4.161 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000124432976 1052641267 /nfs/dbraw/zinc/64/12/67/1052641267.db2.gz MIPQCAMGNNQECE-YLJYHZDGSA-N 2 1 311.473 4.097 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000124432976 1052641268 /nfs/dbraw/zinc/64/12/68/1052641268.db2.gz MIPQCAMGNNQECE-YLJYHZDGSA-N 2 1 311.473 4.097 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1)C1CC1 ZINC000125186837 1052645720 /nfs/dbraw/zinc/64/57/20/1052645720.db2.gz UFEQBDFXUKHDTK-UZLBHIALSA-N 2 1 300.490 4.236 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3c(s2)CCC3)C1 ZINC000125863583 1052656367 /nfs/dbraw/zinc/65/63/67/1052656367.db2.gz UERMLNNJTMUWLX-GJZGRUSLSA-N 2 1 306.519 4.008 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1cccc(O)c1 ZINC000126609559 1052672691 /nfs/dbraw/zinc/67/26/91/1052672691.db2.gz YTSOPTORALKPIU-GJYPPUQNSA-N 2 1 316.489 4.086 20 0 DIADMP c1ccc(C(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000126646991 1052672719 /nfs/dbraw/zinc/67/27/19/1052672719.db2.gz SYEXMGFSHWIBHT-LEWJYISDSA-N 2 1 320.480 4.035 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1cccs1 ZINC000126797090 1052678259 /nfs/dbraw/zinc/67/82/59/1052678259.db2.gz VDZDYDCDDAHTDK-CABCVRRESA-N 2 1 320.527 4.372 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1cccs1 ZINC000126797090 1052678262 /nfs/dbraw/zinc/67/82/62/1052678262.db2.gz VDZDYDCDDAHTDK-CABCVRRESA-N 2 1 320.527 4.372 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cc1 ZINC000128230997 1052713172 /nfs/dbraw/zinc/71/31/72/1052713172.db2.gz KEAXOENIVGIVIN-KRWDZBQOSA-N 2 1 309.457 4.018 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587627 1052797344 /nfs/dbraw/zinc/79/73/44/1052797344.db2.gz FVLAAJNPEJEFGM-MDZLAQPJSA-N 2 1 301.261 4.127 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000129587627 1052797348 /nfs/dbraw/zinc/79/73/48/1052797348.db2.gz FVLAAJNPEJEFGM-MDZLAQPJSA-N 2 1 301.261 4.127 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556178294 1052817057 /nfs/dbraw/zinc/81/70/57/1052817057.db2.gz YZZCEXQWCRXFOE-OWCLPIDISA-N 2 1 314.395 4.143 20 0 DIADMP CC[C@H](CC(F)(F)F)[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556178294 1052817061 /nfs/dbraw/zinc/81/70/61/1052817061.db2.gz YZZCEXQWCRXFOE-OWCLPIDISA-N 2 1 314.395 4.143 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)CC[N@@H+]1C ZINC000498353585 1052820382 /nfs/dbraw/zinc/82/03/82/1052820382.db2.gz MXWPZAVTOQPQHD-VBSBHUPXSA-N 2 1 300.490 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)CC[N@H+]1C ZINC000498353585 1052820383 /nfs/dbraw/zinc/82/03/83/1052820383.db2.gz MXWPZAVTOQPQHD-VBSBHUPXSA-N 2 1 300.490 4.175 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000556225340 1052822899 /nfs/dbraw/zinc/82/28/99/1052822899.db2.gz SKZSHIIDXIKOOX-CHPDAQJUSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]C2CC(C(C)(C)C)C2)C[C@H]1c1ccccc1 ZINC000556225340 1052822901 /nfs/dbraw/zinc/82/29/01/1052822901.db2.gz SKZSHIIDXIKOOX-CHPDAQJUSA-N 2 1 300.490 4.236 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC2CCCC2)CC1 ZINC000556263252 1052829540 /nfs/dbraw/zinc/82/95/40/1052829540.db2.gz FHULXTDIGOZIDN-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(F)c1F ZINC000556281209 1052831967 /nfs/dbraw/zinc/83/19/67/1052831967.db2.gz MDZMJXJEGPOJIQ-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(F)c1F ZINC000556281209 1052831969 /nfs/dbraw/zinc/83/19/69/1052831969.db2.gz MDZMJXJEGPOJIQ-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000556817980 1052886408 /nfs/dbraw/zinc/88/64/08/1052886408.db2.gz WNGBYFBDFIWBPB-IAGOWNOFSA-N 2 1 304.503 4.049 20 0 DIADMP CC1=CC[C@@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000556817980 1052886411 /nfs/dbraw/zinc/88/64/11/1052886411.db2.gz WNGBYFBDFIWBPB-IAGOWNOFSA-N 2 1 304.503 4.049 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000556817982 1052886530 /nfs/dbraw/zinc/88/65/30/1052886530.db2.gz WNGBYFBDFIWBPB-SJORKVTESA-N 2 1 304.503 4.049 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000556817982 1052886535 /nfs/dbraw/zinc/88/65/35/1052886535.db2.gz WNGBYFBDFIWBPB-SJORKVTESA-N 2 1 304.503 4.049 20 0 DIADMP COc1c(C)cc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc1C ZINC000920179703 1052925397 /nfs/dbraw/zinc/92/53/97/1052925397.db2.gz NTOGVHMAIWEWMT-GOSISDBHSA-N 2 1 318.505 4.056 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@H+](C)C2CCCC2)C[C@H](c2ccccc2)C1 ZINC000323422095 1053064047 /nfs/dbraw/zinc/06/40/47/1053064047.db2.gz SYRGNHMMGRFXHR-DFQSSKMNSA-N 2 1 314.517 4.423 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC[N@@H+](C)C2CCCC2)C[C@H](c2ccccc2)C1 ZINC000323422095 1053064053 /nfs/dbraw/zinc/06/40/53/1053064053.db2.gz SYRGNHMMGRFXHR-DFQSSKMNSA-N 2 1 314.517 4.423 20 0 DIADMP CCC(C)(C)c1ccc(C[NH+]2CCC3(CCC[NH2+]3)CC2)cc1 ZINC001228555667 1053134108 /nfs/dbraw/zinc/13/41/08/1053134108.db2.gz HPZDVLPIXWUZRR-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]CC2([NH+](C)C)CCCC2)C[C@H](c2ccccc2)C1 ZINC000323645543 1053163858 /nfs/dbraw/zinc/16/38/58/1053163858.db2.gz UUKZWERFUUYURQ-DFQSSKMNSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000251196523 1053225995 /nfs/dbraw/zinc/22/59/95/1053225995.db2.gz UNIVSXZCMZXEIR-BZSNNMDCSA-N 2 1 306.881 4.398 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)C1 ZINC001319199012 1053227309 /nfs/dbraw/zinc/22/73/09/1053227309.db2.gz LSXLBOYEXKSXIR-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cl)cc1 ZINC000251346830 1053231602 /nfs/dbraw/zinc/23/16/02/1053231602.db2.gz RFVKPFMWTCYWAR-BZSNNMDCSA-N 2 1 306.881 4.254 20 0 DIADMP Fc1ccccc1[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)C1CCCC1 ZINC000091284498 1053257813 /nfs/dbraw/zinc/25/78/13/1053257813.db2.gz BRYRWVVKLAVWFK-YWZLYKJASA-N 2 1 316.464 4.131 20 0 DIADMP Fc1ccc([C@@H]([NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000091284482 1053258702 /nfs/dbraw/zinc/25/87/02/1053258702.db2.gz MRZGQDZWUBVECD-YWZLYKJASA-N 2 1 316.464 4.131 20 0 DIADMP CC(C)[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000091266436 1053258830 /nfs/dbraw/zinc/25/88/30/1053258830.db2.gz FWKOAHDESJQEJP-MRXNPFEDSA-N 2 1 315.288 4.374 20 0 DIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC)C1 ZINC001319754867 1053270784 /nfs/dbraw/zinc/27/07/84/1053270784.db2.gz MHQUVRYSBUOFOP-CABCVRRESA-N 2 1 324.896 4.121 20 0 DIADMP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC)C1 ZINC001319754867 1053270792 /nfs/dbraw/zinc/27/07/92/1053270792.db2.gz MHQUVRYSBUOFOP-CABCVRRESA-N 2 1 324.896 4.121 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNCc2ccco2)C1 ZINC000069708776 1053285404 /nfs/dbraw/zinc/28/54/04/1053285404.db2.gz DWJCBBUQNAYOST-CALCHBBNSA-N 2 1 312.457 4.047 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccco2)C1 ZINC000069708776 1053285411 /nfs/dbraw/zinc/28/54/11/1053285411.db2.gz DWJCBBUQNAYOST-CALCHBBNSA-N 2 1 312.457 4.047 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2C[NH2+]Cc2ccco2)C1 ZINC000069708776 1053285419 /nfs/dbraw/zinc/28/54/19/1053285419.db2.gz DWJCBBUQNAYOST-CALCHBBNSA-N 2 1 312.457 4.047 20 0 DIADMP CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1cccc([C@@H](C)[NH+](C)C)c1)C2 ZINC001229625579 1053368292 /nfs/dbraw/zinc/36/82/92/1053368292.db2.gz IBQSJJNSEHQMML-LBKNJMOBSA-N 2 1 316.489 4.092 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2csc(C)c2C)c1 ZINC001200243640 1053494038 /nfs/dbraw/zinc/49/40/38/1053494038.db2.gz LPGDFXQMKAHKRS-UHFFFAOYSA-N 2 1 302.487 4.106 20 0 DIADMP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631682 1053529310 /nfs/dbraw/zinc/52/93/10/1053529310.db2.gz BVGZMJTUJSTVKV-SJORKVTESA-N 2 1 312.457 4.329 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC001322631682 1053529322 /nfs/dbraw/zinc/52/93/22/1053529322.db2.gz BVGZMJTUJSTVKV-SJORKVTESA-N 2 1 312.457 4.329 20 0 DIADMP CC[N@@H+](C[C@H]1CCC[NH2+]C1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000262535917 1053577230 /nfs/dbraw/zinc/57/72/30/1053577230.db2.gz QHVHGAUJFNASPZ-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(-c2ccccc2)o1)C(C)(C)C ZINC001200413300 1053641143 /nfs/dbraw/zinc/64/11/43/1053641143.db2.gz XFVYEWOJDGFFMG-LJQANCHMSA-N 2 1 314.473 4.403 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC001200410946 1053641563 /nfs/dbraw/zinc/64/15/63/1053641563.db2.gz BFQYPFLLWOBHFK-INIZCTEOSA-N 2 1 308.510 4.342 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC001200410949 1053641703 /nfs/dbraw/zinc/64/17/03/1053641703.db2.gz BFQYPFLLWOBHFK-MRXNPFEDSA-N 2 1 308.510 4.342 20 0 DIADMP C[NH2+][C@@H](C)CC[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001326035936 1053745729 /nfs/dbraw/zinc/74/57/29/1053745729.db2.gz MSFHUULLRVKMDL-KBXCAEBGSA-N 2 1 302.849 4.017 20 0 DIADMP CCc1ccc(C[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)s1 ZINC001231501777 1053770626 /nfs/dbraw/zinc/77/06/26/1053770626.db2.gz QJOIFRSOAJVMMN-INIZCTEOSA-N 2 1 306.519 4.151 20 0 DIADMP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2csc(C)n2)cc1 ZINC000269431537 1053783000 /nfs/dbraw/zinc/78/30/00/1053783000.db2.gz PTERHJHMGKLBLV-CQSZACIVSA-N 2 1 317.502 4.144 20 0 DIADMP Clc1ccc2c(NCC[NH+]3Cc4ccccc4C3)cc[nH+]c2c1 ZINC000620932421 1053794226 /nfs/dbraw/zinc/79/42/26/1053794226.db2.gz PIGBUURKGXBWDT-UHFFFAOYSA-N 2 1 323.827 4.316 20 0 DIADMP Cc1sc2ccccc2c1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001231645175 1053813574 /nfs/dbraw/zinc/81/35/74/1053813574.db2.gz SRRKLGJBRVARCA-UHFFFAOYSA-N 2 1 314.498 4.270 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccco1 ZINC000157646455 1053861902 /nfs/dbraw/zinc/86/19/02/1053861902.db2.gz AXSFWADWUHJDNE-SJORKVTESA-N 2 1 312.457 4.362 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1)c1ccco1 ZINC000157646455 1053861912 /nfs/dbraw/zinc/86/19/12/1053861912.db2.gz AXSFWADWUHJDNE-SJORKVTESA-N 2 1 312.457 4.362 20 0 DIADMP CN1CCC([N@@H+](C)Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001231821518 1053876576 /nfs/dbraw/zinc/87/65/76/1053876576.db2.gz BTGVLTWPFWOZPJ-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP C[N@H+](Cc1ccccc1-c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001231821518 1053876591 /nfs/dbraw/zinc/87/65/91/1053876591.db2.gz BTGVLTWPFWOZPJ-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC001231821518 1053876608 /nfs/dbraw/zinc/87/66/08/1053876608.db2.gz BTGVLTWPFWOZPJ-UHFFFAOYSA-N 2 1 312.432 4.019 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc2ccnc(Cl)c2c1 ZINC001231978962 1053927548 /nfs/dbraw/zinc/92/75/48/1053927548.db2.gz NICNXSNJIVOZHB-UHFFFAOYSA-N 2 1 319.880 4.052 20 0 DIADMP c1c2c[nH+]ccc2[nH]c1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001232014356 1053938529 /nfs/dbraw/zinc/93/85/29/1053938529.db2.gz OHSOTLRKKBFEQB-QGZVFWFLSA-N 2 1 305.425 4.018 20 0 DIADMP COc1cccc([C@H]2CCCC[N@H+]2Cc2cc3c[nH+]ccc3[nH]2)c1 ZINC001232013844 1053941286 /nfs/dbraw/zinc/94/12/86/1053941286.db2.gz GXGPELQJVPINJC-HXUWFJFHSA-N 2 1 321.424 4.299 20 0 DIADMP C[N@@H+](Cc1cc2c[nH+]ccc2[nH]1)Cc1cccc2ccccc21 ZINC001232015031 1053942254 /nfs/dbraw/zinc/94/22/54/1053942254.db2.gz QTKSLLRJGPUKLD-UHFFFAOYSA-N 2 1 301.393 4.348 20 0 DIADMP Clc1cccc([C@@H]2CC[N@@H+](Cc3cc4c[nH+]ccc4[nH]3)C2)c1 ZINC001232016121 1053944930 /nfs/dbraw/zinc/94/49/30/1053944930.db2.gz RDZOVJBQYZKHCW-CQSZACIVSA-N 2 1 311.816 4.206 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC001232151064 1053971394 /nfs/dbraw/zinc/97/13/94/1053971394.db2.gz LCNKIKFDJOVPFQ-UHFFFAOYSA-N 2 1 304.453 4.044 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c1 ZINC001232145950 1053972966 /nfs/dbraw/zinc/97/29/66/1053972966.db2.gz FUDZWBFZOAZHEQ-IEBWSBKVSA-N 2 1 304.453 4.042 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2ccnc(C(C)(C)C)c2)CC1 ZINC001232218680 1053993467 /nfs/dbraw/zinc/99/34/67/1053993467.db2.gz DZNDDUZNFZPMDJ-UHFFFAOYSA-N 2 1 317.521 4.075 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccnc(C(C)(C)C)c2)CC1 ZINC001232218680 1053993473 /nfs/dbraw/zinc/99/34/73/1053993473.db2.gz DZNDDUZNFZPMDJ-UHFFFAOYSA-N 2 1 317.521 4.075 20 0 DIADMP c1ccc2c(c1)ccnc2C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001232252965 1054004764 /nfs/dbraw/zinc/00/47/64/1054004764.db2.gz CICFGAQRVNVHEE-IBGZPJMESA-N 2 1 323.484 4.075 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@H](C)c3cc(C)ccc3C)CC2)[nH+]c1 ZINC000163471338 1054042921 /nfs/dbraw/zinc/04/29/21/1054042921.db2.gz YSFLIAVCSUBBTA-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP Cc1ccccc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000060377506 1054083938 /nfs/dbraw/zinc/08/39/38/1054083938.db2.gz QXWYESCLMODMLV-UHFFFAOYSA-N 2 1 322.496 4.339 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)ccc2c1 ZINC000296028044 1054084472 /nfs/dbraw/zinc/08/44/72/1054084472.db2.gz SNGPNYVSUGSXRA-LRLLJDFBSA-N 2 1 324.468 4.124 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)CC(F)(F)F)cc1 ZINC000166699153 1054094799 /nfs/dbraw/zinc/09/47/99/1054094799.db2.gz ONOISEXZZVSVOF-RYUDHWBXSA-N 2 1 311.351 4.172 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)CC(F)(F)F)cc1 ZINC000166699038 1054095457 /nfs/dbraw/zinc/09/54/57/1054095457.db2.gz ONOISEXZZVSVOF-NWDGAFQWSA-N 2 1 311.351 4.172 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC001232981913 1054163437 /nfs/dbraw/zinc/16/34/37/1054163437.db2.gz LDPHGCKGVUTIBG-UHFFFAOYSA-N 2 1 321.468 4.006 20 0 DIADMP CCC1([NH+]2CCCCC2)CC[NH+](CCCC(F)(F)F)CC1 ZINC001334232559 1054184258 /nfs/dbraw/zinc/18/42/58/1054184258.db2.gz JRIKLAYKMJGJQQ-UHFFFAOYSA-N 2 1 306.416 4.059 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)CCC3)c1 ZINC001341867333 1054410687 /nfs/dbraw/zinc/41/06/87/1054410687.db2.gz BIGCDKLOQHUEOJ-UHFFFAOYSA-N 2 1 322.496 4.305 20 0 DIADMP CC[C@@]1(C)CC[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001473279463 1054487721 /nfs/dbraw/zinc/48/77/21/1054487721.db2.gz ZVCSLJYFCMISPT-FQEVSTJZSA-N 2 1 300.490 4.295 20 0 DIADMP Cc1sccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000339293408 1054495923 /nfs/dbraw/zinc/49/59/23/1054495923.db2.gz MYETZFMHPYFXLC-KXBFYZLASA-N 2 1 314.498 4.199 20 0 DIADMP Cc1sccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000339293408 1054495931 /nfs/dbraw/zinc/49/59/31/1054495931.db2.gz MYETZFMHPYFXLC-KXBFYZLASA-N 2 1 314.498 4.199 20 0 DIADMP CC[C@@H](N[C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419652 1054589962 /nfs/dbraw/zinc/58/99/62/1054589962.db2.gz RHPHDOAYGVHKDB-VXGBXAGGSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419652 1054589976 /nfs/dbraw/zinc/58/99/76/1054589976.db2.gz RHPHDOAYGVHKDB-VXGBXAGGSA-N 2 1 300.899 4.315 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(Cl)s1 ZINC000623419652 1054589988 /nfs/dbraw/zinc/58/99/88/1054589988.db2.gz RHPHDOAYGVHKDB-VXGBXAGGSA-N 2 1 300.899 4.315 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)CC1(C)C ZINC000623512908 1054609305 /nfs/dbraw/zinc/60/93/05/1054609305.db2.gz YMXKXSXVFDQYKC-DJIMGWMZSA-N 2 1 306.881 4.048 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234993515 1054638355 /nfs/dbraw/zinc/63/83/55/1054638355.db2.gz PZPOSVMDFVIGMJ-OAQYLSRUSA-N 2 1 324.443 4.068 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)cc12 ZINC001234992994 1054638752 /nfs/dbraw/zinc/63/87/52/1054638752.db2.gz NVSJRYUOPYCWNG-NRFANRHFSA-N 2 1 320.436 4.162 20 0 DIADMP c1cc(-c2csc(C[N@@H+]3CCC[C@]4(CC[NH2+]C4)C3)c2)cs1 ZINC001234998788 1054639999 /nfs/dbraw/zinc/63/99/99/1054639999.db2.gz JVQFQKUUJSZKTO-QGZVFWFLSA-N 2 1 318.511 4.052 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)c2)cs1 ZINC001234998788 1054640004 /nfs/dbraw/zinc/64/00/04/1054640004.db2.gz JVQFQKUUJSZKTO-QGZVFWFLSA-N 2 1 318.511 4.052 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)cc2)c1 ZINC001235001152 1054640506 /nfs/dbraw/zinc/64/05/06/1054640506.db2.gz TZCVXGPXNKAPLD-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235037811 1054643771 /nfs/dbraw/zinc/64/37/71/1054643771.db2.gz IJELIDRXUISTKD-FQEVSTJZSA-N 2 1 310.441 4.055 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)CC1 ZINC001235030943 1054644004 /nfs/dbraw/zinc/64/40/04/1054644004.db2.gz JFHGXEUQQDECHL-PMACEKPBSA-N 2 1 302.506 4.145 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c(C)c1Cl ZINC001235037930 1054644261 /nfs/dbraw/zinc/64/42/61/1054644261.db2.gz JSYAPKOZZWKBJF-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)c(C)c1Cl ZINC001235037930 1054644270 /nfs/dbraw/zinc/64/42/70/1054644270.db2.gz JSYAPKOZZWKBJF-GOSISDBHSA-N 2 1 306.881 4.065 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@]2(CC[NH2+]C2)C1 ZINC001235030633 1054644600 /nfs/dbraw/zinc/64/46/00/1054644600.db2.gz BHUGTTNGQROHNY-FQEVSTJZSA-N 2 1 322.477 4.240 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)c1 ZINC001235036270 1054644810 /nfs/dbraw/zinc/64/48/10/1054644810.db2.gz KGWBJHOBCWEYKR-SFHVURJKSA-N 2 1 306.519 4.056 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)CC2)cc1 ZINC001235041215 1054647738 /nfs/dbraw/zinc/64/77/38/1054647738.db2.gz OGLMMXOYJPYFRS-HXUWFJFHSA-N 2 1 300.490 4.092 20 0 DIADMP CCCCc1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)s1 ZINC001235045696 1054647809 /nfs/dbraw/zinc/64/78/09/1054647809.db2.gz MEHAPQCJPMTIHC-SFHVURJKSA-N 2 1 306.519 4.199 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001235095455 1054656496 /nfs/dbraw/zinc/65/64/96/1054656496.db2.gz QNXQAGOYGWBXRS-UHFFFAOYSA-N 2 1 320.546 4.446 20 0 DIADMP C(=C/c1ccc(C[NH+]2CCC3(CC[NH2+]3)CC2)cc1)\c1ccccc1 ZINC001235112267 1054659138 /nfs/dbraw/zinc/65/91/38/1054659138.db2.gz ZNEHSRQUJYRSOY-VOTSOKGWSA-N 2 1 318.464 4.185 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235118626 1054662218 /nfs/dbraw/zinc/66/22/18/1054662218.db2.gz GLLFMUYUXCSOSJ-OAQYLSRUSA-N 2 1 320.436 4.304 20 0 DIADMP c1ccc2c(c1)oc1c2cccc1C[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235118626 1054662224 /nfs/dbraw/zinc/66/22/24/1054662224.db2.gz GLLFMUYUXCSOSJ-OAQYLSRUSA-N 2 1 320.436 4.304 20 0 DIADMP C[C@H](C[N@@H+]1CCCC[C@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120419 1054662621 /nfs/dbraw/zinc/66/26/21/1054662621.db2.gz BIGCCYRZIJJXMS-DYESRHJHSA-N 2 1 308.469 4.161 20 0 DIADMP C[C@H](C[N@H+]1CCCC[C@]12CC[NH2+]C2)c1cccc2ccccc21 ZINC001235120419 1054662624 /nfs/dbraw/zinc/66/26/24/1054662624.db2.gz BIGCCYRZIJJXMS-DYESRHJHSA-N 2 1 308.469 4.161 20 0 DIADMP CC(C)c1cc(C[N@@H+]2CCCC23CC[NH2+]CC3)ccc1Cl ZINC001235145961 1054666815 /nfs/dbraw/zinc/66/68/15/1054666815.db2.gz ZKKXGUKTFSWEPM-UHFFFAOYSA-N 2 1 306.881 4.181 20 0 DIADMP CC(C)c1cc(C[N@H+]2CCCC23CC[NH2+]CC3)ccc1Cl ZINC001235145961 1054666817 /nfs/dbraw/zinc/66/68/17/1054666817.db2.gz ZKKXGUKTFSWEPM-UHFFFAOYSA-N 2 1 306.881 4.181 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235154056 1054666977 /nfs/dbraw/zinc/66/69/77/1054666977.db2.gz HLVDCJNVHUAQJM-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c(Cl)c1 ZINC001235156802 1054667329 /nfs/dbraw/zinc/66/73/29/1054667329.db2.gz RPRCTOVYSBJKMM-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP c1cc(C2CCC2)ccc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235155531 1054667772 /nfs/dbraw/zinc/66/77/72/1054667772.db2.gz LIFWQJNPFIRFCI-NRFANRHFSA-N 2 1 312.501 4.308 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCCC[C@@]12CCC[NH2+]C2 ZINC001235167040 1054669536 /nfs/dbraw/zinc/66/95/36/1054669536.db2.gz DXLIUCBZBZBNBD-NRFANRHFSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1Cl ZINC001235160716 1054669813 /nfs/dbraw/zinc/66/98/13/1054669813.db2.gz QJMFTGAROSDSGS-GOSISDBHSA-N 2 1 306.881 4.003 20 0 DIADMP Cc1ccc(F)c(C[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1Cl ZINC001235160660 1054670360 /nfs/dbraw/zinc/67/03/60/1054670360.db2.gz YFLWJPXREUNPBA-QGZVFWFLSA-N 2 1 324.871 4.142 20 0 DIADMP CCSc1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000179233706 1054672818 /nfs/dbraw/zinc/67/28/18/1054672818.db2.gz JDUSQWLJVINIFS-OAHLLOKOSA-N 2 1 317.502 4.435 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCCCC23CC[NH2+]CC3)c1 ZINC001235188867 1054679241 /nfs/dbraw/zinc/67/92/41/1054679241.db2.gz AMZNRIRGQLHSFC-UHFFFAOYSA-N 2 1 300.490 4.092 20 0 DIADMP CCc1cc(C[N@@H+]2CCCCC23CC[NH2+]CC3)ccc1Cl ZINC001235191106 1054679888 /nfs/dbraw/zinc/67/98/88/1054679888.db2.gz LUZYZOKNSMWBKY-UHFFFAOYSA-N 2 1 306.881 4.011 20 0 DIADMP CCc1cc(C[N@H+]2CCCCC23CC[NH2+]CC3)ccc1Cl ZINC001235191106 1054679897 /nfs/dbraw/zinc/67/98/97/1054679897.db2.gz LUZYZOKNSMWBKY-UHFFFAOYSA-N 2 1 306.881 4.011 20 0 DIADMP CCCCCCc1csc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235260700 1054694219 /nfs/dbraw/zinc/69/42/19/1054694219.db2.gz HFBDPBWEHHNRFZ-WMZOPIPTSA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1 ZINC001235260700 1054694230 /nfs/dbraw/zinc/69/42/30/1054694230.db2.gz HFBDPBWEHHNRFZ-WMZOPIPTSA-N 2 1 306.519 4.055 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)CC1 ZINC001235255469 1054695305 /nfs/dbraw/zinc/69/53/05/1054695305.db2.gz NEHSZYQXIWTHGN-SLFFLAALSA-N 2 1 302.506 4.143 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)CC1 ZINC001235255469 1054695309 /nfs/dbraw/zinc/69/53/09/1054695309.db2.gz NEHSZYQXIWTHGN-SLFFLAALSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+](C)C3CC[NH+](C)CC3)c2)cc1 ZINC001235305919 1054697138 /nfs/dbraw/zinc/69/71/38/1054697138.db2.gz AYEXBUXQXCFOAZ-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+](C)C3CC[NH+](C)CC3)c2)cc1 ZINC001235305919 1054697148 /nfs/dbraw/zinc/69/71/48/1054697148.db2.gz AYEXBUXQXCFOAZ-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@@H](C4C[NH2+]C4)C3)cc12 ZINC001235339183 1054704258 /nfs/dbraw/zinc/70/42/58/1054704258.db2.gz DRTVVOYFJWPFMP-OAHLLOKOSA-N 2 1 322.477 4.096 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235427428 1054716072 /nfs/dbraw/zinc/71/60/72/1054716072.db2.gz RWIYCHVUZSCSCA-SJORKVTESA-N 2 1 314.498 4.113 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235429603 1054717737 /nfs/dbraw/zinc/71/77/37/1054717737.db2.gz BGOLUCVBWSYIOA-DLBZAZTESA-N 2 1 318.530 4.010 20 0 DIADMP CCSc1ccccc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235429609 1054718500 /nfs/dbraw/zinc/71/85/00/1054718500.db2.gz BGOLUCVBWSYIOA-IRXDYDNUSA-N 2 1 318.530 4.010 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+](C)CC3CC[NH2+]CC3)cc2)cc1 ZINC001235433762 1054719091 /nfs/dbraw/zinc/71/90/91/1054719091.db2.gz OYISQAZBLGNDMS-UHFFFAOYSA-N 2 1 308.469 4.093 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235427813 1054719314 /nfs/dbraw/zinc/71/93/14/1054719314.db2.gz OHUFHLXTWYLEJQ-SJORKVTESA-N 2 1 320.908 4.168 20 0 DIADMP c1ccc2c(c1)cccc2C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235428217 1054719464 /nfs/dbraw/zinc/71/94/64/1054719464.db2.gz ULAJZRQMSYZWDU-RTBURBONSA-N 2 1 308.469 4.051 20 0 DIADMP Cc1ccc(Cl)c(O[C@@H]2CCC[N@@H+](CCCCCC[NH3+])C2)c1 ZINC001235673693 1054767304 /nfs/dbraw/zinc/76/73/04/1054767304.db2.gz FJLBEGRBOLYZDC-MRXNPFEDSA-N 2 1 324.896 4.011 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001235673557 1054767632 /nfs/dbraw/zinc/76/76/32/1054767632.db2.gz NVSGHXVPDBCCDU-MRXNPFEDSA-N 2 1 319.452 4.006 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001235674436 1054771448 /nfs/dbraw/zinc/77/14/48/1054771448.db2.gz GFNJXGQJJRQYEN-HNNXBMFYSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+]C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)cc2Cl)C1 ZINC001235674436 1054771465 /nfs/dbraw/zinc/77/14/65/1054771465.db2.gz GFNJXGQJJRQYEN-HNNXBMFYSA-N 2 1 314.860 4.178 20 0 DIADMP Fc1ccccc1C1CC[NH+](CCC[NH2+]C2CCCCC2)CC1 ZINC001235679155 1054773037 /nfs/dbraw/zinc/77/30/37/1054773037.db2.gz PFESERVZYTULOW-UHFFFAOYSA-N 2 1 318.480 4.318 20 0 DIADMP Cc1ccc([C@H]2CCC[N@H+]2Cc2cc3c(s2)CC[NH2+]C3)cc1 ZINC001235680571 1054775350 /nfs/dbraw/zinc/77/53/50/1054775350.db2.gz UFUQJDHMORXYRH-GOSISDBHSA-N 2 1 312.482 4.039 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1CC1CC2(C1)CC[NH2+]CC2 ZINC001235693486 1054781995 /nfs/dbraw/zinc/78/19/95/1054781995.db2.gz BIGDWVVFLANSAU-SFHVURJKSA-N 2 1 318.892 4.257 20 0 DIADMP C[C@@H](C[N@@H+](C)CCC1CC[NH2+]CC1)c1cccc2ccccc21 ZINC001235715958 1054785689 /nfs/dbraw/zinc/78/56/89/1054785689.db2.gz ZLOQDHOXKKDOMF-KRWDZBQOSA-N 2 1 310.485 4.265 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H](c2ccc(F)c(Cl)c2)C2CC2)CC1(C)C ZINC001474152924 1054788507 /nfs/dbraw/zinc/78/85/07/1054788507.db2.gz YLMMOBRAYYWWHI-YOEHRIQHSA-N 2 1 324.871 4.393 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC1(C)C ZINC001474152920 1054788664 /nfs/dbraw/zinc/78/86/64/1054788664.db2.gz YLMMOBRAYYWWHI-RHSMWYFYSA-N 2 1 324.871 4.393 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(-c2cccs2)s1 ZINC001235716881 1054789941 /nfs/dbraw/zinc/78/99/41/1054789941.db2.gz LBKYFKOSSWSTOB-UHFFFAOYSA-N 2 1 320.527 4.298 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccccc2-c2ccccc2C)CC1 ZINC001235725530 1054789975 /nfs/dbraw/zinc/78/99/75/1054789975.db2.gz JCEPBCUJZUVULJ-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccc3oc4ccccc4c3c2)CC1 ZINC001235726401 1054791504 /nfs/dbraw/zinc/79/15/04/1054791504.db2.gz OWYDTJVLIRGMKG-UHFFFAOYSA-N 2 1 308.425 4.160 20 0 DIADMP CC[NH2+]C1CC[NH+](Cc2ccc(-c3ccc(C)cc3)cc2)CC1 ZINC001235726946 1054792544 /nfs/dbraw/zinc/79/25/44/1054792544.db2.gz RXSTVVGJKXJZNI-UHFFFAOYSA-N 2 1 308.469 4.236 20 0 DIADMP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1nc(C)cs1 ZINC000623855374 1054797512 /nfs/dbraw/zinc/79/75/12/1054797512.db2.gz YXKXQQIKKGRNHE-HNNXBMFYSA-N 2 1 317.502 4.144 20 0 DIADMP Cc1ccc(Oc2cccc(C[NH+]3CCC(C)([NH3+])CC3)c2)cc1 ZINC001235748750 1054798685 /nfs/dbraw/zinc/79/86/85/1054798685.db2.gz NYJIZMMXNGKXEK-UHFFFAOYSA-N 2 1 310.441 4.101 20 0 DIADMP CC[N@@H+](Cc1ccc(-c2cccs2)s1)C1CC[NH2+]CC1 ZINC001235759812 1054801201 /nfs/dbraw/zinc/80/12/01/1054801201.db2.gz AIENTPZUPLUIFP-UHFFFAOYSA-N 2 1 306.500 4.051 20 0 DIADMP CC[N@@H+](Cc1sc(Cl)c2ccccc21)C1CC[NH2+]CC1 ZINC001235764435 1054802068 /nfs/dbraw/zinc/80/20/68/1054802068.db2.gz CNTSHZCBXUDTNI-UHFFFAOYSA-N 2 1 308.878 4.129 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH3+])C2 ZINC001235810743 1054811925 /nfs/dbraw/zinc/81/19/25/1054811925.db2.gz NILHLGPPFLSGNE-GEALJGNFSA-N 2 1 314.517 4.117 20 0 DIADMP Cc1cc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)ccc1Oc1ccccc1 ZINC001235811483 1054812475 /nfs/dbraw/zinc/81/24/75/1054812475.db2.gz RAOSSFMPHHGUAA-REPLKXPHSA-N 2 1 322.452 4.241 20 0 DIADMP C[NH2+]CCC[N@H+]1CCCC[C@@H]1C(c1ccccc1)c1ccccc1 ZINC001235826520 1054816342 /nfs/dbraw/zinc/81/63/42/1054816342.db2.gz YOEVJOLGFLGKDF-OAQYLSRUSA-N 2 1 322.496 4.283 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908539 1054843976 /nfs/dbraw/zinc/84/39/76/1054843976.db2.gz YFSBDJZRIJWFLJ-DOTOQJQBSA-N 2 1 319.452 4.147 20 0 DIADMP C[C@H]1CC[C@@H]([NH3+])C[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001235908539 1054843992 /nfs/dbraw/zinc/84/39/92/1054843992.db2.gz YFSBDJZRIJWFLJ-DOTOQJQBSA-N 2 1 319.452 4.147 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2C[C@@H]3CC[NH2+]C[C@H]3C2)c1 ZINC001235943875 1054862387 /nfs/dbraw/zinc/86/23/87/1054862387.db2.gz ZONFUKXHMXWKDH-SFTDATJTSA-N 2 1 320.480 4.012 20 0 DIADMP C[N@@H+](CCC1CC[NH2+]CC1)Cc1sc2ccccc2c1Cl ZINC001235947958 1054864174 /nfs/dbraw/zinc/86/41/74/1054864174.db2.gz ILKDHAFIMJRNBQ-UHFFFAOYSA-N 2 1 322.905 4.376 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001235950843 1054866820 /nfs/dbraw/zinc/86/68/20/1054866820.db2.gz NWUVJWKQSLDZQY-MJGOQNOKSA-N 2 1 316.533 4.094 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+](C)C[C@H]3CCC[NH2+]C3)cc2)c1 ZINC001235956187 1054868991 /nfs/dbraw/zinc/86/89/91/1054868991.db2.gz ANWGIPPFOFMLNH-IBGZPJMESA-N 2 1 308.469 4.093 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+](C)C[C@H]2CCC[NH2+]C2)c1 ZINC001235956399 1054870482 /nfs/dbraw/zinc/87/04/82/1054870482.db2.gz CMJWUZDDZJJLAC-FQEVSTJZSA-N 2 1 322.496 4.402 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+](Cc3ccc4c(c3)C[NH2+]CC4)CC2)cc1 ZINC001235959863 1054872283 /nfs/dbraw/zinc/87/22/83/1054872283.db2.gz MAQODXDIIHBCKE-HXUWFJFHSA-N 2 1 320.480 4.102 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[N@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)CC1 ZINC001235975803 1054879113 /nfs/dbraw/zinc/87/91/13/1054879113.db2.gz WZEYMVMYGPNDCP-MOPGFXCFSA-N 2 1 324.512 4.116 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989019 1054883746 /nfs/dbraw/zinc/88/37/46/1054883746.db2.gz BOAPPUYQQFHZBC-GHTZIAJQSA-N 2 1 324.443 4.033 20 0 DIADMP Cc1cc(C[N@H+]2C[C@@H]3CC[C@@]3([NH3+])C2)cc(C)c1-c1ccc(F)cc1 ZINC001235989019 1054883760 /nfs/dbraw/zinc/88/37/60/1054883760.db2.gz BOAPPUYQQFHZBC-GHTZIAJQSA-N 2 1 324.443 4.033 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000624122486 1054885338 /nfs/dbraw/zinc/88/53/38/1054885338.db2.gz SGMUULPPBNPZMO-JXFKEZNVSA-N 2 1 316.464 4.083 20 0 DIADMP C[C@@H]1C[NH2+]CC(F)(F)[C@H]1C[N@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009835 1054895348 /nfs/dbraw/zinc/89/53/48/1054895348.db2.gz XYBDWBSPJMDMNJ-LMPOIIKSSA-N 2 1 316.480 4.014 20 0 DIADMP C[C@@H]1C[NH2+]CC(F)(F)[C@H]1C[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC001236009835 1054895360 /nfs/dbraw/zinc/89/53/60/1054895360.db2.gz XYBDWBSPJMDMNJ-LMPOIIKSSA-N 2 1 316.480 4.014 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051695 1054915667 /nfs/dbraw/zinc/91/56/67/1054915667.db2.gz XZPALSMNFPPSFT-YOEHRIQHSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051695 1054915676 /nfs/dbraw/zinc/91/56/76/1054915676.db2.gz XZPALSMNFPPSFT-YOEHRIQHSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051344 1054916825 /nfs/dbraw/zinc/91/68/25/1054916825.db2.gz WAXMOXSRLCARTO-KDOFPFPSSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1C[C@H]([NH3+])C[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001236051344 1054916837 /nfs/dbraw/zinc/91/68/37/1054916837.db2.gz WAXMOXSRLCARTO-KDOFPFPSSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481292 1054917715 /nfs/dbraw/zinc/91/77/15/1054917715.db2.gz VUPRAVWDMICOOR-CHWSQXEVSA-N 2 1 318.848 4.221 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000181481292 1054917729 /nfs/dbraw/zinc/91/77/29/1054917729.db2.gz VUPRAVWDMICOOR-CHWSQXEVSA-N 2 1 318.848 4.221 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001236068264 1054924288 /nfs/dbraw/zinc/92/42/88/1054924288.db2.gz XFDCMWQMMOXVNL-INIZCTEOSA-N 2 1 314.860 4.048 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(F)c(F)c1)C(C)C ZINC000181601490 1054924793 /nfs/dbraw/zinc/92/47/93/1054924793.db2.gz SATCQCOOHUPLHM-GOSISDBHSA-N 2 1 321.415 4.237 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2cccc(-c3c(C)cccc3C)c2)C1 ZINC001236067459 1054925060 /nfs/dbraw/zinc/92/50/60/1054925060.db2.gz ONJBQOHRUMLQRN-LJQANCHMSA-N 2 1 308.469 4.012 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728514 1054931072 /nfs/dbraw/zinc/93/10/72/1054931072.db2.gz SJDUTUTWQWLVIR-QWHCGFSZSA-N 2 1 306.837 4.079 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cc2cc(Cl)ccc2o1 ZINC000181728514 1054931088 /nfs/dbraw/zinc/93/10/88/1054931088.db2.gz SJDUTUTWQWLVIR-QWHCGFSZSA-N 2 1 306.837 4.079 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000181733398 1054931634 /nfs/dbraw/zinc/93/16/34/1054931634.db2.gz XVYKTYISUFZBBV-GFCCVEGCSA-N 2 1 309.816 4.115 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc2c(c1)C[NH2+]C2 ZINC001236108186 1054952170 /nfs/dbraw/zinc/95/21/70/1054952170.db2.gz JQPNPBUSCXCQRG-IBGZPJMESA-N 2 1 324.493 4.349 20 0 DIADMP C[N@@H+](CCCC[NH3+])Cc1ccccc1-c1ccc(Cl)cc1 ZINC001236140914 1054966733 /nfs/dbraw/zinc/96/67/33/1054966733.db2.gz APLZKSAMTBYASH-UHFFFAOYSA-N 2 1 302.849 4.178 20 0 DIADMP Cc1cc(C[N@@H+](C)CCCC[NH3+])ccc1Oc1ccc(F)cc1 ZINC001236142542 1054969361 /nfs/dbraw/zinc/96/93/61/1054969361.db2.gz YJKHZQOVFNLEAK-UHFFFAOYSA-N 2 1 316.420 4.097 20 0 DIADMP CCC[N@@H+](CC[C@H](C)CCCC(C)(C)OC)C1CC[NH2+]CC1 ZINC001236181382 1054980724 /nfs/dbraw/zinc/98/07/24/1054980724.db2.gz YJEQHLWOOQECBT-QGZVFWFLSA-N 2 1 312.542 4.072 20 0 DIADMP CCC[N@@H+](C[C@@H](C)Cc1ccc(C(C)C)cc1)C1CC[NH2+]CC1 ZINC001236180866 1054980877 /nfs/dbraw/zinc/98/08/77/1054980877.db2.gz PGJJELWCVQWGRR-SFHVURJKSA-N 2 1 316.533 4.453 20 0 DIADMP CCC[N@H+](Cc1cc(Cl)ccc1OC(C)C)C1CC[NH2+]CC1 ZINC001236182361 1054980994 /nfs/dbraw/zinc/98/09/94/1054980994.db2.gz MOHZPIZPWPVMIM-UHFFFAOYSA-N 2 1 324.896 4.091 20 0 DIADMP CCC[N@@H+](Cc1cc(Cl)ccc1OC(C)C)C1CC[NH2+]CC1 ZINC001236182361 1054981007 /nfs/dbraw/zinc/98/10/07/1054981007.db2.gz MOHZPIZPWPVMIM-UHFFFAOYSA-N 2 1 324.896 4.091 20 0 DIADMP C[N@H+](Cc1ccc2ccccc2c1)Cc1ccc2c(c1)CC[NH2+]C2 ZINC001236184088 1054984847 /nfs/dbraw/zinc/98/48/47/1054984847.db2.gz OOHVVXPUIGALGX-UHFFFAOYSA-N 2 1 316.448 4.118 20 0 DIADMP C[NH+]1CCC(CC[N@H+]2CCC[C@H]2c2c[nH]c3ccccc23)CC1 ZINC001236190765 1054989055 /nfs/dbraw/zinc/98/90/55/1054989055.db2.gz XLTUVBFKXORVAT-FQEVSTJZSA-N 2 1 311.473 4.037 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cncc(-c3ccc(C)cc3)c2)CC1 ZINC001236216353 1055004574 /nfs/dbraw/zinc/00/45/74/1055004574.db2.gz ZVOIMSSMDRGDHP-UHFFFAOYSA-N 2 1 323.484 4.019 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(C)c(OC(C)C)c(C)c2)CC1 ZINC001236216064 1055004604 /nfs/dbraw/zinc/00/46/04/1055004604.db2.gz HXEXDDPLQCUPPJ-UHFFFAOYSA-N 2 1 318.505 4.053 20 0 DIADMP COc1ccc(-c2cccc(C[N@H+](C)[C@@H]3CCCC[C@H]3[NH3+])c2)cc1 ZINC001236216263 1055005483 /nfs/dbraw/zinc/00/54/83/1055005483.db2.gz JWOLOAXIADOPDH-NHCUHLMSSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2cccc(C[N@@H+](C)[C@@H]3CCCC[C@H]3[NH3+])c2)cc1 ZINC001236216263 1055005499 /nfs/dbraw/zinc/00/54/99/1055005499.db2.gz JWOLOAXIADOPDH-NHCUHLMSSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@H+](C)[C@H]2CCCC[C@@H]2[NH3+])c1 ZINC001236215404 1055005614 /nfs/dbraw/zinc/00/56/14/1055005614.db2.gz HVBJAPFINJRSPR-SFTDATJTSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccc(-c2ccccc2)c(C[N@@H+](C)[C@H]2CCCC[C@@H]2[NH3+])c1 ZINC001236215404 1055005617 /nfs/dbraw/zinc/00/56/17/1055005617.db2.gz HVBJAPFINJRSPR-SFTDATJTSA-N 2 1 324.468 4.064 20 0 DIADMP C[N@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236215993 1055005839 /nfs/dbraw/zinc/00/58/39/1055005839.db2.gz JLFOTJUDENNFCQ-WOJBJXKFSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236215993 1055005855 /nfs/dbraw/zinc/00/58/55/1055005855.db2.gz JLFOTJUDENNFCQ-WOJBJXKFSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236215988 1055007040 /nfs/dbraw/zinc/00/70/40/1055007040.db2.gz JLFOTJUDENNFCQ-PMACEKPBSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(F)c(-c2ccccc2)c1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236215988 1055007054 /nfs/dbraw/zinc/00/70/54/1055007054.db2.gz JLFOTJUDENNFCQ-PMACEKPBSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236216581 1055007102 /nfs/dbraw/zinc/00/71/02/1055007102.db2.gz KLOKHJGJWXTOSC-VQTJNVASSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1cccc(-c2ccc(F)cc2)c1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236216581 1055007116 /nfs/dbraw/zinc/00/71/16/1055007116.db2.gz KLOKHJGJWXTOSC-VQTJNVASSA-N 2 1 312.432 4.194 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@H+](C)[C@H]3CCCC[C@H]3[NH3+])ccc21 ZINC001236219200 1055010988 /nfs/dbraw/zinc/01/09/88/1055010988.db2.gz VQCGSDUNJHUGOA-NQIIRXRSSA-N 2 1 321.468 4.033 20 0 DIADMP Cn1c2ccccc2c2cc(C[N@@H+](C)[C@H]3CCCC[C@H]3[NH3+])ccc21 ZINC001236219200 1055010999 /nfs/dbraw/zinc/01/09/99/1055010999.db2.gz VQCGSDUNJHUGOA-NQIIRXRSSA-N 2 1 321.468 4.033 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@@H+](C)C2(C)CC[NH2+]CC2)cc1 ZINC001236224783 1055014179 /nfs/dbraw/zinc/01/41/79/1055014179.db2.gz WTBCWWKJMUSNMF-KRWDZBQOSA-N 2 1 302.506 4.063 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236225082 1055014910 /nfs/dbraw/zinc/01/49/10/1055014910.db2.gz ZZWPPFREYUCIJS-IYARVYRRSA-N 2 1 310.441 4.181 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236225048 1055015191 /nfs/dbraw/zinc/01/51/91/1055015191.db2.gz ZHEFOHGPFHZTMW-WKILWMFISA-N 2 1 300.471 4.117 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)cc1 ZINC001236227286 1055016363 /nfs/dbraw/zinc/01/63/63/1055016363.db2.gz BLVYFNWAAOHOJO-UHFFFAOYSA-N 2 1 308.469 4.267 20 0 DIADMP CNc1ccccc1C[N@@H+](Cc1ccccc1)C1CCC([NH3+])CC1 ZINC001236227831 1055019732 /nfs/dbraw/zinc/01/97/32/1055019732.db2.gz BUDOQSDKLYHRQW-UHFFFAOYSA-N 2 1 323.484 4.000 20 0 DIADMP [NH3+]C1CCC([N@@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001236228459 1055020480 /nfs/dbraw/zinc/02/04/80/1055020480.db2.gz VCRLQMJWKWBPLE-UHFFFAOYSA-N 2 1 308.469 4.001 20 0 DIADMP Clc1ccccc1-c1ccccc1C[NH+]1CCC[NH2+]CCC1 ZINC001236241347 1055027055 /nfs/dbraw/zinc/02/70/55/1055027055.db2.gz YHQKOBXSNZYMKV-UHFFFAOYSA-N 2 1 314.860 4.192 20 0 DIADMP C[N@@H+](CCC12CC([NH3+])(C1)C2)Cc1cccc(Oc2ccccc2)c1 ZINC001236242152 1055028022 /nfs/dbraw/zinc/02/80/22/1055028022.db2.gz WAEVWWIFIMGXDQ-UHFFFAOYSA-N 2 1 322.452 4.182 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC001236244487 1055029753 /nfs/dbraw/zinc/02/97/53/1055029753.db2.gz LAYRNPZPPWUAQK-GFCCVEGCSA-N 2 1 320.889 4.240 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC001236244487 1055029767 /nfs/dbraw/zinc/02/97/67/1055029767.db2.gz LAYRNPZPPWUAQK-GFCCVEGCSA-N 2 1 320.889 4.240 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc(F)c2F)c1 ZINC000183257932 1055037963 /nfs/dbraw/zinc/03/79/63/1055037963.db2.gz DYEJGLQIDRWNON-AWEZNQCLSA-N 2 1 318.411 4.267 20 0 DIADMP CC[N@@H+](CCC1CC[NH2+]CC1)Cc1ccc(Cl)cc1Cl ZINC001236265703 1055045042 /nfs/dbraw/zinc/04/50/42/1055045042.db2.gz KIRUKBOFPQFDGA-UHFFFAOYSA-N 2 1 315.288 4.205 20 0 DIADMP Clc1cccc(C[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1 ZINC001236284921 1055048536 /nfs/dbraw/zinc/04/85/36/1055048536.db2.gz AFWRMIINHJZLLP-UHFFFAOYSA-N 2 1 314.860 4.094 20 0 DIADMP Clc1cccc(C[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)c1 ZINC001236284921 1055048549 /nfs/dbraw/zinc/04/85/49/1055048549.db2.gz AFWRMIINHJZLLP-UHFFFAOYSA-N 2 1 314.860 4.094 20 0 DIADMP CC[N@@H+](Cc1cccc(C[NH3+])c1)Cc1cccc(C(F)(F)F)c1 ZINC001236286593 1055050956 /nfs/dbraw/zinc/05/09/56/1055050956.db2.gz MQYKIQMZNRCGCR-UHFFFAOYSA-N 2 1 322.374 4.186 20 0 DIADMP Cc1cccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[NH2+]CC[C@@H]4C3)cc2)c1 ZINC001236320768 1055055694 /nfs/dbraw/zinc/05/56/94/1055055694.db2.gz FJLXENPRKLNBCV-SZPZYZBQSA-N 2 1 320.480 4.093 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)s1 ZINC001236322026 1055058027 /nfs/dbraw/zinc/05/80/27/1055058027.db2.gz SGSJHBCZOZILOI-CALCHBBNSA-N 2 1 320.546 4.302 20 0 DIADMP CC/C=C\CCCCCC[N@@H+]1CC[C@@H]([NH3+])[C@H](C(F)(F)F)C1 ZINC001236361739 1055072147 /nfs/dbraw/zinc/07/21/47/1055072147.db2.gz SJIJRBTUVRXRMA-LPUOJRKPSA-N 2 1 306.416 4.115 20 0 DIADMP CC/C=C\CCCCCC[N@H+]1CC[C@@H]([NH3+])[C@H](C(F)(F)F)C1 ZINC001236361739 1055072163 /nfs/dbraw/zinc/07/21/63/1055072163.db2.gz SJIJRBTUVRXRMA-LPUOJRKPSA-N 2 1 306.416 4.115 20 0 DIADMP Fc1cccc(CCC[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236370447 1055076518 /nfs/dbraw/zinc/07/65/18/1055076518.db2.gz FXZIWLUQZJLJJH-GOSISDBHSA-N 2 1 318.480 4.003 20 0 DIADMP CCCc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)s1 ZINC001236373787 1055079110 /nfs/dbraw/zinc/07/91/10/1055079110.db2.gz LCZGXRHGPIYKTG-MRXNPFEDSA-N 2 1 320.546 4.445 20 0 DIADMP Fc1ccccc1CCC[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236371260 1055080252 /nfs/dbraw/zinc/08/02/52/1055080252.db2.gz JFIMARBTYFEWIN-KRWDZBQOSA-N 2 1 318.480 4.003 20 0 DIADMP Fc1c(Cl)cccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374358 1055080366 /nfs/dbraw/zinc/08/03/66/1055080366.db2.gz PVFBOTPCNJQSFR-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1cc(Cl)cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236376930 1055083494 /nfs/dbraw/zinc/08/34/94/1055083494.db2.gz WCZKUMBRZIREQQ-AWEZNQCLSA-N 2 1 324.871 4.223 20 0 DIADMP C[C@H]([NH2+]CCc1ccccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185724183 1055096466 /nfs/dbraw/zinc/09/64/66/1055096466.db2.gz XFSVBNHXSGBQIZ-DOTOQJQBSA-N 2 1 320.908 4.125 20 0 DIADMP C[C@@H]([NH2+]CCc1ccccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185724230 1055097182 /nfs/dbraw/zinc/09/71/82/1055097182.db2.gz XFSVBNHXSGBQIZ-WBVHZDCISA-N 2 1 320.908 4.125 20 0 DIADMP CC[N@H+](Cc1cccc2c3ccccc3sc21)C[C@H]1CC[NH2+]C1 ZINC001236407424 1055098663 /nfs/dbraw/zinc/09/86/63/1055098663.db2.gz FHXJLRXFUDZXIE-HNNXBMFYSA-N 2 1 324.493 4.486 20 0 DIADMP CC[N@H+](Cc1ccc(-c2cccc(C)c2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236407369 1055099268 /nfs/dbraw/zinc/09/92/68/1055099268.db2.gz DSXNZNXLUUSJNG-LJQANCHMSA-N 2 1 308.469 4.093 20 0 DIADMP CC[N@H+](Cc1cccc2c3ccccc3oc21)C[C@H]1CC[NH2+]C1 ZINC001236410342 1055102231 /nfs/dbraw/zinc/10/22/31/1055102231.db2.gz YZANKUCFWMJAIO-HNNXBMFYSA-N 2 1 308.425 4.017 20 0 DIADMP CCCCCCc1csc(C[N@@H+](CC)C[C@@H]2CC[NH2+]C2)c1 ZINC001236412638 1055103974 /nfs/dbraw/zinc/10/39/74/1055103974.db2.gz WXNOAPVWJBUFLH-QGZVFWFLSA-N 2 1 308.535 4.302 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-c2cccc(C[NH+](C)C)c2)nc1 ZINC001236420379 1055105869 /nfs/dbraw/zinc/10/58/69/1055105869.db2.gz OVXJTUGCDZAAAF-OAQYLSRUSA-N 2 1 323.484 4.357 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CCC[C@H]([NH3+])[C@@H]2C)c1 ZINC001236423009 1055107917 /nfs/dbraw/zinc/10/79/17/1055107917.db2.gz ZDRQBAOSIUMKIL-PXNSSMCTSA-N 2 1 308.469 4.282 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@@H+]2CCC[C@H]([NH3+])[C@@H]2C)c1 ZINC001236423009 1055107924 /nfs/dbraw/zinc/10/79/24/1055107924.db2.gz ZDRQBAOSIUMKIL-PXNSSMCTSA-N 2 1 308.469 4.282 20 0 DIADMP CC(C)C[NH2+]Cc1ccc(-c2ccc(C[N@@H+](C)C3CC3)cn2)cc1 ZINC001236428767 1055111002 /nfs/dbraw/zinc/11/10/02/1055111002.db2.gz GAHMMYMNTJDHQW-UHFFFAOYSA-N 2 1 323.484 4.088 20 0 DIADMP Clc1ccccc1C[N@@H+](C[C@H]1CC=CCC1)C1CC[NH2+]CC1 ZINC001236451359 1055120875 /nfs/dbraw/zinc/12/08/75/1055120875.db2.gz PMSMHGKBZUJTOM-INIZCTEOSA-N 2 1 318.892 4.250 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236454346 1055122192 /nfs/dbraw/zinc/12/21/92/1055122192.db2.gz YCOZIQOGPJJHEF-OAHLLOKOSA-N 2 1 308.897 4.330 20 0 DIADMP Clc1ccc(C[N@H+](Cc2cccs2)C2CC[NH2+]CC2)cc1 ZINC001236454352 1055122377 /nfs/dbraw/zinc/12/23/77/1055122377.db2.gz YDNHLRQGSGTNDN-UHFFFAOYSA-N 2 1 320.889 4.156 20 0 DIADMP Clc1ccc(C[N@@H+](Cc2cccs2)C2CC[NH2+]CC2)cc1 ZINC001236454352 1055122388 /nfs/dbraw/zinc/12/23/88/1055122388.db2.gz YDNHLRQGSGTNDN-UHFFFAOYSA-N 2 1 320.889 4.156 20 0 DIADMP CC(C)(C)CC[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236453544 1055122642 /nfs/dbraw/zinc/12/26/42/1055122642.db2.gz RURKRWDUEBVDLS-UHFFFAOYSA-N 2 1 308.897 4.330 20 0 DIADMP CCC[C@H](C)C[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236454344 1055122892 /nfs/dbraw/zinc/12/28/92/1055122892.db2.gz YCOZIQOGPJJHEF-HNNXBMFYSA-N 2 1 308.897 4.330 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc2ccccc21)C1CC[NH2+]CC1 ZINC001236458171 1055123833 /nfs/dbraw/zinc/12/38/33/1055123833.db2.gz RYTPGGBMZBSUSH-UHFFFAOYSA-N 2 1 310.485 4.440 20 0 DIADMP Cc1ccc2[nH]cc(C[N@@H+](CC(C)(C)C)C3CC[NH2+]CC3)c2c1 ZINC001236456731 1055124077 /nfs/dbraw/zinc/12/40/77/1055124077.db2.gz GHISHDUKVAYAJG-UHFFFAOYSA-N 2 1 313.489 4.076 20 0 DIADMP CC(C)(C)C[N@@H+](CCCCc1ccccc1)C1CC[NH2+]CC1 ZINC001236455524 1055124291 /nfs/dbraw/zinc/12/42/91/1055124291.db2.gz VOLLMKSWHSJAQQ-UHFFFAOYSA-N 2 1 302.506 4.109 20 0 DIADMP Cc1csc(C[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1Cl ZINC001236456426 1055124623 /nfs/dbraw/zinc/12/46/23/1055124623.db2.gz DZPUTIIZCFOFMV-UHFFFAOYSA-N 2 1 314.926 4.310 20 0 DIADMP Cc1csc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1Cl ZINC001236456426 1055124627 /nfs/dbraw/zinc/12/46/27/1055124627.db2.gz DZPUTIIZCFOFMV-UHFFFAOYSA-N 2 1 314.926 4.310 20 0 DIADMP Cc1ccc2c(C[N@@H+](CC(C)(C)C)C3CC[NH2+]CC3)c[nH]c2c1 ZINC001236456310 1055124699 /nfs/dbraw/zinc/12/46/99/1055124699.db2.gz BTHWGILYYLHXBO-UHFFFAOYSA-N 2 1 313.489 4.076 20 0 DIADMP CC(C)Oc1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001236457810 1055125271 /nfs/dbraw/zinc/12/52/71/1055125271.db2.gz OEZYDWKNSLJOGH-UHFFFAOYSA-N 2 1 318.505 4.074 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001236459462 1055126208 /nfs/dbraw/zinc/12/62/08/1055126208.db2.gz PNONJSQZNUPYSJ-UHFFFAOYSA-N 2 1 306.469 4.043 20 0 DIADMP Cc1cc(F)cc(C[N@H+](CCCC(C)C)C2CC[NH2+]CC2)c1 ZINC001236481008 1055139219 /nfs/dbraw/zinc/13/92/19/1055139219.db2.gz MBAWGVLXIDHUOY-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001236489535 1055143487 /nfs/dbraw/zinc/14/34/87/1055143487.db2.gz MBVJUCLPFXETMX-MRXNPFEDSA-N 2 1 306.469 4.124 20 0 DIADMP CC(C)[N@H+](Cc1cccc2c3ccccc3oc21)[C@@H]1CC[NH2+]C1 ZINC001236525676 1055161557 /nfs/dbraw/zinc/16/15/57/1055161557.db2.gz AUIRMHJNKLZSAW-MRXNPFEDSA-N 2 1 308.425 4.158 20 0 DIADMP CC(C)[N@@H+](Cc1cccc2c3ccccc3oc21)[C@@H]1CC[NH2+]C1 ZINC001236525676 1055161567 /nfs/dbraw/zinc/16/15/67/1055161567.db2.gz AUIRMHJNKLZSAW-MRXNPFEDSA-N 2 1 308.425 4.158 20 0 DIADMP CC(C)CCC[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236533738 1055165062 /nfs/dbraw/zinc/16/50/62/1055165062.db2.gz FXXTXHGZKKYCKQ-IYARVYRRSA-N 2 1 306.469 4.334 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000381406411 1055166770 /nfs/dbraw/zinc/16/67/70/1055166770.db2.gz WRQGVVLUBYAGQU-WMZOPIPTSA-N 2 1 314.498 4.229 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(Cl)c2)CC2CCC2)CC1 ZINC001236539800 1055168335 /nfs/dbraw/zinc/16/83/35/1055168335.db2.gz AVCWPCHFOQHQID-IYARVYRRSA-N 2 1 306.881 4.212 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc3[nH]ccc3c2)CC2CCC2)CC1 ZINC001236539780 1055168802 /nfs/dbraw/zinc/16/88/02/1055168802.db2.gz AICBURAYWAOKNH-WGSAOQKQSA-N 2 1 311.473 4.040 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)ccc1F ZINC001236539849 1055168980 /nfs/dbraw/zinc/16/89/80/1055168980.db2.gz BQSSIOOJOYXUDE-IYARVYRRSA-N 2 1 304.453 4.006 20 0 DIADMP Cc1cc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)sc1C ZINC001236542129 1055170052 /nfs/dbraw/zinc/17/00/52/1055170052.db2.gz XRRBSSFJUGBGLQ-QAQDUYKDSA-N 2 1 306.519 4.237 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(F)c2Cl)CC2CCC2)CC1 ZINC001236541654 1055170163 /nfs/dbraw/zinc/17/01/63/1055170163.db2.gz IGUKLIANARBXFF-WKILWMFISA-N 2 1 324.871 4.351 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)c(Cl)c2)CC2CCC2)CC1 ZINC001236541476 1055171161 /nfs/dbraw/zinc/17/11/61/1055171161.db2.gz LICGXLFZUBNVCU-WKILWMFISA-N 2 1 324.871 4.351 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccnc3ccccc23)CC2CCC2)CC1 ZINC001236540658 1055171299 /nfs/dbraw/zinc/17/12/99/1055171299.db2.gz IYNFEWBKBJITQU-WGSAOQKQSA-N 2 1 323.484 4.107 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2Cl)CC2CCC2)CC1 ZINC001236541480 1055171308 /nfs/dbraw/zinc/17/13/08/1055171308.db2.gz LKFGKLWYFWTDJE-QAQDUYKDSA-N 2 1 306.881 4.212 20 0 DIADMP CC(C)(C)c1ccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)[nH]1 ZINC001236542587 1055173090 /nfs/dbraw/zinc/17/30/90/1055173090.db2.gz UEGUKNGBQMIQTC-SAABIXHNSA-N 2 1 317.521 4.184 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(Cl)s1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550750 1055177724 /nfs/dbraw/zinc/17/77/24/1055177724.db2.gz MQNWSABXWNXHMG-JOCQHMNTSA-N 2 1 300.899 4.129 20 0 DIADMP CC(C)C[N@@H+](Cc1c[nH]c2cccc(F)c12)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550873 1055177989 /nfs/dbraw/zinc/17/79/89/1055177989.db2.gz NZAUVCBLOYMINF-WKILWMFISA-N 2 1 317.452 4.035 20 0 DIADMP CCOc1ccc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c(C)c1 ZINC001236549857 1055178346 /nfs/dbraw/zinc/17/83/46/1055178346.db2.gz DNAGUPUGXMBDTJ-WGSAOQKQSA-N 2 1 318.505 4.122 20 0 DIADMP CC(C)C[N@@H+](Cc1ccc(C2CC2)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236551030 1055179339 /nfs/dbraw/zinc/17/93/39/1055179339.db2.gz JQPVGCWLJBZCNU-MXVIHJGJSA-N 2 1 300.490 4.292 20 0 DIADMP CC(C)C[N@@H+](Cc1ccnc(C(C)(C)C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550984 1055180257 /nfs/dbraw/zinc/18/02/57/1055180257.db2.gz GUPOXUWRPFIVPD-IYARVYRRSA-N 2 1 317.521 4.107 20 0 DIADMP CC(C)(CC[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236553334 1055181504 /nfs/dbraw/zinc/18/15/04/1055181504.db2.gz WYQXZCCAVSWYMX-MXVIHJGJSA-N 2 1 314.517 4.336 20 0 DIADMP Clc1ccsc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381764647 1055181798 /nfs/dbraw/zinc/18/17/98/1055181798.db2.gz MVKVUXFWAGAVFK-HNNXBMFYSA-N 2 1 320.889 4.013 20 0 DIADMP Clc1ccsc1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381764647 1055181806 /nfs/dbraw/zinc/18/18/06/1055181806.db2.gz MVKVUXFWAGAVFK-HNNXBMFYSA-N 2 1 320.889 4.013 20 0 DIADMP CC(C)(C)c1cccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236553916 1055181961 /nfs/dbraw/zinc/18/19/61/1055181961.db2.gz UVVKPSPNPQJZNN-MXVIHJGJSA-N 2 1 314.517 4.466 20 0 DIADMP C[C@H]([NH2+]C1CCC(C)CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381774748 1055182061 /nfs/dbraw/zinc/18/20/61/1055182061.db2.gz ABLJTDIIFPXQCF-HECZYDGTSA-N 2 1 300.490 4.065 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2csc3ccccc23)CC2CC2)CC1 ZINC001236553691 1055182251 /nfs/dbraw/zinc/18/22/51/1055182251.db2.gz SOHYQSJFAGASLS-QAQDUYKDSA-N 2 1 314.498 4.383 20 0 DIADMP CCOc1ccc(C)c(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236554561 1055182517 /nfs/dbraw/zinc/18/25/17/1055182517.db2.gz LAAPOBGMBKYVMT-WGSAOQKQSA-N 2 1 318.505 4.122 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)nc2)C2CCCCC2)CC1 ZINC001236565520 1055185395 /nfs/dbraw/zinc/18/53/95/1055185395.db2.gz JHHRUWZYELZPBA-JCNLHEQBSA-N 2 1 321.896 4.140 20 0 DIADMP CC1(C[N@@H+](Cc2cccnc2)[C@H]2CC[C@H]([NH3+])CC2)CCCCC1 ZINC001236564819 1055185456 /nfs/dbraw/zinc/18/54/56/1055185456.db2.gz LLPWRWIZHOUUFU-WGSAOQKQSA-N 2 1 315.505 4.124 20 0 DIADMP C[C@@H]1C[C@@H](C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)C[C@H](C)O1 ZINC001236565486 1055185641 /nfs/dbraw/zinc/18/56/41/1055185641.db2.gz HYABALSSSHXRQT-GLXAHPGQSA-N 2 1 322.537 4.095 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2F)C2CCCCC2)CC1 ZINC001236565483 1055186125 /nfs/dbraw/zinc/18/61/25/1055186125.db2.gz HVLYRRXWBRZJHM-SAABIXHNSA-N 2 1 304.453 4.230 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(Cl)ccc2F)C2CCCC2)CC1 ZINC001236566452 1055186136 /nfs/dbraw/zinc/18/61/36/1055186136.db2.gz HZDWSGVIWNBZNH-JCNLHEQBSA-N 2 1 324.871 4.494 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cncc(Cl)c2)C2CCCCC2)CC1 ZINC001236565731 1055186281 /nfs/dbraw/zinc/18/62/81/1055186281.db2.gz OKPXKCQLQSXIQC-SAABIXHNSA-N 2 1 321.896 4.140 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCSCC2)C2CCCCC2)CC1 ZINC001236566253 1055186358 /nfs/dbraw/zinc/18/63/58/1055186358.db2.gz UWJVFHAEJUXSHH-SAABIXHNSA-N 2 1 310.551 4.034 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3ccccc3n2)C2CCCC2)CC1 ZINC001236566421 1055186378 /nfs/dbraw/zinc/18/63/78/1055186378.db2.gz HABWFJUTPCBTOH-IRJFHVNHSA-N 2 1 323.484 4.249 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236567072 1055188005 /nfs/dbraw/zinc/18/80/05/1055188005.db2.gz SBESDXMHINZNPK-KESTWPANSA-N 2 1 300.490 4.318 20 0 DIADMP CCc1cccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)n1 ZINC001236566663 1055188158 /nfs/dbraw/zinc/18/81/58/1055188158.db2.gz ZORKGTWCQCICGO-UKIBZPOASA-N 2 1 315.505 4.049 20 0 DIADMP COc1cc(C)ccc1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236566984 1055188418 /nfs/dbraw/zinc/18/84/18/1055188418.db2.gz QENMPMIITRTVPI-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(F)c(Cl)c2)C2CCCC2)CC1 ZINC001236566568 1055188671 /nfs/dbraw/zinc/18/86/71/1055188671.db2.gz KYVJGLOWSJILQJ-KOMQPUFPSA-N 2 1 324.871 4.494 20 0 DIADMP Cc1c[nH]c(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1C ZINC001236568339 1055190059 /nfs/dbraw/zinc/19/00/59/1055190059.db2.gz WCSDXZHLPVBOJQ-SAABIXHNSA-N 2 1 303.494 4.036 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cccc3c2CCCC3)C2CCC2)CC1 ZINC001236572572 1055193438 /nfs/dbraw/zinc/19/34/38/1055193438.db2.gz ORFQAGPCRZOPSM-KESTWPANSA-N 2 1 312.501 4.190 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3ccccc3c2)C2CCC2)CC1 ZINC001236572508 1055193487 /nfs/dbraw/zinc/19/34/87/1055193487.db2.gz QSDCTWPWZJAOME-XUTJKUGGSA-N 2 1 308.469 4.464 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc(C)c1F ZINC001236572097 1055193624 /nfs/dbraw/zinc/19/36/24/1055193624.db2.gz RHNRCNJZHUCPMF-UAPYVXQJSA-N 2 1 318.480 4.457 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2F)C2CCC2)CC1 ZINC001236572314 1055193682 /nfs/dbraw/zinc/19/36/82/1055193682.db2.gz PCHOWSFCGXKJFM-KOMQPUFPSA-N 2 1 310.844 4.104 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2cc(Cl)cs2)C2CCCC2)CC1 ZINC001236571560 1055193820 /nfs/dbraw/zinc/19/38/20/1055193820.db2.gz JCLWZCSAFVIOOE-CTYIDZIISA-N 2 1 312.910 4.416 20 0 DIADMP Cc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1Cl ZINC001236573478 1055195137 /nfs/dbraw/zinc/19/51/37/1055195137.db2.gz YKNYGHYSWGUKHF-JCNLHEQBSA-N 2 1 306.881 4.273 20 0 DIADMP Cc1c2ccccc2[nH]c1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572869 1055195392 /nfs/dbraw/zinc/19/53/92/1055195392.db2.gz VUCBBXFPMWIIQY-JCNLHEQBSA-N 2 1 311.473 4.101 20 0 DIADMP Cc1ccc(F)c(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1Cl ZINC001236572837 1055195512 /nfs/dbraw/zinc/19/55/12/1055195512.db2.gz UWYDFDKRUBVULC-CTYIDZIISA-N 2 1 324.871 4.412 20 0 DIADMP CSc1cc(C)cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236577001 1055196643 /nfs/dbraw/zinc/19/66/43/1055196643.db2.gz QNGFDUXDSQXFCX-SAABIXHNSA-N 2 1 318.530 4.341 20 0 DIADMP CC(C)c1cccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236577632 1055197465 /nfs/dbraw/zinc/19/74/65/1055197465.db2.gz WLQMEHXNTCZXJV-KESTWPANSA-N 2 1 300.490 4.434 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c2ccccc12 ZINC001236598246 1055200630 /nfs/dbraw/zinc/20/06/30/1055200630.db2.gz JGJOXOZSFGZKFX-KRWDZBQOSA-N 2 1 308.469 4.112 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)cc1 ZINC001236598210 1055201245 /nfs/dbraw/zinc/20/12/45/1055201245.db2.gz ILBAHRVFEXZJDE-SFHVURJKSA-N 2 1 320.480 4.318 20 0 DIADMP Cc1sc2ccccc2c1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236599785 1055201648 /nfs/dbraw/zinc/20/16/48/1055201648.db2.gz CWSJRZJRQNJAKR-HNNXBMFYSA-N 2 1 314.498 4.174 20 0 DIADMP CCCCc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)s1 ZINC001236598508 1055201829 /nfs/dbraw/zinc/20/18/29/1055201829.db2.gz KIAWMWBGVIILPY-OAHLLOKOSA-N 2 1 306.519 4.055 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236604852 1055203321 /nfs/dbraw/zinc/20/33/21/1055203321.db2.gz PWSCRPRWHRXCEX-LJQANCHMSA-N 2 1 314.860 4.178 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001236604314 1055203496 /nfs/dbraw/zinc/20/34/96/1055203496.db2.gz LUTVLDQOXUANOK-LJQANCHMSA-N 2 1 310.466 4.225 20 0 DIADMP CCCCCC[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000764518623 1055204024 /nfs/dbraw/zinc/20/40/24/1055204024.db2.gz GJOYFGOBHUZPJY-UHFFFAOYSA-N 2 1 306.469 4.003 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccsc1 ZINC000382142353 1055204183 /nfs/dbraw/zinc/20/41/83/1055204183.db2.gz QVSISDUYHBQHOC-LJQANCHMSA-N 2 1 314.498 4.453 20 0 DIADMP CC[C@@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1ccsc1 ZINC000382192135 1055206255 /nfs/dbraw/zinc/20/62/55/1055206255.db2.gz ZDCFSWKHAOIYMS-GOSISDBHSA-N 2 1 302.487 4.311 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@](C)(C[NH3+])C2)c1 ZINC001236617920 1055206902 /nfs/dbraw/zinc/20/69/02/1055206902.db2.gz YRDAFQRJJNJSLV-OAQYLSRUSA-N 2 1 308.469 4.141 20 0 DIADMP Fc1cccc2c(C[N@@H+](C3CCC3)C3CC[NH2+]CC3)cccc12 ZINC001236636309 1055207799 /nfs/dbraw/zinc/20/77/99/1055207799.db2.gz CPAWXUUQFSFZTG-UHFFFAOYSA-N 2 1 312.432 4.085 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+](C2CCC2)C2CC[NH2+]CC2)cc1 ZINC001236636791 1055209395 /nfs/dbraw/zinc/20/93/95/1055209395.db2.gz IYUOUFSASOFSGM-UHFFFAOYSA-N 2 1 320.480 4.460 20 0 DIADMP c1cc2c(cccc2C[NH+]2CCC([NH+]3CCCCC3)CC2)s1 ZINC001236683229 1055227256 /nfs/dbraw/zinc/22/72/56/1055227256.db2.gz PSUMLXAWHVSUGS-UHFFFAOYSA-N 2 1 314.498 4.352 20 0 DIADMP Cc1cc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)oc1C ZINC001236682254 1055227342 /nfs/dbraw/zinc/22/73/42/1055227342.db2.gz QQYXMOLLIZSVIC-WGSAOQKQSA-N 2 1 312.457 4.169 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCC2CCCC2)Cc2ccccc2)CC1 ZINC001236682732 1055227781 /nfs/dbraw/zinc/22/77/81/1055227781.db2.gz YFONEDAYGWDYNZ-MXVIHJGJSA-N 2 1 300.490 4.339 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccsc2)Cc2ccccc2)CC1 ZINC001236681881 1055229415 /nfs/dbraw/zinc/22/94/15/1055229415.db2.gz LACKXTAUKOMVBL-IYARVYRRSA-N 2 1 300.471 4.020 20 0 DIADMP C[N@@H+](Cc1ccc(-n2ccnc2)cc1)Cc1cccc2ccoc21 ZINC001236734465 1055245206 /nfs/dbraw/zinc/24/52/06/1055245206.db2.gz DSLUIPPZZDTVGP-UHFFFAOYSA-N 2 1 317.392 4.251 20 0 DIADMP c1cc2c(cccc2C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)o1 ZINC001236742424 1055248825 /nfs/dbraw/zinc/24/88/25/1055248825.db2.gz DFEMBOCEGVIDMJ-SFHVURJKSA-N 2 1 312.457 4.273 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc2occc21 ZINC001236739716 1055249044 /nfs/dbraw/zinc/24/90/44/1055249044.db2.gz OVJRBOQCVQEJOZ-ZWKOTPCHSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc2occc21 ZINC001236739716 1055249064 /nfs/dbraw/zinc/24/90/64/1055249064.db2.gz OVJRBOQCVQEJOZ-ZWKOTPCHSA-N 2 1 312.457 4.272 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1Cc1cccc2occc21 ZINC001236739716 1055249081 /nfs/dbraw/zinc/24/90/81/1055249081.db2.gz OVJRBOQCVQEJOZ-ZWKOTPCHSA-N 2 1 312.457 4.272 20 0 DIADMP C[C@H](C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236766851 1055250225 /nfs/dbraw/zinc/25/02/25/1055250225.db2.gz DDDQRZZRSNGDRM-BHIYHBOVSA-N 2 1 302.506 4.408 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236766820 1055252161 /nfs/dbraw/zinc/25/21/61/1055252161.db2.gz HAGXZRDUEAGZLL-IYARVYRRSA-N 2 1 306.469 4.252 20 0 DIADMP Cc1ccc(Cl)nc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236765961 1055252688 /nfs/dbraw/zinc/25/26/88/1055252688.db2.gz BPUDXFZZQBLRAH-SHTZXODSSA-N 2 1 323.912 4.161 20 0 DIADMP CC(C)(C)C[N@@H+](CC1(c2ccccc2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236767329 1055252705 /nfs/dbraw/zinc/25/27/05/1055252705.db2.gz HHGZUKNEMHNZDJ-WGSAOQKQSA-N 2 1 314.517 4.336 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccco2)cc1 ZINC000764776124 1055253733 /nfs/dbraw/zinc/25/37/33/1055253733.db2.gz YGZMVOODUVAFNH-HUUCEWRRSA-N 2 1 309.413 4.056 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(C(C)(C)C)[nH]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768851 1055255328 /nfs/dbraw/zinc/25/53/28/1055255328.db2.gz XTVQVWGUNWGBII-JCNLHEQBSA-N 2 1 319.537 4.430 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(N)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790000 1055257260 /nfs/dbraw/zinc/25/72/60/1055257260.db2.gz FACNAFVQDWJZSD-CZIWCDLHSA-N 2 1 323.912 4.183 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc2[nH]ccc2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236781788 1055257920 /nfs/dbraw/zinc/25/79/20/1055257920.db2.gz JABISMNBLAZDDS-UAPYVXQJSA-N 2 1 313.489 4.428 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(C)cc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783029 1055258345 /nfs/dbraw/zinc/25/83/45/1055258345.db2.gz YCGFUVBYURCUDY-SAABIXHNSA-N 2 1 306.469 4.395 20 0 DIADMP CCC(CC)[N@@H+](CCc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236783339 1055258815 /nfs/dbraw/zinc/25/88/15/1055258815.db2.gz SSECVWSFKZMZMA-SAABIXHNSA-N 2 1 306.469 4.129 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(OC)c(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236782891 1055259194 /nfs/dbraw/zinc/25/91/94/1055259194.db2.gz LZPKOKVLHWWZDN-UAPYVXQJSA-N 2 1 318.505 4.264 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[NH+]2CCC([NH+](C)C)CC2)c1 ZINC001236825008 1055280221 /nfs/dbraw/zinc/28/02/21/1055280221.db2.gz XKQFQNPNJMCAFQ-UHFFFAOYSA-N 2 1 322.496 4.496 20 0 DIADMP C[C@@H]1C[C@H]1c1ccc(CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000383482362 1055280679 /nfs/dbraw/zinc/28/06/79/1055280679.db2.gz SQYUZFGHPIYEQI-IMFGXOCKSA-N 2 1 324.468 4.015 20 0 DIADMP CCC[N@@H+](CC(c1ccccc1)c1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC001236828468 1055281119 /nfs/dbraw/zinc/28/11/19/1055281119.db2.gz IWZNIICTGDEXHV-LJQANCHMSA-N 2 1 322.496 4.140 20 0 DIADMP CCC[N@H+](Cc1cccc(-c2ccsc2)c1)C[C@@H]1CC[NH2+]C1 ZINC001236834891 1055283291 /nfs/dbraw/zinc/28/32/91/1055283291.db2.gz JLCQFBSXLJWWIM-QGZVFWFLSA-N 2 1 314.498 4.237 20 0 DIADMP CCC[N@H+](Cc1ccccc1Oc1ccccc1)C[C@@H]1CC[NH2+]C1 ZINC001236835682 1055284109 /nfs/dbraw/zinc/28/41/09/1055284109.db2.gz OWXQBAXTXNPLHY-GOSISDBHSA-N 2 1 324.468 4.300 20 0 DIADMP CCC[N@H+](Cc1sc2ccccc2c1C)C[C@H]1CC[NH2+]C1 ZINC001236835329 1055285637 /nfs/dbraw/zinc/28/56/37/1055285637.db2.gz LHKKTZYUZZEQPA-HNNXBMFYSA-N 2 1 302.487 4.031 20 0 DIADMP CCC[N@@H+](Cc1ccc(C)c(Cl)c1Cl)C[C@H]1CC[NH2+]C1 ZINC001236843481 1055289120 /nfs/dbraw/zinc/28/91/20/1055289120.db2.gz PARRHRVKDKOXCU-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP CCC[N@H+](Cc1ccc(C)c(Cl)c1Cl)C[C@H]1CC[NH2+]C1 ZINC001236843481 1055289128 /nfs/dbraw/zinc/28/91/28/1055289128.db2.gz PARRHRVKDKOXCU-ZDUSSCGKSA-N 2 1 315.288 4.123 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccnc(Cl)c1 ZINC000764962616 1055303051 /nfs/dbraw/zinc/30/30/51/1055303051.db2.gz MEFAACSEEVTOEC-HUUCEWRRSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccnc(Cl)c1 ZINC000764962618 1055303875 /nfs/dbraw/zinc/30/38/75/1055303875.db2.gz MEFAACSEEVTOEC-LSDHHAIUSA-N 2 1 309.885 4.040 20 0 DIADMP Clc1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)ccc1-n1ccnc1 ZINC001236915206 1055317760 /nfs/dbraw/zinc/31/77/60/1055317760.db2.gz ZUORYNANALYXMU-NVXWUHKLSA-N 2 1 315.848 4.290 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC001237057391 1055353274 /nfs/dbraw/zinc/35/32/74/1055353274.db2.gz LUSRIRBSHJACOC-SFHVURJKSA-N 2 1 318.848 4.161 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC001237059289 1055359729 /nfs/dbraw/zinc/35/97/29/1055359729.db2.gz SIMRPAXROCOPNA-SFHVURJKSA-N 2 1 318.848 4.161 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC001237080155 1055363454 /nfs/dbraw/zinc/36/34/54/1055363454.db2.gz DETDTSHZPZCESR-FQEVSTJZSA-N 2 1 300.490 4.295 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1sc(Cl)c2ccccc21 ZINC001237078586 1055364687 /nfs/dbraw/zinc/36/46/87/1055364687.db2.gz KMJSGFZRVFJYDY-YHWZYXNKSA-N 2 1 320.889 4.256 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2oc3ccccc3c2c1 ZINC001237082813 1055366810 /nfs/dbraw/zinc/36/68/10/1055366810.db2.gz XLAUMXYOWPXWNK-ALOPSCKCSA-N 2 1 320.436 4.288 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccsc1 ZINC000765451662 1055396768 /nfs/dbraw/zinc/39/67/68/1055396768.db2.gz CVTCUYGNJPZMFD-HNNXBMFYSA-N 2 1 306.519 4.443 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccnc(-c3ccccc3)c2)CC1 ZINC000624267552 1055412144 /nfs/dbraw/zinc/41/21/44/1055412144.db2.gz QVBAOJQHAKLDHF-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[NH+]2CCC3(CC2)[NH2+]CCc2ccccc23)CC1 ZINC001237274969 1055413714 /nfs/dbraw/zinc/41/37/14/1055413714.db2.gz IIVRWHYAKHBRHX-AZUAARDMSA-N 2 1 324.512 4.116 20 0 DIADMP c1ccc2c(c1)C[N@@H+](CCCC1CCCCC1)C21CC[NH2+]CC1 ZINC001237299673 1055422077 /nfs/dbraw/zinc/42/20/77/1055422077.db2.gz GBGJHRFXIDWPOB-UHFFFAOYSA-N 2 1 312.501 4.441 20 0 DIADMP c1ccc2c(c1)C[N@H+](CCCC1CCCCC1)C21CC[NH2+]CC1 ZINC001237299673 1055422090 /nfs/dbraw/zinc/42/20/90/1055422090.db2.gz GBGJHRFXIDWPOB-UHFFFAOYSA-N 2 1 312.501 4.441 20 0 DIADMP CCc1cccc(C)c1C[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC001237335920 1055432506 /nfs/dbraw/zinc/43/25/06/1055432506.db2.gz QTVGMZSKSFGKAR-UHFFFAOYSA-N 2 1 300.490 4.008 20 0 DIADMP c1ccc(Oc2ccccc2C[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237388187 1055445145 /nfs/dbraw/zinc/44/51/45/1055445145.db2.gz CMFUIFCNOVLZDV-PXNSSMCTSA-N 2 1 322.452 4.053 20 0 DIADMP c1ccc(Oc2ccccc2C[N@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cc1 ZINC001237388187 1055445152 /nfs/dbraw/zinc/44/51/52/1055445152.db2.gz CMFUIFCNOVLZDV-PXNSSMCTSA-N 2 1 322.452 4.053 20 0 DIADMP Cc1cnccc1O[C@@H]1CC[N@H+](Cc2cccc(C(C)C)c2)C1 ZINC001237460845 1055455063 /nfs/dbraw/zinc/45/50/63/1055455063.db2.gz ZAAJTMFJMFOPKU-LJQANCHMSA-N 2 1 310.441 4.167 20 0 DIADMP Cc1c(Cl)cccc1C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC001620868637 1055495720 /nfs/dbraw/zinc/49/57/20/1055495720.db2.gz KORPSDLAJMLQBA-MRXNPFEDSA-N 2 1 308.897 4.106 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC001620925060 1055545641 /nfs/dbraw/zinc/54/56/41/1055545641.db2.gz YDNIGYIBKWJVBL-ONCXSQPRSA-N 2 1 302.506 4.279 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH2+]CCCC[N@H+](C)C2CC2)c(C)c1 ZINC001620960530 1055606045 /nfs/dbraw/zinc/60/60/45/1055606045.db2.gz OEIYULLIIIBQNR-BQYQJAHWSA-N 2 1 300.490 4.089 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cccc(C3CCCC3)c2)C1 ZINC001620964779 1055667561 /nfs/dbraw/zinc/66/75/61/1055667561.db2.gz FLZJSOYPZGGIIG-QGZVFWFLSA-N 2 1 300.490 4.166 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCCC2(CC[NH+](CCOC)CC2)C1 ZINC001278273064 1055735967 /nfs/dbraw/zinc/73/59/67/1055735967.db2.gz SQMJUIUAXPOKDV-IBGZPJMESA-N 2 1 324.553 4.027 20 0 DIADMP c1csc(CC[N@H+]2CCC[C@]3(CC[NH+](C4CCCC4)C3)C2)c1 ZINC001278280336 1055750273 /nfs/dbraw/zinc/75/02/73/1055750273.db2.gz IVAANUKLIGDFAB-IBGZPJMESA-N 2 1 318.530 4.021 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2-c2cccc(Cl)c2F)CC1 ZINC001238958254 1055801828 /nfs/dbraw/zinc/80/18/28/1055801828.db2.gz JDDNPGZLZWAYMB-UHFFFAOYSA-N 2 1 318.823 4.069 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCC[N@H+]2CC2CCCCC2)C[C@H]1C ZINC001620770662 1055938878 /nfs/dbraw/zinc/93/88/78/1055938878.db2.gz ZDNONKCJPPWIND-IZBJGVDFSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC001620779958 1055948861 /nfs/dbraw/zinc/94/88/61/1055948861.db2.gz UYXMJJPRDASLNX-GOSISDBHSA-N 2 1 300.490 4.164 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)C1 ZINC001620786083 1055960757 /nfs/dbraw/zinc/96/07/57/1055960757.db2.gz XKHLUBCWFYIXKX-YZGWKJHDSA-N 2 1 300.490 4.034 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@@H](SC)C2)C1 ZINC001620791721 1055969556 /nfs/dbraw/zinc/96/95/56/1055969556.db2.gz WFKWGGPHXNQKBK-BRWVUGGUSA-N 2 1 312.567 4.151 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+][C@@H]2CCC[C@@H](SC)C2)C1 ZINC001620791721 1055969564 /nfs/dbraw/zinc/96/95/64/1055969564.db2.gz WFKWGGPHXNQKBK-BRWVUGGUSA-N 2 1 312.567 4.151 20 0 DIADMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2ccc(C3CC3)c(C3CC3)c2)C1 ZINC001621006516 1055974763 /nfs/dbraw/zinc/97/47/63/1055974763.db2.gz LEHBPGDEMNBUOE-KRWDZBQOSA-N 2 1 312.501 4.263 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001621015832 1055981901 /nfs/dbraw/zinc/98/19/01/1055981901.db2.gz JYSVPOLDRGUJOJ-AQNXPRMDSA-N 2 1 314.517 4.170 20 0 DIADMP C[C@@H](CCc1ccccc1)C[NH2+]C[C@@H](C1CCCCC1)[NH+](C)C ZINC001620724577 1055986843 /nfs/dbraw/zinc/98/68/43/1055986843.db2.gz DFBDMAYAJSXDPX-RXVVDRJESA-N 2 1 316.533 4.355 20 0 DIADMP C[N@H+](Cc1ccccc1Nc1ccc[nH+]c1N)C1CCCCC1 ZINC001212406183 1056188900 /nfs/dbraw/zinc/18/89/00/1056188900.db2.gz WSBMUMOKQARNCH-UHFFFAOYSA-N 2 1 310.445 4.172 20 0 DIADMP C[N@@H+](Cc1ccccc1Nc1ccc[nH+]c1N)C1CCCCC1 ZINC001212406183 1056188906 /nfs/dbraw/zinc/18/89/06/1056188906.db2.gz WSBMUMOKQARNCH-UHFFFAOYSA-N 2 1 310.445 4.172 20 0 DIADMP C[N@H+]1CCc2ccc(-c3ccc(C[NH2+]C(C)(C)C)cc3)cc2C1 ZINC001240377489 1056461988 /nfs/dbraw/zinc/46/19/88/1056461988.db2.gz HOHGRPBEHUBQIO-UHFFFAOYSA-N 2 1 308.469 4.230 20 0 DIADMP C[C@H]1SCC[N@H+](CCC[NH+]2CCCCC2)[C@@H]1c1ccccc1 ZINC001615522888 1056527905 /nfs/dbraw/zinc/52/79/05/1056527905.db2.gz BORZGJHYRLYUKK-MJGOQNOKSA-N 2 1 318.530 4.041 20 0 DIADMP C[C@H]1SCC[N@@H+](CCC[NH+]2CCCCC2)[C@@H]1c1ccccc1 ZINC001615522888 1056527917 /nfs/dbraw/zinc/52/79/17/1056527917.db2.gz BORZGJHYRLYUKK-MJGOQNOKSA-N 2 1 318.530 4.041 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001615540639 1056532276 /nfs/dbraw/zinc/53/22/76/1056532276.db2.gz ZLKJFJZWCAREST-ROUUACIJSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001615540639 1056532289 /nfs/dbraw/zinc/53/22/89/1056532289.db2.gz ZLKJFJZWCAREST-ROUUACIJSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001615540639 1056532300 /nfs/dbraw/zinc/53/23/00/1056532300.db2.gz ZLKJFJZWCAREST-ROUUACIJSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001615540639 1056532313 /nfs/dbraw/zinc/53/23/13/1056532313.db2.gz ZLKJFJZWCAREST-ROUUACIJSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c(C)c1C ZINC001615791572 1056574704 /nfs/dbraw/zinc/57/47/04/1056574704.db2.gz JFCSUTMFWCBZJX-BFUOFWGJSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(C)c1C ZINC001615791572 1056574715 /nfs/dbraw/zinc/57/47/15/1056574715.db2.gz JFCSUTMFWCBZJX-BFUOFWGJSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c(C)c1C ZINC001615791572 1056574723 /nfs/dbraw/zinc/57/47/23/1056574723.db2.gz JFCSUTMFWCBZJX-BFUOFWGJSA-N 2 1 302.506 4.143 20 0 DIADMP Cc1c(C)c(C)c(C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c(C)c1C ZINC001615791572 1056574733 /nfs/dbraw/zinc/57/47/33/1056574733.db2.gz JFCSUTMFWCBZJX-BFUOFWGJSA-N 2 1 302.506 4.143 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001615867207 1056588150 /nfs/dbraw/zinc/58/81/50/1056588150.db2.gz FECUXNNARNYJDQ-QGZVFWFLSA-N 2 1 318.480 4.302 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC001616382374 1056646534 /nfs/dbraw/zinc/64/65/34/1056646534.db2.gz KJDVDABZAPZJNF-WOJBJXKFSA-N 2 1 300.490 4.382 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)C[C@H]1CCCCC1(C)C ZINC001617168682 1056786554 /nfs/dbraw/zinc/78/65/54/1056786554.db2.gz CYCFZETXVKUNBE-QGZVFWFLSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)C[C@H]1CCCCC1(C)C ZINC001617168682 1056786563 /nfs/dbraw/zinc/78/65/63/1056786563.db2.gz CYCFZETXVKUNBE-QGZVFWFLSA-N 2 1 305.510 4.374 20 0 DIADMP CCc1ccc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1 ZINC000065976628 1056817339 /nfs/dbraw/zinc/81/73/39/1056817339.db2.gz AWKAFWWIMGLOEC-UHFFFAOYSA-N 2 1 310.485 4.379 20 0 DIADMP CC[NH+](CC)CCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC001617473387 1056839313 /nfs/dbraw/zinc/83/93/13/1056839313.db2.gz FLYVNXNAEWQYNR-ACDBMABISA-N 2 1 300.490 4.129 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(-c2cnc(N(C)C)cc2C)nc1 ZINC001241239772 1056975772 /nfs/dbraw/zinc/97/57/72/1056975772.db2.gz CVNFBYVHDIHQDV-LJQANCHMSA-N 2 1 324.472 4.065 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000360028642 1057018358 /nfs/dbraw/zinc/01/83/58/1057018358.db2.gz GSTQAXMKGGWZJO-ZENOOKHLSA-N 2 1 322.905 4.093 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000360028642 1057018361 /nfs/dbraw/zinc/01/83/61/1057018361.db2.gz GSTQAXMKGGWZJO-ZENOOKHLSA-N 2 1 322.905 4.093 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CC3)[C@H]1c1cccs1 ZINC000657890306 1057064752 /nfs/dbraw/zinc/06/47/52/1057064752.db2.gz RUJPELRKGZPYQX-OIISXLGYSA-N 2 1 304.503 4.053 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CC3)[C@H]1c1cccs1 ZINC000657890306 1057064755 /nfs/dbraw/zinc/06/47/55/1057064755.db2.gz RUJPELRKGZPYQX-OIISXLGYSA-N 2 1 304.503 4.053 20 0 DIADMP Cc1[nH+]c(C2=CC[N@@H+](Cc3ccccc3)CC2)cc2[nH]ccc21 ZINC001241502682 1057071608 /nfs/dbraw/zinc/07/16/08/1057071608.db2.gz RXUHHMGFOHHBOW-UHFFFAOYSA-N 2 1 303.409 4.161 20 0 DIADMP c1ccc(C[N@@H+]2CC=C(c3ccc([C@@H]4CC[NH2+]C4)cc3)CC2)cc1 ZINC001241506681 1057076797 /nfs/dbraw/zinc/07/67/97/1057076797.db2.gz JTPPXZWAOSERBY-JOCHJYFZSA-N 2 1 318.464 4.053 20 0 DIADMP CC1(C)C=C(c2ccc3c(C4C[NH2+]C4)[nH+]cn3c2)CC(C)(C)C1 ZINC001241892967 1057202667 /nfs/dbraw/zinc/20/26/67/1057202667.db2.gz FVPABRMSQIAKKW-UHFFFAOYSA-N 2 1 309.457 4.251 20 0 DIADMP CCC[N@H+]1CCCC[C@H]1c1ccc(-c2ccc(C[NH3+])cc2)nc1 ZINC001241913238 1057209294 /nfs/dbraw/zinc/20/92/94/1057209294.db2.gz SADFPQHABWSTSJ-FQEVSTJZSA-N 2 1 309.457 4.144 20 0 DIADMP CC(C)[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccn1 ZINC000766082370 1057298598 /nfs/dbraw/zinc/29/85/98/1057298598.db2.gz RREJIANLCBTMJL-FQEVSTJZSA-N 2 1 315.505 4.165 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000174452804 1057361881 /nfs/dbraw/zinc/36/18/81/1057361881.db2.gz CBLALEDXEBSPGK-UHFFFAOYSA-N 2 1 309.413 4.022 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000675752156 1057406923 /nfs/dbraw/zinc/40/69/23/1057406923.db2.gz LFMTVCUPJWKPDI-AQNXPRMDSA-N 2 1 300.490 4.004 20 0 DIADMP [NH3+]C1CC[NH+](Cc2cccc(-c3cc4cc(F)ccc4o3)c2)CC1 ZINC001242705894 1057453583 /nfs/dbraw/zinc/45/35/83/1057453583.db2.gz DWMBTRKRJAUIRU-UHFFFAOYSA-N 2 1 324.399 4.162 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCNc2ccccc21 ZINC000347913901 1057532696 /nfs/dbraw/zinc/53/26/96/1057532696.db2.gz HKOUUWIHLZSEGZ-XLIONFOSSA-N 2 1 315.505 4.178 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166461 1057534133 /nfs/dbraw/zinc/53/41/33/1057534133.db2.gz SDGHZGBKDONIHY-DYEKYZERSA-N 2 1 314.445 4.135 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(SC(F)F)cc1 ZINC000766166461 1057534134 /nfs/dbraw/zinc/53/41/34/1057534134.db2.gz SDGHZGBKDONIHY-DYEKYZERSA-N 2 1 314.445 4.135 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCC(F)(F)C1 ZINC000626062920 1057555332 /nfs/dbraw/zinc/55/53/32/1057555332.db2.gz LJIVJXRIGCPQHN-QGZVFWFLSA-N 2 1 310.432 4.006 20 0 DIADMP CC(C)[C@H](C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000671770034 1057560276 /nfs/dbraw/zinc/56/02/76/1057560276.db2.gz QFCTYLMHRQQYSL-QRVBRYPASA-N 2 1 320.908 4.296 20 0 DIADMP c1ccc(-c2cccc(C[N@@H+]3CC[C@H](C[NH+]4CCCC4)C3)c2)cc1 ZINC000536662728 1057674057 /nfs/dbraw/zinc/67/40/57/1057674057.db2.gz VKTIHMMEJNHITH-HXUWFJFHSA-N 2 1 320.480 4.271 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166839572 1057677572 /nfs/dbraw/zinc/67/75/72/1057677572.db2.gz OKKSGRAXBUYXJH-HDMKZQKVSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166839572 1057677575 /nfs/dbraw/zinc/67/75/75/1057677575.db2.gz OKKSGRAXBUYXJH-HDMKZQKVSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166839351 1057677904 /nfs/dbraw/zinc/67/79/04/1057677904.db2.gz OKKSGRAXBUYXJH-IIDMSEBBSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(F)cc1F ZINC000166839351 1057677908 /nfs/dbraw/zinc/67/79/08/1057677908.db2.gz OKKSGRAXBUYXJH-IIDMSEBBSA-N 2 1 322.443 4.268 20 0 DIADMP COC(=[NH2+])c1cccc(-c2ccc(C3CC[NH+](C)CC3)cc2)c1 ZINC001243656402 1057745821 /nfs/dbraw/zinc/74/58/21/1057745821.db2.gz FCTVDAJBPDRKKK-UHFFFAOYSA-N 2 1 308.425 4.135 20 0 DIADMP C1=CC[C@@H](C[NH+]2CCC3(CC[N@H+](C4CCCC4)C3)CC2)CC1 ZINC001278386538 1058025130 /nfs/dbraw/zinc/02/51/30/1058025130.db2.gz QFANJYYNYJXSPV-GOSISDBHSA-N 2 1 302.506 4.073 20 0 DIADMP CCCC[C@@H](CC)C[N@@H+]1CCO[C@@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391380 1058065527 /nfs/dbraw/zinc/06/55/27/1058065527.db2.gz QARQGPWLDPGMMZ-WOJBJXKFSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[N@H+]1CCO[C@@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391380 1058065530 /nfs/dbraw/zinc/06/55/30/1058065530.db2.gz QARQGPWLDPGMMZ-WOJBJXKFSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCO[C@@]2(CCC[N@H+](CC(C)C)C2)C1 ZINC001278391380 1058065533 /nfs/dbraw/zinc/06/55/33/1058065533.db2.gz QARQGPWLDPGMMZ-WOJBJXKFSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@@H](CC)C[NH+]1CCO[C@@]2(CCC[N@@H+](CC(C)C)C2)C1 ZINC001278391380 1058065535 /nfs/dbraw/zinc/06/55/35/1058065535.db2.gz QARQGPWLDPGMMZ-WOJBJXKFSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[N@@H+]1CCO[C@@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391379 1058065650 /nfs/dbraw/zinc/06/56/50/1058065650.db2.gz QARQGPWLDPGMMZ-VQTJNVASSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCO[C@@]2(CCC[NH+](CC(C)C)C2)C1 ZINC001278391379 1058065655 /nfs/dbraw/zinc/06/56/55/1058065655.db2.gz QARQGPWLDPGMMZ-VQTJNVASSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCO[C@@]2(CCC[N@H+](CC(C)C)C2)C1 ZINC001278391379 1058065658 /nfs/dbraw/zinc/06/56/58/1058065658.db2.gz QARQGPWLDPGMMZ-VQTJNVASSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[NH+]1CCO[C@@]2(CCC[N@@H+](CC(C)C)C2)C1 ZINC001278391379 1058065662 /nfs/dbraw/zinc/06/56/62/1058065662.db2.gz QARQGPWLDPGMMZ-VQTJNVASSA-N 2 1 324.553 4.026 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+][C@@H](c3ccncc3)C3CCC3)CC[NH2+]2)cc1 ZINC001550351848 1058340382 /nfs/dbraw/zinc/34/03/82/1058340382.db2.gz SLDUAVMSHINFEF-PCCBWWKXSA-N 2 1 321.468 4.006 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[C@H](c3[nH+]ccn3C)C1)CCC2 ZINC001550502737 1058342159 /nfs/dbraw/zinc/34/21/59/1058342159.db2.gz ADGITTOWTZGVCO-JENIJYKNSA-N 2 1 309.457 4.032 20 0 DIADMP Cc1cccc(C2([NH2+][C@H]3CC[C@@H](c4[nH+]ccn4C)C3)CCC2)c1 ZINC001550512049 1058342518 /nfs/dbraw/zinc/34/25/18/1058342518.db2.gz QCDOCKFRVZAXSU-AEFFLSMTSA-N 2 1 309.457 4.034 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@@H](c3[nH+]ccn3C)C1)CCC2 ZINC001550502739 1058342782 /nfs/dbraw/zinc/34/27/82/1058342782.db2.gz ADGITTOWTZGVCO-ZHALLVOQSA-N 2 1 309.457 4.032 20 0 DIADMP Cn1cc[nH+]c1[C@@H]1CC[C@@H]([NH2+][C@H](C2CCC2)C2CCCC2)C1 ZINC001550511505 1058342905 /nfs/dbraw/zinc/34/29/05/1058342905.db2.gz FIJDIZREENZWBG-KURKYZTESA-N 2 1 301.478 4.005 20 0 DIADMP Cc1ccccc1C1([NH2+][C@@H]2CC[C@H](c3[nH+]ccn3C)C2)CCC1 ZINC001550512552 1058343202 /nfs/dbraw/zinc/34/32/02/1058343202.db2.gz AGRCEEZECUPSSL-DLBZAZTESA-N 2 1 309.457 4.034 20 0 DIADMP FC1CC([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)(c2ccccc2)C1 ZINC001552312470 1058433185 /nfs/dbraw/zinc/43/31/85/1058433185.db2.gz PWABGAUPIBYHBV-YZDRJCRTSA-N 2 1 324.443 4.097 20 0 DIADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc3c[nH+]cn3c2)nc1 ZINC001245898755 1058605903 /nfs/dbraw/zinc/60/59/03/1058605903.db2.gz WORLTKZSSQSYEW-HXUWFJFHSA-N 2 1 320.440 4.333 20 0 DIADMP C[N@H+]1CCCC[C@@H]1c1ccc(-c2ccc(C(C)(C)[NH3+])cc2)nc1 ZINC001245907400 1058610405 /nfs/dbraw/zinc/61/04/05/1058610405.db2.gz RCZCHVSUZOCIKY-LJQANCHMSA-N 2 1 309.457 4.099 20 0 DIADMP CC(C)[C@H]1C[C@H]([NH2+]C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246070754 1058662469 /nfs/dbraw/zinc/66/24/69/1058662469.db2.gz FFUBJPYODICYQZ-WOJBJXKFSA-N 2 1 308.469 4.142 20 0 DIADMP Cc1cccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccc(F)cc3C)C2)c1 ZINC001246071179 1058662917 /nfs/dbraw/zinc/66/29/17/1058662917.db2.gz ITBDBOSIZMLSMH-AZUAARDMSA-N 2 1 312.432 4.025 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246070750 1058663754 /nfs/dbraw/zinc/66/37/54/1058663754.db2.gz FFUBJPYODICYQZ-PMACEKPBSA-N 2 1 308.469 4.142 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1Cl ZINC001246076920 1058665895 /nfs/dbraw/zinc/66/58/95/1058665895.db2.gz QDIRPWFSZVULHQ-ZZVYKPCYSA-N 2 1 313.272 4.317 20 0 DIADMP c1ccc([C@H]2C[C@@H]([NH2+][C@@H]3CCCc4ccccc43)CC[NH2+]2)cc1 ZINC001246076657 1058667133 /nfs/dbraw/zinc/66/71/33/1058667133.db2.gz DNVUOXWTVCEBMD-CEWLAPEOSA-N 2 1 306.453 4.147 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CC2)CC[NH2+]1 ZINC001246076787 1058667431 /nfs/dbraw/zinc/66/74/31/1058667431.db2.gz PNGJRPJSAWGDAT-IRXDYDNUSA-N 2 1 306.881 4.230 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C2(C)CCCCC2)CC[NH2+]1 ZINC001246084119 1058670119 /nfs/dbraw/zinc/67/01/19/1058670119.db2.gz WBOVVCUOBPCGBM-FUHWJXTLSA-N 2 1 304.453 4.240 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)ccc1Cl ZINC001246115960 1058684149 /nfs/dbraw/zinc/68/41/49/1058684149.db2.gz LWFKTTZZQGDIOD-CMPLNLGQSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccc1Cl ZINC001246162849 1058706669 /nfs/dbraw/zinc/70/66/69/1058706669.db2.gz GRJZWFJYDREPSY-GJZGRUSLSA-N 2 1 306.881 4.446 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C2(c3ccccc3)CC2)CC[NH2+]1 ZINC001246173569 1058717344 /nfs/dbraw/zinc/71/73/44/1058717344.db2.gz BDMNVDUKPBWMHB-ICSRJNTNSA-N 2 1 324.443 4.206 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+]C34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246178572 1058723614 /nfs/dbraw/zinc/72/36/14/1058723614.db2.gz IYFUPGLSLJEMII-QXVHMHJJSA-N 2 1 310.485 4.038 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CC[NH2+]1 ZINC001246177628 1058723908 /nfs/dbraw/zinc/72/39/08/1058723908.db2.gz CJGJSAXMAKZCSL-UHVLJITJSA-N 2 1 324.443 4.230 20 0 DIADMP C[C@]1([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CCC[NH2+]C1 ZINC001246187000 1058729503 /nfs/dbraw/zinc/72/95/03/1058729503.db2.gz FHQXTDRYXNTZGL-VJFUWPCTSA-N 2 1 306.881 4.098 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246185903 1058731673 /nfs/dbraw/zinc/73/16/73/1058731673.db2.gz WEBFENQSQISXQT-WMQCIHAUSA-N 2 1 324.443 4.204 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c(C)c1 ZINC001246185948 1058732265 /nfs/dbraw/zinc/73/22/65/1058732265.db2.gz XLAAMPLIAAQCRW-FPOVZHCZSA-N 2 1 308.469 4.195 20 0 DIADMP CCCC(CCC)[NH2+][C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246196898 1058737064 /nfs/dbraw/zinc/73/70/64/1058737064.db2.gz IKSNOIBQOZRWOS-MJGOQNOKSA-N 2 1 306.469 4.486 20 0 DIADMP Cc1cc(Cl)cc(Cl)c1C[NH2+][C@@H]1CC[NH2+][C@@H](C(C)C)C1 ZINC001246196005 1058737126 /nfs/dbraw/zinc/73/71/26/1058737126.db2.gz CXOVGSIDXSNONJ-CZUORRHYSA-N 2 1 315.288 4.168 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc(Cl)c(F)c2)CC[NH2+]1 ZINC001246211722 1058745043 /nfs/dbraw/zinc/74/50/43/1058745043.db2.gz LJJICUHPHKJJOQ-SNPRPXQTSA-N 2 1 312.860 4.441 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+]C[C@@]1(C)CC[NH2+]CC1(F)F ZINC001246221900 1058747945 /nfs/dbraw/zinc/74/79/45/1058747945.db2.gz PEOQSUZWUADONS-QZTJIDSGSA-N 2 1 324.459 4.012 20 0 DIADMP CCCc1ccc(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246229816 1058752878 /nfs/dbraw/zinc/75/28/78/1058752878.db2.gz LSOYGQMYXISTMA-NHCUHLMSSA-N 2 1 308.469 4.222 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246235526 1058756055 /nfs/dbraw/zinc/75/60/55/1058756055.db2.gz HTIKGSQYXWFMOF-IAGOWNOFSA-N 2 1 306.881 4.230 20 0 DIADMP CC[C@H]1CC([NH2+]C2(c3cccc(Cl)c3)CC2)C[C@H](CC)[NH2+]1 ZINC001246237311 1058761490 /nfs/dbraw/zinc/76/14/90/1058761490.db2.gz NNJJCJSGHKVTGD-HOTGVXAUSA-N 2 1 306.881 4.228 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[NH2+][C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246251844 1058770058 /nfs/dbraw/zinc/77/00/58/1058770058.db2.gz FLIRLJVEVVEYRO-DDIVZENXSA-N 2 1 301.261 4.173 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1cc(Cl)cc(Cl)c1 ZINC001246255273 1058773446 /nfs/dbraw/zinc/77/34/46/1058773446.db2.gz VGJZPNFVNJYKRA-MZORAGNBSA-N 2 1 313.272 4.317 20 0 DIADMP c1ccc([C@@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]4CCCC[C@@H]34)CC[NH2+]2)cc1 ZINC001246254218 1058774905 /nfs/dbraw/zinc/77/49/05/1058774905.db2.gz GAAKMZDNTVRYJM-YNWKUBOOSA-N 2 1 312.501 4.428 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246255287 1058775301 /nfs/dbraw/zinc/77/53/01/1058775301.db2.gz VNJHYQWKUYLWIE-YGRLFVJLSA-N 2 1 301.261 4.175 20 0 DIADMP [NH3+]C[C@@H](Cc1ccccc1)[NH2+]C1CCC2(CCCCC2)CC1 ZINC001246265254 1058780215 /nfs/dbraw/zinc/78/02/15/1058780215.db2.gz IUWONKHPAHAOIN-LJQANCHMSA-N 2 1 300.490 4.039 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)ccc1F ZINC001246262353 1058780632 /nfs/dbraw/zinc/78/06/32/1058780632.db2.gz BAFIWUOBJUXOHW-QAPCUYQASA-N 2 1 322.443 4.460 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C(C)C)CC[NH2+]1 ZINC001246271088 1058784368 /nfs/dbraw/zinc/78/43/68/1058784368.db2.gz DVVNQWASDYNUOW-GPMSIDNRSA-N 2 1 306.469 4.423 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2F)C(C)C)CC[NH2+]1 ZINC001246271091 1058785612 /nfs/dbraw/zinc/78/56/12/1058785612.db2.gz DVVNQWASDYNUOW-MDZRGWNJSA-N 2 1 306.469 4.423 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001246280520 1058793580 /nfs/dbraw/zinc/79/35/80/1058793580.db2.gz PJXUYKPYFXCLIM-QGZVFWFLSA-N 2 1 322.443 4.244 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2F)C2CCC2)CC[NH2+]1 ZINC001246279435 1058794702 /nfs/dbraw/zinc/79/47/02/1058794702.db2.gz KESYFXPVONKETK-MNEFBYGVSA-N 2 1 318.480 4.423 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+]C(C)(C)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246281725 1058799343 /nfs/dbraw/zinc/79/93/43/1058799343.db2.gz UYHCDUPWJONXLA-DLBZAZTESA-N 2 1 310.432 4.100 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)c(F)c1 ZINC001246281904 1058800553 /nfs/dbraw/zinc/80/05/53/1058800553.db2.gz ADPBCZQMZACVQD-VVFCZOMOSA-N 2 1 316.395 4.109 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCCC2(C)C)CC[NH2+]1 ZINC001246292588 1058808962 /nfs/dbraw/zinc/80/89/62/1058808962.db2.gz XUORLHYVUOUSDS-NJAFHUGGSA-N 2 1 304.453 4.096 20 0 DIADMP CC[C@@H]1CC([NH2+]C(C)(C)c2ccccc2Cl)C[C@@H](CC)[NH2+]1 ZINC001246314268 1058827014 /nfs/dbraw/zinc/82/70/14/1058827014.db2.gz XCKZLUOUGCNMAA-ZIAGYGMSSA-N 2 1 308.897 4.474 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](CC)c2ccc(F)cc2F)CC[NH2+]1 ZINC001246316506 1058827291 /nfs/dbraw/zinc/82/72/91/1058827291.db2.gz GXNIKYLUZNHJJS-IIDMSEBBSA-N 2 1 310.432 4.316 20 0 DIADMP c1cc2c(cccc2C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)s1 ZINC001246318904 1058828332 /nfs/dbraw/zinc/82/83/32/1058828332.db2.gz TTZBFSCRCVVDBB-PKOBYXMFSA-N 2 1 322.477 4.484 20 0 DIADMP c1cc2c(cccc2C[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC001246318897 1058832239 /nfs/dbraw/zinc/83/22/39/1058832239.db2.gz TTZBFSCRCVVDBB-HKUYNNGSSA-N 2 1 322.477 4.484 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CCC[NH2+][C@@H]1C ZINC001246325231 1058836659 /nfs/dbraw/zinc/83/66/59/1058836659.db2.gz ITWFCPKBJQSBDW-HSMVNMDESA-N 2 1 315.288 4.045 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](CC(C)C)c2ccccn2)C[C@H](CC)[NH2+]1 ZINC001246325072 1058839680 /nfs/dbraw/zinc/83/96/80/1058839680.db2.gz IAEAOBJYLPQWSZ-SFNKJDCFSA-N 2 1 303.494 4.068 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[NH2+][C@H]1C[NH2+]CC[C@@H]1C ZINC001246334069 1058842789 /nfs/dbraw/zinc/84/27/89/1058842789.db2.gz XYBUIWYEHOGWSK-SVMVAKDDSA-N 2 1 322.496 4.185 20 0 DIADMP CC(C)(C)[C@H](C[NH3+])[NH2+]C1CCC(c2ccc(Cl)cc2)CC1 ZINC001246345667 1058856751 /nfs/dbraw/zinc/85/67/51/1058856751.db2.gz NNPROVXBEOXQKX-PREGVCBESA-N 2 1 308.897 4.329 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]Cc3cccc(C4CC4)c3)CC[NH2+]2)cc1 ZINC001246361817 1058870123 /nfs/dbraw/zinc/87/01/23/1058870123.db2.gz JPPHADNNSHLGQC-NHCUHLMSSA-N 2 1 306.453 4.147 20 0 DIADMP CC[C@@H]1CC([NH2+]C2(c3ccccc3F)CCC2)C[C@@H](CC)[NH2+]1 ZINC001246368978 1058872915 /nfs/dbraw/zinc/87/29/15/1058872915.db2.gz URPBEKQNQFBSRA-HUUCEWRRSA-N 2 1 304.453 4.104 20 0 DIADMP Cc1ccccc1CC(C)(C)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246373932 1058879669 /nfs/dbraw/zinc/87/96/69/1058879669.db2.gz RXQUKUDVVFSPKJ-NHCUHLMSSA-N 2 1 322.496 4.399 20 0 DIADMP CC(C)CC[C@H](C)[NH2+]C1(c2ccccc2Cl)CC[NH2+]CC1 ZINC001246375303 1058880572 /nfs/dbraw/zinc/88/05/72/1058880572.db2.gz OCBJVIBGOOJLCN-HNNXBMFYSA-N 2 1 308.897 4.333 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](CC2CC2)c2ccccc2F)CC[NH2+]1 ZINC001246391736 1058897500 /nfs/dbraw/zinc/89/75/00/1058897500.db2.gz GTWMTAQBQGMWNO-SNRMKQJTSA-N 2 1 304.453 4.033 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CCCCC2(C)C)CC[NH2+]1 ZINC001246392438 1058898486 /nfs/dbraw/zinc/89/84/86/1058898486.db2.gz DFQCIJAIKDPFRJ-NEWSRXKRSA-N 2 1 318.480 4.486 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@H](c2cncc(Cl)c2)C2CC2)CC[NH2+]1 ZINC001246396570 1058900260 /nfs/dbraw/zinc/90/02/60/1058900260.db2.gz CDRCDYXLVVGVHH-KURKYZTESA-N 2 1 321.896 4.087 20 0 DIADMP Cc1ccc(C)c([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246416640 1058917890 /nfs/dbraw/zinc/91/78/90/1058917890.db2.gz SKJKPBBLUXAZFA-DSKINZAPSA-N 2 1 308.469 4.447 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246433223 1058925018 /nfs/dbraw/zinc/92/50/18/1058925018.db2.gz QZFLZSSPEXQICG-MJGOQNOKSA-N 2 1 316.464 4.097 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]CC2(CC3CC3)CC2)CC[NH2+]1 ZINC001246433225 1058925064 /nfs/dbraw/zinc/92/50/64/1058925064.db2.gz QZFLZSSPEXQICG-PKOBYXMFSA-N 2 1 316.464 4.097 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C1(c2ccccc2F)CC[NH2+]CC1 ZINC001246439547 1058933988 /nfs/dbraw/zinc/93/39/88/1058933988.db2.gz YVYQNKLKCPVFHM-MRXNPFEDSA-N 2 1 304.453 4.129 20 0 DIADMP CC[C@@]1([NH2+][C@H](C)CCc2ccc(Cl)c(Cl)c2)CC[NH2+]C1 ZINC001246459784 1058943856 /nfs/dbraw/zinc/94/38/56/1058943856.db2.gz GQVWTVFUEJAGMH-MLGOLLRUSA-N 2 1 315.288 4.046 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@@H](CC)[NH2+][C@@H](CC)C1)c1cc(F)cc(F)c1 ZINC001246459474 1058945714 /nfs/dbraw/zinc/94/57/14/1058945714.db2.gz AKKPOSLUTCVMAH-XMTFNYHQSA-N 2 1 310.432 4.315 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@@H](CC)[NH2+][C@H](CC)C1)c1cc(F)cc(F)c1 ZINC001246459472 1058946552 /nfs/dbraw/zinc/94/65/52/1058946552.db2.gz AKKPOSLUTCVMAH-JFIYKMOQSA-N 2 1 310.432 4.315 20 0 DIADMP Cc1ccc(C2([NH2+][C@@H]3CCCC[NH2+]C3)CCC(F)(F)CC2)cc1 ZINC001246462924 1058947901 /nfs/dbraw/zinc/94/79/01/1058947901.db2.gz ZQRSKJBBLLUDRU-QGZVFWFLSA-N 2 1 322.443 4.131 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+][C@H](c2ccccc2OC)C2CC2)CC[NH2+]1 ZINC001246469826 1058955696 /nfs/dbraw/zinc/95/56/96/1058955696.db2.gz TUAFXRLBALPBJS-QKLQHJQFSA-N 2 1 316.489 4.047 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]CC[C@@H]1CC[NH2+]CC1(F)F ZINC001246483103 1058962355 /nfs/dbraw/zinc/96/23/55/1058962355.db2.gz RHGUOBJVADRYPL-ROUUACIJSA-N 2 1 324.459 4.012 20 0 DIADMP Cc1cccc(C2([NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)CC2)c1 ZINC001246477962 1058963683 /nfs/dbraw/zinc/96/36/83/1058963683.db2.gz KYEWYHYGBOKTTN-PMACEKPBSA-N 2 1 306.453 4.067 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)cc(Cl)c2)C[C@H](CC)[NH2+]1 ZINC001246489296 1058965865 /nfs/dbraw/zinc/96/58/65/1058965865.db2.gz MZFXPEOWKAJMGX-KLWIRTJPSA-N 2 1 312.860 4.439 20 0 DIADMP FC1(F)C[NH2+]CC[C@H]1CC[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001246490123 1058966513 /nfs/dbraw/zinc/96/65/13/1058966513.db2.gz QFLIYLGJVQNQNM-HOTGVXAUSA-N 2 1 314.464 4.104 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)C1CCCCC1 ZINC001246491755 1058967643 /nfs/dbraw/zinc/96/76/43/1058967643.db2.gz SXQJVFDEOLCIHL-SLFFLAALSA-N 2 1 300.490 4.428 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3c(F)cc(F)cc32)CC[NH2+]1 ZINC001246497074 1058969323 /nfs/dbraw/zinc/96/93/23/1058969323.db2.gz GACAOJKQXCQWHF-KKXDTOCCSA-N 2 1 322.443 4.099 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H]1CCc2cccc(Cl)c2C1 ZINC001246495357 1058970724 /nfs/dbraw/zinc/97/07/24/1058970724.db2.gz JSESTXVIBHOAKJ-HNNXBMFYSA-N 2 1 308.897 4.085 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(C(F)(F)F)c(Cl)c1 ZINC001246493096 1058971614 /nfs/dbraw/zinc/97/16/14/1058971614.db2.gz YKUQDMRGVHSJJO-FOGDFJRCSA-N 2 1 320.786 4.150 20 0 DIADMP CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)CCc1ccc(Cl)c(Cl)c1 ZINC001246502983 1058973881 /nfs/dbraw/zinc/97/38/81/1058973881.db2.gz IQOHHMBWCXXTPV-JSGCOSHPSA-N 2 1 317.304 4.278 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@H](C)Cc1ccc(F)cc1Cl ZINC001246503851 1058974283 /nfs/dbraw/zinc/97/42/83/1058974283.db2.gz NDPWPDJJLFJJMA-CYBMUJFWSA-N 2 1 314.876 4.297 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001246522374 1058980715 /nfs/dbraw/zinc/98/07/15/1058980715.db2.gz JXWMMCREENRBRS-FQEVSTJZSA-N 2 1 314.517 4.254 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@@H+](Cc2ccccc2)C(C)(C)C)CC[NH2+]1 ZINC001246518636 1058980917 /nfs/dbraw/zinc/98/09/17/1058980917.db2.gz HOJZGRATIYJFIL-ROUUACIJSA-N 2 1 302.506 4.454 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001246522376 1058981669 /nfs/dbraw/zinc/98/16/69/1058981669.db2.gz JXWMMCREENRBRS-HXUWFJFHSA-N 2 1 314.517 4.254 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@@H+](Cc2ccccc2)C(C)(C)C)CC[NH2+]1 ZINC001246518632 1058982356 /nfs/dbraw/zinc/98/23/56/1058982356.db2.gz HOJZGRATIYJFIL-MSOLQXFVSA-N 2 1 302.506 4.454 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)C1CCC2(CCC[NH2+]C2)CC1 ZINC001246520253 1058982736 /nfs/dbraw/zinc/98/27/36/1058982736.db2.gz SLWXMIUGAGWSOF-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2[C@H](C)CCC[C@@H]2C)CC[NH2+]1 ZINC001246518561 1058983179 /nfs/dbraw/zinc/98/31/79/1058983179.db2.gz HGFMNOUAHQWNQN-HIRMHNASSA-N 2 1 304.453 4.190 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2[C@H](C)CCC[C@@H]2C)CC[NH2+]1 ZINC001246518561 1058983200 /nfs/dbraw/zinc/98/32/00/1058983200.db2.gz HGFMNOUAHQWNQN-HIRMHNASSA-N 2 1 304.453 4.190 20 0 DIADMP CC[C@@H]1C[C@@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530805 1058985236 /nfs/dbraw/zinc/98/52/36/1058985236.db2.gz QFDWRTADPPSBKF-UXHICEINSA-N 2 1 308.469 4.238 20 0 DIADMP CCC[N@H+](CC1CC1)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532467 1058985747 /nfs/dbraw/zinc/98/57/47/1058985747.db2.gz QOHGVXNKFHOYBV-IEBWSBKVSA-N 2 1 304.453 4.049 20 0 DIADMP CCC[N@@H+](CC1CC1)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246532467 1058985768 /nfs/dbraw/zinc/98/57/68/1058985768.db2.gz QOHGVXNKFHOYBV-IEBWSBKVSA-N 2 1 304.453 4.049 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2cccc(C)c2)C[C@H](CC)[NH2+]1 ZINC001246536435 1058986162 /nfs/dbraw/zinc/98/61/62/1058986162.db2.gz FLMCZNFNDLESLV-IYWMVGAKSA-N 2 1 300.490 4.441 20 0 DIADMP Cc1cccc([C@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)c1 ZINC001246536163 1058988030 /nfs/dbraw/zinc/98/80/30/1058988030.db2.gz CHLJJKWQKKUGDG-NYLDSWQDSA-N 2 1 312.501 4.444 20 0 DIADMP C1CCC2(CC1)CCC([N@H+]1CCCC3(CC[NH2+]CC3)C1)CC2 ZINC001246524390 1058988719 /nfs/dbraw/zinc/98/87/19/1058988719.db2.gz OZUOPVNDBCTNFS-UHFFFAOYSA-N 2 1 304.522 4.345 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@@H]2c2cccc(C)c2)C[C@@H](CC)[NH2+]1 ZINC001246536437 1058988905 /nfs/dbraw/zinc/98/89/05/1058988905.db2.gz FLMCZNFNDLESLV-QWFCFKBJSA-N 2 1 300.490 4.441 20 0 DIADMP CC[C@H]1CC([N@@H+]2CCc3ccc(Cl)cc3C2)C[C@H](CC)[NH2+]1 ZINC001246536463 1058989887 /nfs/dbraw/zinc/98/98/87/1058989887.db2.gz FTXHUUJLFLQKFB-IRXDYDNUSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@H]1CC([N@H+]2CCc3ccc(Cl)cc3C2)C[C@H](CC)[NH2+]1 ZINC001246536463 1058989902 /nfs/dbraw/zinc/98/99/02/1058989902.db2.gz FTXHUUJLFLQKFB-IRXDYDNUSA-N 2 1 306.881 4.007 20 0 DIADMP C1CCC2(CC1)CC[NH+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)CC2 ZINC001246548326 1058996218 /nfs/dbraw/zinc/99/62/18/1058996218.db2.gz HTBOXJDGPODWMD-GOSISDBHSA-N 2 1 304.522 4.488 20 0 DIADMP C[C@@H]1C[N@@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546489 1058998802 /nfs/dbraw/zinc/99/88/02/1058998802.db2.gz KKNPDDGZTFHTFF-LKUPVBHCSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246546489 1058998822 /nfs/dbraw/zinc/99/88/22/1058998822.db2.gz KKNPDDGZTFHTFF-LKUPVBHCSA-N 2 1 306.453 4.099 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@H](C[NH3+])[C@@H](C)C1 ZINC001246568537 1059002330 /nfs/dbraw/zinc/00/23/30/1059002330.db2.gz PCZXKPRBOHSALB-YSIASYRMSA-N 2 1 302.506 4.095 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@H](C[NH3+])[C@H](C)C1 ZINC001246568536 1059004867 /nfs/dbraw/zinc/00/48/67/1059004867.db2.gz PCZXKPRBOHSALB-MISYRCLQSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@@H]1C[N@H+]([C@H]2CCC[C@@H](c3ccccc3)C2)CCC[C@@H]1C[NH3+] ZINC001246561707 1059005562 /nfs/dbraw/zinc/00/55/62/1059005562.db2.gz KFWMZLXNSOOJHZ-AFYVEPGGSA-N 2 1 300.490 4.020 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@H]1CC[NH2+][C@@H](c3ccc(F)cc3C)C1)C2 ZINC001246568873 1059006138 /nfs/dbraw/zinc/00/61/38/1059006138.db2.gz SLZUPTNMQGKYQT-GHTZIAJQSA-N 2 1 324.443 4.251 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@H]1CC[NH2+][C@@H](c3ccc(F)cc3C)C1)C2 ZINC001246568873 1059006149 /nfs/dbraw/zinc/00/61/49/1059006149.db2.gz SLZUPTNMQGKYQT-GHTZIAJQSA-N 2 1 324.443 4.251 20 0 DIADMP CCCCCC1CCC([N@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)CC1 ZINC001246562736 1059006614 /nfs/dbraw/zinc/00/66/14/1059006614.db2.gz ZHUJWWSLKUEKOW-PCKAHOCUSA-N 2 1 302.453 4.041 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC001246572729 1059007411 /nfs/dbraw/zinc/00/74/11/1059007411.db2.gz KITGZQJAXJAJPZ-LLYILUEJSA-N 2 1 318.480 4.295 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC001246572729 1059007429 /nfs/dbraw/zinc/00/74/29/1059007429.db2.gz KITGZQJAXJAJPZ-LLYILUEJSA-N 2 1 318.480 4.295 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+](C2CCC(c3ccccc3)CC2)CC1 ZINC001246575628 1059009357 /nfs/dbraw/zinc/00/93/57/1059009357.db2.gz KMRMSXRMSQRPDN-SOAGJPPSSA-N 2 1 300.490 4.164 20 0 DIADMP CC(C)[N@@H+]([C@H]1CCc2cc(Cl)ccc2C1)[C@@H]1CCC[NH2+]CC1 ZINC001246581819 1059010729 /nfs/dbraw/zinc/01/07/29/1059010729.db2.gz AXIKYMPDXLPYSG-MOPGFXCFSA-N 2 1 320.908 4.050 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001246579526 1059010996 /nfs/dbraw/zinc/01/09/96/1059010996.db2.gz FJGJJKDKZFCRIX-UXHICEINSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1CCCC[C@@H](C[NH3+])C1 ZINC001246582563 1059012385 /nfs/dbraw/zinc/01/23/85/1059012385.db2.gz NTSIWTNZXNFYOT-HOTGVXAUSA-N 2 1 324.534 4.131 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001246581807 1059013487 /nfs/dbraw/zinc/01/34/87/1059013487.db2.gz AWEMXCGDUDCYMX-QUCCMNQESA-N 2 1 302.506 4.169 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)Cc1ccccc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC001246589756 1059017204 /nfs/dbraw/zinc/01/72/04/1059017204.db2.gz FNRUSXPBHTYBJB-DOTOQJQBSA-N 2 1 308.897 4.124 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+]1C[C@@H](C[NH3+])CC[C@H]1C ZINC001246593662 1059017317 /nfs/dbraw/zinc/01/73/17/1059017317.db2.gz SINXNHIFWRBTPP-OWCLPIDISA-N 2 1 324.534 4.129 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1cccc(Cl)c1)[C@@H]1CCC[NH2+]CC1 ZINC001246595979 1059017630 /nfs/dbraw/zinc/01/76/30/1059017630.db2.gz UNZYRWOOTAXHJI-CRAIPNDOSA-N 2 1 308.897 4.124 20 0 DIADMP CC(C)[N@@H+]([C@H]1CCc2c(Cl)cccc2C1)[C@@H]1CCC[NH2+]CC1 ZINC001246593432 1059019932 /nfs/dbraw/zinc/01/99/32/1059019932.db2.gz MZJMOLHYMAEEOU-SJORKVTESA-N 2 1 320.908 4.050 20 0 DIADMP C1C[N@@H+](C2CCC3(CCCCC3)CC2)[C@@]2(C1)CCC[NH2+]CC2 ZINC001246606639 1059021494 /nfs/dbraw/zinc/02/14/94/1059021494.db2.gz NLVADTBAZKFWGG-HXUWFJFHSA-N 2 1 304.522 4.488 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609617 1059025576 /nfs/dbraw/zinc/02/55/76/1059025576.db2.gz MARWMWJICIOYPU-PBHICJAKSA-N 2 1 324.921 4.039 20 0 DIADMP C[C@H](CSc1ccc(Cl)cc1)[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609617 1059025596 /nfs/dbraw/zinc/02/55/96/1059025596.db2.gz MARWMWJICIOYPU-PBHICJAKSA-N 2 1 324.921 4.039 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]C2 ZINC001246609737 1059027718 /nfs/dbraw/zinc/02/77/18/1059027718.db2.gz MZOYVXZIVFOBGE-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609638 1059029064 /nfs/dbraw/zinc/02/90/64/1059029064.db2.gz MARWMWJICIOYPU-WMLDXEAASA-N 2 1 324.921 4.039 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1CCC[C@@]12CCC[NH2+]C2 ZINC001246609638 1059029079 /nfs/dbraw/zinc/02/90/79/1059029079.db2.gz MARWMWJICIOYPU-WMLDXEAASA-N 2 1 324.921 4.039 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614305 1059029936 /nfs/dbraw/zinc/02/99/36/1059029936.db2.gz NYYCFXTYBDWNKZ-HKUYNNGSSA-N 2 1 316.464 4.336 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC23CCCCC3)CC[NH2+]1 ZINC001246614305 1059029952 /nfs/dbraw/zinc/02/99/52/1059029952.db2.gz NYYCFXTYBDWNKZ-HKUYNNGSSA-N 2 1 316.464 4.336 20 0 DIADMP c1ccc([C@@H]2CCC[C@@H]([N@H+]3CCC[C@@]4(CCCC[NH2+]4)C3)C2)cc1 ZINC001246616252 1059032800 /nfs/dbraw/zinc/03/28/00/1059032800.db2.gz UYLYAORUGYELNB-NJYVYQBISA-N 2 1 312.501 4.321 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001246619365 1059036029 /nfs/dbraw/zinc/03/60/29/1059036029.db2.gz LWLCUPAERRXSPC-WOJBJXKFSA-N 2 1 300.490 4.006 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246629979 1059037569 /nfs/dbraw/zinc/03/75/69/1059037569.db2.gz GUJFOWAYWRGHSM-RTWAWAEBSA-N 2 1 314.517 4.252 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246634374 1059037842 /nfs/dbraw/zinc/03/78/42/1059037842.db2.gz NASMAGIUNDFHHT-SFTDATJTSA-N 2 1 314.517 4.396 20 0 DIADMP c1ccc(C2CCC([N@@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)CC2)cc1 ZINC001246628797 1059038409 /nfs/dbraw/zinc/03/84/09/1059038409.db2.gz CGFQUXZRZIOXQC-CBNMVNINSA-N 2 1 312.501 4.321 20 0 DIADMP c1ccc(C2CCC([N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)CC2)cc1 ZINC001246628797 1059038430 /nfs/dbraw/zinc/03/84/30/1059038430.db2.gz CGFQUXZRZIOXQC-CBNMVNINSA-N 2 1 312.501 4.321 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246629975 1059039422 /nfs/dbraw/zinc/03/94/22/1059039422.db2.gz GUJFOWAYWRGHSM-LEWJYISDSA-N 2 1 314.517 4.252 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@H+]2CCC[C@]3(CCC[NH2+]3)C2)CC1 ZINC001246626590 1059040356 /nfs/dbraw/zinc/04/03/56/1059040356.db2.gz XTCSHLOOOHZLRT-KITAHSCOSA-N 2 1 324.512 4.031 20 0 DIADMP CCCCCC[C@@H](C)[N@H+]1C[C@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246623842 1059040474 /nfs/dbraw/zinc/04/04/74/1059040474.db2.gz NTRJOODZROMBQI-IEBWSBKVSA-N 2 1 300.490 4.034 20 0 DIADMP CCCC[C@H](CCC)[N@H+]1C[C@@H](c2ccccc2)C2(C[NH2+]C2)C1 ZINC001246625075 1059040623 /nfs/dbraw/zinc/04/06/23/1059040623.db2.gz QYCGWQWCHHRCOB-OALUTQOASA-N 2 1 300.490 4.034 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246634371 1059041396 /nfs/dbraw/zinc/04/13/96/1059041396.db2.gz NASMAGIUNDFHHT-NHCUHLMSSA-N 2 1 314.517 4.396 20 0 DIADMP CCCCCC[C@H](CC)[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001246638562 1059042073 /nfs/dbraw/zinc/04/20/73/1059042073.db2.gz MOOQKUGUJPSXKH-JKSUJKDBSA-N 2 1 302.453 4.056 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@H+]3CCC[C@@]4(CCC[NH2+]4)CC3)C2)cc1 ZINC001246636666 1059045079 /nfs/dbraw/zinc/04/50/79/1059045079.db2.gz VYHAOHGAUAPMBY-HKBOAZHASA-N 2 1 312.501 4.321 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001246636278 1059045366 /nfs/dbraw/zinc/04/53/66/1059045366.db2.gz ULHIMBUZPQVXSO-LEWJYISDSA-N 2 1 314.517 4.396 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([N@H+]3CCCC[C@H]3C3CC[NH2+]CC3)C2)cc1 ZINC001246657469 1059052465 /nfs/dbraw/zinc/05/24/65/1059052465.db2.gz NYZIZHQJYYETEM-NJYVYQBISA-N 2 1 312.501 4.177 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCCC12CC[NH2+]CC2 ZINC001246656071 1059052758 /nfs/dbraw/zinc/05/27/58/1059052758.db2.gz SLRJKINLLULEPY-IBGZPJMESA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc(C2CCC([N@@H+]3CCCC[C@]34CCC[NH2+]C4)CC2)cc1 ZINC001246653431 1059053699 /nfs/dbraw/zinc/05/36/99/1059053699.db2.gz SXJAFSANYOISDV-XVAXZDLZSA-N 2 1 312.501 4.321 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001246662971 1059056273 /nfs/dbraw/zinc/05/62/73/1059056273.db2.gz WLQNFQLFOBCTHD-RXVVDRJESA-N 2 1 314.517 4.170 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1 ZINC001246662965 1059059880 /nfs/dbraw/zinc/05/98/80/1059059880.db2.gz WLQNFQLFOBCTHD-NQIIRXRSSA-N 2 1 314.517 4.170 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cc1 ZINC001246677529 1059060976 /nfs/dbraw/zinc/06/09/76/1059060976.db2.gz IMWNWGLLUNIYEW-JBACZVJFSA-N 2 1 314.517 4.028 20 0 DIADMP C[C@@H]1CC[C@@H]([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C[C@@H]1C ZINC001246676824 1059061955 /nfs/dbraw/zinc/06/19/55/1059061955.db2.gz SXGBOFIYXYLPDP-CXUGJCBMSA-N 2 1 312.501 4.033 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246677125 1059063143 /nfs/dbraw/zinc/06/31/43/1059063143.db2.gz BWAGXIOUXDVFRO-GHTZIAJQSA-N 2 1 320.480 4.392 20 0 DIADMP CC1(C)CCC([N@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001246682494 1059063183 /nfs/dbraw/zinc/06/31/83/1059063183.db2.gz DFJDVIKZECMJQU-CTNGQTDRSA-N 2 1 312.501 4.034 20 0 DIADMP CC[C@H](CC(C)C)[N@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246683287 1059063684 /nfs/dbraw/zinc/06/36/84/1059063684.db2.gz IFUIJJUNWREXMD-HBMCJLEFSA-N 2 1 314.517 4.064 20 0 DIADMP Cc1ccc(CC[C@H](C)[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cc1 ZINC001246677530 1059063868 /nfs/dbraw/zinc/06/38/68/1059063868.db2.gz IMWNWGLLUNIYEW-SESVDKBCSA-N 2 1 314.517 4.028 20 0 DIADMP CC[C@H](CC(C)C)[N@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246683290 1059065476 /nfs/dbraw/zinc/06/54/76/1059065476.db2.gz IFUIJJUNWREXMD-NJYVYQBISA-N 2 1 314.517 4.064 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246683335 1059067753 /nfs/dbraw/zinc/06/77/53/1059067753.db2.gz RNKHLAAKZBDGDO-HMXCVIKNSA-N 2 1 312.501 4.200 20 0 DIADMP c1ccc(C2CC[NH+]([C@@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)cc1 ZINC001246688863 1059069265 /nfs/dbraw/zinc/06/92/65/1059069265.db2.gz ICBZQGQCYJAZNT-FGZHOGPDSA-N 2 1 320.480 4.359 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCCCC[C@H]2C)CC[NH2+]1 ZINC001246767246 1059072821 /nfs/dbraw/zinc/07/28/21/1059072821.db2.gz AWHBVMDHQDQYRK-SUMDDJOVSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCCCC[C@H]2C)CC[NH2+]1 ZINC001246767246 1059072834 /nfs/dbraw/zinc/07/28/34/1059072834.db2.gz AWHBVMDHQDQYRK-SUMDDJOVSA-N 2 1 304.453 4.192 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCC[C@@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246775315 1059073719 /nfs/dbraw/zinc/07/37/19/1059073719.db2.gz JFPQMWGUUPWFFU-HBMCJLEFSA-N 2 1 314.517 4.252 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246767250 1059074613 /nfs/dbraw/zinc/07/46/13/1059074613.db2.gz AXFWMYKOJNYDIY-VQTJNVASSA-N 2 1 300.490 4.211 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@@H](Cc3ccccc3)C2)CC[NH2+]1 ZINC001246775318 1059076660 /nfs/dbraw/zinc/07/66/60/1059076660.db2.gz JFPQMWGUUPWFFU-PWRODBHTSA-N 2 1 314.517 4.252 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246779305 1059079895 /nfs/dbraw/zinc/07/98/95/1059079895.db2.gz RTMXOXNCEWPCJF-UXHICEINSA-N 2 1 312.501 4.321 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC001246784986 1059083727 /nfs/dbraw/zinc/08/37/27/1059083727.db2.gz ITNIEJJIRDVMLW-DLBZAZTESA-N 2 1 304.865 4.152 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+]C2(CCC2)C1 ZINC001246789127 1059090111 /nfs/dbraw/zinc/09/01/11/1059090111.db2.gz JFNHZANANMJOBG-PBHICJAKSA-N 2 1 304.865 4.152 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246791846 1059092052 /nfs/dbraw/zinc/09/20/52/1059092052.db2.gz YVFYNUHETSLZTB-YYAJDYIMSA-N 2 1 302.437 4.026 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246791946 1059092556 /nfs/dbraw/zinc/09/25/56/1059092556.db2.gz ZIEHGHYHVZFLDM-XMTFNYHQSA-N 2 1 304.865 4.150 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1[C@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246793639 1059094518 /nfs/dbraw/zinc/09/45/18/1059094518.db2.gz VAUAGRSWODSCOU-ZCNNSNEGSA-N 2 1 300.490 4.004 20 0 DIADMP Clc1ccccc1[C@H]1CCC[N@H+]1C1CCC2(C[NH2+]C2)CC1 ZINC001246793567 1059096655 /nfs/dbraw/zinc/09/66/55/1059096655.db2.gz UDFNDZXSWDIMNE-QGZVFWFLSA-N 2 1 304.865 4.009 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1C1CCC2(CCC[NH2+]C2)CC1 ZINC001246793827 1059098020 /nfs/dbraw/zinc/09/80/20/1059098020.db2.gz FBLGEZJXRLZTLA-AJPWXKBRSA-N 2 1 316.464 4.275 20 0 DIADMP Fc1cccc([C@@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)c1 ZINC001246803493 1059100218 /nfs/dbraw/zinc/10/02/18/1059100218.db2.gz YLVKMPOUSOTHTJ-GPJFCIFZSA-N 2 1 316.464 4.275 20 0 DIADMP C[N@@H+](Cc1ccc(Cl)cc1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246798800 1059100915 /nfs/dbraw/zinc/10/09/15/1059100915.db2.gz SKPGQKCRYDPQIJ-UHFFFAOYSA-N 2 1 306.881 4.084 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801518 1059101211 /nfs/dbraw/zinc/10/12/11/1059101211.db2.gz IKJGOLGGPVUAOB-HKUYNNGSSA-N 2 1 316.464 4.193 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC3(CCCC3)C2)CC[NH2+]1 ZINC001246801518 1059101215 /nfs/dbraw/zinc/10/12/15/1059101215.db2.gz IKJGOLGGPVUAOB-HKUYNNGSSA-N 2 1 316.464 4.193 20 0 DIADMP CC[C@H]1C[C@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246804306 1059102028 /nfs/dbraw/zinc/10/20/28/1059102028.db2.gz FWAXRVKTHMYNIB-VWPQPMDRSA-N 2 1 320.480 4.165 20 0 DIADMP Fc1ccccc1[C@H]1CC[N@H+]([C@@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246809472 1059107404 /nfs/dbraw/zinc/10/74/04/1059107404.db2.gz WRLYTOJCAZYCRV-DLBZAZTESA-N 2 1 316.464 4.070 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2CCCCCCC2)CC[NH2+]1 ZINC001246815269 1059107504 /nfs/dbraw/zinc/10/75/04/1059107504.db2.gz WVDUCIPTCSPAQV-MJGOQNOKSA-N 2 1 304.453 4.193 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC[NH2+]1 ZINC001246809212 1059107781 /nfs/dbraw/zinc/10/77/81/1059107781.db2.gz FYLQISZYYDWTGL-DAYGRLMNSA-N 2 1 320.908 4.296 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)C[C@H]1CC[NH2+]C1 ZINC001246815627 1059108936 /nfs/dbraw/zinc/10/89/36/1059108936.db2.gz ZSLKTKWIYKDCHU-MOPGFXCFSA-N 2 1 322.496 4.138 20 0 DIADMP C[N@@H+](CCc1ccccc1Cl)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246815801 1059109917 /nfs/dbraw/zinc/10/99/17/1059109917.db2.gz AVTKDMRXZQRZGP-UHFFFAOYSA-N 2 1 320.908 4.127 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)[C@@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246842863 1059117639 /nfs/dbraw/zinc/11/76/39/1059117639.db2.gz CQMBRGKBSBFUOF-YPAWHYETSA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCc3c(Cl)cccc3C2)C[C@@H](CC)[NH2+]1 ZINC001246839373 1059117923 /nfs/dbraw/zinc/11/79/23/1059117923.db2.gz AHGVDXLNXAAAHV-HUUCEWRRSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCc3c(Cl)cccc3C2)C[C@@H](CC)[NH2+]1 ZINC001246839373 1059117929 /nfs/dbraw/zinc/11/79/29/1059117929.db2.gz AHGVDXLNXAAAHV-HUUCEWRRSA-N 2 1 306.881 4.007 20 0 DIADMP CCC(CC)[N@H+](CC)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246839491 1059118990 /nfs/dbraw/zinc/11/89/90/1059118990.db2.gz IVBBEBFNTLBYOH-IEBWSBKVSA-N 2 1 306.469 4.438 20 0 DIADMP CCC(CC)[N@@H+](CC)[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246839491 1059119021 /nfs/dbraw/zinc/11/90/21/1059119021.db2.gz IVBBEBFNTLBYOH-IEBWSBKVSA-N 2 1 306.469 4.438 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841211 1059119226 /nfs/dbraw/zinc/11/92/26/1059119226.db2.gz NAHGFPYKURNEJU-IEBWSBKVSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+](C)CC2CCCC2)CC[NH2+]1 ZINC001246841211 1059119229 /nfs/dbraw/zinc/11/92/29/1059119229.db2.gz NAHGFPYKURNEJU-IEBWSBKVSA-N 2 1 304.453 4.049 20 0 DIADMP CC[C@@H]1CC([N@@H+](CC)Cc2ccc(Cl)cc2)C[C@@H](CC)[NH2+]1 ZINC001246842894 1059119409 /nfs/dbraw/zinc/11/94/09/1059119409.db2.gz CSYAQOLRDAWTNC-IAGOWNOFSA-N 2 1 308.897 4.471 20 0 DIADMP CCCC[C@H]1C[C@H]([N@@H+](CC)Cc2ccc(Cl)cc2)CC[NH2+]1 ZINC001246845731 1059121707 /nfs/dbraw/zinc/12/17/07/1059121707.db2.gz NIKQTEZPUZDMKY-ZWKOTPCHSA-N 2 1 308.897 4.473 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@H](c3ccccc3)CC2)CC[NH2+]1 ZINC001246845074 1059121849 /nfs/dbraw/zinc/12/18/49/1059121849.db2.gz KCEDJMSHZRLEAR-ZCNNSNEGSA-N 2 1 314.517 4.423 20 0 DIADMP Fc1ccc([C@@H]2CC[N@@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246846404 1059122561 /nfs/dbraw/zinc/12/25/61/1059122561.db2.gz GWBXFOXKAYNJNY-HLAWJBBLSA-N 2 1 324.443 4.108 20 0 DIADMP Fc1ccc([C@@H]2CC[N@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)C2)cc1 ZINC001246846404 1059122574 /nfs/dbraw/zinc/12/25/74/1059122574.db2.gz GWBXFOXKAYNJNY-HLAWJBBLSA-N 2 1 324.443 4.108 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2CCC(C(C)C)CC2)CC[NH2+]1 ZINC001246845517 1059124705 /nfs/dbraw/zinc/12/47/05/1059124705.db2.gz KOEZSURQURJVEG-ICSRJNTNSA-N 2 1 318.480 4.295 20 0 DIADMP COc1ccc([C@H](C)[N@H+](C)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246848785 1059126392 /nfs/dbraw/zinc/12/63/92/1059126392.db2.gz FDBXMLQJSPYOAN-LRQRDZAKSA-N 2 1 324.468 4.181 20 0 DIADMP COc1ccc([C@H](C)[N@@H+](C)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246848785 1059126398 /nfs/dbraw/zinc/12/63/98/1059126398.db2.gz FDBXMLQJSPYOAN-LRQRDZAKSA-N 2 1 324.468 4.181 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246849902 1059128236 /nfs/dbraw/zinc/12/82/36/1059128236.db2.gz SJJCQLUZCBJSDJ-OLMNPRSZSA-N 2 1 306.881 4.255 20 0 DIADMP F[C@@H]1CCC2(C1)CC[NH+]([C@H]1CC[NH2+][C@H](c3ccccc3)C1)CC2 ZINC001246851290 1059131345 /nfs/dbraw/zinc/13/13/45/1059131345.db2.gz FENXSYJERGCKBT-QYZOEREBSA-N 2 1 316.464 4.084 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)CC[NH2+]1 ZINC001246856415 1059131594 /nfs/dbraw/zinc/13/15/94/1059131594.db2.gz ZEVKVFILBFHPNS-BHIYHBOVSA-N 2 1 320.908 4.440 20 0 DIADMP Clc1ccc([C@@H]2CC[N@H+]([C@H]3CCC[C@]4(CC[NH2+]C4)C3)C2)cc1 ZINC001246852951 1059132091 /nfs/dbraw/zinc/13/20/91/1059132091.db2.gz PCMOFKNKXSCRTQ-NEWSRXKRSA-N 2 1 318.892 4.052 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)CC[NH2+]1 ZINC001246852154 1059132180 /nfs/dbraw/zinc/13/21/80/1059132180.db2.gz NFEJXGNWYQNTGI-UHOSZYNNSA-N 2 1 320.908 4.440 20 0 DIADMP Clc1ccc([C@H]2CC[N@H+]([C@@H]3CCC4(C3)CC[NH2+]CC4)C2)cc1 ZINC001246855184 1059134185 /nfs/dbraw/zinc/13/41/85/1059134185.db2.gz VXVBADJADFKYNV-FUHWJXTLSA-N 2 1 318.892 4.052 20 0 DIADMP c1ccc(C[C@H]2C[C@@H]([N@@H+](Cc3ccccc3)C3CC3)CC[NH2+]2)cc1 ZINC001246861088 1059136959 /nfs/dbraw/zinc/13/69/59/1059136959.db2.gz QIDQLRQAIUJOLD-UNMCSNQZSA-N 2 1 320.480 4.014 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@H+]1Cc2ccccc2C2(CC[NH2+]CC2)C1 ZINC001246863718 1059137190 /nfs/dbraw/zinc/13/71/90/1059137190.db2.gz SOPOEIYPCLNQBY-GOSISDBHSA-N 2 1 312.501 4.258 20 0 DIADMP c1ccc(C[N@H+](C2CC2)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246861098 1059137560 /nfs/dbraw/zinc/13/75/60/1059137560.db2.gz QLRCYWJILKPGAF-SFTDATJTSA-N 2 1 306.453 4.144 20 0 DIADMP c1ccc(C[N@@H+](C2CC2)[C@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246861098 1059137578 /nfs/dbraw/zinc/13/75/78/1059137578.db2.gz QLRCYWJILKPGAF-SFTDATJTSA-N 2 1 306.453 4.144 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@H+]([C@H](C)CC(c2ccccc2)c2ccccc2)C1 ZINC001246861663 1059138715 /nfs/dbraw/zinc/13/87/15/1059138715.db2.gz CUUNZTXTCXKBFW-MOPGFXCFSA-N 2 1 322.496 4.138 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2CC3(C2)CCCCC3)CC[NH2+]1 ZINC001246861054 1059139031 /nfs/dbraw/zinc/13/90/31/1059139031.db2.gz PXPKGMZNLGTRSG-MJGOQNOKSA-N 2 1 316.464 4.193 20 0 DIADMP CC1(C)C[N@@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872668 1059140443 /nfs/dbraw/zinc/14/04/43/1059140443.db2.gz WXDOYUQCLAYRRE-FPOVZHCZSA-N 2 1 320.480 4.273 20 0 DIADMP CC1(C)C[N@H+]([C@H]2CC[NH2+][C@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872668 1059140463 /nfs/dbraw/zinc/14/04/63/1059140463.db2.gz WXDOYUQCLAYRRE-FPOVZHCZSA-N 2 1 320.480 4.273 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCc3ccccc3[C@H]2CC)CC[NH2+]1 ZINC001246867649 1059140568 /nfs/dbraw/zinc/14/05/68/1059140568.db2.gz PTRFSBNXZRUWSA-QWFCFKBJSA-N 2 1 300.490 4.307 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCc3ccccc3[C@H]2CC)C[C@H](CC)[NH2+]1 ZINC001246868221 1059142056 /nfs/dbraw/zinc/14/20/56/1059142056.db2.gz RIEDDWLDQZMSCK-AJYBTWMASA-N 2 1 300.490 4.305 20 0 DIADMP C1C[C@H](C2CCCCC2)[N@H+]([C@@H]2CC[NH2+]C3(CCCCC3)C2)C1 ZINC001246867487 1059142568 /nfs/dbraw/zinc/14/25/68/1059142568.db2.gz XYQGUUWGYUOTOR-RTBURBONSA-N 2 1 304.522 4.486 20 0 DIADMP CC[C@H]1CC([N@H+]2Cc3ccccc3C(C)(C)C2)C[C@H](CC)[NH2+]1 ZINC001246869521 1059142976 /nfs/dbraw/zinc/14/29/76/1059142976.db2.gz IBDAWFQCBSGXGT-IRXDYDNUSA-N 2 1 300.490 4.089 20 0 DIADMP CC1(C)C[N@@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872669 1059143259 /nfs/dbraw/zinc/14/32/59/1059143259.db2.gz WXDOYUQCLAYRRE-PZJWPPBQSA-N 2 1 320.480 4.273 20 0 DIADMP CC1(C)C[N@H+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC001246872669 1059143270 /nfs/dbraw/zinc/14/32/70/1059143270.db2.gz WXDOYUQCLAYRRE-PZJWPPBQSA-N 2 1 320.480 4.273 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)CC[NH2+]1 ZINC001246871104 1059143573 /nfs/dbraw/zinc/14/35/73/1059143573.db2.gz NXVAYKVLLDHNHH-POZUXBRTSA-N 2 1 320.908 4.078 20 0 DIADMP C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@H+]2[C@@H]1CCC[NH2+]CC1 ZINC001246878889 1059145338 /nfs/dbraw/zinc/14/53/38/1059145338.db2.gz LIUGZFUESQEFDM-YHYVQYDKSA-N 2 1 318.464 4.005 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2[C@@H]3Cc4ccccc4[C@@]2(C)c2ccccc23)CC[NH2+]1 ZINC001246876886 1059146568 /nfs/dbraw/zinc/14/65/68/1059146568.db2.gz DBJDDGGAXTXZSC-NAYASGRBSA-N 2 1 318.464 4.003 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CCN2)cc1 ZINC001246886577 1059149374 /nfs/dbraw/zinc/14/93/74/1059149374.db2.gz HLZWCSBKVYLNAQ-VQQMMKBISA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886577 1059149388 /nfs/dbraw/zinc/14/93/88/1059149388.db2.gz HLZWCSBKVYLNAQ-VQQMMKBISA-N 2 1 318.464 4.066 20 0 DIADMP c1ccc([C@H]2C[C@H]([N@H+]3C[C@@H]4C[C@H](C3)c3ccccc34)CC[NH2+]2)cc1 ZINC001246886577 1059149402 /nfs/dbraw/zinc/14/94/02/1059149402.db2.gz HLZWCSBKVYLNAQ-VQQMMKBISA-N 2 1 318.464 4.066 20 0 DIADMP C[NH2+]C1CCC([N@H+]2CCC[C@@H]2c2ccccc2SC)CC1 ZINC001246890143 1059154259 /nfs/dbraw/zinc/15/42/59/1059154259.db2.gz ROTMGFLXLSELAP-VMBOVVBDSA-N 2 1 304.503 4.076 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246886931 1059155871 /nfs/dbraw/zinc/15/58/71/1059155871.db2.gz FZDWEXXHQOYJOE-GBESFXJTSA-N 2 1 318.892 4.399 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246886786 1059156413 /nfs/dbraw/zinc/15/64/13/1059156413.db2.gz FZDWEXXHQOYJOE-CEXWTWQISA-N 2 1 318.892 4.399 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c(F)c1 ZINC001246889725 1059156730 /nfs/dbraw/zinc/15/67/30/1059156730.db2.gz YWNPOSZNUKNPHH-MAUKXSAKSA-N 2 1 320.427 4.024 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001246899024 1059158445 /nfs/dbraw/zinc/15/84/45/1059158445.db2.gz CCYKYFJXZWKBQD-NRFANRHFSA-N 2 1 323.484 4.179 20 0 DIADMP CCC[N@@H+](C1CC[NH2+]CC1)[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC001246898378 1059160378 /nfs/dbraw/zinc/16/03/78/1059160378.db2.gz MYPOGBXDSSEEST-AZUAARDMSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+](C)CCCC[NH3+] ZINC001246894122 1059160676 /nfs/dbraw/zinc/16/06/76/1059160676.db2.gz RTMMYMKNINVYGS-GOSISDBHSA-N 2 1 310.485 4.268 20 0 DIADMP CC[C@H]1CC([N@H+]2CCC[C@@H]2c2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246896725 1059160916 /nfs/dbraw/zinc/16/09/16/1059160916.db2.gz ZZEDGMQKQAEKGU-JENIJYKNSA-N 2 1 304.453 4.272 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246903577 1059162595 /nfs/dbraw/zinc/16/25/95/1059162595.db2.gz ZBFDOGSYNGMNJE-UZLBHIALSA-N 2 1 323.484 4.227 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](C)Cc2cccc(Oc3ccccc3)c2)CC[NH2+]1 ZINC001246904621 1059162907 /nfs/dbraw/zinc/16/29/07/1059162907.db2.gz HXBBFZZNXZICQC-RBUKOAKNSA-N 2 1 324.468 4.441 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2C2C[C@H](C)[NH2+][C@@H](C)C2)cc1C ZINC001246908582 1059167296 /nfs/dbraw/zinc/16/72/96/1059167296.db2.gz LOEDPNKXWFAEHK-ZWOKBUDYSA-N 2 1 300.490 4.359 20 0 DIADMP Cc1ccc(C[N@H+](C)[C@@H]2CC[NH2+][C@H](Cc3ccccc3)C2)cc1C ZINC001246907080 1059167680 /nfs/dbraw/zinc/16/76/80/1059167680.db2.gz HZFSLVHFTWTIAI-FGZHOGPDSA-N 2 1 322.496 4.099 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2[C@@H]2CC[NH2+]C(C)(C)C2)cc1C ZINC001246908675 1059167890 /nfs/dbraw/zinc/16/78/90/1059167890.db2.gz MCDSJXKPBBZUMW-MOPGFXCFSA-N 2 1 300.490 4.361 20 0 DIADMP [NH3+]C1CCC([N@@H+](Cc2ccccc2)C2CCC(F)(F)CC2)CC1 ZINC001246905685 1059167918 /nfs/dbraw/zinc/16/79/18/1059167918.db2.gz FFUFPTZGMPEXET-UHFFFAOYSA-N 2 1 322.443 4.336 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001246905299 1059167988 /nfs/dbraw/zinc/16/79/88/1059167988.db2.gz CUTRCTNWWSZTOM-CTWPCTMYSA-N 2 1 300.490 4.337 20 0 DIADMP CC[N@H+](Cc1ccc(C)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246906754 1059168027 /nfs/dbraw/zinc/16/80/27/1059168027.db2.gz GNEIWRHTTYJZOP-NHCUHLMSSA-N 2 1 308.469 4.310 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246906754 1059168036 /nfs/dbraw/zinc/16/80/36/1059168036.db2.gz GNEIWRHTTYJZOP-NHCUHLMSSA-N 2 1 308.469 4.310 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2[C@@H]2C[C@@H](C)[NH2+][C@@H](C)C2)cc1C ZINC001246908580 1059169020 /nfs/dbraw/zinc/16/90/20/1059169020.db2.gz LOEDPNKXWFAEHK-HNJRGHQBSA-N 2 1 300.490 4.359 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)C1CCC2(CC[NH2+]C2)CC1 ZINC001246911607 1059170100 /nfs/dbraw/zinc/17/01/00/1059170100.db2.gz VGJRMNMMXBREME-KSTDHSDQSA-N 2 1 306.881 4.255 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246911381 1059170797 /nfs/dbraw/zinc/17/07/97/1059170797.db2.gz PKWJHHCUEFKWGK-JYJNAYRXSA-N 2 1 324.534 4.272 20 0 DIADMP CCC[N@H+](CC(C)C)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246910729 1059171481 /nfs/dbraw/zinc/17/14/81/1059171481.db2.gz KTVUSIQEUHVMIK-PKOBYXMFSA-N 2 1 306.469 4.295 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246910729 1059171492 /nfs/dbraw/zinc/17/14/92/1059171492.db2.gz KTVUSIQEUHVMIK-PKOBYXMFSA-N 2 1 306.469 4.295 20 0 DIADMP CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246908757 1059171769 /nfs/dbraw/zinc/17/17/69/1059171769.db2.gz MIRDYSRYBDUMLN-VXKWHMMOSA-N 2 1 322.496 4.180 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246908830 1059172055 /nfs/dbraw/zinc/17/20/55/1059172055.db2.gz NKGSRAPJMGNTAB-VKJFTORMSA-N 2 1 306.881 4.255 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246908788 1059172093 /nfs/dbraw/zinc/17/20/93/1059172093.db2.gz NBEHVKFQSSDWOA-PMACEKPBSA-N 2 1 300.490 4.048 20 0 DIADMP CCC1CCC([N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)CC1 ZINC001246914248 1059174542 /nfs/dbraw/zinc/17/45/42/1059174542.db2.gz KKRLVUUSMKIZCT-UHFFFAOYSA-N 2 1 300.490 4.209 20 0 DIADMP FC(F)(F)c1ccc([C@@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC001246920257 1059176347 /nfs/dbraw/zinc/17/63/47/1059176347.db2.gz DJLMVAKVXNITEG-WFVVYAPDSA-N 2 1 324.390 4.125 20 0 DIADMP CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246917765 1059176512 /nfs/dbraw/zinc/17/65/12/1059176512.db2.gz XIIZDQDIIXZJQN-HNNXBMFYSA-N 2 1 314.395 4.058 20 0 DIADMP [NH3+][C@@H]1CC[N@H+]([C@H]2CCCC3(CCCCC3)C2)C[C@@H]1C(F)(F)F ZINC001246940802 1059183072 /nfs/dbraw/zinc/18/30/72/1059183072.db2.gz VKDQMZGYNJUSRS-SOUVJXGZSA-N 2 1 318.427 4.091 20 0 DIADMP [NH3+][C@@H]1CC[N@H+]([C@@H]2CCCC3(CCCCC3)C2)C[C@@H]1C(F)(F)F ZINC001246940796 1059183157 /nfs/dbraw/zinc/18/31/57/1059183157.db2.gz VKDQMZGYNJUSRS-QLFBSQMISA-N 2 1 318.427 4.091 20 0 DIADMP C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C[C@@H]1C ZINC001246936615 1059183417 /nfs/dbraw/zinc/18/34/17/1059183417.db2.gz WTNRNNIAWJDFMV-JTDSTZFVSA-N 2 1 318.480 4.204 20 0 DIADMP C[C@H]1CC([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)C[C@H](C)C1 ZINC001246937154 1059183740 /nfs/dbraw/zinc/18/37/40/1059183740.db2.gz ZIQMJYQJTLKQRB-HZPDHXFCSA-N 2 1 318.480 4.204 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+]1[C@@H](C)CC(c1ccccc1)c1ccccc1 ZINC001246940487 1059184156 /nfs/dbraw/zinc/18/41/56/1059184156.db2.gz VBVGWGTUKXVFPY-GHTZIAJQSA-N 2 1 322.496 4.281 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246937954 1059184345 /nfs/dbraw/zinc/18/43/45/1059184345.db2.gz KLYUVNGMXUGAPN-SCTDSRPQSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@@H]1CC[NH2+][C@H](c2ccc(F)cc2C)C1 ZINC001246937954 1059184356 /nfs/dbraw/zinc/18/43/56/1059184356.db2.gz KLYUVNGMXUGAPN-SCTDSRPQSA-N 2 1 304.453 4.192 20 0 DIADMP CC1(C)CCC[C@H]([N@@H+](Cc2cccc(F)c2)C2CC[NH2+]CC2)C1 ZINC001246933742 1059185841 /nfs/dbraw/zinc/18/58/41/1059185841.db2.gz BOOUQBBDGHGBSB-IBGZPJMESA-N 2 1 318.480 4.349 20 0 DIADMP CC1(C)CCC([N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)CC1 ZINC001246935126 1059186253 /nfs/dbraw/zinc/18/62/53/1059186253.db2.gz RHVSHIMJNGQDJL-UHFFFAOYSA-N 2 1 318.480 4.349 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001246944364 1059189217 /nfs/dbraw/zinc/18/92/17/1059189217.db2.gz AXCPVLWVQAHTQO-KRWDZBQOSA-N 2 1 308.897 4.473 20 0 DIADMP Fc1ccc(C[N@H+](C2CCC3(CC3)CC2)[C@@H]2CCC[NH2+]C2)cc1 ZINC001246941773 1059189698 /nfs/dbraw/zinc/18/96/98/1059189698.db2.gz HXAJUYFJIVSIQP-LJQANCHMSA-N 2 1 316.464 4.103 20 0 DIADMP Fc1ccc(C[N@@H+](C2CCC3(CC3)CC2)[C@@H]2CCC[NH2+]C2)cc1 ZINC001246941773 1059189712 /nfs/dbraw/zinc/18/97/12/1059189712.db2.gz HXAJUYFJIVSIQP-LJQANCHMSA-N 2 1 316.464 4.103 20 0 DIADMP CC[C@H](CC(C)C)[N@@H+](Cc1cccc(F)c1)C1CC[NH2+]CC1 ZINC001246942088 1059190176 /nfs/dbraw/zinc/19/01/76/1059190176.db2.gz MUYGZIIQTNQYKJ-GOSISDBHSA-N 2 1 306.469 4.204 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001246941715 1059190593 /nfs/dbraw/zinc/19/05/93/1059190593.db2.gz BEKQAFOERBOCFQ-UXHICEINSA-N 2 1 312.501 4.363 20 0 DIADMP Fc1cccc(C[N@@H+](C2CC[NH2+]CC2)C2CCCCCC2)c1 ZINC001246942056 1059190771 /nfs/dbraw/zinc/19/07/71/1059190771.db2.gz LVXZASVTXNZCRB-UHFFFAOYSA-N 2 1 304.453 4.103 20 0 DIADMP CCCCCC[C@@H](CCC)[N@@H+](CCOCC)C1CC[NH2+]CC1 ZINC001246952103 1059192853 /nfs/dbraw/zinc/19/28/53/1059192853.db2.gz YDWZRZGUZUFXIH-GOSISDBHSA-N 2 1 312.542 4.216 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CC[NH2+]CC2)[C@H]2CCC[C@@H](C)C2)c1 ZINC001246950703 1059194954 /nfs/dbraw/zinc/19/49/54/1059194954.db2.gz DWBGBKGQTMSJNH-QRWLVFNGSA-N 2 1 318.480 4.267 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246950222 1059195111 /nfs/dbraw/zinc/19/51/11/1059195111.db2.gz WAILJPZQLDHZQL-ZTFGCOKTSA-N 2 1 322.443 4.268 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cc(F)ccc2F)CC[NH2+]1 ZINC001246950222 1059195118 /nfs/dbraw/zinc/19/51/18/1059195118.db2.gz WAILJPZQLDHZQL-ZTFGCOKTSA-N 2 1 322.443 4.268 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2cc(C)cc(F)c2)C2CC[NH2+]CC2)C1 ZINC001246952444 1059195832 /nfs/dbraw/zinc/19/58/32/1059195832.db2.gz SKYUFOCMNIDOQV-UZLBHIALSA-N 2 1 318.480 4.267 20 0 DIADMP CCc1ccc(C[C@H](C)[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001246949821 1059196181 /nfs/dbraw/zinc/19/61/81/1059196181.db2.gz LXPDLSPRTRZLLH-KRWDZBQOSA-N 2 1 316.533 4.280 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)cc1 ZINC001246952353 1059196513 /nfs/dbraw/zinc/19/65/13/1059196513.db2.gz ZDEDUOSMTGPWSB-GOSISDBHSA-N 2 1 316.533 4.416 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246954060 1059198187 /nfs/dbraw/zinc/19/81/87/1059198187.db2.gz DJSYCTFTQFLXEV-CQSZACIVSA-N 2 1 310.432 4.098 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1cc(F)ccc1C)C1CC[NH2+]CC1 ZINC001246954417 1059198441 /nfs/dbraw/zinc/19/84/41/1059198441.db2.gz HDJPLZXSKAWANR-INIZCTEOSA-N 2 1 306.469 4.267 20 0 DIADMP Cc1ccc(C[N@@H+](C2CC[NH2+]CC2)[C@H]2CCC[C@@H](C)C2)c(F)c1 ZINC001246955643 1059199487 /nfs/dbraw/zinc/19/94/87/1059199487.db2.gz MRBDNVNJAATLRC-BEFAXECRSA-N 2 1 318.480 4.267 20 0 DIADMP CC1(C)CC[C@H]([N@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955933 1059199538 /nfs/dbraw/zinc/19/95/38/1059199538.db2.gz OCIGLISJIDQRNI-KRWDZBQOSA-N 2 1 322.443 4.098 20 0 DIADMP CC1(C)CC[C@H]([N@@H+](Cc2ccc(F)cc2F)C2CC[NH2+]CC2)C1 ZINC001246955933 1059199550 /nfs/dbraw/zinc/19/95/50/1059199550.db2.gz OCIGLISJIDQRNI-KRWDZBQOSA-N 2 1 322.443 4.098 20 0 DIADMP Cc1ccc(C[N@@H+](C2CC[NH2+]CC2)[C@@H]2CCC[C@@H](C)C2)c(F)c1 ZINC001246955644 1059200366 /nfs/dbraw/zinc/20/03/66/1059200366.db2.gz MRBDNVNJAATLRC-DNVCBOLYSA-N 2 1 318.480 4.267 20 0 DIADMP Cc1cc(F)cc(C[N@@H+]([C@@H]2CCC(C)(C)C2)C2CC[NH2+]CC2)c1 ZINC001246952792 1059200612 /nfs/dbraw/zinc/20/06/12/1059200612.db2.gz VVMUSCHNOAPLBE-LJQANCHMSA-N 2 1 318.480 4.267 20 0 DIADMP CCCCC[C@@H](C)[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246955427 1059200917 /nfs/dbraw/zinc/20/09/17/1059200917.db2.gz LXOXPUKQEKSSIA-OAHLLOKOSA-N 2 1 324.459 4.488 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246955427 1059200941 /nfs/dbraw/zinc/20/09/41/1059200941.db2.gz LXOXPUKQEKSSIA-OAHLLOKOSA-N 2 1 324.459 4.488 20 0 DIADMP CC(C)CC[C@@H](C)[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954899 1059202223 /nfs/dbraw/zinc/20/22/23/1059202223.db2.gz JNYNFTQTNUTZBF-OAHLLOKOSA-N 2 1 324.459 4.344 20 0 DIADMP CC(C)CC[C@@H](C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954899 1059202238 /nfs/dbraw/zinc/20/22/38/1059202238.db2.gz JNYNFTQTNUTZBF-OAHLLOKOSA-N 2 1 324.459 4.344 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246962763 1059203762 /nfs/dbraw/zinc/20/37/62/1059203762.db2.gz DPEWODLAJCBKOQ-XIRDDKMYSA-N 2 1 312.567 4.279 20 0 DIADMP CC(C)C[C@@H](C)C[C@H](C)[N@@H+](Cc1ccccn1)C1CC[NH2+]CC1 ZINC001246956640 1059206599 /nfs/dbraw/zinc/20/65/99/1059206599.db2.gz ZKVMSIWLLCYMTH-MSOLQXFVSA-N 2 1 317.521 4.096 20 0 DIADMP C[C@]1(C[NH3+])CC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)C1 ZINC001246969190 1059211579 /nfs/dbraw/zinc/21/15/79/1059211579.db2.gz VCNTYASWHPZIFV-VMWRSERWSA-N 2 1 306.881 4.037 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@@H+](CCC)C[C@@H]1CC[NH2+]C1 ZINC001246974639 1059215761 /nfs/dbraw/zinc/21/57/61/1059215761.db2.gz LDUKRKOZLPTEQS-UXHICEINSA-N 2 1 302.506 4.109 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001246971307 1059216377 /nfs/dbraw/zinc/21/63/77/1059216377.db2.gz FMMZRSOTWSGMIV-VQTJNVASSA-N 2 1 314.517 4.252 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[N@@H+](CCC)C[C@@H]1CC[NH2+]C1 ZINC001246972397 1059217372 /nfs/dbraw/zinc/21/73/72/1059217372.db2.gz DRAPOKRGAJPWSK-WOJBJXKFSA-N 2 1 302.506 4.109 20 0 DIADMP CCC(CC)[N@@H+]([C@H](C)c1ccccc1)[C@@H]1C[C@H]2C[NH2+]C[C@H]2C1 ZINC001246974884 1059217661 /nfs/dbraw/zinc/21/76/61/1059217661.db2.gz SEBHIGQLJVQNFM-LBKNJMOBSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@H](Cc1ccccc1F)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246970885 1059220056 /nfs/dbraw/zinc/22/00/56/1059220056.db2.gz SHFFOHQRTKHSJU-ATZDWAIDSA-N 2 1 318.480 4.129 20 0 DIADMP [NH3+][C@@H]1CC[C@H]2C[N@H+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]12 ZINC001246978245 1059220972 /nfs/dbraw/zinc/22/09/72/1059220972.db2.gz VRGQSJYZUWZMBG-ZEOCNOFWSA-N 2 1 318.892 4.035 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246978864 1059221250 /nfs/dbraw/zinc/22/12/50/1059221250.db2.gz NBFOANZQTREMJM-PLACYPQZSA-N 2 1 314.517 4.393 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([N@@H+](C3CCC3)C3CC[NH2+]CC3)C2)cc1 ZINC001246978413 1059225262 /nfs/dbraw/zinc/22/52/62/1059225262.db2.gz UEGPWYCQJORWOW-NQIIRXRSSA-N 2 1 312.501 4.319 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCC2(CCc3ccccc32)CC1 ZINC001246982145 1059226977 /nfs/dbraw/zinc/22/69/77/1059226977.db2.gz CSOMJZMUUYVEJQ-UQHAKMKOSA-N 2 1 324.512 4.015 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984389 1059229499 /nfs/dbraw/zinc/22/94/99/1059229499.db2.gz FKXIYMJDQZDKPI-HZPDHXFCSA-N 2 1 315.288 4.202 20 0 DIADMP CC(C)[C@H]1C[C@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246984389 1059229517 /nfs/dbraw/zinc/22/95/17/1059229517.db2.gz FKXIYMJDQZDKPI-HZPDHXFCSA-N 2 1 315.288 4.202 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006108 1059233085 /nfs/dbraw/zinc/23/30/85/1059233085.db2.gz WRRQLNHKFVGAIX-VXXKDZQQSA-N 2 1 318.480 4.438 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([N@H+](C)[C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001247006108 1059233106 /nfs/dbraw/zinc/23/31/06/1059233106.db2.gz WRRQLNHKFVGAIX-VXXKDZQQSA-N 2 1 318.480 4.438 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247015287 1059243861 /nfs/dbraw/zinc/24/38/61/1059243861.db2.gz OBIBUYOZVYAWOR-FUHWJXTLSA-N 2 1 300.490 4.296 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247014930 1059244194 /nfs/dbraw/zinc/24/41/94/1059244194.db2.gz MMVCCSIMPZIWRR-FQEVSTJZSA-N 2 1 320.480 4.102 20 0 DIADMP Fc1cccc(F)c1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC001559482157 1059255983 /nfs/dbraw/zinc/25/59/83/1059255983.db2.gz SPGQBUSEOKIBPJ-UHFFFAOYSA-N 2 1 322.443 4.053 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2CC)CC1 ZINC001559489502 1059264645 /nfs/dbraw/zinc/26/46/45/1059264645.db2.gz UHTUSCTWYNSZJT-UHFFFAOYSA-N 2 1 302.506 4.193 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2CC(C)(C)OC2(C)C)CC1 ZINC001559489221 1059266773 /nfs/dbraw/zinc/26/67/73/1059266773.db2.gz JQWGNQBWZVKKFN-SFHVURJKSA-N 2 1 324.553 4.024 20 0 DIADMP Cc1ccccc1C[NH+](CC[C@H]1CCC[N@H+]1C)Cc1ccccc1 ZINC001559506302 1059296574 /nfs/dbraw/zinc/29/65/74/1059296574.db2.gz YEBPVFYNCGXCDT-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1ccccc1 ZINC001559506302 1059296591 /nfs/dbraw/zinc/29/65/91/1059296591.db2.gz YEBPVFYNCGXCDT-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[N@H+](CC[C@H]1CCC[NH+]1C)Cc1ccccc1 ZINC001559506302 1059296608 /nfs/dbraw/zinc/29/66/08/1059296608.db2.gz YEBPVFYNCGXCDT-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP Cc1ccccc1C[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1ccccc1 ZINC001559506302 1059296621 /nfs/dbraw/zinc/29/66/21/1059296621.db2.gz YEBPVFYNCGXCDT-JOCHJYFZSA-N 2 1 322.496 4.482 20 0 DIADMP CC[C@@H](CC(F)F)C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001559524831 1059320330 /nfs/dbraw/zinc/32/03/30/1059320330.db2.gz RNMIFPCLJNKMKG-IRXDYDNUSA-N 2 1 316.480 4.256 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCCc2ccccc2Cl)CC1 ZINC001559524957 1059321299 /nfs/dbraw/zinc/32/12/99/1059321299.db2.gz WFBOWAPQJQKSJO-UHFFFAOYSA-N 2 1 322.924 4.325 20 0 DIADMP C[C@@H]1CCC[C@@H](C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC001559525071 1059326286 /nfs/dbraw/zinc/32/62/86/1059326286.db2.gz YWWARUVSEDSYEA-VAMGGRTRSA-N 2 1 306.538 4.401 20 0 DIADMP C[C@@H]1CCC[C@H](C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC001559525068 1059326536 /nfs/dbraw/zinc/32/65/36/1059326536.db2.gz YWWARUVSEDSYEA-AABGKKOBSA-N 2 1 306.538 4.401 20 0 DIADMP CCc1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001559546522 1059348801 /nfs/dbraw/zinc/34/88/01/1059348801.db2.gz YLFVJEMTHBWLTD-RBUKOAKNSA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001559546522 1059348824 /nfs/dbraw/zinc/34/88/24/1059348824.db2.gz YLFVJEMTHBWLTD-RBUKOAKNSA-N 2 1 314.517 4.335 20 0 DIADMP CCc1ccccc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001559546522 1059348844 /nfs/dbraw/zinc/34/88/44/1059348844.db2.gz YLFVJEMTHBWLTD-RBUKOAKNSA-N 2 1 314.517 4.335 20 0 DIADMP Clc1ccc(/C=C\C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547494 1059353193 /nfs/dbraw/zinc/35/31/93/1059353193.db2.gz XFRFLVPTIYDFRU-XDXAGZTOSA-N 2 1 318.892 4.161 20 0 DIADMP Clc1ccc(/C=C\C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547494 1059353211 /nfs/dbraw/zinc/35/32/11/1059353211.db2.gz XFRFLVPTIYDFRU-XDXAGZTOSA-N 2 1 318.892 4.161 20 0 DIADMP Cc1ccc([C@@H]2CCCCC[N@H+]2CCC[NH+]2CCCCC2)o1 ZINC001559557573 1059367544 /nfs/dbraw/zinc/36/75/44/1059367544.db2.gz CFQWOSFZSYMDDG-SFHVURJKSA-N 2 1 304.478 4.381 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001559568100 1059397752 /nfs/dbraw/zinc/39/77/52/1059397752.db2.gz QGRPBIJGDMKMIL-GOSISDBHSA-N 2 1 318.505 4.028 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cccc(OC(C)(C)C)c2)C1 ZINC001559568100 1059397773 /nfs/dbraw/zinc/39/77/73/1059397773.db2.gz QGRPBIJGDMKMIL-GOSISDBHSA-N 2 1 318.505 4.028 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)C[C@@H]1C ZINC001559584393 1059418763 /nfs/dbraw/zinc/41/87/63/1059418763.db2.gz KVCHGKHHDCPBGA-QFBILLFUSA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@@H]1C ZINC001559584393 1059418770 /nfs/dbraw/zinc/41/87/70/1059418770.db2.gz KVCHGKHHDCPBGA-QFBILLFUSA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@@H]1C ZINC001559584393 1059418778 /nfs/dbraw/zinc/41/87/78/1059418778.db2.gz KVCHGKHHDCPBGA-QFBILLFUSA-N 2 1 302.506 4.289 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]3C[N@@H+](CCC4CCC4)CC[C@@H]32)cc1 ZINC001559594557 1059429704 /nfs/dbraw/zinc/42/97/04/1059429704.db2.gz QWSWEJJBQHCTPL-SFTDATJTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]3C[NH+](CCC4CCC4)CC[C@@H]32)cc1 ZINC001559594557 1059429721 /nfs/dbraw/zinc/42/97/21/1059429721.db2.gz QWSWEJJBQHCTPL-SFTDATJTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]3C[NH+](CCC4CCC4)CC[C@@H]32)cc1 ZINC001559594557 1059429734 /nfs/dbraw/zinc/42/97/34/1059429734.db2.gz QWSWEJJBQHCTPL-SFTDATJTSA-N 2 1 312.501 4.163 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(OC(C)(C)C)c2)[C@H](C)C1 ZINC001559600771 1059434910 /nfs/dbraw/zinc/43/49/10/1059434910.db2.gz HCHPYRMYCXQWFX-APWZRJJASA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@H](C)C1 ZINC001559600771 1059434919 /nfs/dbraw/zinc/43/49/19/1059434919.db2.gz HCHPYRMYCXQWFX-APWZRJJASA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(OC(C)(C)C)c2)[C@H](C)C1 ZINC001559600771 1059434939 /nfs/dbraw/zinc/43/49/39/1059434939.db2.gz HCHPYRMYCXQWFX-APWZRJJASA-N 2 1 318.505 4.026 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635130 1059464472 /nfs/dbraw/zinc/46/44/72/1059464472.db2.gz LLSWPTSGOMBYCQ-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635130 1059464475 /nfs/dbraw/zinc/46/44/75/1059464475.db2.gz LLSWPTSGOMBYCQ-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635130 1059464481 /nfs/dbraw/zinc/46/44/81/1059464481.db2.gz LLSWPTSGOMBYCQ-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC001559635130 1059464483 /nfs/dbraw/zinc/46/44/83/1059464483.db2.gz LLSWPTSGOMBYCQ-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001559660558 1059488022 /nfs/dbraw/zinc/48/80/22/1059488022.db2.gz XDYBMZRCOJKMFY-NQIIRXRSSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001559660558 1059488028 /nfs/dbraw/zinc/48/80/28/1059488028.db2.gz XDYBMZRCOJKMFY-NQIIRXRSSA-N 2 1 312.501 4.259 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001559660558 1059488035 /nfs/dbraw/zinc/48/80/35/1059488035.db2.gz XDYBMZRCOJKMFY-NQIIRXRSSA-N 2 1 312.501 4.259 20 0 DIADMP CCCc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[N@H+]2C)C(C)C)cc1 ZINC001559670011 1059495417 /nfs/dbraw/zinc/49/54/17/1059495417.db2.gz XTBBZRCKNPBGCI-PMACEKPBSA-N 2 1 302.506 4.410 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCCC1(C)C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001559737882 1059571020 /nfs/dbraw/zinc/57/10/20/1059571020.db2.gz PSVHPVQTJNQIBI-KSZLIROESA-N 2 1 306.538 4.445 20 0 DIADMP c1ccc(C[NH+]2CCC3(CC[N@H+](CCCC4CC4)C3)CC2)cc1 ZINC001559870338 1059690098 /nfs/dbraw/zinc/69/00/98/1059690098.db2.gz UMKATYZHWUKNJO-UHFFFAOYSA-N 2 1 312.501 4.165 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001559875355 1059695313 /nfs/dbraw/zinc/69/53/13/1059695313.db2.gz STBOZQMHKRMADE-QFIPXVFZSA-N 2 1 320.480 4.196 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001559875355 1059695327 /nfs/dbraw/zinc/69/53/27/1059695327.db2.gz STBOZQMHKRMADE-QFIPXVFZSA-N 2 1 320.480 4.196 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCc2ccc(-c3ccccc3)cc2C1 ZINC001559875355 1059695343 /nfs/dbraw/zinc/69/53/43/1059695343.db2.gz STBOZQMHKRMADE-QFIPXVFZSA-N 2 1 320.480 4.196 20 0 DIADMP Cc1cc(C[N@@H+]2CCC[C@H]2CC[NH+]2CCC(C)CC2)c(C)s1 ZINC001560068909 1059881024 /nfs/dbraw/zinc/88/10/24/1059881024.db2.gz IRBZZJYVNGZHFK-IBGZPJMESA-N 2 1 320.546 4.451 20 0 DIADMP C[C@]12C[NH+](Cc3ccccc3)C[C@]1(C)C[NH+](CC1CCCC1)C2 ZINC001560072936 1059889939 /nfs/dbraw/zinc/88/99/39/1059889939.db2.gz WZRCGPWMFWTWOD-NHCUHLMSSA-N 2 1 312.501 4.021 20 0 DIADMP CC[C@@H](C)C[NH2+]Cc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560269329 1060043512 /nfs/dbraw/zinc/04/35/12/1060043512.db2.gz YKPNMWGFLYGMAW-KURKYZTESA-N 2 1 302.506 4.300 20 0 DIADMP c1csc(-c2ccc(CN[C@H]3CC[N@H+]4CCCC[C@H]34)cc2)c1 ZINC001560271559 1060046850 /nfs/dbraw/zinc/04/68/50/1060046850.db2.gz PHHYBHKDZUUYOK-ZWKOTPCHSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CCN4CCCC[C@H]34)cc2)c1 ZINC001560271559 1060046865 /nfs/dbraw/zinc/04/68/65/1060046865.db2.gz PHHYBHKDZUUYOK-ZWKOTPCHSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@H]34)cc2)c1 ZINC001560271559 1060046880 /nfs/dbraw/zinc/04/68/80/1060046880.db2.gz PHHYBHKDZUUYOK-ZWKOTPCHSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@H]34)cc2)c1 ZINC001560271559 1060046896 /nfs/dbraw/zinc/04/68/96/1060046896.db2.gz PHHYBHKDZUUYOK-ZWKOTPCHSA-N 2 1 312.482 4.132 20 0 DIADMP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1 ZINC001560301569 1060086974 /nfs/dbraw/zinc/08/69/74/1060086974.db2.gz YMMPONRMIQBVJH-OAHLLOKOSA-N 2 1 316.420 4.048 20 0 DIADMP CC(C)CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](CC3CCCC3)C2)C1 ZINC001560360239 1060145114 /nfs/dbraw/zinc/14/51/14/1060145114.db2.gz GVLXFCJKSKTTBI-YZGWKJHDSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](CC3CCCC3)C2)C1 ZINC001560360239 1060145119 /nfs/dbraw/zinc/14/51/19/1060145119.db2.gz GVLXFCJKSKTTBI-YZGWKJHDSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@H+](CC3CCCC3)C2)C1 ZINC001560360237 1060145265 /nfs/dbraw/zinc/14/52/65/1060145265.db2.gz GVLXFCJKSKTTBI-MISYRCLQSA-N 2 1 306.538 4.445 20 0 DIADMP CC(C)CC[C@@H]1CC[C@@H]([NH2+][C@@H]2CC[N@@H+](CC3CCCC3)C2)C1 ZINC001560360237 1060145285 /nfs/dbraw/zinc/14/52/85/1060145285.db2.gz GVLXFCJKSKTTBI-MISYRCLQSA-N 2 1 306.538 4.445 20 0 DIADMP CCC[N@H+](CC)CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560362407 1060148398 /nfs/dbraw/zinc/14/83/98/1060148398.db2.gz IHTKKRAEWPXMFN-SFHVURJKSA-N 2 1 318.549 4.484 20 0 DIADMP CCC[N@@H+](CC)CC[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560362407 1060148407 /nfs/dbraw/zinc/14/84/07/1060148407.db2.gz IHTKKRAEWPXMFN-SFHVURJKSA-N 2 1 318.549 4.484 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC(C1CC1)C1CC1 ZINC001560360844 1060148503 /nfs/dbraw/zinc/14/85/03/1060148503.db2.gz ALBWLEYOEUQNIP-UHFFFAOYSA-N 2 1 314.517 4.170 20 0 DIADMP CCc1cccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC001560418393 1060203390 /nfs/dbraw/zinc/20/33/90/1060203390.db2.gz LLWWTACPDANILN-XMSQKQJNSA-N 2 1 322.496 4.249 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560492364 1060288076 /nfs/dbraw/zinc/28/80/76/1060288076.db2.gz SLCYUJZZBBBGON-MSOLQXFVSA-N 2 1 318.549 4.481 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001560492364 1060288091 /nfs/dbraw/zinc/28/80/91/1060288091.db2.gz SLCYUJZZBBBGON-MSOLQXFVSA-N 2 1 318.549 4.481 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCc2ccccc21 ZINC001560525486 1060326841 /nfs/dbraw/zinc/32/68/41/1060326841.db2.gz BYSZCCZKBCNCJU-OAQYLSRUSA-N 2 1 322.496 4.422 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCc2cccc(-c3ccccc3)c2)CC1(C)C ZINC001560543410 1060351207 /nfs/dbraw/zinc/35/12/07/1060351207.db2.gz SXFUONZVBWXQJG-NRFANRHFSA-N 2 1 322.496 4.359 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(-c2ccccc2)c(Cl)c1)[NH+](C)C ZINC001560547159 1060354994 /nfs/dbraw/zinc/35/49/94/1060354994.db2.gz XCWMSARJKPQPTP-OAHLLOKOSA-N 2 1 316.876 4.437 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001560610179 1060424570 /nfs/dbraw/zinc/42/45/70/1060424570.db2.gz MCXNJTYHFPQNFM-WMZOPIPTSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C2(C)C(C)(C)C2(C)C)CC[N@H+]1Cc1ccccc1 ZINC001560610179 1060424584 /nfs/dbraw/zinc/42/45/84/1060424584.db2.gz MCXNJTYHFPQNFM-WMZOPIPTSA-N 2 1 314.517 4.454 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)CC1 ZINC001560670388 1060501442 /nfs/dbraw/zinc/50/14/42/1060501442.db2.gz CAECFEGBULJOPM-NHCUHLMSSA-N 2 1 312.501 4.120 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2cc(F)ccc2F)C2CCCC2)CC1 ZINC001560676225 1060509245 /nfs/dbraw/zinc/50/92/45/1060509245.db2.gz VPDUNXKHQRNVTJ-UHFFFAOYSA-N 2 1 322.443 4.051 20 0 DIADMP CC(C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001560703746 1060561970 /nfs/dbraw/zinc/56/19/70/1060561970.db2.gz LNRJGZODAFXROH-OYNPSCLESA-N 2 1 314.517 4.311 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC001560749505 1060616969 /nfs/dbraw/zinc/61/69/69/1060616969.db2.gz HRKOZYBALRDYBT-NLWGTHIKSA-N 2 1 314.517 4.169 20 0 DIADMP CC[N@H+](CCCc1c(Cl)cccc1Cl)CCC[NH+](C)C ZINC001560811226 1060671459 /nfs/dbraw/zinc/67/14/59/1060671459.db2.gz CGDBYKQBSHZIMT-UHFFFAOYSA-N 2 1 317.304 4.200 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c(C)c1 ZINC001560814510 1060675487 /nfs/dbraw/zinc/67/54/87/1060675487.db2.gz ZTTBASPIZBQFGE-CKUGGHARSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c(C)c1 ZINC001560814510 1060675493 /nfs/dbraw/zinc/67/54/93/1060675493.db2.gz ZTTBASPIZBQFGE-CKUGGHARSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c(C)c1 ZINC001560814510 1060675498 /nfs/dbraw/zinc/67/54/98/1060675498.db2.gz ZTTBASPIZBQFGE-CKUGGHARSA-N 2 1 312.501 4.041 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001560844823 1060700657 /nfs/dbraw/zinc/70/06/57/1060700657.db2.gz BUIWDGXNXDLKCH-NJYVYQBISA-N 2 1 314.517 4.423 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001560870760 1060729481 /nfs/dbraw/zinc/72/94/81/1060729481.db2.gz PDUBCOCHTQCGNV-QGPMSJSTSA-N 2 1 308.897 4.294 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001560870760 1060729498 /nfs/dbraw/zinc/72/94/98/1060729498.db2.gz PDUBCOCHTQCGNV-QGPMSJSTSA-N 2 1 308.897 4.294 20 0 DIADMP CSc1ccc(C[N@@H+](C)CCCC[NH+]2CCCCC2)s1 ZINC001560982788 1060848235 /nfs/dbraw/zinc/84/82/35/1060848235.db2.gz HQHSACINAVLNQW-UHFFFAOYSA-N 2 1 312.548 4.168 20 0 DIADMP C[C@@H]([NH2+]CC1CCC=CCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001561017716 1060876126 /nfs/dbraw/zinc/87/61/26/1060876126.db2.gz FUTOZKINHHOLMJ-NQIIRXRSSA-N 2 1 312.501 4.233 20 0 DIADMP CC(C)C1CCC(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)CC1 ZINC001561045037 1060895549 /nfs/dbraw/zinc/89/55/49/1060895549.db2.gz CGJWUDBRZRAAPN-RNUBBMKBSA-N 2 1 306.538 4.111 20 0 DIADMP CCCc1ccc(C[N@@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)s1 ZINC001561053030 1060900223 /nfs/dbraw/zinc/90/02/23/1060900223.db2.gz RPCUODLOTXLWBC-KDURUIRLSA-N 2 1 318.530 4.008 20 0 DIADMP CCCc1ccc(C[N@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)s1 ZINC001561053030 1060900241 /nfs/dbraw/zinc/90/02/41/1060900241.db2.gz RPCUODLOTXLWBC-KDURUIRLSA-N 2 1 318.530 4.008 20 0 DIADMP CCCc1ccc(C[NH+]2C[C@@]34C[N@H+](C)C[C@]3(C2)CCCC4)s1 ZINC001561053030 1060900253 /nfs/dbraw/zinc/90/02/53/1060900253.db2.gz RPCUODLOTXLWBC-KDURUIRLSA-N 2 1 318.530 4.008 20 0 DIADMP CCCc1ccc(C[NH+]2C[C@@]34C[N@@H+](C)C[C@]3(C2)CCCC4)s1 ZINC001561053030 1060900266 /nfs/dbraw/zinc/90/02/66/1060900266.db2.gz RPCUODLOTXLWBC-KDURUIRLSA-N 2 1 318.530 4.008 20 0 DIADMP CCC[C@H](C)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203070 1060966729 /nfs/dbraw/zinc/96/67/29/1060966729.db2.gz HMWPDPBYYRPDQZ-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203070 1060966752 /nfs/dbraw/zinc/96/67/52/1060966752.db2.gz HMWPDPBYYRPDQZ-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203070 1060966762 /nfs/dbraw/zinc/96/67/62/1060966762.db2.gz HMWPDPBYYRPDQZ-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[C@H](C)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203070 1060966784 /nfs/dbraw/zinc/96/67/84/1060966784.db2.gz HMWPDPBYYRPDQZ-AZUAARDMSA-N 2 1 300.490 4.163 20 0 DIADMP CC(C)C[C@@H](C)[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203040 1060967147 /nfs/dbraw/zinc/96/71/47/1060967147.db2.gz GMRDUMWJNZZQMU-TZIWHRDSSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@@H](C)[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001473203040 1060967173 /nfs/dbraw/zinc/96/71/73/1060967173.db2.gz GMRDUMWJNZZQMU-TZIWHRDSSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@@H](C)[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC001473203040 1060967195 /nfs/dbraw/zinc/96/71/95/1060967195.db2.gz GMRDUMWJNZZQMU-TZIWHRDSSA-N 2 1 314.517 4.409 20 0 DIADMP CC(C)C[C@@H](C)[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC001473203040 1060967216 /nfs/dbraw/zinc/96/72/16/1060967216.db2.gz GMRDUMWJNZZQMU-TZIWHRDSSA-N 2 1 314.517 4.409 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC001462145368 1060967705 /nfs/dbraw/zinc/96/77/05/1060967705.db2.gz FBFADZGBUUWMMX-VNTMZGSJSA-N 2 1 312.501 4.065 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC001462145368 1060967724 /nfs/dbraw/zinc/96/77/24/1060967724.db2.gz FBFADZGBUUWMMX-VNTMZGSJSA-N 2 1 312.501 4.065 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)CCCCc2cccc(Cl)c2)CC1 ZINC001473211305 1060980436 /nfs/dbraw/zinc/98/04/36/1060980436.db2.gz WNKCAVLDHAOYSI-UHFFFAOYSA-N 2 1 322.924 4.469 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001462183237 1061005723 /nfs/dbraw/zinc/00/57/23/1061005723.db2.gz YHRGSJVIEBBWLO-SHJAMOMRSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1CC[C@H](C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001462183237 1061005737 /nfs/dbraw/zinc/00/57/37/1061005737.db2.gz YHRGSJVIEBBWLO-SHJAMOMRSA-N 2 1 312.501 4.380 20 0 DIADMP CC[N@@H+](Cc1cc(Cl)cs1)Cc1ccc(C[NH+](C)C)cc1 ZINC001462192819 1061013879 /nfs/dbraw/zinc/01/38/79/1061013879.db2.gz QKWIGLPFSGSDDV-UHFFFAOYSA-N 2 1 322.905 4.485 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)cc1C ZINC001462198884 1061020646 /nfs/dbraw/zinc/02/06/46/1061020646.db2.gz FPSCGFHTMVGALM-UHFFFAOYSA-N 2 1 316.411 4.178 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC001462265915 1061061602 /nfs/dbraw/zinc/06/16/02/1061061602.db2.gz MPRVVBMDYQAZDI-WBVHZDCISA-N 2 1 316.480 4.301 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462306533 1061094000 /nfs/dbraw/zinc/09/40/00/1061094000.db2.gz PIACNGRPOBCMED-IHPCNDPISA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001462306533 1061094015 /nfs/dbraw/zinc/09/40/15/1061094015.db2.gz PIACNGRPOBCMED-IHPCNDPISA-N 2 1 302.506 4.108 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@H](C[NH2+]C3CC4(CCC4)C3)C2)cc1 ZINC001462310148 1061095548 /nfs/dbraw/zinc/09/55/48/1061095548.db2.gz AGUOKAANXWAABY-LJQANCHMSA-N 2 1 312.501 4.211 20 0 DIADMP CCCc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001473369602 1061115885 /nfs/dbraw/zinc/11/58/85/1061115885.db2.gz HIXTZTWOJJWQAW-XLIONFOSSA-N 2 1 314.517 4.382 20 0 DIADMP CC[N@@H+](CCC[NH2+]CCc1cc(C)cc(C)c1)C1CCCCC1 ZINC001462408140 1061153873 /nfs/dbraw/zinc/15/38/73/1061153873.db2.gz MMZRGRYNVXVPQU-UHFFFAOYSA-N 2 1 316.533 4.480 20 0 DIADMP C[C@H]1CC(CC[N@H+]2CCCC3(CC[NH+](C)CC3)C2)C[C@H](C)C1 ZINC001473426909 1061156497 /nfs/dbraw/zinc/15/64/97/1061156497.db2.gz MHGQRCQTLBLNII-QZTJIDSGSA-N 2 1 306.538 4.257 20 0 DIADMP CCC[C@@H](C)CCC[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001473428306 1061156534 /nfs/dbraw/zinc/15/65/34/1061156534.db2.gz PIINUQBPQYHOCB-MRXNPFEDSA-N 2 1 304.478 4.450 20 0 DIADMP CC[C@H](C)[C@@H](C)[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001473465352 1061177997 /nfs/dbraw/zinc/17/79/97/1061177997.db2.gz OLNHJJIGQCUBDZ-NSHGMRRFSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001473465352 1061178006 /nfs/dbraw/zinc/17/80/06/1061178006.db2.gz OLNHJJIGQCUBDZ-NSHGMRRFSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001473465352 1061178008 /nfs/dbraw/zinc/17/80/08/1061178008.db2.gz OLNHJJIGQCUBDZ-NSHGMRRFSA-N 2 1 300.490 4.019 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC001473501647 1061195865 /nfs/dbraw/zinc/19/58/65/1061195865.db2.gz FHWPMRZIMXROQB-RBBKRZOGSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC001473501647 1061195874 /nfs/dbraw/zinc/19/58/74/1061195874.db2.gz FHWPMRZIMXROQB-RBBKRZOGSA-N 2 1 320.480 4.118 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCc2ccccc2[C@H]1c1ccccc1 ZINC001473501647 1061195881 /nfs/dbraw/zinc/19/58/81/1061195881.db2.gz FHWPMRZIMXROQB-RBBKRZOGSA-N 2 1 320.480 4.118 20 0 DIADMP C[C@@H](c1cccc(Cl)c1)[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC001473586263 1061273543 /nfs/dbraw/zinc/27/35/43/1061273543.db2.gz FOCMEWMKGREUCB-HNNXBMFYSA-N 2 1 315.848 4.008 20 0 DIADMP CC(C)C1(C[N@H+]2CCC[C@@H](c3cncn3C(C)(C)C)C2)CC1 ZINC001462671182 1061327842 /nfs/dbraw/zinc/32/78/42/1061327842.db2.gz TXALWVWLJVADSE-MRXNPFEDSA-N 2 1 303.494 4.254 20 0 DIADMP CC(C)C1(C[N@H+]2CCC[C@H](c3cncn3C(C)(C)C)C2)CC1 ZINC001462671173 1061329594 /nfs/dbraw/zinc/32/95/94/1061329594.db2.gz TXALWVWLJVADSE-INIZCTEOSA-N 2 1 303.494 4.254 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@H](C)[C@H]1CC1(F)F)c1ccccc1 ZINC001462673051 1061331925 /nfs/dbraw/zinc/33/19/25/1061331925.db2.gz HTLQQRWDCHUDSD-OIISXLGYSA-N 2 1 310.432 4.093 20 0 DIADMP CCCC[N@@H+](CCc1ccccn1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001473682703 1061339644 /nfs/dbraw/zinc/33/96/44/1061339644.db2.gz BEJWFSSJBXFSEO-UHFFFAOYSA-N 2 1 317.521 4.035 20 0 DIADMP CCC1([NH+](C)C)CC[NH+](C[C@H]2CCC3(CCCCCC3)O2)CC1 ZINC001473695416 1061353912 /nfs/dbraw/zinc/35/39/12/1061353912.db2.gz OBFOFVGPIUFARO-GOSISDBHSA-N 2 1 322.537 4.065 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](c1ccc(F)cc1)C1CCCCC1 ZINC001473717294 1061368851 /nfs/dbraw/zinc/36/88/51/1061368851.db2.gz UMYFDKTZTGRKGI-IBGZPJMESA-N 2 1 315.436 4.242 20 0 DIADMP CC(C)C[N@@H+](CCCCc1ccccc1)CC1CC[NH+](C)CC1 ZINC001473739321 1061383448 /nfs/dbraw/zinc/38/34/48/1061383448.db2.gz NQKMCSYPZZRZEA-UHFFFAOYSA-N 2 1 316.533 4.309 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CCN(c3cc[nH+]cc3)C[C@H]2C)c(C)c1 ZINC001473809777 1061417546 /nfs/dbraw/zinc/41/75/46/1061417546.db2.gz QNVNPZMTZWBGPQ-RTBURBONSA-N 2 1 323.484 4.279 20 0 DIADMP C[N@@H+](CCC[NH2+]C1CCc2ccccc2CC1)C1CCCCC1 ZINC001473910664 1061458927 /nfs/dbraw/zinc/45/89/27/1061458927.db2.gz WZYZMARLAMEAMK-UHFFFAOYSA-N 2 1 314.517 4.178 20 0 DIADMP CCc1cccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001473913517 1061460283 /nfs/dbraw/zinc/46/02/83/1061460283.db2.gz SPOFNZATXPTTKS-UHFFFAOYSA-N 2 1 308.469 4.003 20 0 DIADMP CCSc1cccc(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001473935398 1061479260 /nfs/dbraw/zinc/47/92/60/1061479260.db2.gz CYLRLKKQZLCFKN-CALCHBBNSA-N 2 1 320.546 4.256 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC001473933775 1061480286 /nfs/dbraw/zinc/48/02/86/1061480286.db2.gz QPBYCCUOQGAQNY-DCXXXQMHSA-N 2 1 314.517 4.443 20 0 DIADMP Cc1ccc(F)cc1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC001473968837 1061513486 /nfs/dbraw/zinc/51/34/86/1061513486.db2.gz GIQGRYRBXOXMDH-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP CC[N@H+](CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1)C(C)C ZINC001473974781 1061519196 /nfs/dbraw/zinc/51/91/96/1061519196.db2.gz LKQJCHDKICUDNP-GOSISDBHSA-N 2 1 318.549 4.483 20 0 DIADMP CC[N@@H+](CC[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1)C(C)C ZINC001473974781 1061519212 /nfs/dbraw/zinc/51/92/12/1061519212.db2.gz LKQJCHDKICUDNP-GOSISDBHSA-N 2 1 318.549 4.483 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1CC[NH2+]C[C@@H](C)CCc1ccccc1 ZINC001473994698 1061537653 /nfs/dbraw/zinc/53/76/53/1061537653.db2.gz BHESBNWBQDEGQA-ICSRJNTNSA-N 2 1 302.506 4.109 20 0 DIADMP CC[C@H]1CCCC[N@H+]1CC[NH2+]C[C@@H](C)CCc1ccccc1 ZINC001473994698 1061537674 /nfs/dbraw/zinc/53/76/74/1061537674.db2.gz BHESBNWBQDEGQA-ICSRJNTNSA-N 2 1 302.506 4.109 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc2cc(C)c(C)cc2o1 ZINC001474018640 1061560558 /nfs/dbraw/zinc/56/05/58/1061560558.db2.gz AMBIOQYSXUXFBE-UHFFFAOYSA-N 2 1 311.429 4.125 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)C1 ZINC001474027223 1061565991 /nfs/dbraw/zinc/56/59/91/1061565991.db2.gz CQGSXEBVGUBJRP-LSDHHAIUSA-N 2 1 316.420 4.048 20 0 DIADMP CCC1(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCC1 ZINC001474037965 1061583028 /nfs/dbraw/zinc/58/30/28/1061583028.db2.gz PVIOCDMFIHEZHX-UHFFFAOYSA-N 2 1 302.506 4.315 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(C)(C)C)cc2)C1 ZINC001474078491 1061625211 /nfs/dbraw/zinc/62/52/11/1061625211.db2.gz LTUPQWCMJGEEBZ-IBGZPJMESA-N 2 1 316.533 4.442 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C[C@H]2CCC[C@@H]2c2ccccc2)CC1(C)C ZINC001474159398 1061701690 /nfs/dbraw/zinc/70/16/90/1061701690.db2.gz KDXRIDALGNESRX-CEXWTWQISA-N 2 1 300.490 4.033 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC001474209903 1061765699 /nfs/dbraw/zinc/76/56/99/1061765699.db2.gz KKEUPYNNDSHQRD-HMXCVIKNSA-N 2 1 314.517 4.424 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC001474209904 1061766068 /nfs/dbraw/zinc/76/60/68/1061766068.db2.gz KKEUPYNNDSHQRD-NRSPTQNISA-N 2 1 314.517 4.424 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001474217687 1061775466 /nfs/dbraw/zinc/77/54/66/1061775466.db2.gz ITRUUDVDFOAMJE-PKOBYXMFSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)CC1([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001474217687 1061775487 /nfs/dbraw/zinc/77/54/87/1061775487.db2.gz ITRUUDVDFOAMJE-PKOBYXMFSA-N 2 1 300.490 4.208 20 0 DIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCCC[C@@H]1F ZINC001474229143 1061793392 /nfs/dbraw/zinc/79/33/92/1061793392.db2.gz WFSHPTKVRLHOJE-ZWKOTPCHSA-N 2 1 306.469 4.015 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCCC[C@@H]1F ZINC001474229143 1061793410 /nfs/dbraw/zinc/79/34/10/1061793410.db2.gz WFSHPTKVRLHOJE-ZWKOTPCHSA-N 2 1 306.469 4.015 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270090 1061838530 /nfs/dbraw/zinc/83/85/30/1061838530.db2.gz SGCIAVSTXMXBGT-PKOBYXMFSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C(C)(C)C ZINC001474270090 1061838546 /nfs/dbraw/zinc/83/85/46/1061838546.db2.gz SGCIAVSTXMXBGT-PKOBYXMFSA-N 2 1 314.517 4.455 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](C[C@@]2(C)C[C@@H]2c2ccccc2)CC1 ZINC001474364028 1061992460 /nfs/dbraw/zinc/99/24/60/1061992460.db2.gz ROKZXVSFKKDRNK-NHCUHLMSSA-N 2 1 314.517 4.232 20 0 DIADMP Cc1nccn1CCCC[N@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001253940744 1062000464 /nfs/dbraw/zinc/00/04/64/1062000464.db2.gz CBOMKDGIIZXANQ-SFTDATJTSA-N 2 1 323.484 4.373 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001253940744 1062000484 /nfs/dbraw/zinc/00/04/84/1062000484.db2.gz CBOMKDGIIZXANQ-SFTDATJTSA-N 2 1 323.484 4.373 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001253940744 1062000508 /nfs/dbraw/zinc/00/05/08/1062000508.db2.gz CBOMKDGIIZXANQ-SFTDATJTSA-N 2 1 323.484 4.373 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c(C)c1 ZINC001474412898 1062079338 /nfs/dbraw/zinc/07/93/38/1062079338.db2.gz LOTIMTYEAPPKEB-BQYQJAHWSA-N 2 1 314.517 4.430 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@H+](C)C2CC[NH+](C(C)C)CC2)c(C)c1 ZINC001474412898 1062079357 /nfs/dbraw/zinc/07/93/57/1062079357.db2.gz LOTIMTYEAPPKEB-BQYQJAHWSA-N 2 1 314.517 4.430 20 0 DIADMP C[N@@H+](C1CCN(Cc2ccccc2)CC1)C1CCC2(CC2)CC1 ZINC001254441730 1062103462 /nfs/dbraw/zinc/10/34/62/1062103462.db2.gz WDIBTNWFYPBCNH-UHFFFAOYSA-N 2 1 312.501 4.306 20 0 DIADMP CC[N@@H+](CC[C@H]1CCC[NH+]1C)[C@H](C)c1cc2ccccc2o1 ZINC001459348563 1062103486 /nfs/dbraw/zinc/10/34/86/1062103486.db2.gz YVSZSJGQVZPNKQ-NVXWUHKLSA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@@H+]1C)[C@H](C)c1cc2ccccc2o1 ZINC001459348563 1062103495 /nfs/dbraw/zinc/10/34/95/1062103495.db2.gz YVSZSJGQVZPNKQ-NVXWUHKLSA-N 2 1 300.446 4.300 20 0 DIADMP CC[NH+](CC[C@H]1CCC[N@H+]1C)[C@H](C)c1cc2ccccc2o1 ZINC001459348563 1062103500 /nfs/dbraw/zinc/10/35/00/1062103500.db2.gz YVSZSJGQVZPNKQ-NVXWUHKLSA-N 2 1 300.446 4.300 20 0 DIADMP C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CCC2(CC2)CC1 ZINC001254445490 1062106050 /nfs/dbraw/zinc/10/60/50/1062106050.db2.gz OBZLKEHKTQGCPL-IBGZPJMESA-N 2 1 312.501 4.163 20 0 DIADMP C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC2(CC2)CC1 ZINC001254445490 1062106061 /nfs/dbraw/zinc/10/60/61/1062106061.db2.gz OBZLKEHKTQGCPL-IBGZPJMESA-N 2 1 312.501 4.163 20 0 DIADMP C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC2(CC2)CC1 ZINC001254445490 1062106071 /nfs/dbraw/zinc/10/60/71/1062106071.db2.gz OBZLKEHKTQGCPL-IBGZPJMESA-N 2 1 312.501 4.163 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)C[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001459413285 1062136066 /nfs/dbraw/zinc/13/60/66/1062136066.db2.gz MTWGMQJIYJWAIK-UYAOXDASSA-N 2 1 314.517 4.375 20 0 DIADMP FC1(F)CC[C@H](C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)C1 ZINC001459437207 1062144540 /nfs/dbraw/zinc/14/45/40/1062144540.db2.gz JESZKPGMSIZHER-DLBZAZTESA-N 2 1 314.464 4.010 20 0 DIADMP FC1(F)CC[C@@H](C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC001459437248 1062145915 /nfs/dbraw/zinc/14/59/15/1062145915.db2.gz JESZKPGMSIZHER-SJORKVTESA-N 2 1 314.464 4.010 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC1 ZINC001254507447 1062149007 /nfs/dbraw/zinc/14/90/07/1062149007.db2.gz CELUBNWCUGPNEY-APWZRJJASA-N 2 1 304.453 4.131 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[N@@H+](C)CC1)c1cc(Cl)cc(Cl)c1 ZINC001254506498 1062149470 /nfs/dbraw/zinc/14/94/70/1062149470.db2.gz SZAHLTQAQYQEQV-XHDPSFHLSA-N 2 1 301.261 4.128 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C2(c3ccccc3)CCC(F)(F)CC2)CC1 ZINC001254511058 1062149748 /nfs/dbraw/zinc/14/97/48/1062149748.db2.gz UIQITPXQZMKWKI-KRWDZBQOSA-N 2 1 322.443 4.165 20 0 DIADMP Cc1ccc(Oc2ccc(C[NH2+][C@H]3CCC[N@H+](C)CC3)cc2)cc1 ZINC001254512792 1062152669 /nfs/dbraw/zinc/15/26/69/1062152669.db2.gz SDGAHLQGDKTQAG-IBGZPJMESA-N 2 1 324.468 4.361 20 0 DIADMP CC[C@@H](C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC001474500731 1062180553 /nfs/dbraw/zinc/18/05/53/1062180553.db2.gz POYXVORJFNTIMW-FQEVSTJZSA-N 2 1 310.485 4.374 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC001474503343 1062182653 /nfs/dbraw/zinc/18/26/53/1062182653.db2.gz KJCGNDHDVVNLDK-KRWDZBQOSA-N 2 1 320.908 4.121 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)CC1 ZINC001474503679 1062183407 /nfs/dbraw/zinc/18/34/07/1062183407.db2.gz NCNHBZSPOKHMCI-QLOJAFMTSA-N 2 1 306.538 4.113 20 0 DIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC001459527055 1062185267 /nfs/dbraw/zinc/18/52/67/1062185267.db2.gz RFBKYNCQWFWMFL-NHCUHLMSSA-N 2 1 312.501 4.437 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001474508064 1062190578 /nfs/dbraw/zinc/19/05/78/1062190578.db2.gz HFOBVKDRCFBABM-XUVXKRRUSA-N 2 1 300.490 4.177 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001474508064 1062190585 /nfs/dbraw/zinc/19/05/85/1062190585.db2.gz HFOBVKDRCFBABM-XUVXKRRUSA-N 2 1 300.490 4.177 20 0 DIADMP Cc1cccc([C@H]2CCCC[NH+]2CC[C@@H]2CCC[N@@H+]2C)c1C ZINC001459565680 1062212588 /nfs/dbraw/zinc/21/25/88/1062212588.db2.gz RYNORGDGACTJSQ-AZUAARDMSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@H]2CCCC[N@H+]2CC[C@@H]2CCC[NH+]2C)c1C ZINC001459565680 1062212610 /nfs/dbraw/zinc/21/26/10/1062212610.db2.gz RYNORGDGACTJSQ-AZUAARDMSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1cccc([C@H]2CCCC[N@@H+]2CC[C@@H]2CCC[NH+]2C)c1C ZINC001459565680 1062212631 /nfs/dbraw/zinc/21/26/31/1062212631.db2.gz RYNORGDGACTJSQ-AZUAARDMSA-N 2 1 300.490 4.315 20 0 DIADMP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@@H]1CCc2c1cccc2Cl ZINC001459571133 1062217861 /nfs/dbraw/zinc/21/78/61/1062217861.db2.gz FAELUBCFPQIXBO-RDTXWAMCSA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@@H]1CCc2c1cccc2Cl ZINC001459571133 1062217882 /nfs/dbraw/zinc/21/78/82/1062217882.db2.gz FAELUBCFPQIXBO-RDTXWAMCSA-N 2 1 306.881 4.134 20 0 DIADMP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@@H]1CCc2c1cccc2Cl ZINC001459571133 1062217900 /nfs/dbraw/zinc/21/79/00/1062217900.db2.gz FAELUBCFPQIXBO-RDTXWAMCSA-N 2 1 306.881 4.134 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@H](C)CCc1ccccc1F ZINC001474538443 1062225523 /nfs/dbraw/zinc/22/55/23/1062225523.db2.gz SUOOHERZODRWEX-MJGOQNOKSA-N 2 1 320.496 4.247 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+][C@@H](C)CCc1ccsc1 ZINC001474538827 1062229586 /nfs/dbraw/zinc/22/95/86/1062229586.db2.gz WOBDGQMZTUGKSD-WMZOPIPTSA-N 2 1 308.535 4.169 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(C)ccc3ccccc32)C[C@@H]1C ZINC001459614613 1062246701 /nfs/dbraw/zinc/24/67/01/1062246701.db2.gz QLYQVRJDTPEIIB-HKUYNNGSSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(C)ccc3ccccc32)C[C@@H]1C ZINC001459614613 1062246720 /nfs/dbraw/zinc/24/67/20/1062246720.db2.gz QLYQVRJDTPEIIB-HKUYNNGSSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(C)ccc3ccccc32)C[C@@H]1C ZINC001459614613 1062246743 /nfs/dbraw/zinc/24/67/43/1062246743.db2.gz QLYQVRJDTPEIIB-HKUYNNGSSA-N 2 1 310.485 4.453 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2c(C)ccc3ccccc32)C[C@H]1C ZINC001459614632 1062248508 /nfs/dbraw/zinc/24/85/08/1062248508.db2.gz QLYQVRJDTPEIIB-MJGOQNOKSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2c(C)ccc3ccccc32)C[C@H]1C ZINC001459614632 1062248532 /nfs/dbraw/zinc/24/85/32/1062248532.db2.gz QLYQVRJDTPEIIB-MJGOQNOKSA-N 2 1 310.485 4.453 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2c(C)ccc3ccccc32)C[C@H]1C ZINC001459614632 1062248552 /nfs/dbraw/zinc/24/85/52/1062248552.db2.gz QLYQVRJDTPEIIB-MJGOQNOKSA-N 2 1 310.485 4.453 20 0 DIADMP CC(C)[N@@H+](C)C[C@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474556661 1062257260 /nfs/dbraw/zinc/25/72/60/1062257260.db2.gz FUMRCGFUNCSZKI-KGLIPLIRSA-N 2 1 316.411 4.127 20 0 DIADMP CC(C)[N@H+](C)C[C@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC001474556661 1062257280 /nfs/dbraw/zinc/25/72/80/1062257280.db2.gz FUMRCGFUNCSZKI-KGLIPLIRSA-N 2 1 316.411 4.127 20 0 DIADMP CC(C)SCC[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC001459664528 1062285380 /nfs/dbraw/zinc/28/53/80/1062285380.db2.gz AEKAXTQUEJPPDB-QGZVFWFLSA-N 2 1 312.567 4.105 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC001459669994 1062293389 /nfs/dbraw/zinc/29/33/89/1062293389.db2.gz QGAIFHQPCHDXMT-PGRDOPGGSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC001459669994 1062293405 /nfs/dbraw/zinc/29/34/05/1062293405.db2.gz QGAIFHQPCHDXMT-PGRDOPGGSA-N 2 1 324.512 4.435 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCCc2cccc3ccccc32)[C@@H](C)C1 ZINC001459669994 1062293415 /nfs/dbraw/zinc/29/34/15/1062293415.db2.gz QGAIFHQPCHDXMT-PGRDOPGGSA-N 2 1 324.512 4.435 20 0 DIADMP F[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001255135936 1062330284 /nfs/dbraw/zinc/33/02/84/1062330284.db2.gz GJDTXFAFEDUFJQ-HAGHYFMRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001255135936 1062330305 /nfs/dbraw/zinc/33/03/05/1062330305.db2.gz GJDTXFAFEDUFJQ-HAGHYFMRSA-N 2 1 316.464 4.006 20 0 DIADMP F[C@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC001255135936 1062330328 /nfs/dbraw/zinc/33/03/28/1062330328.db2.gz GJDTXFAFEDUFJQ-HAGHYFMRSA-N 2 1 316.464 4.006 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001255136149 1062330992 /nfs/dbraw/zinc/33/09/92/1062330992.db2.gz HKEFGAARJJDOSU-YCXYWVQESA-N 2 1 312.501 4.445 20 0 DIADMP C[C@@H]1CCC[C@@H](C)[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001255136149 1062331015 /nfs/dbraw/zinc/33/10/15/1062331015.db2.gz HKEFGAARJJDOSU-YCXYWVQESA-N 2 1 312.501 4.445 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC4(CCCC4)C2)C3)cc1 ZINC001255143282 1062336471 /nfs/dbraw/zinc/33/64/71/1062336471.db2.gz JMFJSTICXWOHGY-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+]2CCC4(CCCC4)C2)C3)cc1 ZINC001255143282 1062336495 /nfs/dbraw/zinc/33/64/95/1062336495.db2.gz JMFJSTICXWOHGY-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+]2CCC4(CCCC4)C2)C3)cc1 ZINC001255143282 1062336522 /nfs/dbraw/zinc/33/65/22/1062336522.db2.gz JMFJSTICXWOHGY-WKCHPHFGSA-N 2 1 324.512 4.448 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@@H]4CCC[C@H]42)C3)cc1 ZINC001255143298 1062337708 /nfs/dbraw/zinc/33/77/08/1062337708.db2.gz JRNUMWFLILLAMT-VNXMGFANSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@@H]4CCC[C@H]42)C3)cc1 ZINC001255143298 1062337733 /nfs/dbraw/zinc/33/77/33/1062337733.db2.gz JRNUMWFLILLAMT-VNXMGFANSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCC[C@@H]4CCC[C@H]42)C3)cc1 ZINC001255143298 1062337755 /nfs/dbraw/zinc/33/77/55/1062337755.db2.gz JRNUMWFLILLAMT-VNXMGFANSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCC[C@@H]4CCC[C@H]42)C3)cc1 ZINC001255143298 1062337771 /nfs/dbraw/zinc/33/77/71/1062337771.db2.gz JRNUMWFLILLAMT-VNXMGFANSA-N 2 1 324.512 4.447 20 0 DIADMP CC[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001255146059 1062338426 /nfs/dbraw/zinc/33/84/26/1062338426.db2.gz BRKKPKJLIRUSAT-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001255146059 1062338453 /nfs/dbraw/zinc/33/84/53/1062338453.db2.gz BRKKPKJLIRUSAT-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP CC[C@H]1CCC[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001255146059 1062338475 /nfs/dbraw/zinc/33/84/75/1062338475.db2.gz BRKKPKJLIRUSAT-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474617335 1062340413 /nfs/dbraw/zinc/34/04/13/1062340413.db2.gz ASZVBOGXECCEQN-NQSCKRDGSA-N 2 1 320.480 4.174 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC4(CCC4)C2)C3)cc1 ZINC001255143305 1062341058 /nfs/dbraw/zinc/34/10/58/1062341058.db2.gz JURMOKAJNSGXAX-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001255143305 1062341076 /nfs/dbraw/zinc/34/10/76/1062341076.db2.gz JURMOKAJNSGXAX-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001255143305 1062341095 /nfs/dbraw/zinc/34/10/95/1062341095.db2.gz JURMOKAJNSGXAX-PMOLBWCYSA-N 2 1 310.485 4.058 20 0 DIADMP CC1(C)CCC([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC1 ZINC001255301805 1062384945 /nfs/dbraw/zinc/38/49/45/1062384945.db2.gz USLDAVINOSOUFX-UHFFFAOYSA-N 2 1 304.453 4.044 20 0 DIADMP CCCC[C@@H](C)[NH2+]C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C ZINC001255319168 1062394364 /nfs/dbraw/zinc/39/43/64/1062394364.db2.gz HDASPPCEGPOANS-GGPKGHCWSA-N 2 1 302.506 4.313 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001255332339 1062405728 /nfs/dbraw/zinc/40/57/28/1062405728.db2.gz NNOGFZNWTUTWIN-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001255332339 1062405737 /nfs/dbraw/zinc/40/57/37/1062405737.db2.gz NNOGFZNWTUTWIN-DFQSSKMNSA-N 2 1 300.490 4.019 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001255332340 1062406394 /nfs/dbraw/zinc/40/63/94/1062406394.db2.gz NNOGFZNWTUTWIN-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001255332340 1062406400 /nfs/dbraw/zinc/40/64/00/1062406400.db2.gz NNOGFZNWTUTWIN-IHPCNDPISA-N 2 1 300.490 4.019 20 0 DIADMP CC(C)C[N@H+](Cc1cc(Cl)cs1)CC1CC[NH+](C)CC1 ZINC001474678124 1062407969 /nfs/dbraw/zinc/40/79/69/1062407969.db2.gz HQXSBMCFZGSXPE-UHFFFAOYSA-N 2 1 314.926 4.201 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255376132 1062418918 /nfs/dbraw/zinc/41/89/18/1062418918.db2.gz IBJOWMPGCBDDNO-RLLQIKCJSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255376130 1062419590 /nfs/dbraw/zinc/41/95/90/1062419590.db2.gz IBJOWMPGCBDDNO-MISYRCLQSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383026 1062421135 /nfs/dbraw/zinc/42/11/35/1062421135.db2.gz YTQFZUOYELWNFD-RLLQIKCJSA-N 2 1 300.490 4.209 20 0 DIADMP FC1(F)CC[C@H](C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383077 1062421253 /nfs/dbraw/zinc/42/12/53/1062421253.db2.gz ZOGZGIYQSJNMBP-ROUUACIJSA-N 2 1 322.443 4.066 20 0 DIADMP Cc1cccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1C ZINC001255384171 1062421445 /nfs/dbraw/zinc/42/14/45/1062421445.db2.gz UTDYGPXMXLWBCG-JOCHJYFZSA-N 2 1 322.496 4.448 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)s1 ZINC001255381527 1062421965 /nfs/dbraw/zinc/42/19/65/1062421965.db2.gz PKHYAGZVZXUEMF-GOSISDBHSA-N 2 1 314.498 4.201 20 0 DIADMP FC1(F)CC[C@@H](C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383076 1062422295 /nfs/dbraw/zinc/42/22/95/1062422295.db2.gz ZOGZGIYQSJNMBP-QZTJIDSGSA-N 2 1 322.443 4.066 20 0 DIADMP C=Cc1ccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255384750 1062422351 /nfs/dbraw/zinc/42/23/51/1062422351.db2.gz BCKJQGGGYKZSTD-QFIPXVFZSA-N 2 1 320.480 4.474 20 0 DIADMP Cc1cccc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1C ZINC001255384172 1062424362 /nfs/dbraw/zinc/42/43/62/1062424362.db2.gz UTDYGPXMXLWBCG-QFIPXVFZSA-N 2 1 322.496 4.448 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255390490 1062426765 /nfs/dbraw/zinc/42/67/65/1062426765.db2.gz HYZUXCAWIIJEGK-RBUKOAKNSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[N@H+](Cc3ccccc3)CC2)nc1 ZINC001255393243 1062427236 /nfs/dbraw/zinc/42/72/36/1062427236.db2.gz MSUHUVPHQQRIMP-UYAOXDASSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)nc1 ZINC001255393243 1062427249 /nfs/dbraw/zinc/42/72/49/1062427249.db2.gz MSUHUVPHQQRIMP-UYAOXDASSA-N 2 1 323.484 4.095 20 0 DIADMP CC1(C)CCC[C@H]1[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386768 1062429704 /nfs/dbraw/zinc/42/97/04/1062429704.db2.gz BKEWVWFXNRFHQU-RTBURBONSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCC4(CCC4)CC3)CC2)cc1 ZINC001255396959 1062431489 /nfs/dbraw/zinc/43/14/89/1062431489.db2.gz CGZADQLAZSUHNN-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCC4(CCC4)CC3)CC2)cc1 ZINC001255396959 1062431501 /nfs/dbraw/zinc/43/15/01/1062431501.db2.gz CGZADQLAZSUHNN-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP C[C@@H]1CC[C@@H](C)C1[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255395794 1062433114 /nfs/dbraw/zinc/43/31/14/1062433114.db2.gz DMAXBFNRNOSQBK-LMMKCTJWSA-N 2 1 300.490 4.065 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@@H]3CCCC34CCC4)CC2)cc1 ZINC001255395756 1062433950 /nfs/dbraw/zinc/43/39/50/1062433950.db2.gz CQEDNFDYXZGYFJ-VQTJNVASSA-N 2 1 312.501 4.354 20 0 DIADMP CC1(C)CC(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255396220 1062435024 /nfs/dbraw/zinc/43/50/24/1062435024.db2.gz HLBNJUMKBNYTHM-LJQANCHMSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]1CC[C@H](C)[C@H]1[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255395792 1062435659 /nfs/dbraw/zinc/43/56/59/1062435659.db2.gz DMAXBFNRNOSQBK-BWPNAZKDSA-N 2 1 300.490 4.065 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCC4(CCCC4)C3)CC2)cc1 ZINC001255406986 1062438141 /nfs/dbraw/zinc/43/81/41/1062438141.db2.gz VHEOGLIWOKDFAS-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@@H+]3CCC4(CCCC4)C3)CC2)cc1 ZINC001255406986 1062438151 /nfs/dbraw/zinc/43/81/51/1062438151.db2.gz VHEOGLIWOKDFAS-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@H+]3CCC4(CCCC4)C3)CC2)cc1 ZINC001255406986 1062438157 /nfs/dbraw/zinc/43/81/57/1062438157.db2.gz VHEOGLIWOKDFAS-HXUWFJFHSA-N 2 1 312.501 4.307 20 0 DIADMP C[N@@H+](CC1CCCC1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255408965 1062439353 /nfs/dbraw/zinc/43/93/53/1062439353.db2.gz QZDLGULDJLZODU-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](CC1CCCC1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255408965 1062439367 /nfs/dbraw/zinc/43/93/67/1062439367.db2.gz QZDLGULDJLZODU-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP C[NH+](CC1CCCC1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255408965 1062439377 /nfs/dbraw/zinc/43/93/77/1062439377.db2.gz QZDLGULDJLZODU-FQEVSTJZSA-N 2 1 300.490 4.163 20 0 DIADMP FC(F)C1CC[NH+]([C@H]2CCC[N@@H+](Cc3ccccc3)CC2)CC1 ZINC001255406431 1062439415 /nfs/dbraw/zinc/43/94/15/1062439415.db2.gz SFEZTBUQKRRDAZ-SFHVURJKSA-N 2 1 322.443 4.018 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCC[C@@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406424 1062441255 /nfs/dbraw/zinc/44/12/55/1062441255.db2.gz SECADTOPSXUCLP-ACRUOGEOSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCC[C@@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406424 1062441262 /nfs/dbraw/zinc/44/12/62/1062441262.db2.gz SECADTOPSXUCLP-ACRUOGEOSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCC[C@@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406424 1062441272 /nfs/dbraw/zinc/44/12/72/1062441272.db2.gz SECADTOPSXUCLP-ACRUOGEOSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCC[C@@H]4CCC[C@@H]43)CC2)cc1 ZINC001255406424 1062441280 /nfs/dbraw/zinc/44/12/80/1062441280.db2.gz SECADTOPSXUCLP-ACRUOGEOSA-N 2 1 312.501 4.306 20 0 DIADMP FC(F)(F)C1CCC([NH+]2CCC([NH+]3CCCCC3)CC2)CC1 ZINC001255513758 1062469095 /nfs/dbraw/zinc/46/90/95/1062469095.db2.gz YDBXCESKIZNCNI-UHFFFAOYSA-N 2 1 318.427 4.058 20 0 DIADMP C[C@@H](CC(F)(F)F)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255643176 1062494116 /nfs/dbraw/zinc/49/41/16/1062494116.db2.gz LRZNIZBNNBTIRG-BPUTZDHNSA-N 2 1 320.443 4.480 20 0 DIADMP CCC(CC)([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1 ZINC001255666254 1062504861 /nfs/dbraw/zinc/50/48/61/1062504861.db2.gz YGVUTJWEFLZDFK-YQQQUEKLSA-N 2 1 300.490 4.307 20 0 DIADMP CCC(CC)([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1 ZINC001255666254 1062504881 /nfs/dbraw/zinc/50/48/81/1062504881.db2.gz YGVUTJWEFLZDFK-YQQQUEKLSA-N 2 1 300.490 4.307 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1 ZINC001255669702 1062509777 /nfs/dbraw/zinc/50/97/77/1062509777.db2.gz JZASRAQQGVMMMB-XVLXNVKGSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1 ZINC001255669702 1062509801 /nfs/dbraw/zinc/50/98/01/1062509801.db2.gz JZASRAQQGVMMMB-XVLXNVKGSA-N 2 1 304.453 4.128 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)ccc1F ZINC001255669268 1062510975 /nfs/dbraw/zinc/51/09/75/1062510975.db2.gz TUFBIKZMWYSOLD-MUSFGAPCSA-N 2 1 308.416 4.021 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255684229 1062512986 /nfs/dbraw/zinc/51/29/86/1062512986.db2.gz UWTBAPNXPYXKQV-JZWPEALZSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+](C)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255684229 1062513008 /nfs/dbraw/zinc/51/30/08/1062513008.db2.gz UWTBAPNXPYXKQV-JZWPEALZSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255684229 1062513023 /nfs/dbraw/zinc/51/30/23/1062513023.db2.gz UWTBAPNXPYXKQV-JZWPEALZSA-N 2 1 306.881 4.348 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+](C)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255684229 1062513045 /nfs/dbraw/zinc/51/30/45/1062513045.db2.gz UWTBAPNXPYXKQV-JZWPEALZSA-N 2 1 306.881 4.348 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255702087 1062528169 /nfs/dbraw/zinc/52/81/69/1062528169.db2.gz XEZLCHRFMMDGQC-YHUYYLMFSA-N 2 1 318.427 4.089 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC001255711970 1062533533 /nfs/dbraw/zinc/53/35/33/1062533533.db2.gz GJGCMGZYVQYMOM-JKSUJKDBSA-N 2 1 320.443 4.160 20 0 DIADMP C[C@H](CSc1ccc(F)cc1)[N@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001255737558 1062560162 /nfs/dbraw/zinc/56/01/62/1062560162.db2.gz IULVZWQRDRNHMK-CVEARBPZSA-N 2 1 324.509 4.147 20 0 DIADMP CCc1ccccc1CC[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC001460021059 1062574230 /nfs/dbraw/zinc/57/42/30/1062574230.db2.gz CBJWIXVAONMLRM-UHFFFAOYSA-N 2 1 324.468 4.038 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+]2CCCC[C@H](CCC[NH3+])C2)cc1 ZINC001255759694 1062581831 /nfs/dbraw/zinc/58/18/31/1062581831.db2.gz AWUYHLOTKDFGQM-ZWKOTPCHSA-N 2 1 320.546 4.317 20 0 DIADMP CC[NH+](CC)C1CC[NH+]([C@@H](C)CSc2ccc(C)cc2)CC1 ZINC001255765574 1062584643 /nfs/dbraw/zinc/58/46/43/1062584643.db2.gz GAPJJBAGORKDLG-KRWDZBQOSA-N 2 1 320.546 4.282 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@@H]2CC[N@H+](C(C)C)C[C@H]2C)cc1 ZINC001255762666 1062586350 /nfs/dbraw/zinc/58/63/50/1062586350.db2.gz VUOACGWRIRNWBE-ZIFCJYIRSA-N 2 1 320.546 4.184 20 0 DIADMP Cc1ccc(SC[C@H](C)[NH2+][C@H]2CC[N@H+](C(C)C)C[C@@H]2C)cc1 ZINC001255762660 1062586714 /nfs/dbraw/zinc/58/67/14/1062586714.db2.gz VUOACGWRIRNWBE-LNLFQRSKSA-N 2 1 320.546 4.184 20 0 DIADMP Cc1ccc(SC[C@@H](C)n2c[nH+]cc2C2CC[NH2+]CC2)cc1 ZINC001255766514 1062588545 /nfs/dbraw/zinc/58/85/45/1062588545.db2.gz BMNBNWMEEFSICH-OAHLLOKOSA-N 2 1 315.486 4.012 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100452 1062636987 /nfs/dbraw/zinc/63/69/87/1062636987.db2.gz SMORZWBIFDDFRO-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC001460100452 1062636998 /nfs/dbraw/zinc/63/69/98/1062636998.db2.gz SMORZWBIFDDFRO-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[NH2+][C@@H](c1ccccc1F)C1CCC1 ZINC001255948656 1062670254 /nfs/dbraw/zinc/67/02/54/1062670254.db2.gz PLBLZWAQUNQRLW-DNVCBOLYSA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001255963880 1062673468 /nfs/dbraw/zinc/67/34/68/1062673468.db2.gz MEFZRPFWONNZCA-AWEZNQCLSA-N 2 1 316.411 4.258 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC001255963880 1062673481 /nfs/dbraw/zinc/67/34/81/1062673481.db2.gz MEFZRPFWONNZCA-AWEZNQCLSA-N 2 1 316.411 4.258 20 0 DIADMP c1csc(-c2cccc(C[NH2+]C3CC[NH+](C4CC4)CC3)c2)c1 ZINC001256069611 1062695225 /nfs/dbraw/zinc/69/52/25/1062695225.db2.gz IGAWXQYKENRILD-UHFFFAOYSA-N 2 1 312.482 4.132 20 0 DIADMP Fc1ccc([C@H](CC2CCC2)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC001256071773 1062695754 /nfs/dbraw/zinc/69/57/54/1062695754.db2.gz OLEQAQWWINVASI-FQEVSTJZSA-N 2 1 316.464 4.273 20 0 DIADMP [NH3+]CC[N@H+](Cc1ccccc1)[C@H]1CCC[C@H](c2ccccc2)C1 ZINC001256107081 1062708150 /nfs/dbraw/zinc/70/81/50/1062708150.db2.gz SVOMFBQICSCISX-SFTDATJTSA-N 2 1 308.469 4.174 20 0 DIADMP [NH3+]CC[N@@H+](Cc1ccccc1)[C@H]1CCC[C@H](c2ccccc2)C1 ZINC001256107081 1062708170 /nfs/dbraw/zinc/70/81/70/1062708170.db2.gz SVOMFBQICSCISX-SFTDATJTSA-N 2 1 308.469 4.174 20 0 DIADMP CCOC1CCC([N@@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001256434497 1062821771 /nfs/dbraw/zinc/82/17/71/1062821771.db2.gz MKPRFXBZYWSVGI-RTWGARKQSA-N 2 1 322.537 4.096 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC001256520669 1062843749 /nfs/dbraw/zinc/84/37/49/1062843749.db2.gz RZXMJMFELKSXIP-NNMXDRDESA-N 2 1 322.496 4.433 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccccc1 ZINC001256520669 1062843774 /nfs/dbraw/zinc/84/37/74/1062843774.db2.gz RZXMJMFELKSXIP-NNMXDRDESA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256527210 1062845786 /nfs/dbraw/zinc/84/57/86/1062845786.db2.gz QSQINPWCTBTCKY-CGBFIWBNSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256527210 1062845803 /nfs/dbraw/zinc/84/58/03/1062845803.db2.gz QSQINPWCTBTCKY-CGBFIWBNSA-N 2 1 302.506 4.454 20 0 DIADMP C=Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001256527166 1062849574 /nfs/dbraw/zinc/84/95/74/1062849574.db2.gz QQOREEMCGAWGGK-AVRDEDQJSA-N 2 1 320.480 4.472 20 0 DIADMP C=Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001256527166 1062849595 /nfs/dbraw/zinc/84/95/95/1062849595.db2.gz QQOREEMCGAWGGK-AVRDEDQJSA-N 2 1 320.480 4.472 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256529447 1062850678 /nfs/dbraw/zinc/85/06/78/1062850678.db2.gz BZKCHQGGRLDMAV-HLRQEUIKSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256529447 1062850713 /nfs/dbraw/zinc/85/07/13/1062850713.db2.gz BZKCHQGGRLDMAV-HLRQEUIKSA-N 2 1 320.480 4.185 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256536824 1062852520 /nfs/dbraw/zinc/85/25/20/1062852520.db2.gz GDQSXTKQSFTQQY-UYAOXDASSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256536824 1062852543 /nfs/dbraw/zinc/85/25/43/1062852543.db2.gz GDQSXTKQSFTQQY-UYAOXDASSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536824 1062852567 /nfs/dbraw/zinc/85/25/67/1062852567.db2.gz GDQSXTKQSFTQQY-UYAOXDASSA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536824 1062852583 /nfs/dbraw/zinc/85/25/83/1062852583.db2.gz GDQSXTKQSFTQQY-UYAOXDASSA-N 2 1 312.501 4.448 20 0 DIADMP Cc1cccc2c1C[NH+]([C@H]1CC[N@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536790 1062855268 /nfs/dbraw/zinc/85/52/68/1062855268.db2.gz FWKVWUZLUCQKRO-NQIIRXRSSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[NH+]([C@H]1CC[N@@H+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536790 1062855283 /nfs/dbraw/zinc/85/52/83/1062855283.db2.gz FWKVWUZLUCQKRO-NQIIRXRSSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@H+]([C@H]1CC[NH+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536790 1062855299 /nfs/dbraw/zinc/85/52/99/1062855299.db2.gz FWKVWUZLUCQKRO-NQIIRXRSSA-N 2 1 320.480 4.364 20 0 DIADMP Cc1cccc2c1C[N@@H+]([C@H]1CC[NH+](Cc3ccccc3)[C@H](C)C1)C2 ZINC001256536790 1062855315 /nfs/dbraw/zinc/85/53/15/1062855315.db2.gz FWKVWUZLUCQKRO-NQIIRXRSSA-N 2 1 320.480 4.364 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC[C@@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256536873 1062856816 /nfs/dbraw/zinc/85/68/16/1062856816.db2.gz GXCTWAHDZDMERA-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCC[C@@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256536873 1062856841 /nfs/dbraw/zinc/85/68/41/1062856841.db2.gz GXCTWAHDZDMERA-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536873 1062856872 /nfs/dbraw/zinc/85/68/72/1062856872.db2.gz GXCTWAHDZDMERA-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCCC[C@@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001256536873 1062856900 /nfs/dbraw/zinc/85/69/00/1062856900.db2.gz GXCTWAHDZDMERA-MISYRCLQSA-N 2 1 318.480 4.254 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256536823 1062857878 /nfs/dbraw/zinc/85/78/78/1062857878.db2.gz GDQSXTKQSFTQQY-QUCCMNQESA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256536823 1062857899 /nfs/dbraw/zinc/85/78/99/1062857899.db2.gz GDQSXTKQSFTQQY-QUCCMNQESA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536823 1062857920 /nfs/dbraw/zinc/85/79/20/1062857920.db2.gz GDQSXTKQSFTQQY-QUCCMNQESA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC23CCCCC3)CC[NH+]1Cc1ccccc1 ZINC001256536823 1062857935 /nfs/dbraw/zinc/85/79/35/1062857935.db2.gz GDQSXTKQSFTQQY-QUCCMNQESA-N 2 1 312.501 4.448 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@@H](C)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256541168 1062862213 /nfs/dbraw/zinc/86/22/13/1062862213.db2.gz LEQYZYFHBWFZHQ-JZXOWHBKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@@H](C)C2)CC[N@H+]1Cc1ccccc1 ZINC001256541168 1062862234 /nfs/dbraw/zinc/86/22/34/1062862234.db2.gz LEQYZYFHBWFZHQ-JZXOWHBKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC(F)(F)[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541168 1062862267 /nfs/dbraw/zinc/86/22/67/1062862267.db2.gz LEQYZYFHBWFZHQ-JZXOWHBKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC(F)(F)[C@@H](C)C2)CC[NH+]1Cc1ccccc1 ZINC001256541168 1062862292 /nfs/dbraw/zinc/86/22/92/1062862292.db2.gz LEQYZYFHBWFZHQ-JZXOWHBKSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256540543 1062862774 /nfs/dbraw/zinc/86/27/74/1062862774.db2.gz IVQSMSCRENJNHO-AYWYSENESA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256540543 1062862801 /nfs/dbraw/zinc/86/28/01/1062862801.db2.gz IVQSMSCRENJNHO-AYWYSENESA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256540543 1062862824 /nfs/dbraw/zinc/86/28/24/1062862824.db2.gz IVQSMSCRENJNHO-AYWYSENESA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256540543 1062862851 /nfs/dbraw/zinc/86/28/51/1062862851.db2.gz IVQSMSCRENJNHO-AYWYSENESA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001256537877 1062863300 /nfs/dbraw/zinc/86/33/00/1062863300.db2.gz QPFYNKISZXUECQ-YLJYHZDGSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]CC2(CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001256537877 1062863320 /nfs/dbraw/zinc/86/33/20/1062863320.db2.gz QPFYNKISZXUECQ-YLJYHZDGSA-N 2 1 312.501 4.209 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256550764 1062867755 /nfs/dbraw/zinc/86/77/55/1062867755.db2.gz NPTUYUPDWOPAOE-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256550764 1062867770 /nfs/dbraw/zinc/86/77/70/1062867770.db2.gz NPTUYUPDWOPAOE-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550764 1062867783 /nfs/dbraw/zinc/86/77/83/1062867783.db2.gz NPTUYUPDWOPAOE-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550764 1062867803 /nfs/dbraw/zinc/86/78/03/1062867803.db2.gz NPTUYUPDWOPAOE-UYAOXDASSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256553833 1062877352 /nfs/dbraw/zinc/87/73/52/1062877352.db2.gz LALJGDQKNHFJPR-AZUAARDMSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256553833 1062877369 /nfs/dbraw/zinc/87/73/69/1062877369.db2.gz LALJGDQKNHFJPR-AZUAARDMSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256552863 1062877925 /nfs/dbraw/zinc/87/79/25/1062877925.db2.gz FEZMYFLRWWIKCE-NJAFHUGGSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@H+]1Cc1ccccc1 ZINC001256552863 1062877947 /nfs/dbraw/zinc/87/79/47/1062877947.db2.gz FEZMYFLRWWIKCE-NJAFHUGGSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552863 1062877968 /nfs/dbraw/zinc/87/79/68/1062877968.db2.gz FEZMYFLRWWIKCE-NJAFHUGGSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CCC[C@H](C(F)F)C2)CC[NH+]1Cc1ccccc1 ZINC001256552863 1062877993 /nfs/dbraw/zinc/87/79/93/1062877993.db2.gz FEZMYFLRWWIKCE-NJAFHUGGSA-N 2 1 322.443 4.017 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256553671 1062880151 /nfs/dbraw/zinc/88/01/51/1062880151.db2.gz IVQSMSCRENJNHO-WJMWBRGCSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256553671 1062880172 /nfs/dbraw/zinc/88/01/72/1062880172.db2.gz IVQSMSCRENJNHO-WJMWBRGCSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256553671 1062880192 /nfs/dbraw/zinc/88/01/92/1062880192.db2.gz IVQSMSCRENJNHO-WJMWBRGCSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+]2C[C@@H]3CCCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001256553671 1062880216 /nfs/dbraw/zinc/88/02/16/1062880216.db2.gz IVQSMSCRENJNHO-WJMWBRGCSA-N 2 1 312.501 4.162 20 0 DIADMP CCC[NH+](CC(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556765 1062880874 /nfs/dbraw/zinc/88/08/74/1062880874.db2.gz GOGRIMFGWIJFDF-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[N@H+](CC(C)C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556765 1062880808 /nfs/dbraw/zinc/88/08/08/1062880808.db2.gz GOGRIMFGWIJFDF-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556765 1062880828 /nfs/dbraw/zinc/88/08/28/1062880828.db2.gz GOGRIMFGWIJFDF-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP CCC[NH+](CC(C)C)[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256556765 1062880849 /nfs/dbraw/zinc/88/08/49/1062880849.db2.gz GOGRIMFGWIJFDF-ICSRJNTNSA-N 2 1 302.506 4.408 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256555722 1062881999 /nfs/dbraw/zinc/88/19/99/1062881999.db2.gz WACMRBGVTQTDNZ-BVYCBKJFSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256555722 1062882019 /nfs/dbraw/zinc/88/20/19/1062882019.db2.gz WACMRBGVTQTDNZ-BVYCBKJFSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555722 1062882044 /nfs/dbraw/zinc/88/20/44/1062882044.db2.gz WACMRBGVTQTDNZ-BVYCBKJFSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555722 1062882064 /nfs/dbraw/zinc/88/20/64/1062882064.db2.gz WACMRBGVTQTDNZ-BVYCBKJFSA-N 2 1 320.480 4.487 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559843 1062882486 /nfs/dbraw/zinc/88/24/86/1062882486.db2.gz NTXSPXCRYBWPAC-IHPCNDPISA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559843 1062882502 /nfs/dbraw/zinc/88/25/02/1062882502.db2.gz NTXSPXCRYBWPAC-IHPCNDPISA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559843 1062882523 /nfs/dbraw/zinc/88/25/23/1062882523.db2.gz NTXSPXCRYBWPAC-IHPCNDPISA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256559843 1062882541 /nfs/dbraw/zinc/88/25/41/1062882541.db2.gz NTXSPXCRYBWPAC-IHPCNDPISA-N 2 1 300.490 4.304 20 0 DIADMP CC(C)C1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256556120 1062884036 /nfs/dbraw/zinc/88/40/36/1062884036.db2.gz XFBYDWRSJYOQJG-RXVVDRJESA-N 2 1 314.517 4.408 20 0 DIADMP CC(C)C1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001256556120 1062884058 /nfs/dbraw/zinc/88/40/58/1062884058.db2.gz XFBYDWRSJYOQJG-RXVVDRJESA-N 2 1 314.517 4.408 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256559845 1062884102 /nfs/dbraw/zinc/88/41/02/1062884102.db2.gz NTXSPXCRYBWPAC-YZGWKJHDSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256559845 1062884127 /nfs/dbraw/zinc/88/41/27/1062884127.db2.gz NTXSPXCRYBWPAC-YZGWKJHDSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256559845 1062884149 /nfs/dbraw/zinc/88/41/49/1062884149.db2.gz NTXSPXCRYBWPAC-YZGWKJHDSA-N 2 1 300.490 4.304 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256559845 1062884161 /nfs/dbraw/zinc/88/41/61/1062884161.db2.gz NTXSPXCRYBWPAC-YZGWKJHDSA-N 2 1 300.490 4.304 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001256574215 1062900488 /nfs/dbraw/zinc/90/04/88/1062900488.db2.gz WPCYFDFNYODQJW-OAHLLOKOSA-N 2 1 320.908 4.392 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CC[C@@H](c3ccccc3Cl)C2)CC1 ZINC001256574215 1062900510 /nfs/dbraw/zinc/90/05/10/1062900510.db2.gz WPCYFDFNYODQJW-OAHLLOKOSA-N 2 1 320.908 4.392 20 0 DIADMP Fc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001256599512 1062910199 /nfs/dbraw/zinc/91/01/99/1062910199.db2.gz VOOPTWPPJHEDDC-OAQYLSRUSA-N 2 1 324.443 4.067 20 0 DIADMP CCCC1CC[NH+](C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001256610782 1062913688 /nfs/dbraw/zinc/91/36/88/1062913688.db2.gz GYUWUZDOMSJYDN-UHFFFAOYSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@H]1CC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001256603579 1062914625 /nfs/dbraw/zinc/91/46/25/1062914625.db2.gz GTSIGTVXTWRSAW-INIZCTEOSA-N 2 1 322.443 4.018 20 0 DIADMP C[C@H]1CC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)CCC1(F)F ZINC001256603579 1062914648 /nfs/dbraw/zinc/91/46/48/1062914648.db2.gz GTSIGTVXTWRSAW-INIZCTEOSA-N 2 1 322.443 4.018 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(Cc2ccc(Cl)cc2)CC1 ZINC001460647285 1062958528 /nfs/dbraw/zinc/95/85/28/1062958528.db2.gz BIOIXLSNRZXQMQ-LJQANCHMSA-N 2 1 320.908 4.079 20 0 DIADMP CCC1CCC([NH+]2C[C@@H]3C[NH+](Cc4cccs4)C[C@H]3C2)CC1 ZINC001256871080 1063026286 /nfs/dbraw/zinc/02/62/86/1063026286.db2.gz IKNUBHCWABIBCB-SAGYGOJTSA-N 2 1 318.530 4.081 20 0 DIADMP CC(C)C[C@@H](C)C[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460749754 1063037565 /nfs/dbraw/zinc/03/75/65/1063037565.db2.gz RWBOSAQVRIVHBP-HLAWJBBLSA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460749754 1063037583 /nfs/dbraw/zinc/03/75/83/1063037583.db2.gz RWBOSAQVRIVHBP-HLAWJBBLSA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460749754 1063037598 /nfs/dbraw/zinc/03/75/98/1063037598.db2.gz RWBOSAQVRIVHBP-HLAWJBBLSA-N 2 1 314.517 4.123 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001257217308 1063143343 /nfs/dbraw/zinc/14/33/43/1063143343.db2.gz LSYQKXHEKMXGRM-HNNXBMFYSA-N 2 1 306.881 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CC[C@H](c3ccccc3Cl)C2)CC1 ZINC001257217308 1063143359 /nfs/dbraw/zinc/14/33/59/1063143359.db2.gz LSYQKXHEKMXGRM-HNNXBMFYSA-N 2 1 306.881 4.002 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001257220458 1063146920 /nfs/dbraw/zinc/14/69/20/1063146920.db2.gz QATWLFKNCVOKPW-SFHVURJKSA-N 2 1 306.881 4.350 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H]2c2ccccc2Cl)CC1 ZINC001257220458 1063146928 /nfs/dbraw/zinc/14/69/28/1063146928.db2.gz QATWLFKNCVOKPW-SFHVURJKSA-N 2 1 306.881 4.350 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC001257222269 1063149254 /nfs/dbraw/zinc/14/92/54/1063149254.db2.gz ZVZYVHJIBUIUHY-IBGZPJMESA-N 2 1 300.490 4.129 20 0 DIADMP CCC[C@H](CC)[N@@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257253408 1063160280 /nfs/dbraw/zinc/16/02/80/1063160280.db2.gz NYGDGUHQQZFMKK-FHWLQOOXSA-N 2 1 306.469 4.476 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCc2cc(C(C)C)ccc2C1 ZINC001460972947 1063162031 /nfs/dbraw/zinc/16/20/31/1063162031.db2.gz KOFCRMHBLRYODW-UHFFFAOYSA-N 2 1 311.473 4.153 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCc2cc(C(C)C)ccc2C1 ZINC001460972947 1063162042 /nfs/dbraw/zinc/16/20/42/1063162042.db2.gz KOFCRMHBLRYODW-UHFFFAOYSA-N 2 1 311.473 4.153 20 0 DIADMP CCc1cccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC001461020258 1063193572 /nfs/dbraw/zinc/19/35/72/1063193572.db2.gz WDBMPGCUPSWEQN-UHFFFAOYSA-N 2 1 322.496 4.046 20 0 DIADMP CCC[C@@H](C)[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001257319592 1063202060 /nfs/dbraw/zinc/20/20/60/1063202060.db2.gz QHZSIRYJRNDSPG-MRXNPFEDSA-N 2 1 306.519 4.225 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+]CCC[N@H+](C)C(C)C ZINC001461034967 1063204691 /nfs/dbraw/zinc/20/46/91/1063204691.db2.gz KQBSWMLSYLVCJK-UHFFFAOYSA-N 2 1 310.485 4.482 20 0 DIADMP CSCc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC001461049524 1063214837 /nfs/dbraw/zinc/21/48/37/1063214837.db2.gz FFNGSOBSUKUEFN-QGZVFWFLSA-N 2 1 320.546 4.151 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001461049228 1063216663 /nfs/dbraw/zinc/21/66/63/1063216663.db2.gz DKOLOVFTYYWBLQ-CALCHBBNSA-N 2 1 322.924 4.496 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@H]2[C@@H](CCN2Cc2nccs2)C1 ZINC001257337153 1063218087 /nfs/dbraw/zinc/21/80/87/1063218087.db2.gz RYHNAZBNQFEPNW-RDJZCZTQSA-N 2 1 321.534 4.008 20 0 DIADMP CCCC(CCC)[NH+]1C[C@@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257338452 1063218857 /nfs/dbraw/zinc/21/88/57/1063218857.db2.gz WOLISDCRXSGUOJ-HOTGVXAUSA-N 2 1 306.519 4.081 20 0 DIADMP C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](C3CCCC3)C[C@@H]21 ZINC001257350539 1063224345 /nfs/dbraw/zinc/22/43/45/1063224345.db2.gz FBKGHWBSWLLGGT-AYOQOUSVSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@@H+](C3CCCC3)C[C@@H]21 ZINC001257350539 1063224369 /nfs/dbraw/zinc/22/43/69/1063224369.db2.gz FBKGHWBSWLLGGT-AYOQOUSVSA-N 2 1 318.530 4.223 20 0 DIADMP C[NH+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[N@H+](C3CCCC3)C[C@@H]21 ZINC001257350539 1063224389 /nfs/dbraw/zinc/22/43/89/1063224389.db2.gz FBKGHWBSWLLGGT-AYOQOUSVSA-N 2 1 318.530 4.223 20 0 DIADMP CS[C@@H]1CCC[C@@H]([NH2+]CC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)C1 ZINC001461109625 1063259995 /nfs/dbraw/zinc/25/99/95/1063259995.db2.gz JPMCMPYYEJEXNB-YYIAUSFCSA-N 2 1 312.567 4.007 20 0 DIADMP CC[C@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC001257433783 1063276245 /nfs/dbraw/zinc/27/62/45/1063276245.db2.gz KFAZVHUOZRQHAV-VLCRHTCISA-N 2 1 322.496 4.433 20 0 DIADMP CC[C@H](C)[N@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001257438684 1063277312 /nfs/dbraw/zinc/27/73/12/1063277312.db2.gz BDMKTFWMCPBZQY-CWLKWCNXSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@@H]([N@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001257438684 1063277324 /nfs/dbraw/zinc/27/73/24/1063277324.db2.gz BDMKTFWMCPBZQY-CWLKWCNXSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@H](C)[NH+]1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3cccs3)[C@@H]2C1 ZINC001257438684 1063277343 /nfs/dbraw/zinc/27/73/43/1063277343.db2.gz BDMKTFWMCPBZQY-CWLKWCNXSA-N 2 1 306.519 4.079 20 0 DIADMP CC[C@@H](C)[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001257447169 1063280052 /nfs/dbraw/zinc/28/00/52/1063280052.db2.gz ALBQKMQTQZAQJS-CYBMUJFWSA-N 2 1 314.395 4.058 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]3C[NH+](C4CCCCC4)CC[C@H]3C2)cc1 ZINC001257466747 1063291303 /nfs/dbraw/zinc/29/13/03/1063291303.db2.gz PAQWTKUKAKOCJV-VQTJNVASSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@@H+](C4CCCCC4)CC[C@H]3C2)cc1 ZINC001257466747 1063291318 /nfs/dbraw/zinc/29/13/18/1063291318.db2.gz PAQWTKUKAKOCJV-VQTJNVASSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CC[C@@H]3C[N@H+](C4CCCCC4)CC[C@H]3C2)cc1 ZINC001257466747 1063291346 /nfs/dbraw/zinc/29/13/46/1063291346.db2.gz PAQWTKUKAKOCJV-VQTJNVASSA-N 2 1 312.501 4.163 20 0 DIADMP CCC[C@@H](C)CC[C@@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257476161 1063297048 /nfs/dbraw/zinc/29/70/48/1063297048.db2.gz OFYROPWURCUNOP-NCXUSEDFSA-N 2 1 324.553 4.342 20 0 DIADMP CCCCC[C@@H](C)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257506650 1063317301 /nfs/dbraw/zinc/31/73/01/1063317301.db2.gz REIUWBNYDQFXBO-ZHALLVOQSA-N 2 1 303.494 4.122 20 0 DIADMP CC(C)OC1CCC([N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001257876910 1063418223 /nfs/dbraw/zinc/41/82/23/1063418223.db2.gz QMEOVOGPDZSJND-CAAWEGIDSA-N 2 1 322.537 4.237 20 0 DIADMP CC(C)OC1CCC([N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)CC1 ZINC001257882729 1063422066 /nfs/dbraw/zinc/42/20/66/1063422066.db2.gz YXDQNWOMZJVBBG-XEVCZEQESA-N 2 1 322.537 4.063 20 0 DIADMP CCC[N@@H+](CCC[NH+]1CCCCC1)[C@H]1CCc2ccccc21 ZINC001473125747 1063428825 /nfs/dbraw/zinc/42/88/25/1063428825.db2.gz UXKDEGNXWUQUCR-FQEVSTJZSA-N 2 1 300.490 4.262 20 0 DIADMP CCC(CC)C[NH2+]CC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001461356245 1063439942 /nfs/dbraw/zinc/43/99/42/1063439942.db2.gz FZEYKRHQVKWBLH-FXAWDEMLSA-N 2 1 302.506 4.313 20 0 DIADMP C[NH+](C)[C@H]1CCCC[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC001257993590 1063452809 /nfs/dbraw/zinc/45/28/09/1063452809.db2.gz SZBPKYWRHHJBMS-GUMHCPJTSA-N 2 1 300.490 4.175 20 0 DIADMP FCc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001473148133 1063453414 /nfs/dbraw/zinc/45/34/14/1063453414.db2.gz NYBPWBIFLHDGAL-FQEVSTJZSA-N 2 1 318.480 4.244 20 0 DIADMP FCc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC001473148133 1063453419 /nfs/dbraw/zinc/45/34/19/1063453419.db2.gz NYBPWBIFLHDGAL-FQEVSTJZSA-N 2 1 318.480 4.244 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+](Cc2ccccc2)C(C)(C)C)CC1 ZINC001258012401 1063463588 /nfs/dbraw/zinc/46/35/88/1063463588.db2.gz WLSXXQDPYNZGMC-UHFFFAOYSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)c1cccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC001473176347 1063481379 /nfs/dbraw/zinc/48/13/79/1063481379.db2.gz VEMWRYPOTVKSFT-HXUWFJFHSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)C[C@@H](C)C[C@@H](C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258062908 1063491349 /nfs/dbraw/zinc/49/13/49/1063491349.db2.gz QRSDBKTXZYYHQP-NCXUSEDFSA-N 2 1 324.553 4.198 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258085444 1063509291 /nfs/dbraw/zinc/50/92/91/1063509291.db2.gz KCOOEWDVHRSNPJ-MRXNPFEDSA-N 2 1 304.453 4.210 20 0 DIADMP CC(C)=CCC[C@H](C)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258088374 1063510108 /nfs/dbraw/zinc/51/01/08/1063510108.db2.gz SFOUYIWYXVWTJX-BJLQDIEVSA-N 2 1 315.505 4.288 20 0 DIADMP CC(C)=CCC[C@@H](C)[N@@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258088376 1063510310 /nfs/dbraw/zinc/51/03/10/1063510310.db2.gz SFOUYIWYXVWTJX-QWFCFKBJSA-N 2 1 315.505 4.288 20 0 DIADMP CC(C)=CCC[C@H](C)[N@@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258093618 1063514106 /nfs/dbraw/zinc/51/41/06/1063514106.db2.gz SIEQYLXFCLTKGP-ZWKOTPCHSA-N 2 1 322.537 4.133 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH+]1CCC2(CCn3c(C)c[nH+]c32)CC1 ZINC001258092546 1063515130 /nfs/dbraw/zinc/51/51/30/1063515130.db2.gz IVVCZOOKHRNMCL-MRXNPFEDSA-N 2 1 301.478 4.064 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H](C[NH2+]C3CCC4(CCC4)CC3)C2)cc1 ZINC001461459719 1063520836 /nfs/dbraw/zinc/52/08/36/1063520836.db2.gz IAENZCQURJCJDB-IBGZPJMESA-N 2 1 312.501 4.211 20 0 DIADMP CCCC[N@H+](CCC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258146467 1063531214 /nfs/dbraw/zinc/53/12/14/1063531214.db2.gz YSHDPERJOFWKFK-UHFFFAOYSA-N 2 1 302.506 4.206 20 0 DIADMP CCCC[N@@H+](CCC)C1CC[NH+](CCc2ccccc2)CC1 ZINC001258146467 1063531226 /nfs/dbraw/zinc/53/12/26/1063531226.db2.gz YSHDPERJOFWKFK-UHFFFAOYSA-N 2 1 302.506 4.206 20 0 DIADMP c1ccc(CC[NH+]2CCC([N@@H+]3CCC34CCCCC4)CC2)cc1 ZINC001258144686 1063531759 /nfs/dbraw/zinc/53/17/59/1063531759.db2.gz UHIYSEXDKVYIFY-UHFFFAOYSA-N 2 1 312.501 4.102 20 0 DIADMP c1ccc(CC[NH+]2CCC([N@H+]3CCC34CCCCC4)CC2)cc1 ZINC001258144686 1063531774 /nfs/dbraw/zinc/53/17/74/1063531774.db2.gz UHIYSEXDKVYIFY-UHFFFAOYSA-N 2 1 312.501 4.102 20 0 DIADMP CCC[C@@H]1CCCC[N@@H+]1C1CC[NH+](CCc2ccccc2)CC1 ZINC001258145846 1063532080 /nfs/dbraw/zinc/53/20/80/1063532080.db2.gz MLMPPPHMTVNVJT-HXUWFJFHSA-N 2 1 314.517 4.348 20 0 DIADMP CCC[C@@H]1CCCC[N@H+]1C1CC[NH+](CCc2ccccc2)CC1 ZINC001258145846 1063532096 /nfs/dbraw/zinc/53/20/96/1063532096.db2.gz MLMPPPHMTVNVJT-HXUWFJFHSA-N 2 1 314.517 4.348 20 0 DIADMP CC(C)C1CC[NH+](C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC001258146952 1063532267 /nfs/dbraw/zinc/53/22/67/1063532267.db2.gz BXEQEQWBGBZCQS-UHFFFAOYSA-N 2 1 314.517 4.062 20 0 DIADMP CSCC[C@H](C)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258209815 1063561991 /nfs/dbraw/zinc/56/19/91/1063561991.db2.gz UUQJPVOQTAATQU-WBAXXEDZSA-N 2 1 324.509 4.039 20 0 DIADMP CSCC[C@@H](C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001258209927 1063562809 /nfs/dbraw/zinc/56/28/09/1063562809.db2.gz XAMSGIVKZUYFPZ-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP CSCC[C@@H](C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001258209927 1063562821 /nfs/dbraw/zinc/56/28/21/1063562821.db2.gz XAMSGIVKZUYFPZ-SJLPKXTDSA-N 2 1 320.546 4.018 20 0 DIADMP CC1(C)CCC[C@H]([N@@H+](Cc2ccncc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258282595 1063586823 /nfs/dbraw/zinc/58/68/23/1063586823.db2.gz ZJICGFNZZAKMDE-FHWLQOOXSA-N 2 1 315.505 4.122 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC001258293989 1063593765 /nfs/dbraw/zinc/59/37/65/1063593765.db2.gz FLNICGACZFEULP-HZPDHXFCSA-N 2 1 324.534 4.001 20 0 DIADMP CC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)CC(C)(C)SCc1ccco1 ZINC001258298064 1063594785 /nfs/dbraw/zinc/59/47/85/1063594785.db2.gz KBFPOPWDYMRDRO-HOTGVXAUSA-N 2 1 324.534 4.144 20 0 DIADMP CC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)CC(C)(C)SCc1ccco1 ZINC001258298064 1063594795 /nfs/dbraw/zinc/59/47/95/1063594795.db2.gz KBFPOPWDYMRDRO-HOTGVXAUSA-N 2 1 324.534 4.144 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1CCN(C)CC1 ZINC001258304373 1063600457 /nfs/dbraw/zinc/60/04/57/1063600457.db2.gz HONYFQRIDQLPGD-HNNXBMFYSA-N 2 1 324.534 4.096 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@H+](C)C1CC[NH+](C)CC1 ZINC001258304373 1063600464 /nfs/dbraw/zinc/60/04/64/1063600464.db2.gz HONYFQRIDQLPGD-HNNXBMFYSA-N 2 1 324.534 4.096 20 0 DIADMP C[C@@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C1CC[NH+](C)CC1 ZINC001258304373 1063600469 /nfs/dbraw/zinc/60/04/69/1063600469.db2.gz HONYFQRIDQLPGD-HNNXBMFYSA-N 2 1 324.534 4.096 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H](C)CC(C)(C)SC)CC1 ZINC001258349586 1063620026 /nfs/dbraw/zinc/62/00/26/1063620026.db2.gz NUVWBYSSJYJPDE-OAHLLOKOSA-N 2 1 300.556 4.103 20 0 DIADMP CCCCC(CCCC)[NH+]1CCC([N@@H+](CC)[C@H]2CCOC2)CC1 ZINC001258387092 1063630254 /nfs/dbraw/zinc/63/02/54/1063630254.db2.gz CYFTYEZGYMWUDU-FQEVSTJZSA-N 2 1 324.553 4.311 20 0 DIADMP C([NH2+]C1CCC2(CCCC2)CC1)[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001461664386 1063645388 /nfs/dbraw/zinc/64/53/88/1063645388.db2.gz QKBVMJKOMPXZTF-SFHVURJKSA-N 2 1 304.522 4.201 20 0 DIADMP c1ccc(C[C@@]2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)C=CCCC2)cc1 ZINC001461688178 1063657819 /nfs/dbraw/zinc/65/78/19/1063657819.db2.gz VKCCGNVGYMEWIA-YPAWHYETSA-N 2 1 324.512 4.172 20 0 DIADMP C[C@H](CC1CC1)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258453619 1063661141 /nfs/dbraw/zinc/66/11/41/1063661141.db2.gz SSVHTDHHXHLTHQ-NIKGAXFTSA-N 2 1 304.453 4.086 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258598646 1063701614 /nfs/dbraw/zinc/70/16/14/1063701614.db2.gz VYZIEEYRVKQRPU-KZNAEPCWSA-N 2 1 318.480 4.476 20 0 DIADMP CC1(C)CC[C@@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258598461 1063702669 /nfs/dbraw/zinc/70/26/69/1063702669.db2.gz SUFAMWNCALHYGD-GUDVDZBRSA-N 2 1 318.480 4.476 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258653321 1063725760 /nfs/dbraw/zinc/72/57/60/1063725760.db2.gz OUZDXRINQKPCSF-ACRUOGEOSA-N 2 1 314.517 4.380 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC(C)(C)C1 ZINC001258691692 1063754823 /nfs/dbraw/zinc/75/48/23/1063754823.db2.gz HFMBENMWRCCZRV-JKSUJKDBSA-N 2 1 318.480 4.290 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC(C)(C)C1 ZINC001258691691 1063755014 /nfs/dbraw/zinc/75/50/14/1063755014.db2.gz HFMBENMWRCCZRV-HZPDHXFCSA-N 2 1 318.480 4.290 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001258706304 1063763723 /nfs/dbraw/zinc/76/37/23/1063763723.db2.gz QGIQMIYEVLBPFP-BURNTYAHSA-N 2 1 314.517 4.393 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001258706304 1063763726 /nfs/dbraw/zinc/76/37/26/1063763726.db2.gz QGIQMIYEVLBPFP-BURNTYAHSA-N 2 1 314.517 4.393 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[NH+]1CCC([N@@H+](C)CC)CC1 ZINC001258711381 1063767784 /nfs/dbraw/zinc/76/77/84/1063767784.db2.gz AELHKMWFHVKQJX-FQEVSTJZSA-N 2 1 302.506 4.204 20 0 DIADMP CC[C@H]1C[N@@H+](CC2CC[NH+](CC)CC2)CC[C@@H]1c1ccccc1 ZINC001461880562 1063770054 /nfs/dbraw/zinc/77/00/54/1063770054.db2.gz JVQGKPGJZXIHDX-FPOVZHCZSA-N 2 1 314.517 4.234 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[NH2+]CCC[N@H+]1CCCC[C@@H]1C ZINC001258738396 1063786424 /nfs/dbraw/zinc/78/64/24/1063786424.db2.gz RGCNVMOIKCQHJF-CVEARBPZSA-N 2 1 308.897 4.125 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC001258738398 1063787461 /nfs/dbraw/zinc/78/74/61/1063787461.db2.gz RGCNVMOIKCQHJF-HZPDHXFCSA-N 2 1 308.897 4.125 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001258741616 1063791025 /nfs/dbraw/zinc/79/10/25/1063791025.db2.gz NBARULUTZGJBOB-CRAIPNDOSA-N 2 1 320.908 4.268 20 0 DIADMP C[C@H](Cc1cccc(Cl)c1)[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001258741616 1063791033 /nfs/dbraw/zinc/79/10/33/1063791033.db2.gz NBARULUTZGJBOB-CRAIPNDOSA-N 2 1 320.908 4.268 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1cccc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258741608 1063791694 /nfs/dbraw/zinc/79/16/94/1063791694.db2.gz MYTDVHHXZXERRL-ZTFGCOKTSA-N 2 1 308.897 4.251 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H](C)Cc2cccc(Cl)c2)CC1 ZINC001258753575 1063800906 /nfs/dbraw/zinc/80/09/06/1063800906.db2.gz MIVNWPFUUKNPHG-INIZCTEOSA-N 2 1 322.924 4.467 20 0 DIADMP CCCC[C@H](CCC)[N@@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001258762535 1063806799 /nfs/dbraw/zinc/80/67/99/1063806799.db2.gz YHBDCVYBULPPLQ-ROUUACIJSA-N 2 1 324.553 4.357 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001258774581 1063816298 /nfs/dbraw/zinc/81/62/98/1063816298.db2.gz SKKNBYQDGVDNLD-LJQANCHMSA-N 2 1 304.453 4.227 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCCC[C@@H]2c2ccccc2F)CC1 ZINC001258774581 1063816305 /nfs/dbraw/zinc/81/63/05/1063816305.db2.gz SKKNBYQDGVDNLD-LJQANCHMSA-N 2 1 304.453 4.227 20 0 DIADMP CCC[NH+]1CCC([NH+]2CCC(c3ccccc3Cl)CC2)CC1 ZINC001258775891 1063817581 /nfs/dbraw/zinc/81/75/81/1063817581.db2.gz ISBPERVJJAFJKG-UHFFFAOYSA-N 2 1 320.908 4.394 20 0 DIADMP CC[C@@H](C)C[C@H](CC)[NH+]1CCC([NH3+])(c2cccc(F)c2)CC1 ZINC001258784706 1063820792 /nfs/dbraw/zinc/82/07/92/1063820792.db2.gz BIVLKXKLZLCOCM-QAPCUYQASA-N 2 1 306.469 4.290 20 0 DIADMP CC[C@H](C)C[C@H](CC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258785119 1063821347 /nfs/dbraw/zinc/82/13/47/1063821347.db2.gz DTZVLPROYSFBIM-IRXDYDNUSA-N 2 1 318.505 4.160 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[N@@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258785871 1063824251 /nfs/dbraw/zinc/82/42/51/1063824251.db2.gz JNSTXIVMDFMNGE-VBSBHUPXSA-N 2 1 317.521 4.368 20 0 DIADMP CC(C)C1CCC([NH+]2CCC([NH3+])(c3ccccc3F)CC2)CC1 ZINC001258802754 1063836980 /nfs/dbraw/zinc/83/69/80/1063836980.db2.gz YYWGLVYEUGZZAQ-UHFFFAOYSA-N 2 1 318.480 4.290 20 0 DIADMP C[C@H]1CCC[C@@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C1 ZINC001258813989 1063843754 /nfs/dbraw/zinc/84/37/54/1063843754.db2.gz SRJMWEACVRRFRK-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCC[C@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814391 1063844468 /nfs/dbraw/zinc/84/44/68/1063844468.db2.gz OSDDWADHKFHWSY-AFYVEPGGSA-N 2 1 300.490 4.337 20 0 DIADMP C[C@H]1CCC[C@H]([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258814399 1063845893 /nfs/dbraw/zinc/84/58/93/1063845893.db2.gz OSDDWADHKFHWSY-LEAZDLGRSA-N 2 1 300.490 4.337 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828387 1063853124 /nfs/dbraw/zinc/85/31/24/1063853124.db2.gz MHJXQTRMDVJHFO-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828387 1063853134 /nfs/dbraw/zinc/85/31/34/1063853134.db2.gz MHJXQTRMDVJHFO-UZLBHIALSA-N 2 1 318.480 4.301 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@@H+](C)CC1CC[NH+](C(C)C)CC1 ZINC001258849989 1063867716 /nfs/dbraw/zinc/86/77/16/1063867716.db2.gz YIABLJKPXOGEPG-FQEVSTJZSA-N 2 1 302.506 4.060 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]1CCF ZINC000556857294 1063899790 /nfs/dbraw/zinc/89/97/90/1063899790.db2.gz RMPRZGTWDQBWAE-QFBILLFUSA-N 2 1 306.469 4.145 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001462079485 1063918748 /nfs/dbraw/zinc/91/87/48/1063918748.db2.gz JKCFAMXTCNIPBM-ICSRJNTNSA-N 2 1 314.517 4.089 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](Cc2ccccc2)c2ccccc2)CC1 ZINC000378895595 1063979325 /nfs/dbraw/zinc/97/93/25/1063979325.db2.gz ABHZUSSPNFUOMP-OAQYLSRUSA-N 2 1 308.469 4.044 20 0 DIADMP C[C@@H](CC[NH2+]Cc1cc(Cl)cs1)[N@H+](C)Cc1ccccc1 ZINC000379630252 1063984480 /nfs/dbraw/zinc/98/44/80/1063984480.db2.gz PHHAUJJOERKOHO-AWEZNQCLSA-N 2 1 322.905 4.402 20 0 DIADMP C[C@@H](CC[NH2+]Cc1cc(Cl)cs1)[N@@H+](C)Cc1ccccc1 ZINC000379630252 1063984487 /nfs/dbraw/zinc/98/44/87/1063984487.db2.gz PHHAUJJOERKOHO-AWEZNQCLSA-N 2 1 322.905 4.402 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379637610 1063984864 /nfs/dbraw/zinc/98/48/64/1063984864.db2.gz SPAFRROPEFXBAH-WRJHFWDFSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379637610 1063984870 /nfs/dbraw/zinc/98/48/70/1063984870.db2.gz SPAFRROPEFXBAH-WRJHFWDFSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H](C)C1 ZINC000379632391 1063985000 /nfs/dbraw/zinc/98/50/00/1063985000.db2.gz NQKVKYIFRKAUTL-QIYLELGZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H](C)C1 ZINC000379632391 1063985003 /nfs/dbraw/zinc/98/50/03/1063985003.db2.gz NQKVKYIFRKAUTL-QIYLELGZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H]1C ZINC000379621916 1063985516 /nfs/dbraw/zinc/98/55/16/1063985516.db2.gz GBZYUWOCJHAGJQ-MTFRMWQMSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C[C@@H]1C ZINC000379621916 1063985525 /nfs/dbraw/zinc/98/55/25/1063985525.db2.gz GBZYUWOCJHAGJQ-MTFRMWQMSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C[C@@H]1C ZINC000381025452 1063990335 /nfs/dbraw/zinc/99/03/35/1063990335.db2.gz XVOOBYVOOULOAO-ZFMNYDKASA-N 2 1 314.517 4.313 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000381776093 1063992799 /nfs/dbraw/zinc/99/27/99/1063992799.db2.gz CYABKXIPQZSVFI-OHEMXVPPSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000381810948 1063993615 /nfs/dbraw/zinc/99/36/15/1063993615.db2.gz ZSOFQPQFINGWNB-SDZDHKAXSA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H](CC(C)(C)C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000384523715 1064005804 /nfs/dbraw/zinc/00/58/04/1064005804.db2.gz XRZCOJWHKOEXFE-KRWDZBQOSA-N 2 1 302.506 4.108 20 0 DIADMP CC(C)CCC[C@H](C)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000390239514 1064151684 /nfs/dbraw/zinc/15/16/84/1064151684.db2.gz BMEVIVSDZRACCN-IBGZPJMESA-N 2 1 316.533 4.498 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390615982 1064165663 /nfs/dbraw/zinc/16/56/63/1064165663.db2.gz YDNKPGOSVRKXII-YLJYHZDGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H](CC1CCC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390615982 1064165670 /nfs/dbraw/zinc/16/56/70/1064165670.db2.gz YDNKPGOSVRKXII-YLJYHZDGSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc2c(c1)CCCC2 ZINC000390848069 1064171347 /nfs/dbraw/zinc/17/13/47/1064171347.db2.gz CBRPBKQNKPAJLX-YOYVGRRSSA-N 2 1 312.501 4.231 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc2c(c1)CCCC2 ZINC000390848069 1064171349 /nfs/dbraw/zinc/17/13/49/1064171349.db2.gz CBRPBKQNKPAJLX-YOYVGRRSSA-N 2 1 312.501 4.231 20 0 DIADMP C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1CCC[NH2+]CC1 ZINC000391442020 1064189385 /nfs/dbraw/zinc/18/93/85/1064189385.db2.gz WHVMEWCZKFCOQL-GOSISDBHSA-N 2 1 310.441 4.053 20 0 DIADMP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(-c2ccccc2)c1 ZINC001279274470 1064339794 /nfs/dbraw/zinc/33/97/94/1064339794.db2.gz BPHUMJVUILKDSD-SEJPIABJSA-N 2 1 306.453 4.068 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[NH+]2CC3(C2)CC[N@@H+](C)C3)CC1 ZINC001279472975 1064350892 /nfs/dbraw/zinc/35/08/92/1064350892.db2.gz RMEPXWHUAXOGAS-LJQANCHMSA-N 2 1 302.506 4.097 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[NH+]2CC3(C2)CC[N@H+](C)C3)CC1 ZINC001279472975 1064350901 /nfs/dbraw/zinc/35/09/01/1064350901.db2.gz RMEPXWHUAXOGAS-LJQANCHMSA-N 2 1 302.506 4.097 20 0 DIADMP Cc1ccc(C[NH+]2CCC3(CC[N@H+](C)C3)CC2)c2ccccc12 ZINC001279444741 1064351041 /nfs/dbraw/zinc/35/10/41/1064351041.db2.gz ZQEJBNWBAPZHBB-UHFFFAOYSA-N 2 1 308.469 4.066 20 0 DIADMP c1c[nH]c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CCCC2CCCC2)c1 ZINC001279477859 1064351901 /nfs/dbraw/zinc/35/19/01/1064351901.db2.gz HJXLKZFTNUUEMQ-IHWFROFDSA-N 2 1 315.505 4.070 20 0 DIADMP C[N@H+]1CCC[C@@]2(CCC[NH+](CCCc3ccc(Cl)cc3)C2)C1 ZINC001279631857 1064362166 /nfs/dbraw/zinc/36/21/66/1064362166.db2.gz GEMFMEGFUXRGCG-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CCC[N@H+](CCCc3ccc(Cl)cc3)C2)C1 ZINC001279631857 1064362175 /nfs/dbraw/zinc/36/21/75/1064362175.db2.gz GEMFMEGFUXRGCG-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[NH+]1CCC[C@@]2(CCC[N@@H+](CCCc3ccc(Cl)cc3)C2)C1 ZINC001279631857 1064362184 /nfs/dbraw/zinc/36/21/84/1064362184.db2.gz GEMFMEGFUXRGCG-LJQANCHMSA-N 2 1 320.908 4.080 20 0 DIADMP C[N@H+]1CCCC2(CC[NH+](Cc3ccc4cccccc3-4)CC2)C1 ZINC001279693804 1064364876 /nfs/dbraw/zinc/36/48/76/1064364876.db2.gz NAGITQUBKVHGBW-UHFFFAOYSA-N 2 1 308.469 4.099 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCC2(C1)CC[NH+](CCOCC)CC2 ZINC001280150762 1064381496 /nfs/dbraw/zinc/38/14/96/1064381496.db2.gz DOGFKALLSGVCQW-IBGZPJMESA-N 2 1 324.553 4.027 20 0 DIADMP Fc1ccc(C2([NH2+][C@H]3CC[NH2+][C@H](c4ccccc4)C3)CCC2)cc1 ZINC000643467823 1064411940 /nfs/dbraw/zinc/41/19/40/1064411940.db2.gz VTKDBAQBGQHABF-PMACEKPBSA-N 2 1 324.443 4.288 20 0 DIADMP C[NH+](Cc1ccccc1)C[C@@H](C[N@H+](C)CC1CC1)c1ccccc1 ZINC001307421961 1065382651 /nfs/dbraw/zinc/38/26/51/1065382651.db2.gz LFGZDEAUFKWFFD-QFIPXVFZSA-N 2 1 322.496 4.244 20 0 DIADMP C[NH+](C[C@H](C[N@H+](C)Cc1ccccc1)c1ccccc1)CC1CC1 ZINC001307421961 1065382657 /nfs/dbraw/zinc/38/26/57/1065382657.db2.gz LFGZDEAUFKWFFD-QFIPXVFZSA-N 2 1 322.496 4.244 20 0 DIADMP C[NH+](C[C@H](C[N@@H+](C)Cc1ccccc1)c1ccccc1)CC1CC1 ZINC001307421961 1065382664 /nfs/dbraw/zinc/38/26/64/1065382664.db2.gz LFGZDEAUFKWFFD-QFIPXVFZSA-N 2 1 322.496 4.244 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC001307516616 1065454695 /nfs/dbraw/zinc/45/46/95/1065454695.db2.gz KGBGRFNLTMDQRE-MJGOQNOKSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC001307516616 1065454708 /nfs/dbraw/zinc/45/47/08/1065454708.db2.gz KGBGRFNLTMDQRE-MJGOQNOKSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c1 ZINC001307516616 1065454714 /nfs/dbraw/zinc/45/47/14/1065454714.db2.gz KGBGRFNLTMDQRE-MJGOQNOKSA-N 2 1 310.485 4.371 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c1 ZINC001307516616 1065454721 /nfs/dbraw/zinc/45/47/21/1065454721.db2.gz KGBGRFNLTMDQRE-MJGOQNOKSA-N 2 1 310.485 4.371 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001307593430 1065505149 /nfs/dbraw/zinc/50/51/49/1065505149.db2.gz ZDYDRGDKUFKUNI-CTNGQTDRSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001307593430 1065505156 /nfs/dbraw/zinc/50/51/56/1065505156.db2.gz ZDYDRGDKUFKUNI-CTNGQTDRSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001307593430 1065505167 /nfs/dbraw/zinc/50/51/67/1065505167.db2.gz ZDYDRGDKUFKUNI-CTNGQTDRSA-N 2 1 312.501 4.088 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCCC[C@H]1CCCc1ccccc1 ZINC001307601776 1065510613 /nfs/dbraw/zinc/51/06/13/1065510613.db2.gz ABVWBSZXSVSNOI-SFTDATJTSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@@H+]1CCCC[C@H]1CCCc1ccccc1 ZINC001307601776 1065510621 /nfs/dbraw/zinc/51/06/21/1065510621.db2.gz ABVWBSZXSVSNOI-SFTDATJTSA-N 2 1 314.517 4.348 20 0 DIADMP C[NH+]1CCC[C@H]1CC[N@H+]1CCCC[C@H]1CCCc1ccccc1 ZINC001307601776 1065510632 /nfs/dbraw/zinc/51/06/32/1065510632.db2.gz ABVWBSZXSVSNOI-SFTDATJTSA-N 2 1 314.517 4.348 20 0 DIADMP Cc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670208 1065553628 /nfs/dbraw/zinc/55/36/28/1065553628.db2.gz QKMJEUAGTWHYLI-WBVHZDCISA-N 2 1 320.908 4.391 20 0 DIADMP Cc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(Cl)c1 ZINC001307670208 1065553642 /nfs/dbraw/zinc/55/36/42/1065553642.db2.gz QKMJEUAGTWHYLI-WBVHZDCISA-N 2 1 320.908 4.391 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)C1c2ccccc2-c2ccccc21 ZINC001307726808 1065588534 /nfs/dbraw/zinc/58/85/34/1065588534.db2.gz ZFUKHMZYHGLPEU-UHFFFAOYSA-N 2 1 306.453 4.174 20 0 DIADMP CCC(C)(C)[N@@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001307739379 1065596667 /nfs/dbraw/zinc/59/66/67/1065596667.db2.gz ZSMVRQBBFXVXBR-UHFFFAOYSA-N 2 1 316.533 4.452 20 0 DIADMP CCCCC[NH+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001308007527 1065721912 /nfs/dbraw/zinc/72/19/12/1065721912.db2.gz HTSCGQNPHKBXFG-PMACEKPBSA-N 2 1 300.490 4.021 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](CCc1ccccc1)CCC(C)(C)C ZINC001308031232 1065733838 /nfs/dbraw/zinc/73/38/38/1065733838.db2.gz BMEIORAFSPNETQ-HXUWFJFHSA-N 2 1 316.533 4.452 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](CCc1ccccc1)CCC(C)(C)C ZINC001308031232 1065733845 /nfs/dbraw/zinc/73/38/45/1065733845.db2.gz BMEIORAFSPNETQ-HXUWFJFHSA-N 2 1 316.533 4.452 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](CCc1ccccc1)CCC(C)(C)C ZINC001308031232 1065733852 /nfs/dbraw/zinc/73/38/52/1065733852.db2.gz BMEIORAFSPNETQ-HXUWFJFHSA-N 2 1 316.533 4.452 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)[C@H]1CCCc2ccccc21 ZINC001308037599 1065734853 /nfs/dbraw/zinc/73/48/53/1065734853.db2.gz DMVDHZLTYPFZGY-FQEVSTJZSA-N 2 1 300.490 4.262 20 0 DIADMP CCc1ccccc1C[NH+]1CCC(C)([NH+]2CCCCC2)CC1 ZINC001308055658 1065745407 /nfs/dbraw/zinc/74/54/07/1065745407.db2.gz CGVYAFILHQGGFS-UHFFFAOYSA-N 2 1 300.490 4.089 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC001308181524 1065790973 /nfs/dbraw/zinc/79/09/73/1065790973.db2.gz WQVOLCKUQOBQCI-UHFFFAOYSA-N 2 1 322.440 4.369 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)CC1 ZINC001308180457 1065791240 /nfs/dbraw/zinc/79/12/40/1065791240.db2.gz IHBYERDQERCGDZ-QUCCMNQESA-N 2 1 300.490 4.177 20 0 DIADMP CC[NH+](CC)[C@H](C[NH2+]C[C@@H]1C[C@H]1c1ccccc1)CC(C)C ZINC001308194343 1065804972 /nfs/dbraw/zinc/80/49/72/1065804972.db2.gz VWCJBYOGOOQKQP-UFYCRDLUSA-N 2 1 302.506 4.136 20 0 DIADMP CCC(CC)C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC001308198745 1065806569 /nfs/dbraw/zinc/80/65/69/1065806569.db2.gz BAXNBJPIFYHKFD-KRWDZBQOSA-N 2 1 302.506 4.444 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C\c1cccc(F)c1 ZINC001308203144 1065811053 /nfs/dbraw/zinc/81/10/53/1065811053.db2.gz LZLUALMKAIGBIZ-CGQZWFTASA-N 2 1 304.453 4.083 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]C/C=C\c2ccccc2)C1 ZINC001308203715 1065812282 /nfs/dbraw/zinc/81/22/82/1065812282.db2.gz IGDCNRFTKILGGI-SPCXEMBUSA-N 2 1 300.490 4.048 20 0 DIADMP CCCc1cccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001308203769 1065812727 /nfs/dbraw/zinc/81/27/27/1065812727.db2.gz KKELYCROFSCMQA-KDURUIRLSA-N 2 1 316.533 4.487 20 0 DIADMP C[C@@H]1CCC[C@@](C[NH2+]CC(C)(C)c2ccccc2)([NH+](C)C)C1 ZINC001308219104 1065826268 /nfs/dbraw/zinc/82/62/68/1065826268.db2.gz QVNCDYUQUMMBDP-YLJYHZDGSA-N 2 1 302.506 4.064 20 0 DIADMP CCCC[N@@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC001308255229 1065858226 /nfs/dbraw/zinc/85/82/26/1065858226.db2.gz WPFAJOMBFPITOL-RTBURBONSA-N 2 1 322.537 4.113 20 0 DIADMP CCCC[N@H+]1CCCC[C@@H]1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC001308255229 1065858238 /nfs/dbraw/zinc/85/82/38/1065858238.db2.gz WPFAJOMBFPITOL-RTBURBONSA-N 2 1 322.537 4.113 20 0 DIADMP C[C@H]([NH2+]C1(C[NH2+][C@@H]2CCC[C@@H]2C)CCCC1)c1ccccc1 ZINC001308278583 1065878875 /nfs/dbraw/zinc/87/88/75/1065878875.db2.gz DOCNEVGLKIIFDQ-JENIJYKNSA-N 2 1 300.490 4.428 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)cc1 ZINC001308283014 1065880906 /nfs/dbraw/zinc/88/09/06/1065880906.db2.gz QVXCVPLRIFOERQ-MJGOQNOKSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cc1 ZINC001308283014 1065880918 /nfs/dbraw/zinc/88/09/18/1065880918.db2.gz QVXCVPLRIFOERQ-MJGOQNOKSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC001308389588 1065957509 /nfs/dbraw/zinc/95/75/09/1065957509.db2.gz JITWBZSOLYDCBJ-UHFFFAOYSA-N 2 1 306.494 4.097 20 0 DIADMP Cc1ccc(-c2ccc(C[NH2+]CC[C@@H]3CCC[N@H+](C)C3)o2)cc1 ZINC001308433303 1065985437 /nfs/dbraw/zinc/98/54/37/1065985437.db2.gz USKXLKQAYRZTKW-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP C[C@@H](CC[NH2+]Cc1ccc(Sc2ccccc2)cc1)[NH+](C)C ZINC001308478926 1066018662 /nfs/dbraw/zinc/01/86/62/1066018662.db2.gz LRVXKHJQHUROTD-INIZCTEOSA-N 2 1 314.498 4.268 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@@H+]2C2CCCCCC2)c(C)c1 ZINC001308491820 1066024772 /nfs/dbraw/zinc/02/47/72/1066024772.db2.gz ACXPMYDXIHQQEV-HXUWFJFHSA-N 2 1 314.517 4.499 20 0 DIADMP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@H+]2C2CCCCCC2)c(C)c1 ZINC001308491820 1066024782 /nfs/dbraw/zinc/02/47/82/1066024782.db2.gz ACXPMYDXIHQQEV-HXUWFJFHSA-N 2 1 314.517 4.499 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559480 1066071025 /nfs/dbraw/zinc/07/10/25/1066071025.db2.gz CRKOZJIJYCRVND-AQWUKCDYSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559480 1066071034 /nfs/dbraw/zinc/07/10/34/1066071034.db2.gz CRKOZJIJYCRVND-AQWUKCDYSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559480 1066071041 /nfs/dbraw/zinc/07/10/41/1066071041.db2.gz CRKOZJIJYCRVND-AQWUKCDYSA-N 2 1 314.517 4.289 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C/C=C\c2c(C)cc(C)cc2C)C1 ZINC001308559480 1066071054 /nfs/dbraw/zinc/07/10/54/1066071054.db2.gz CRKOZJIJYCRVND-AQWUKCDYSA-N 2 1 314.517 4.289 20 0 DIADMP CC(C)c1ccc(CC[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC001308564043 1066072813 /nfs/dbraw/zinc/07/28/13/1066072813.db2.gz GUJMQLGQQWNXKC-HXUWFJFHSA-N 2 1 314.517 4.160 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562132 1066072896 /nfs/dbraw/zinc/07/28/96/1066072896.db2.gz BOWIDGFSEXIOGQ-PXDRNWIDSA-N 2 1 312.501 4.043 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(C)c1 ZINC001308562132 1066072907 /nfs/dbraw/zinc/07/29/07/1066072907.db2.gz BOWIDGFSEXIOGQ-PXDRNWIDSA-N 2 1 312.501 4.043 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(CC3CCC3)c2)[C@@H](C)C1 ZINC001308567729 1066078844 /nfs/dbraw/zinc/07/88/44/1066078844.db2.gz KLEJUFXXJDBNER-LAUBAEHRSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(CC3CCC3)c2)[C@@H](C)C1 ZINC001308567729 1066078853 /nfs/dbraw/zinc/07/88/53/1066078853.db2.gz KLEJUFXXJDBNER-LAUBAEHRSA-N 2 1 314.517 4.191 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(CC3CCC3)c2)[C@@H](C)C1 ZINC001308567729 1066078865 /nfs/dbraw/zinc/07/88/65/1066078865.db2.gz KLEJUFXXJDBNER-LAUBAEHRSA-N 2 1 314.517 4.191 20 0 DIADMP CC(C)C1CCC(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)CC1 ZINC001308600280 1066109836 /nfs/dbraw/zinc/10/98/36/1066109836.db2.gz YVRLHUFJMXHFAP-GPJFCIFZSA-N 2 1 306.538 4.113 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)CC1 ZINC001308600280 1066109839 /nfs/dbraw/zinc/10/98/39/1066109839.db2.gz YVRLHUFJMXHFAP-GPJFCIFZSA-N 2 1 306.538 4.113 20 0 DIADMP CC(C)C1CCC(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)CC1 ZINC001308600280 1066109846 /nfs/dbraw/zinc/10/98/46/1066109846.db2.gz YVRLHUFJMXHFAP-GPJFCIFZSA-N 2 1 306.538 4.113 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001308610234 1066116138 /nfs/dbraw/zinc/11/61/38/1066116138.db2.gz IPGPXLRGHSTLRQ-SFHVURJKSA-N 2 1 320.908 4.407 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001308610234 1066116142 /nfs/dbraw/zinc/11/61/42/1066116142.db2.gz IPGPXLRGHSTLRQ-SFHVURJKSA-N 2 1 320.908 4.407 20 0 DIADMP CC1=CC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC001308636141 1066130332 /nfs/dbraw/zinc/13/03/32/1066130332.db2.gz UGQHBTQYYXCXFM-MYGLTJDJSA-N 2 1 324.512 4.376 20 0 DIADMP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]C4CCCCC4)[C@@H]3C2)cc1 ZINC001308636362 1066131716 /nfs/dbraw/zinc/13/17/16/1066131716.db2.gz ZRLGMWZMVCKNMO-CEWLAPEOSA-N 2 1 312.501 4.209 20 0 DIADMP CCCOc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c(C)c1 ZINC001308660906 1066141775 /nfs/dbraw/zinc/14/17/75/1066141775.db2.gz PSNPJAVGDCGZIC-UHFFFAOYSA-N 2 1 318.505 4.088 20 0 DIADMP C[N@H+](CCC[NH+]1CCCC1)Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001308721102 1066198515 /nfs/dbraw/zinc/19/85/15/1066198515.db2.gz ATYFHAMWRVBAIS-UHFFFAOYSA-N 2 1 312.501 4.359 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(C2CC2)c(C2CC2)c1 ZINC001308721102 1066198525 /nfs/dbraw/zinc/19/85/25/1066198525.db2.gz ATYFHAMWRVBAIS-UHFFFAOYSA-N 2 1 312.501 4.359 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccs3)cc2)C1 ZINC001308741857 1066216777 /nfs/dbraw/zinc/21/67/77/1066216777.db2.gz WIPZVQYGGIWFJB-QGZVFWFLSA-N 2 1 314.498 4.235 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747214 1066221349 /nfs/dbraw/zinc/22/13/49/1066221349.db2.gz WDOGUABVXHTWCL-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747214 1066221365 /nfs/dbraw/zinc/22/13/65/1066221365.db2.gz WDOGUABVXHTWCL-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747214 1066221380 /nfs/dbraw/zinc/22/13/80/1066221380.db2.gz WDOGUABVXHTWCL-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccs2)cc1 ZINC001308747214 1066221391 /nfs/dbraw/zinc/22/13/91/1066221391.db2.gz WDOGUABVXHTWCL-YJBOKZPZSA-N 2 1 314.498 4.187 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001308790833 1066266896 /nfs/dbraw/zinc/26/68/96/1066266896.db2.gz AYFNEWVMRVILBX-MISYRCLQSA-N 2 1 302.506 4.423 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001308790833 1066266909 /nfs/dbraw/zinc/26/69/09/1066266909.db2.gz AYFNEWVMRVILBX-MISYRCLQSA-N 2 1 302.506 4.423 20 0 DIADMP CC1(C)CCC[N@@H+]1CC[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001308815520 1066290580 /nfs/dbraw/zinc/29/05/80/1066290580.db2.gz OMIZGKUFEOCKPJ-UHFFFAOYSA-N 2 1 314.517 4.424 20 0 DIADMP CC1(C)CCC[N@H+]1CC[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001308815520 1066290592 /nfs/dbraw/zinc/29/05/92/1066290592.db2.gz OMIZGKUFEOCKPJ-UHFFFAOYSA-N 2 1 314.517 4.424 20 0 DIADMP C[N@H+]1CCCC[C@H](C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)C1 ZINC001308863899 1066345449 /nfs/dbraw/zinc/34/54/49/1066345449.db2.gz ODCOYFDWBVPELX-HOJAQTOUSA-N 2 1 300.490 4.034 20 0 DIADMP C([NH2+][C@@H]1CCCCC12CCCC2)[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308884346 1066366537 /nfs/dbraw/zinc/36/65/37/1066366537.db2.gz PZFJEUJSKGZOGC-RBUKOAKNSA-N 2 1 304.522 4.201 20 0 DIADMP C([NH2+][C@@H]1CCCCC12CCCC2)[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308884347 1066367246 /nfs/dbraw/zinc/36/72/46/1066367246.db2.gz PZFJEUJSKGZOGC-RTBURBONSA-N 2 1 304.522 4.201 20 0 DIADMP Cc1ccc(C[N@@H+](CCCC(C)C)CC2CC[NH+](C)CC2)o1 ZINC001308940479 1066409703 /nfs/dbraw/zinc/40/97/03/1066409703.db2.gz BBEFMMIPIQNBGV-UHFFFAOYSA-N 2 1 306.494 4.168 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](c2ccccc2)C(C)C)cn1 ZINC000091288631 193032054 /nfs/dbraw/zinc/03/20/54/193032054.db2.gz LNLLIFDUCBVVCN-HXUWFJFHSA-N 2 1 320.440 4.063 20 0 DIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1cc(C)ccc1OC ZINC000091728010 193097937 /nfs/dbraw/zinc/09/79/37/193097937.db2.gz DXWCGHLITCULOP-GOSISDBHSA-N 2 1 315.461 4.030 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000274317581 130225762 /nfs/dbraw/zinc/22/57/62/130225762.db2.gz WGPPUYQYOWPDMV-OAHLLOKOSA-N 2 1 315.461 4.110 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000274801375 130263450 /nfs/dbraw/zinc/26/34/50/130263450.db2.gz VINKCKYUBLUOJB-ILXRZTDVSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000274801375 130263454 /nfs/dbraw/zinc/26/34/54/130263454.db2.gz VINKCKYUBLUOJB-ILXRZTDVSA-N 2 1 321.896 4.039 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(Cl)cc1Cl ZINC000275648507 130353225 /nfs/dbraw/zinc/35/32/25/130353225.db2.gz UFMZYAAAFYGALF-RYUDHWBXSA-N 2 1 324.255 4.103 20 0 DIADMP Cc1ccnc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000285846362 131205057 /nfs/dbraw/zinc/20/50/57/131205057.db2.gz XQDPHWGNXOCBNE-QGZVFWFLSA-N 2 1 311.473 4.081 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CCC(C)(F)F)CC1 ZINC000297184979 132003158 /nfs/dbraw/zinc/00/31/58/132003158.db2.gz FBPLWFLZNZJAFO-UHFFFAOYSA-N 2 1 310.432 4.065 20 0 DIADMP Cc1cc(Cl)cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000559295250 332018266 /nfs/dbraw/zinc/01/82/66/332018266.db2.gz VAGWXJZOHCSHBG-DOTOQJQBSA-N 2 1 320.908 4.391 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000130250510 332023564 /nfs/dbraw/zinc/02/35/64/332023564.db2.gz ATAPEOYKROYVEQ-HOCLYGCPSA-N 2 1 324.559 4.385 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000131770268 332033388 /nfs/dbraw/zinc/03/33/88/332033388.db2.gz QMNZLLDTLIIWNG-UXDRXVOSSA-N 2 1 316.489 4.140 20 0 DIADMP CC(C)Oc1ccc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC000131770268 332033390 /nfs/dbraw/zinc/03/33/90/332033390.db2.gz QMNZLLDTLIIWNG-UXDRXVOSSA-N 2 1 316.489 4.140 20 0 DIADMP CCc1oc2ccccc2c1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000131775611 332033495 /nfs/dbraw/zinc/03/34/95/332033495.db2.gz NRZIGDBTABNGRD-MQVJKMGUSA-N 2 1 312.457 4.100 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc21 ZINC000448028900 332201332 /nfs/dbraw/zinc/20/13/32/332201332.db2.gz PIDMDSPQWFXCSJ-UGNRZPKXSA-N 2 1 312.501 4.130 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000394272455 332207532 /nfs/dbraw/zinc/20/75/32/332207532.db2.gz AILNCKUMBOROOZ-IEBWSBKVSA-N 2 1 314.498 4.311 20 0 DIADMP CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H]2C[C@@H](C)[N@@H+](C)C[C@H]2C)c2ccccc21 ZINC000448032716 332270509 /nfs/dbraw/zinc/27/05/09/332270509.db2.gz XKAHFOBOBJBVFU-JPDLMGPVSA-N 2 1 314.517 4.232 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000559735759 332278614 /nfs/dbraw/zinc/27/86/14/332278614.db2.gz NDGZVKYROJPFBV-QMMLZNLJSA-N 2 1 308.469 4.215 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000559735759 332278615 /nfs/dbraw/zinc/27/86/15/332278615.db2.gz NDGZVKYROJPFBV-QMMLZNLJSA-N 2 1 308.469 4.215 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000559735747 332278627 /nfs/dbraw/zinc/27/86/27/332278627.db2.gz NDGZVKYROJPFBV-DUXKGJEZSA-N 2 1 308.469 4.215 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000559735747 332278628 /nfs/dbraw/zinc/27/86/28/332278628.db2.gz NDGZVKYROJPFBV-DUXKGJEZSA-N 2 1 308.469 4.215 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCCC2CCCC2)C[C@@H]1c1ccccc1 ZINC000559737188 332278659 /nfs/dbraw/zinc/27/86/59/332278659.db2.gz VLRMZYCFFJHERZ-VQTJNVASSA-N 2 1 300.490 4.382 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCC2CCCC2)C[C@@H]1c1ccccc1 ZINC000559737188 332278660 /nfs/dbraw/zinc/27/86/60/332278660.db2.gz VLRMZYCFFJHERZ-VQTJNVASSA-N 2 1 300.490 4.382 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2(C)CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000559794456 332282569 /nfs/dbraw/zinc/28/25/69/332282569.db2.gz XLSCFJUSXULQAR-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)CC2(C)CCC2)CC[N@H+]1Cc1ccccc1 ZINC000559794456 332282571 /nfs/dbraw/zinc/28/25/71/332282571.db2.gz XLSCFJUSXULQAR-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794456 332282572 /nfs/dbraw/zinc/28/25/72/332282572.db2.gz XLSCFJUSXULQAR-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)CC2(C)CCC2)CC[NH+]1Cc1ccccc1 ZINC000559794456 332282574 /nfs/dbraw/zinc/28/25/74/332282574.db2.gz XLSCFJUSXULQAR-HKUYNNGSSA-N 2 1 300.490 4.162 20 0 DIADMP Cc1cc[nH+]c(NC2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000560545953 332357001 /nfs/dbraw/zinc/35/70/01/332357001.db2.gz ONKYDLFKGWSRPO-UHFFFAOYSA-N 2 1 309.457 4.245 20 0 DIADMP Cc1cc[nH+]c(NC2CCC([N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000560545953 332357002 /nfs/dbraw/zinc/35/70/02/332357002.db2.gz ONKYDLFKGWSRPO-UHFFFAOYSA-N 2 1 309.457 4.245 20 0 DIADMP CC(C)[C@H](C[NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000560579483 332363937 /nfs/dbraw/zinc/36/39/37/332363937.db2.gz ABHYXGQQHGZHFU-JLSDUUJJSA-N 2 1 308.897 4.152 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cccc(-c2ccncc2)c1 ZINC000119736049 332377191 /nfs/dbraw/zinc/37/71/91/332377191.db2.gz BTMDRUSHOSLXIN-MRXNPFEDSA-N 2 1 321.468 4.026 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000583388825 332381137 /nfs/dbraw/zinc/38/11/37/332381137.db2.gz FBZAYHLOKWKWKC-GOSISDBHSA-N 2 1 317.452 4.259 20 0 DIADMP CC1(C)CC([NH2+]Cc2c(Cl)oc3ccccc32)CC(C)(C)[NH2+]1 ZINC000317849097 332395021 /nfs/dbraw/zinc/39/50/21/332395021.db2.gz YTVBCPWOPRIBGK-UHFFFAOYSA-N 2 1 320.864 4.485 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000261808209 332395914 /nfs/dbraw/zinc/39/59/14/332395914.db2.gz VMLKIOMPZMWYMZ-WCRBZPEASA-N 2 1 306.453 4.068 20 0 DIADMP CCc1ccc(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)o1 ZINC000151219116 332563206 /nfs/dbraw/zinc/56/32/06/332563206.db2.gz IREOCEDEYZDOJB-AWEZNQCLSA-N 2 1 309.413 4.187 20 0 DIADMP C[C@@H]1C[C@H](C)C[N@H+](CCCC[NH2+]Cc2cc3ccccc3o2)C1 ZINC000518763342 333006028 /nfs/dbraw/zinc/00/60/28/333006028.db2.gz DBKDYJJZESIERU-CALCHBBNSA-N 2 1 314.473 4.281 20 0 DIADMP c1ccc(C[C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000378922292 333064958 /nfs/dbraw/zinc/06/49/58/333064958.db2.gz QBBLDKPBXWYPMK-FSSWDIPSSA-N 2 1 320.480 4.187 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)Cc2ccco2)o1 ZINC000174452481 333086737 /nfs/dbraw/zinc/08/67/37/333086737.db2.gz KGLFWQTULYUNDE-UHFFFAOYSA-N 2 1 324.424 4.103 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](C/C=C\c2ccc(Cl)cc2)CC1 ZINC000526057260 333113836 /nfs/dbraw/zinc/11/38/36/333113836.db2.gz ANCCGOCRUVPUDN-PLNGDYQASA-N 2 1 320.908 4.405 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000323404385 333121751 /nfs/dbraw/zinc/12/17/51/333121751.db2.gz BPDCMZKIOAUYEU-MRXNPFEDSA-N 2 1 305.425 4.209 20 0 DIADMP CC(C)[NH+](CCC[NH2+][C@@H](C)c1nccc2ccccc21)C(C)C ZINC000582032501 333175401 /nfs/dbraw/zinc/17/54/01/333175401.db2.gz LIZIILMTRCJWFZ-KRWDZBQOSA-N 2 1 313.489 4.394 20 0 DIADMP c1cn2c(cccc2C[N@H+]2C[C@@H](c3ccccc3)[C@H]3CCC[C@H]32)n1 ZINC000582089597 333208879 /nfs/dbraw/zinc/20/88/79/333208879.db2.gz MYLDSCWEMCKJSK-HSALFYBXSA-N 2 1 317.436 4.102 20 0 DIADMP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)C1 ZINC000320684158 335123706 /nfs/dbraw/zinc/12/37/06/335123706.db2.gz PHGUAZHIAKMYSN-MSOLQXFVSA-N 2 1 308.469 4.346 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497834949 333298534 /nfs/dbraw/zinc/29/85/34/333298534.db2.gz AZLQIFFBDUNNMR-OXQOHEQNSA-N 2 1 316.464 4.083 20 0 DIADMP CC(C)[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cn1 ZINC000497851904 333301448 /nfs/dbraw/zinc/30/14/48/333301448.db2.gz HPSLGVMAFIIPRM-APWZRJJASA-N 2 1 321.484 4.020 20 0 DIADMP CC[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000390681192 333314738 /nfs/dbraw/zinc/31/47/38/333314738.db2.gz VWRLHOJUUKMUIQ-XICAJGIJSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697166 333315728 /nfs/dbraw/zinc/31/57/28/333315728.db2.gz RYJWPSVBBFUWJL-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C)C1CCC1 ZINC000390697166 333315730 /nfs/dbraw/zinc/31/57/30/333315730.db2.gz RYJWPSVBBFUWJL-VQIMIIECSA-N 2 1 300.490 4.065 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1ccc(Cl)s1)Cc1ccccc1 ZINC000020547397 333362789 /nfs/dbraw/zinc/36/27/89/333362789.db2.gz NERRCVJQGMHCAA-UHFFFAOYSA-N 2 1 308.878 4.013 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1ccc(Cl)s1)Cc1ccccc1 ZINC000020547397 333362790 /nfs/dbraw/zinc/36/27/90/333362790.db2.gz NERRCVJQGMHCAA-UHFFFAOYSA-N 2 1 308.878 4.013 20 0 DIADMP COc1ccc2cc([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)ccc2c1 ZINC000323550594 333388454 /nfs/dbraw/zinc/38/84/54/333388454.db2.gz GUEIGMFXZNRBEJ-MRXNPFEDSA-N 2 1 314.473 4.229 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCC1(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390794906 333394097 /nfs/dbraw/zinc/39/40/97/333394097.db2.gz HRWCHUNBZAMPIY-WDSOQIARSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]CCC1CCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000390801614 333394311 /nfs/dbraw/zinc/39/43/11/333394311.db2.gz PMCRZYSUKQPQLW-PXNSSMCTSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000391364623 333458138 /nfs/dbraw/zinc/45/81/38/333458138.db2.gz METCCEOOONCXTI-WIYYLYMNSA-N 2 1 314.517 4.252 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1nccc2ccccc21 ZINC000563574088 333627151 /nfs/dbraw/zinc/62/71/51/333627151.db2.gz PGHCLWFTQMPGLY-KRWDZBQOSA-N 2 1 311.473 4.007 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000343447447 335165472 /nfs/dbraw/zinc/16/54/72/335165472.db2.gz IORISBXJNNSZBX-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP Cc1ccoc1C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000343447447 335165473 /nfs/dbraw/zinc/16/54/73/335165473.db2.gz IORISBXJNNSZBX-INIZCTEOSA-N 2 1 312.457 4.110 20 0 DIADMP C[C@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000414658081 334059767 /nfs/dbraw/zinc/05/97/67/334059767.db2.gz IXTPBTAIPYJHPO-RDJZCZTQSA-N 2 1 312.482 4.007 20 0 DIADMP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2csc(Cl)c2Cl)cc1 ZINC000414806393 334104406 /nfs/dbraw/zinc/10/44/06/334104406.db2.gz BRHAQDBQLDOYSA-VIFPVBQESA-N 2 1 315.269 4.364 20 0 DIADMP c1c2ccccc2oc1CC[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000415084288 334272608 /nfs/dbraw/zinc/27/26/08/334272608.db2.gz GSRYDECFBGKONR-AZUAARDMSA-N 2 1 320.436 4.058 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)C(C)(C)c1ccccc1 ZINC000415086026 334274603 /nfs/dbraw/zinc/27/46/03/334274603.db2.gz RDVKBQLSJOODOO-WMQCIHAUSA-N 2 1 322.496 4.436 20 0 DIADMP CC(C)(C)c1nc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cs1 ZINC000415045318 334261215 /nfs/dbraw/zinc/26/12/15/334261215.db2.gz BMNGQUAVDGOGSJ-MRXNPFEDSA-N 2 1 317.502 4.010 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccs1 ZINC000415079912 334269411 /nfs/dbraw/zinc/26/94/11/334269411.db2.gz ITCIJXUWMNIZJG-IKGGRYGDSA-N 2 1 300.471 4.282 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1cccs1 ZINC000415079916 334269676 /nfs/dbraw/zinc/26/96/76/334269676.db2.gz ITCIJXUWMNIZJG-YESZJQIVSA-N 2 1 300.471 4.282 20 0 DIADMP Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1ccccc1F ZINC000534472095 334270777 /nfs/dbraw/zinc/27/07/77/334270777.db2.gz GSORSHRGJTYCJG-KRWDZBQOSA-N 2 1 323.415 4.148 20 0 DIADMP C[C@H](C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)Cc1cccs1 ZINC000415090297 334280030 /nfs/dbraw/zinc/28/00/30/334280030.db2.gz YXJVESSPOCNNKR-IEZWGBDMSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000531939175 334299620 /nfs/dbraw/zinc/29/96/20/334299620.db2.gz KNSBOQDTSGDXIL-SFHVURJKSA-N 2 1 316.489 4.066 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCSc3ccc(Cl)cc32)C1 ZINC000531970793 334331210 /nfs/dbraw/zinc/33/12/10/334331210.db2.gz PXULOTCNJNCEQE-CZUORRHYSA-N 2 1 324.921 4.198 20 0 DIADMP CC(C)CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000531972606 334336863 /nfs/dbraw/zinc/33/68/63/334336863.db2.gz ZSWWJTYCZTZFHX-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000531988796 334364257 /nfs/dbraw/zinc/36/42/57/334364257.db2.gz SBKARNGXJPKJEH-PLMTUMEDSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000531988796 334364258 /nfs/dbraw/zinc/36/42/58/334364258.db2.gz SBKARNGXJPKJEH-PLMTUMEDSA-N 2 1 308.469 4.317 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000531988796 334364260 /nfs/dbraw/zinc/36/42/60/334364260.db2.gz SBKARNGXJPKJEH-PLMTUMEDSA-N 2 1 308.469 4.317 20 0 DIADMP Cc1nc2ccccc2n1C[C@H]1CCC[N@H+]1Cc1cccc(F)c1 ZINC000535204303 334380217 /nfs/dbraw/zinc/38/02/17/334380217.db2.gz BBTBJRBVCZAZPO-GOSISDBHSA-N 2 1 323.415 4.148 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000535228791 334380824 /nfs/dbraw/zinc/38/08/24/334380824.db2.gz DUEBKOSPBIHNNS-QGTPRVQTSA-N 2 1 304.503 4.076 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1 ZINC000535228791 334380826 /nfs/dbraw/zinc/38/08/26/334380826.db2.gz DUEBKOSPBIHNNS-QGTPRVQTSA-N 2 1 304.503 4.076 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000341746131 334476268 /nfs/dbraw/zinc/47/62/68/334476268.db2.gz XPPMTBNTPGGIFE-GOSISDBHSA-N 2 1 317.864 4.366 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000344306443 335239229 /nfs/dbraw/zinc/23/92/29/335239229.db2.gz WPDWWUFTGWXONG-FQEVSTJZSA-N 2 1 316.489 4.024 20 0 DIADMP C[NH+](Cc1ccoc1)Cc1ccc(C[N@@H+](C)Cc2ccoc2)cc1 ZINC000345094929 335297937 /nfs/dbraw/zinc/29/79/37/335297937.db2.gz ZOTBYFBZOONBDC-UHFFFAOYSA-N 2 1 324.424 4.137 20 0 DIADMP FC(F)(F)c1ccccc1[C@H]1CCCC[N@H+]1CCn1ccnc1 ZINC000346300875 335396316 /nfs/dbraw/zinc/39/63/16/335396316.db2.gz DDRQGESTTIYBLB-MRXNPFEDSA-N 2 1 323.362 4.129 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1)c1cccc(O)c1 ZINC000192035261 336016742 /nfs/dbraw/zinc/01/67/42/336016742.db2.gz YTSOPTORALKPIU-FCEWJHQRSA-N 2 1 316.489 4.086 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CCN([C@H](C)c2cccc(Cl)c2F)C1 ZINC000480556357 336031178 /nfs/dbraw/zinc/03/11/78/336031178.db2.gz RLNHQAJUWYPIPG-ZIAGYGMSSA-N 2 1 312.860 4.204 20 0 DIADMP CC[C@@H](c1ccccc1)[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000352365563 336214494 /nfs/dbraw/zinc/21/44/94/336214494.db2.gz TXSKFZUXIPWXEN-IBGZPJMESA-N 2 1 310.441 4.385 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+][C@H]2CCc3ccccc32)CC1 ZINC000532476315 336251223 /nfs/dbraw/zinc/25/12/23/336251223.db2.gz TYMXSARZJZKPQT-QFIPXVFZSA-N 2 1 320.480 4.237 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000532485499 336251644 /nfs/dbraw/zinc/25/16/44/336251644.db2.gz RCGMXFZSPVFEMM-TZIWHRDSSA-N 2 1 322.496 4.210 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000532504734 336252520 /nfs/dbraw/zinc/25/25/20/336252520.db2.gz MDNBKLNZMVLKJL-HNNZLLSDSA-N 2 1 314.517 4.279 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000532504736 336252562 /nfs/dbraw/zinc/25/25/62/336252562.db2.gz MDNBKLNZMVLKJL-YGZIPRCYSA-N 2 1 314.517 4.279 20 0 DIADMP COC1CC[NH+](C2(C[NH2+][C@@H](C)CCC=C(C)C)CCCC2)CC1 ZINC000532514431 336253132 /nfs/dbraw/zinc/25/31/32/336253132.db2.gz GNROGIILTUWGHK-SFHVURJKSA-N 2 1 322.537 4.135 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cc2ccccc2o1 ZINC000580359887 336259532 /nfs/dbraw/zinc/25/95/32/336259532.db2.gz BQTRJIGMVPKOMF-QOKNQOGYSA-N 2 1 300.446 4.202 20 0 DIADMP CC(C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc2ccccc2o1 ZINC000580359887 336259533 /nfs/dbraw/zinc/25/95/33/336259533.db2.gz BQTRJIGMVPKOMF-QOKNQOGYSA-N 2 1 300.446 4.202 20 0 DIADMP COc1ccc2cc([C@H](C)N[C@@H]3CC[N@H+]4CCCC[C@H]34)ccc2c1 ZINC000324893319 336271506 /nfs/dbraw/zinc/27/15/06/336271506.db2.gz ONFKKYGKAMROCU-IWMITWMQSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CCN4CCCC[C@H]34)ccc2c1 ZINC000324893319 336271507 /nfs/dbraw/zinc/27/15/07/336271507.db2.gz ONFKKYGKAMROCU-IWMITWMQSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCCC[C@H]34)ccc2c1 ZINC000324893319 336271508 /nfs/dbraw/zinc/27/15/08/336271508.db2.gz ONFKKYGKAMROCU-IWMITWMQSA-N 2 1 324.468 4.126 20 0 DIADMP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CC[N@H+]4CCCC[C@H]34)ccc2c1 ZINC000324893319 336271509 /nfs/dbraw/zinc/27/15/09/336271509.db2.gz ONFKKYGKAMROCU-IWMITWMQSA-N 2 1 324.468 4.126 20 0 DIADMP Cc1cc(NCc2ccccc2C[NH+]2CCCCCC2)nc(C)[nH+]1 ZINC000301249786 336296745 /nfs/dbraw/zinc/29/67/45/336296745.db2.gz RJSMXZOKQUMTBG-UHFFFAOYSA-N 2 1 324.472 4.082 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC(Nc2cc[nH+]cc2Cl)CC1 ZINC000301541067 336313429 /nfs/dbraw/zinc/31/34/29/336313429.db2.gz VKURWMAKKJXECO-AWEZNQCLSA-N 2 1 315.848 4.373 20 0 DIADMP CCC[N@@H+]1CC[C@@H](CNc2cc[nH+]c3ccc(Cl)cc23)C1 ZINC000301973794 336340763 /nfs/dbraw/zinc/34/07/63/336340763.db2.gz AYNYFCSJPPANHS-ZDUSSCGKSA-N 2 1 303.837 4.032 20 0 DIADMP CCC[N@H+]1CC[C@@H](CNc2cc[nH+]c3ccc(Cl)cc23)C1 ZINC000301973794 336340764 /nfs/dbraw/zinc/34/07/64/336340764.db2.gz AYNYFCSJPPANHS-ZDUSSCGKSA-N 2 1 303.837 4.032 20 0 DIADMP CCCc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c2ccccc2[nH+]1 ZINC000301989628 336341685 /nfs/dbraw/zinc/34/16/85/336341685.db2.gz OORZNDYAOGZRBM-OAHLLOKOSA-N 2 1 320.440 4.294 20 0 DIADMP Cc1cccc2c(NCCc3cn4c([nH+]3)CCCC4)c(C)c[nH+]c12 ZINC000302641230 336363300 /nfs/dbraw/zinc/36/33/00/336363300.db2.gz IHTPDPFDMDBZMF-UHFFFAOYSA-N 2 1 320.440 4.039 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](C(c1ccccc1)c1ccccc1)CC2 ZINC000514141373 336375084 /nfs/dbraw/zinc/37/50/84/336375084.db2.gz DOUOXOAACQGKAQ-UHFFFAOYSA-N 2 1 320.480 4.336 20 0 DIADMP CC[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccccc1 ZINC000353033843 336384305 /nfs/dbraw/zinc/38/43/05/336384305.db2.gz OJRBRFSMQMBUMB-NRFANRHFSA-N 2 1 308.469 4.176 20 0 DIADMP CC[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccccc1 ZINC000353033843 336384306 /nfs/dbraw/zinc/38/43/06/336384306.db2.gz OJRBRFSMQMBUMB-NRFANRHFSA-N 2 1 308.469 4.176 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000152470500 336388808 /nfs/dbraw/zinc/38/88/08/336388808.db2.gz DXKRVUNSZGRYCG-VXGBXAGGSA-N 2 1 313.272 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472447 336389271 /nfs/dbraw/zinc/38/92/71/336389271.db2.gz BGPNMCSGHUBEIC-JKSUJKDBSA-N 2 1 310.441 4.082 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(-c2ccccc2)o1 ZINC000152472447 336389272 /nfs/dbraw/zinc/38/92/72/336389272.db2.gz BGPNMCSGHUBEIC-JKSUJKDBSA-N 2 1 310.441 4.082 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccoc1 ZINC000353400160 336415382 /nfs/dbraw/zinc/41/53/82/336415382.db2.gz DNVCEDOGAIFMRM-LJQANCHMSA-N 2 1 306.494 4.467 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]C2CCC(F)(F)CC2)cc1 ZINC000358348771 336625389 /nfs/dbraw/zinc/62/53/89/336625389.db2.gz DGVQWEXHZYJWKS-CYBMUJFWSA-N 2 1 319.399 4.409 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000360933468 336728194 /nfs/dbraw/zinc/72/81/94/336728194.db2.gz POMBZQYUZIUAKM-AWEZNQCLSA-N 2 1 311.454 4.271 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1cc2cc(Cl)ccc2o1 ZINC000377798945 337061429 /nfs/dbraw/zinc/06/14/29/337061429.db2.gz OTMIXEXWTDIPRW-ZWNOBZJWSA-N 2 1 315.804 4.017 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccccc2)cc1F ZINC000173350733 337134742 /nfs/dbraw/zinc/13/47/42/337134742.db2.gz QVAQYLVXKFSUGV-AWEZNQCLSA-N 2 1 309.388 4.171 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1cccc(Cl)c1 ZINC000173386258 337135013 /nfs/dbraw/zinc/13/50/13/337135013.db2.gz AGIDINBZUUYJHU-CXAGYDPISA-N 2 1 305.853 4.222 20 0 DIADMP CCSc1ccccc1[C@H](C)[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000178699531 337166060 /nfs/dbraw/zinc/16/60/60/337166060.db2.gz VKQKFKXKGMZQJF-GJZGRUSLSA-N 2 1 317.502 4.290 20 0 DIADMP CCSc1ccccc1[C@@H](C)[NH2+]C[C@@H](C)Cn1cc[nH+]c1C ZINC000178699497 337166103 /nfs/dbraw/zinc/16/61/03/337166103.db2.gz VKQKFKXKGMZQJF-HUUCEWRRSA-N 2 1 317.502 4.290 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)c2cncc(C)c2)cc1 ZINC000184384587 337198181 /nfs/dbraw/zinc/19/81/81/337198181.db2.gz BGXDEQHZKYDVPZ-CVEARBPZSA-N 2 1 320.440 4.296 20 0 DIADMP C[C@H](C[NH2+][C@H](C)c1ccc(Cl)s1)C[NH+]1CCCCC1 ZINC000038041955 337263858 /nfs/dbraw/zinc/26/38/58/337263858.db2.gz UVIYTWJTIWRZNC-CHWSQXEVSA-N 2 1 300.899 4.174 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398033081 337304782 /nfs/dbraw/zinc/30/47/82/337304782.db2.gz OGSQBBQPBZBHPP-WOIUINJBSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@H](C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1 ZINC000398033081 337304783 /nfs/dbraw/zinc/30/47/83/337304783.db2.gz OGSQBBQPBZBHPP-WOIUINJBSA-N 2 1 322.496 4.290 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1nccc2ccccc21 ZINC000584439555 337325774 /nfs/dbraw/zinc/32/57/74/337325774.db2.gz APCGCNXWUYCIOI-SJORKVTESA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1nccc2ccccc21 ZINC000584439555 337325775 /nfs/dbraw/zinc/32/57/75/337325775.db2.gz APCGCNXWUYCIOI-SJORKVTESA-N 2 1 311.473 4.150 20 0 DIADMP CC(C)(C[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1 ZINC000422829671 337688318 /nfs/dbraw/zinc/68/83/18/337688318.db2.gz HPUXFPFHRXKDGL-PMACEKPBSA-N 2 1 308.469 4.047 20 0 DIADMP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422836188 337688591 /nfs/dbraw/zinc/68/85/91/337688591.db2.gz JMIOUYMYZLHCOA-KFTCGEBBSA-N 2 1 310.416 4.184 20 0 DIADMP c1c2ccccc2sc1C[NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000422897814 337690586 /nfs/dbraw/zinc/69/05/86/337690586.db2.gz CYKWGOUPOLSHOY-PKOBYXMFSA-N 2 1 322.477 4.484 20 0 DIADMP CCCOc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)c(C)c1 ZINC000423071814 337698362 /nfs/dbraw/zinc/69/83/62/337698362.db2.gz OXXINEOTVFSAPU-WOJBJXKFSA-N 2 1 310.441 4.018 20 0 DIADMP CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000423260183 337707843 /nfs/dbraw/zinc/70/78/43/337707843.db2.gz GUOIXPVQIILCCF-CVEARBPZSA-N 2 1 315.505 4.187 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cc2c(ccc3ccccc23)o1 ZINC000423376794 337717274 /nfs/dbraw/zinc/71/72/74/337717274.db2.gz LFDOZMDDRSCWBE-IJEWVQPXSA-N 2 1 308.425 4.377 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000119951208 337868064 /nfs/dbraw/zinc/86/80/64/337868064.db2.gz SYPPRGOPPPJTHU-QGZVFWFLSA-N 2 1 324.468 4.010 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)[C@@H]1C ZINC000516198400 338007235 /nfs/dbraw/zinc/00/72/35/338007235.db2.gz QGGWMHPNRBEQOC-CVYSASLGSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)[C@@H]1C ZINC000516198400 338007236 /nfs/dbraw/zinc/00/72/36/338007236.db2.gz QGGWMHPNRBEQOC-CVYSASLGSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1ccc2cc([C@H](C)[NH2+][C@@H]3CCC[C@@H]([NH+](C)C)C3)oc2c1 ZINC000426032182 338019851 /nfs/dbraw/zinc/01/98/51/338019851.db2.gz XDKOEZBLHHYGLP-USXIJHARSA-N 2 1 300.446 4.265 20 0 DIADMP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CCCc2sc(Cl)cc21 ZINC000426303125 338025685 /nfs/dbraw/zinc/02/56/85/338025685.db2.gz LJIGHHPMFOCYHJ-MHDGFBEUSA-N 2 1 312.910 4.097 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CCCc2sc(Cl)cc21 ZINC000426303125 338025686 /nfs/dbraw/zinc/02/56/86/338025686.db2.gz LJIGHHPMFOCYHJ-MHDGFBEUSA-N 2 1 312.910 4.097 20 0 DIADMP C[C@H](CCSc1ccccc1)[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000431624831 338134951 /nfs/dbraw/zinc/13/49/51/338134951.db2.gz XLBLPOWUWVJPFS-HZPDHXFCSA-N 2 1 315.486 4.160 20 0 DIADMP Clc1scc(CN2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1Cl ZINC000432743467 338165632 /nfs/dbraw/zinc/16/56/32/338165632.db2.gz VNCJKGBVRNSXRM-SECBINFHSA-N 2 1 316.257 4.158 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCC[C@H]([NH+](C)C)CC3)o2)cc1 ZINC000432815060 338168937 /nfs/dbraw/zinc/16/89/37/338168937.db2.gz ZYBPLIMZPODELZ-SFHVURJKSA-N 2 1 312.457 4.171 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]([NH+](C)C)CC3)o2)cc1 ZINC000432815060 338168938 /nfs/dbraw/zinc/16/89/38/338168938.db2.gz ZYBPLIMZPODELZ-SFHVURJKSA-N 2 1 312.457 4.171 20 0 DIADMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000432814786 338168947 /nfs/dbraw/zinc/16/89/47/338168947.db2.gz BDEKDMXBNJGGQG-QGZVFWFLSA-N 2 1 314.498 4.331 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)c1cccc(O)c1 ZINC000433045080 338178330 /nfs/dbraw/zinc/17/83/30/338178330.db2.gz DCVHOVNAYTVMAP-QINHECLXSA-N 2 1 316.489 4.086 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434613084 338221097 /nfs/dbraw/zinc/22/10/97/338221097.db2.gz ZSLVWPNYCNKNNI-GOSISDBHSA-N 2 1 303.425 4.050 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434613084 338221098 /nfs/dbraw/zinc/22/10/98/338221098.db2.gz ZSLVWPNYCNKNNI-GOSISDBHSA-N 2 1 303.425 4.050 20 0 DIADMP C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000434752291 338224905 /nfs/dbraw/zinc/22/49/05/338224905.db2.gz AUEPRKMYTAFBCA-XLIONFOSSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H]1CCCC[C@@H]1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000435056229 338231346 /nfs/dbraw/zinc/23/13/46/338231346.db2.gz FMUNKCKVPNMCIE-FUHWJXTLSA-N 2 1 315.505 4.225 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC000436267960 338264493 /nfs/dbraw/zinc/26/44/93/338264493.db2.gz FPWAGXNMGDPCCP-NRSPTQNISA-N 2 1 314.517 4.424 20 0 DIADMP CC1(C)CCc2ccccc2[C@@H]([NH2+]C2CC[NH+](C3CC3)CC2)C1 ZINC000436302851 338267676 /nfs/dbraw/zinc/26/76/76/338267676.db2.gz ABXHOQKDAIVJIY-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP CC1(C)CCc2ccccc2[C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)C1 ZINC000436307934 338268297 /nfs/dbraw/zinc/26/82/97/338268297.db2.gz OTVQBBKUBNIBOY-CMKODMSKSA-N 2 1 312.501 4.307 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)C1 ZINC000436312120 338268479 /nfs/dbraw/zinc/26/84/79/338268479.db2.gz JRERLDIJFHQYLA-GIVPXCGWSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@@H]([N@H+]2CCC[C@H](N3CCCC3)C2)C1 ZINC000437583462 338314590 /nfs/dbraw/zinc/31/45/90/338314590.db2.gz SRPOGRXBZSZGOF-HKBOAZHASA-N 2 1 312.501 4.057 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@@H](N2CCC[C@H]([NH+]3CCCC3)C2)C1 ZINC000437583462 338314591 /nfs/dbraw/zinc/31/45/91/338314591.db2.gz SRPOGRXBZSZGOF-HKBOAZHASA-N 2 1 312.501 4.057 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@@H]([N@H+]2CCC[C@@H](N3CCCC3)C2)C1 ZINC000437583464 338314693 /nfs/dbraw/zinc/31/46/93/338314693.db2.gz SRPOGRXBZSZGOF-NJYVYQBISA-N 2 1 312.501 4.057 20 0 DIADMP C[C@]1(c2ccccc2)CC[C@@H](N2CCC[C@@H]([NH+]3CCCC3)C2)C1 ZINC000437583464 338314694 /nfs/dbraw/zinc/31/46/94/338314694.db2.gz SRPOGRXBZSZGOF-NJYVYQBISA-N 2 1 312.501 4.057 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](CC(c2ccccc2)c2ccccc2)C1 ZINC000438849099 338353777 /nfs/dbraw/zinc/35/37/77/338353777.db2.gz DDCBEZNGWSLUER-IBGZPJMESA-N 2 1 322.496 4.092 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000438849099 338353778 /nfs/dbraw/zinc/35/37/78/338353778.db2.gz DDCBEZNGWSLUER-IBGZPJMESA-N 2 1 322.496 4.092 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](CC(c2ccccc2)c2ccccc2)C1 ZINC000438849099 338353779 /nfs/dbraw/zinc/35/37/79/338353779.db2.gz DDCBEZNGWSLUER-IBGZPJMESA-N 2 1 322.496 4.092 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1 ZINC000449780711 338652529 /nfs/dbraw/zinc/65/25/29/338652529.db2.gz ZAGJFVPOXMULGF-YJBOKZPZSA-N 2 1 306.881 4.050 20 0 DIADMP Clc1ccc([C@H]([NH2+]C2CC[NH+](C3CC3)CC2)C2CCC2)cc1 ZINC000453068824 338789741 /nfs/dbraw/zinc/78/97/41/338789741.db2.gz JTMHXFZFAQESNB-LJQANCHMSA-N 2 1 318.892 4.398 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cs1 ZINC000453110593 338795057 /nfs/dbraw/zinc/79/50/57/338795057.db2.gz CNRPQUHGVBLTMR-HNNXBMFYSA-N 2 1 315.486 4.080 20 0 DIADMP C[C@@H]1C[C@@H]1[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000459403977 339027195 /nfs/dbraw/zinc/02/71/95/339027195.db2.gz BYTAMYRJENRSOK-ZNZDAUKMSA-N 2 1 318.892 4.254 20 0 DIADMP c1ccc(C[C@@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459401943 339027197 /nfs/dbraw/zinc/02/71/97/339027197.db2.gz JKZFGSKCDMAIOG-GHTZIAJQSA-N 2 1 312.501 4.004 20 0 DIADMP c1ccc(C[C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000459401945 339027262 /nfs/dbraw/zinc/02/72/62/339027262.db2.gz JKZFGSKCDMAIOG-RXVVDRJESA-N 2 1 312.501 4.004 20 0 DIADMP C[C@@H]([NH2+]CCc1cccc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000459454133 339030173 /nfs/dbraw/zinc/03/01/73/339030173.db2.gz BOPMMIMBTHGXDA-NVXWUHKLSA-N 2 1 320.908 4.125 20 0 DIADMP C[C@H]([NH2+]CCc1cccc(Cl)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000459454132 339030186 /nfs/dbraw/zinc/03/01/86/339030186.db2.gz BOPMMIMBTHGXDA-DOTOQJQBSA-N 2 1 320.908 4.125 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C)c(C)n2)cc1 ZINC000459659547 339041186 /nfs/dbraw/zinc/04/11/86/339041186.db2.gz DIPZQFYWHAUUGK-INIZCTEOSA-N 2 1 320.440 4.043 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000459721005 339044264 /nfs/dbraw/zinc/04/42/64/339044264.db2.gz ABYPUDLZTHIBJX-JXFKEZNVSA-N 2 1 316.464 4.083 20 0 DIADMP CCC1CCC([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000462772480 339087916 /nfs/dbraw/zinc/08/79/16/339087916.db2.gz IFIOPAKCMYOMLH-CKHPTIKVSA-N 2 1 314.517 4.109 20 0 DIADMP CC[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)C1 ZINC000462780839 339088119 /nfs/dbraw/zinc/08/81/19/339088119.db2.gz ZOCGEDZRURRZMM-HLAWJBBLSA-N 2 1 314.517 4.109 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000462805958 339090240 /nfs/dbraw/zinc/09/02/40/339090240.db2.gz UFCGJSQVCWBCDJ-MRXNPFEDSA-N 2 1 306.494 4.245 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1 ZINC000462805958 339090241 /nfs/dbraw/zinc/09/02/41/339090241.db2.gz UFCGJSQVCWBCDJ-MRXNPFEDSA-N 2 1 306.494 4.245 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463132676 339106728 /nfs/dbraw/zinc/10/67/28/339106728.db2.gz BLTLCEWQNVTXQP-SIKLNZKXSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000463132676 339106729 /nfs/dbraw/zinc/10/67/29/339106729.db2.gz BLTLCEWQNVTXQP-SIKLNZKXSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463138937 339106973 /nfs/dbraw/zinc/10/69/73/339106973.db2.gz FOYUSKKTYZNUMS-UGKGYDQZSA-N 2 1 322.496 4.180 20 0 DIADMP Cc1ccccc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000463138937 339106974 /nfs/dbraw/zinc/10/69/74/339106974.db2.gz FOYUSKKTYZNUMS-UGKGYDQZSA-N 2 1 322.496 4.180 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)C(C)(C)C ZINC000463144541 339107172 /nfs/dbraw/zinc/10/71/72/339107172.db2.gz KMUUYWPNOZAQBS-LJQANCHMSA-N 2 1 320.496 4.247 20 0 DIADMP CC1(C[NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CCCC1 ZINC000463157112 339107382 /nfs/dbraw/zinc/10/73/82/339107382.db2.gz QYSCCXZMBSHJSD-UHFFFAOYSA-N 2 1 318.480 4.003 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC23CCCC3)CC[N@@H+]1Cc1ccccc1 ZINC000463235050 339110871 /nfs/dbraw/zinc/11/08/71/339110871.db2.gz FHSYNXMSPHSTCD-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC000463235050 339110872 /nfs/dbraw/zinc/11/08/72/339110872.db2.gz FHSYNXMSPHSTCD-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1cscc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463243494 339111485 /nfs/dbraw/zinc/11/14/85/339111485.db2.gz SMBADKSBXQLTLL-APWZRJJASA-N 2 1 314.498 4.199 20 0 DIADMP Cc1cscc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000463243494 339111486 /nfs/dbraw/zinc/11/14/86/339111486.db2.gz SMBADKSBXQLTLL-APWZRJJASA-N 2 1 314.498 4.199 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)C1 ZINC000464082607 339133655 /nfs/dbraw/zinc/13/36/55/339133655.db2.gz PEAPKWNVMKDVPO-MISYRCLQSA-N 2 1 314.517 4.279 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000466459483 339205869 /nfs/dbraw/zinc/20/58/69/339205869.db2.gz YRFUQDIWOFTXNY-WXLSXGNJSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H](C[NH2+]CC1CCC(C(F)(F)F)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000466459483 339205870 /nfs/dbraw/zinc/20/58/70/339205870.db2.gz YRFUQDIWOFTXNY-WXLSXGNJSA-N 2 1 320.443 4.065 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1Cl ZINC000467382220 339235666 /nfs/dbraw/zinc/23/56/66/339235666.db2.gz OIPYGDCTHYUPPB-HOCLYGCPSA-N 2 1 324.896 4.091 20 0 DIADMP CCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1Cl ZINC000467382220 339235667 /nfs/dbraw/zinc/23/56/67/339235667.db2.gz OIPYGDCTHYUPPB-HOCLYGCPSA-N 2 1 324.896 4.091 20 0 DIADMP CC(C)Oc1ccccc1C[NH2+]CCC[NH+](C(C)C)C(C)C ZINC000467770201 339246332 /nfs/dbraw/zinc/24/63/32/339246332.db2.gz QFFXLNUPELBXRT-UHFFFAOYSA-N 2 1 306.494 4.072 20 0 DIADMP C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000468229250 339256865 /nfs/dbraw/zinc/25/68/65/339256865.db2.gz FZLDQHWLWNORHU-DYESRHJHSA-N 2 1 312.501 4.187 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CC2CCC(C(F)(F)F)CC2)C[C@@H]1C ZINC000468392717 339261371 /nfs/dbraw/zinc/26/13/71/339261371.db2.gz PCFJQQPEDMVEFJ-SLTXQBBLSA-N 2 1 320.443 4.160 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)CC[NH+](C)C ZINC000468791498 339270942 /nfs/dbraw/zinc/27/09/42/339270942.db2.gz BKUALRMNIYHLOV-KGLIPLIRSA-N 2 1 317.502 4.109 20 0 DIADMP CC[N@H+]1CC[C@H]([NH2+]CCCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC000469158922 339281769 /nfs/dbraw/zinc/28/17/69/339281769.db2.gz WOEVIAQHCDSIAH-PXNSSMCTSA-N 2 1 302.506 4.063 20 0 DIADMP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000470000570 339307926 /nfs/dbraw/zinc/30/79/26/339307926.db2.gz SPSCCHRSXIMPDI-ZDUSSCGKSA-N 2 1 320.889 4.110 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2Cl)s1)C1CC[NH2+]CC1 ZINC000470007250 339308280 /nfs/dbraw/zinc/30/82/80/339308280.db2.gz YYCHRYHRPOMYFZ-UHFFFAOYSA-N 2 1 320.889 4.252 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000471245661 339341008 /nfs/dbraw/zinc/34/10/08/339341008.db2.gz VVKSNQGXFIRFGF-DYESRHJHSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000471245661 339341009 /nfs/dbraw/zinc/34/10/09/339341009.db2.gz VVKSNQGXFIRFGF-DYESRHJHSA-N 2 1 310.485 4.044 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)CCc2ccc3ccccc3c2)[C@H](C)C1 ZINC000471245661 339341010 /nfs/dbraw/zinc/34/10/10/339341010.db2.gz VVKSNQGXFIRFGF-DYESRHJHSA-N 2 1 310.485 4.044 20 0 DIADMP C[C@@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Oc2ccccc2)cc1 ZINC000471758975 339353280 /nfs/dbraw/zinc/35/32/80/339353280.db2.gz MMFQLALDYLMEDB-MRXNPFEDSA-N 2 1 321.424 4.106 20 0 DIADMP CC(C)CC[C@H]([NH2+]CCc1c[nH+]cn1C)c1ccc(Cl)cc1 ZINC000471771601 339353596 /nfs/dbraw/zinc/35/35/96/339353596.db2.gz NQXCZIDNKKAAIZ-SFHVURJKSA-N 2 1 319.880 4.383 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472462679 339372457 /nfs/dbraw/zinc/37/24/57/339372457.db2.gz MDRCLSJGUOINKZ-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472462679 339372458 /nfs/dbraw/zinc/37/24/58/339372458.db2.gz MDRCLSJGUOINKZ-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000472462679 339372459 /nfs/dbraw/zinc/37/24/59/339372459.db2.gz MDRCLSJGUOINKZ-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP C[C@@H](c1ccccc1Cl)[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000472462679 339372460 /nfs/dbraw/zinc/37/24/60/339372460.db2.gz MDRCLSJGUOINKZ-GOEBONIOSA-N 2 1 306.881 4.065 20 0 DIADMP Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CC[C@@H]2CCCC[NH+]2C)C1 ZINC000472579394 339374128 /nfs/dbraw/zinc/37/41/28/339374128.db2.gz OIJOUPHNOFVDCW-OTWHNJEPSA-N 2 1 300.490 4.047 20 0 DIADMP C[N@H+]1CCCC[C@H]1CC[NH+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000472727387 339376608 /nfs/dbraw/zinc/37/66/08/339376608.db2.gz GFGFJFCQMBSSFV-AEFFLSMTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000472727387 339376609 /nfs/dbraw/zinc/37/66/09/339376609.db2.gz GFGFJFCQMBSSFV-AEFFLSMTSA-N 2 1 306.881 4.004 20 0 DIADMP C[NH+]1CCCC[C@H]1CC[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000472727387 339376610 /nfs/dbraw/zinc/37/66/10/339376610.db2.gz GFGFJFCQMBSSFV-AEFFLSMTSA-N 2 1 306.881 4.004 20 0 DIADMP CCSc1cccc(C[N@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000473148185 339382847 /nfs/dbraw/zinc/38/28/47/339382847.db2.gz QSJFIPRBGBOPKV-RDJZCZTQSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)c1 ZINC000473148185 339382848 /nfs/dbraw/zinc/38/28/48/339382848.db2.gz QSJFIPRBGBOPKV-RDJZCZTQSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)c1 ZINC000473148185 339382849 /nfs/dbraw/zinc/38/28/49/339382849.db2.gz QSJFIPRBGBOPKV-RDJZCZTQSA-N 2 1 306.519 4.103 20 0 DIADMP CCSc1cccc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)c1 ZINC000473148185 339382850 /nfs/dbraw/zinc/38/28/50/339382850.db2.gz QSJFIPRBGBOPKV-RDJZCZTQSA-N 2 1 306.519 4.103 20 0 DIADMP CCC[N@@H+](CCn1ccnc1C)[C@@H](C)c1cc2ccccc2o1 ZINC000499048470 339383844 /nfs/dbraw/zinc/38/38/44/339383844.db2.gz QIJMLMXGDJPDMP-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP CCC[N@H+](CCn1cc[nH+]c1C)[C@@H](C)c1cc2ccccc2o1 ZINC000499048470 339383845 /nfs/dbraw/zinc/38/38/45/339383845.db2.gz QIJMLMXGDJPDMP-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP CCC[N@@H+](CCn1cc[nH+]c1C)[C@@H](C)c1cc2ccccc2o1 ZINC000499048470 339383846 /nfs/dbraw/zinc/38/38/46/339383846.db2.gz QIJMLMXGDJPDMP-HNNXBMFYSA-N 2 1 311.429 4.411 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c1 ZINC000474025430 339397491 /nfs/dbraw/zinc/39/74/91/339397491.db2.gz UYHPJYOWQGHFGV-OAHLLOKOSA-N 2 1 324.459 4.442 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)C1CCC(F)(F)CC1 ZINC000474047303 339399090 /nfs/dbraw/zinc/39/90/90/339399090.db2.gz PPHWZEHEEYPLOG-JKSUJKDBSA-N 2 1 316.480 4.445 20 0 DIADMP C[C@H]([NH2+]CCC[NH+](C)C)c1ccc2ccccc2c1OC(F)F ZINC000479871040 339551784 /nfs/dbraw/zinc/55/17/84/339551784.db2.gz FKDGWBHLWWBQNC-ZDUSSCGKSA-N 2 1 322.399 4.044 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H]2CCCc3c4ccccc4sc32)CC1 ZINC000480033090 339556148 /nfs/dbraw/zinc/55/61/48/339556148.db2.gz CJTLALLHHVZZDD-QGZVFWFLSA-N 2 1 314.498 4.353 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000480157402 339560966 /nfs/dbraw/zinc/56/09/66/339560966.db2.gz FHFUJIVSLZWSSO-INIZCTEOSA-N 2 1 300.490 4.479 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1cccc(-c2ccccc2)c1 ZINC000482106748 339623321 /nfs/dbraw/zinc/62/33/21/339623321.db2.gz CEHFMYNUAXFQMP-MRXNPFEDSA-N 2 1 305.425 4.209 20 0 DIADMP Cc1ccc(N2CCC([NH2+][C@@H]3CCC(C)(C)C[C@@H]3C)CC2)[nH+]c1 ZINC000483500153 339667299 /nfs/dbraw/zinc/66/72/99/339667299.db2.gz GIPLXCHLIOMRFS-FUHWJXTLSA-N 2 1 315.505 4.163 20 0 DIADMP CCC[C@@H]([NH2+]C1CCN(c2ccc(C)c[nH+]2)CC1)c1ccccc1 ZINC000484172678 339682393 /nfs/dbraw/zinc/68/23/93/339682393.db2.gz GBPUILAPVLLDDE-HXUWFJFHSA-N 2 1 323.484 4.490 20 0 DIADMP CC(C)(C)CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000499148682 340031177 /nfs/dbraw/zinc/03/11/77/340031177.db2.gz DDDNFSJRRAQTJI-REPLKXPHSA-N 2 1 300.490 4.208 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC2(C4CC4)CCC2)C3)cc1 ZINC000499165042 340031505 /nfs/dbraw/zinc/03/15/05/340031505.db2.gz ADTFLRQKODWUJS-MZADTFQBSA-N 2 1 324.512 4.352 20 0 DIADMP Fc1ccc2c(N[C@@H]3CC[N@H+](Cc4ccccc4)C3)cc[nH+]c2c1 ZINC000500468307 340059824 /nfs/dbraw/zinc/05/98/24/340059824.db2.gz BOBOLJIZEWJILS-QGZVFWFLSA-N 2 1 321.399 4.060 20 0 DIADMP Fc1ccc2c(N[C@@H]3CC[N@@H+](Cc4ccccc4)C3)cc[nH+]c2c1 ZINC000500468307 340059825 /nfs/dbraw/zinc/05/98/25/340059825.db2.gz BOBOLJIZEWJILS-QGZVFWFLSA-N 2 1 321.399 4.060 20 0 DIADMP C(C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006802 340072097 /nfs/dbraw/zinc/07/20/97/340072097.db2.gz KJFCWGUFLUQDGC-QFBILLFUSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)SC1CCCCC1 ZINC000501006802 340072098 /nfs/dbraw/zinc/07/20/98/340072098.db2.gz KJFCWGUFLUQDGC-QFBILLFUSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006802 340072099 /nfs/dbraw/zinc/07/20/99/340072099.db2.gz KJFCWGUFLUQDGC-QFBILLFUSA-N 2 1 322.562 4.001 20 0 DIADMP C(C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)SC1CCCCC1 ZINC000501006802 340072100 /nfs/dbraw/zinc/07/21/00/340072100.db2.gz KJFCWGUFLUQDGC-QFBILLFUSA-N 2 1 322.562 4.001 20 0 DIADMP CCC(CC)[C@H](C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1)[NH+](C)C ZINC000501470770 340081746 /nfs/dbraw/zinc/08/17/46/340081746.db2.gz YZTHASIQVYYYMG-SXLOBPIMSA-N 2 1 317.521 4.064 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]3C[C@]32C)CC[N@@H+]1Cc1ccccc1 ZINC000502267789 340098247 /nfs/dbraw/zinc/09/82/47/340098247.db2.gz JURQZAXUEJCBHD-RSRIQPTJSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]3C[C@]32C)CC[N@H+]1Cc1ccccc1 ZINC000502267789 340098248 /nfs/dbraw/zinc/09/82/48/340098248.db2.gz JURQZAXUEJCBHD-RSRIQPTJSA-N 2 1 312.501 4.208 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)[C@@H]1c1cccs1 ZINC000502274001 340098394 /nfs/dbraw/zinc/09/83/94/340098394.db2.gz MFXQMTDGZKGPHY-YRGVVPAESA-N 2 1 318.530 4.299 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)[C@@H]1c1cccs1 ZINC000502274001 340098395 /nfs/dbraw/zinc/09/83/95/340098395.db2.gz MFXQMTDGZKGPHY-YRGVVPAESA-N 2 1 318.530 4.299 20 0 DIADMP CC[C@H]1C[C@@]1([NH2+]CCCCn1cc[nH+]c1C)c1cccc(C)c1 ZINC000502514869 340106600 /nfs/dbraw/zinc/10/66/00/340106600.db2.gz XDPWRVPNDZCVDP-ICSRJNTNSA-N 2 1 311.473 4.195 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+]C(C)(C)c1cccc(C(F)(F)F)c1 ZINC000502692504 340110750 /nfs/dbraw/zinc/11/07/50/340110750.db2.gz OTIJELJRDBRRKZ-OAHLLOKOSA-N 2 1 314.395 4.014 20 0 DIADMP C[N@@H+]1CCC[C@H]1CC[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000503065483 340120016 /nfs/dbraw/zinc/12/00/16/340120016.db2.gz VUWCJVDWBRJRGU-ZDUSSCGKSA-N 2 1 313.272 4.056 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000503065483 340120017 /nfs/dbraw/zinc/12/00/17/340120017.db2.gz VUWCJVDWBRJRGU-ZDUSSCGKSA-N 2 1 313.272 4.056 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC000503240231 340123756 /nfs/dbraw/zinc/12/37/56/340123756.db2.gz FTJPUGWSAQOBCK-IRLDBZIGSA-N 2 1 320.480 4.044 20 0 DIADMP Fc1cc(-c2ccccc2)ccc1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000503561928 340130751 /nfs/dbraw/zinc/13/07/51/340130751.db2.gz HAUDTIAHSATMRN-WOJBJXKFSA-N 2 1 324.443 4.209 20 0 DIADMP COc1cc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)ccc1F ZINC000504900203 340155374 /nfs/dbraw/zinc/15/53/74/340155374.db2.gz SZUJBAPARIJTGV-HZPDHXFCSA-N 2 1 322.468 4.140 20 0 DIADMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](CCCc2ccccc2)C1 ZINC000506483800 340195677 /nfs/dbraw/zinc/19/56/77/340195677.db2.gz XGJKWADDLIMYEA-PZJWPPBQSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](CCCc2ccccc2)C1 ZINC000506483800 340195678 /nfs/dbraw/zinc/19/56/78/340195678.db2.gz XGJKWADDLIMYEA-PZJWPPBQSA-N 2 1 314.517 4.206 20 0 DIADMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000506483800 340195679 /nfs/dbraw/zinc/19/56/79/340195679.db2.gz XGJKWADDLIMYEA-PZJWPPBQSA-N 2 1 314.517 4.206 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000507834634 340233619 /nfs/dbraw/zinc/23/36/19/340233619.db2.gz VBUGLMGXTGMPLV-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000507834634 340233620 /nfs/dbraw/zinc/23/36/20/340233620.db2.gz VBUGLMGXTGMPLV-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000507834634 340233621 /nfs/dbraw/zinc/23/36/21/340233621.db2.gz VBUGLMGXTGMPLV-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1sccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000507834634 340233622 /nfs/dbraw/zinc/23/36/22/340233622.db2.gz VBUGLMGXTGMPLV-WBVHZDCISA-N 2 1 306.519 4.143 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[N@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000508543809 340246245 /nfs/dbraw/zinc/24/62/45/340246245.db2.gz JTWMGMAGMHGQPA-ZDUSSCGKSA-N 2 1 322.905 4.247 20 0 DIADMP Cc1c2cccc(Cl)c2sc1C[N@@H+]1CC[C@@H](C[NH+](C)C)C1 ZINC000508543809 340246246 /nfs/dbraw/zinc/24/62/46/340246246.db2.gz JTWMGMAGMHGQPA-ZDUSSCGKSA-N 2 1 322.905 4.247 20 0 DIADMP CCCC1(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000508694124 340250861 /nfs/dbraw/zinc/25/08/61/340250861.db2.gz FCKWORVDOXGGSE-MJGOQNOKSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H]([NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000508720380 340251535 /nfs/dbraw/zinc/25/15/35/340251535.db2.gz RIWADGFUYNTLAC-QRQLOZEOSA-N 2 1 302.506 4.311 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508790001 340253183 /nfs/dbraw/zinc/25/31/83/340253183.db2.gz QHCHEMLJKWWXTC-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(C3CCC3)cc2)C1 ZINC000508790001 340253184 /nfs/dbraw/zinc/25/31/84/340253184.db2.gz QHCHEMLJKWWXTC-SFHVURJKSA-N 2 1 300.490 4.118 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)CC(C)(C)C1 ZINC000302796085 340282200 /nfs/dbraw/zinc/28/22/00/340282200.db2.gz UUTSSOHFFCVTHG-XLIONFOSSA-N 2 1 314.517 4.455 20 0 DIADMP C[N@@H+](CCCNc1cc[nH+]c2ccccc12)Cc1ccccc1 ZINC000302908705 340285817 /nfs/dbraw/zinc/28/58/17/340285817.db2.gz UHVFIXXXHQCMDA-UHFFFAOYSA-N 2 1 305.425 4.169 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC000302988951 340292597 /nfs/dbraw/zinc/29/25/97/340292597.db2.gz FNFGXFQHOUTYMJ-RBUKOAKNSA-N 2 1 300.490 4.192 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](C/C=C/c3ccccc3)C2)CC1 ZINC000302989895 340292610 /nfs/dbraw/zinc/29/26/10/340292610.db2.gz FTNCTLHNGYUNIA-AEVNEEFTSA-N 2 1 312.501 4.144 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](C/C=C/c3ccccc3)C2)CC1 ZINC000302989895 340292611 /nfs/dbraw/zinc/29/26/11/340292611.db2.gz FTNCTLHNGYUNIA-AEVNEEFTSA-N 2 1 312.501 4.144 20 0 DIADMP C[C@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2CC[C@H]2C2CCC2)CC1 ZINC000510665150 340305615 /nfs/dbraw/zinc/30/56/15/340305615.db2.gz BOONOUODWJEZQK-TYCQWZJGSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]2C2CCC2)CC[N@@H+]1Cc1ccccc1 ZINC000510680284 340306361 /nfs/dbraw/zinc/30/63/61/340306361.db2.gz HVGJNZYZEAPEIA-QYRPDUKASA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H]2C2CCC2)CC[N@H+]1Cc1ccccc1 ZINC000510680284 340306362 /nfs/dbraw/zinc/30/63/62/340306362.db2.gz HVGJNZYZEAPEIA-QYRPDUKASA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H](c1ccccc1)[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000303161456 340307629 /nfs/dbraw/zinc/30/76/29/340307629.db2.gz HDBIHFYEIDZCAE-RBUKOAKNSA-N 2 1 300.490 4.336 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CC[C@@H]3C3CCC3)C2)c1 ZINC000510723820 340308287 /nfs/dbraw/zinc/30/82/87/340308287.db2.gz UBTUCYQATYTYCX-LZQZEXGQSA-N 2 1 318.530 4.128 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CC[C@@H]3C3CCC3)C2)c1 ZINC000510723820 340308288 /nfs/dbraw/zinc/30/82/88/340308288.db2.gz UBTUCYQATYTYCX-LZQZEXGQSA-N 2 1 318.530 4.128 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@@H]2CCCF)c1 ZINC000510738299 340308941 /nfs/dbraw/zinc/30/89/41/340308941.db2.gz UTQWNQLKFLJHTJ-MOPGFXCFSA-N 2 1 306.469 4.146 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000510959838 340316302 /nfs/dbraw/zinc/31/63/02/340316302.db2.gz PZUYOYKOYIFFHL-QGZVFWFLSA-N 2 1 323.843 4.361 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)[NH2+]CCCn1cc[nH+]c1C ZINC000511021014 340318592 /nfs/dbraw/zinc/31/85/92/340318592.db2.gz ZQQPGSCEFYBHEG-AWEZNQCLSA-N 2 1 311.429 4.241 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC000511054440 340319657 /nfs/dbraw/zinc/31/96/57/340319657.db2.gz MKUGMAPWDZPRRR-IBGZPJMESA-N 2 1 315.436 4.242 20 0 DIADMP CC(C)Sc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000511151100 340322586 /nfs/dbraw/zinc/32/25/86/340322586.db2.gz SKQPVPQIQPYNJK-SFHVURJKSA-N 2 1 318.530 4.105 20 0 DIADMP CC(C)Sc1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000511151100 340322587 /nfs/dbraw/zinc/32/25/87/340322587.db2.gz SKQPVPQIQPYNJK-SFHVURJKSA-N 2 1 318.530 4.105 20 0 DIADMP Cc1ccccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000303517664 340329718 /nfs/dbraw/zinc/32/97/18/340329718.db2.gz CHIUWIDINQHZHU-MOPGFXCFSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303517664 340329719 /nfs/dbraw/zinc/32/97/19/340329719.db2.gz CHIUWIDINQHZHU-MOPGFXCFSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000303517664 340329720 /nfs/dbraw/zinc/32/97/20/340329720.db2.gz CHIUWIDINQHZHU-MOPGFXCFSA-N 2 1 300.490 4.081 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH2+][C@@H]2CCC[C@@H](C(C)(C)C)CC2)s1 ZINC000511907956 340342616 /nfs/dbraw/zinc/34/26/16/340342616.db2.gz MSMJGTDSIVEVBP-HUUCEWRRSA-N 2 1 323.550 4.289 20 0 DIADMP C[C@@H](CCC1CCCCC1)[NH2+]Cc1ncc(C[NH+](C)C)s1 ZINC000512013645 340345416 /nfs/dbraw/zinc/34/54/16/340345416.db2.gz DGDDICDKVZZQAY-AWEZNQCLSA-N 2 1 309.523 4.043 20 0 DIADMP CCCCC1CCC([NH2+]Cc2ncc(C[NH+](C)C)s2)CC1 ZINC000512081876 340347890 /nfs/dbraw/zinc/34/78/90/340347890.db2.gz FOMQHKAFCPZGJJ-UHFFFAOYSA-N 2 1 309.523 4.043 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC000512135620 340349573 /nfs/dbraw/zinc/34/95/73/340349573.db2.gz MOCCFILBHLVLFH-BVBGJJFLSA-N 2 1 322.443 4.222 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512396213 340360527 /nfs/dbraw/zinc/36/05/27/340360527.db2.gz JUDRVGUNMAKQLP-ZBFHGGJFSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000512396213 340360528 /nfs/dbraw/zinc/36/05/28/340360528.db2.gz JUDRVGUNMAKQLP-ZBFHGGJFSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512396210 340360540 /nfs/dbraw/zinc/36/05/40/340360540.db2.gz JUDRVGUNMAKQLP-GDBMZVCRSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000512396210 340360541 /nfs/dbraw/zinc/36/05/41/340360541.db2.gz JUDRVGUNMAKQLP-GDBMZVCRSA-N 2 1 306.881 4.083 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173908652 340377410 /nfs/dbraw/zinc/37/74/10/340377410.db2.gz ZJFXHCXOWBLTIP-KBPBESRZSA-N 2 1 314.395 4.040 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173908652 340377411 /nfs/dbraw/zinc/37/74/11/340377411.db2.gz ZJFXHCXOWBLTIP-KBPBESRZSA-N 2 1 314.395 4.040 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000173908652 340377412 /nfs/dbraw/zinc/37/74/12/340377412.db2.gz ZJFXHCXOWBLTIP-KBPBESRZSA-N 2 1 314.395 4.040 20 0 DIADMP CC(C)[NH2+]C1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000513063367 340391524 /nfs/dbraw/zinc/39/15/24/340391524.db2.gz KEKSXOJPQOANBK-UHFFFAOYSA-N 2 1 308.469 4.316 20 0 DIADMP Fc1cccc2c1CC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000513081766 340392547 /nfs/dbraw/zinc/39/25/47/340392547.db2.gz KAIAUMFVHJWFPF-FQEVSTJZSA-N 2 1 316.464 4.200 20 0 DIADMP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@H](C)Cn1cc[nH+]c1C ZINC000513501428 340410986 /nfs/dbraw/zinc/41/09/86/340410986.db2.gz SXJYPNLSBGNBCG-LTBFUDJGSA-N 2 1 317.864 4.174 20 0 DIADMP C[C@H](C[NH2+][C@@H](C)c1nccc2ccccc21)C[NH+]1CCCCC1 ZINC000517441821 340469785 /nfs/dbraw/zinc/46/97/85/340469785.db2.gz GLOMLKKXNDZLMQ-SJORKVTESA-N 2 1 311.473 4.007 20 0 DIADMP CC[C@H]1CCC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000237075204 340667715 /nfs/dbraw/zinc/66/77/15/340667715.db2.gz PBXCWLLQMDHFLY-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(Cl)o2)cc1 ZINC000037488035 340785469 /nfs/dbraw/zinc/78/54/69/340785469.db2.gz PYPWNZFILQOUOE-UHFFFAOYSA-N 2 1 306.837 4.065 20 0 DIADMP Cn1c[nH+]cc1CC[NH2+][C@@H](c1cc2ccccc2o1)C(C)(C)C ZINC000530354978 340789029 /nfs/dbraw/zinc/78/90/29/340789029.db2.gz NQCCXLCDTZBHRN-SFHVURJKSA-N 2 1 311.429 4.086 20 0 DIADMP CCCC[C@@H](COC)[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000125143383 340802450 /nfs/dbraw/zinc/80/24/50/340802450.db2.gz VZVISMOMEDTHTH-XLIONFOSSA-N 2 1 318.505 4.007 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000542486762 341009775 /nfs/dbraw/zinc/00/97/75/341009775.db2.gz MAWRTJDFKBVLAF-CABCVRRESA-N 2 1 323.550 4.490 20 0 DIADMP C[C@H](CCc1cccc(F)c1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000543080902 341030988 /nfs/dbraw/zinc/03/09/88/341030988.db2.gz JUXQARNHGNKHDI-XLIONFOSSA-N 2 1 318.480 4.097 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)CCCc2ccccc2Cl)CC1 ZINC000543207633 341036983 /nfs/dbraw/zinc/03/69/83/341036983.db2.gz HOXWNDDHDQVMJC-UHFFFAOYSA-N 2 1 308.897 4.079 20 0 DIADMP CSc1ccccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000543460600 341045893 /nfs/dbraw/zinc/04/58/93/341045893.db2.gz OGQIZNIBJLKZED-DOTOQJQBSA-N 2 1 318.530 4.151 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@@H+]1CCC[C@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142032 341071984 /nfs/dbraw/zinc/07/19/84/341071984.db2.gz IHFWTZMFVHBZJZ-HKUYNNGSSA-N 2 1 318.892 4.278 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([N@H+]1CCC[C@H]([NH+]3CCCC3)CC1)CC2 ZINC000544142032 341071985 /nfs/dbraw/zinc/07/19/85/341071985.db2.gz IHFWTZMFVHBZJZ-HKUYNNGSSA-N 2 1 318.892 4.278 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cc2ccccc2o1 ZINC000544374195 341078866 /nfs/dbraw/zinc/07/88/66/341078866.db2.gz BQRQDNQOVRTATC-JKSUJKDBSA-N 2 1 300.446 4.348 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)c1cc2ccccc2o1)[NH+]1CCCCC1 ZINC000544374193 341078879 /nfs/dbraw/zinc/07/88/79/341078879.db2.gz BQRQDNQOVRTATC-HOTGVXAUSA-N 2 1 300.446 4.348 20 0 DIADMP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cc(F)c(F)c(F)c1 ZINC000544374605 341078891 /nfs/dbraw/zinc/07/88/91/341078891.db2.gz XPLWJWPDPIQFOZ-QWHCGFSZSA-N 2 1 314.395 4.019 20 0 DIADMP Cc1ccccc1C1CC[NH+](CC[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000544532091 341085131 /nfs/dbraw/zinc/08/51/31/341085131.db2.gz VRWCUTUHCMWMBM-IBGZPJMESA-N 2 1 300.490 4.049 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(-c2ccccc2)s1 ZINC000544581424 341087206 /nfs/dbraw/zinc/08/72/06/341087206.db2.gz IUGUWUZVABUAIB-AWEZNQCLSA-N 2 1 300.471 4.160 20 0 DIADMP Cc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)C[C@@H]3C)cc2)c1 ZINC000544825685 341094889 /nfs/dbraw/zinc/09/48/89/341094889.db2.gz OPAWGDFPHJYASX-LAUBAEHRSA-N 2 1 308.469 4.092 20 0 DIADMP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc(Cl)s1 ZINC000544895385 341097872 /nfs/dbraw/zinc/09/78/72/341097872.db2.gz AROHGZJQORJKBF-GFCCVEGCSA-N 2 1 300.899 4.174 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCCC(F)(F)F)CC1 ZINC000132670453 341139092 /nfs/dbraw/zinc/13/90/92/341139092.db2.gz SKMRRKJYXZCKDR-UHFFFAOYSA-N 2 1 308.432 4.163 20 0 DIADMP Cc1ccc([C@H](N[C@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc2)cc1 ZINC000133948124 341202329 /nfs/dbraw/zinc/20/23/29/341202329.db2.gz PSAWBKZVMPEDJM-JRGCBEDISA-N 2 1 308.469 4.157 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CCN(C)[C@H](C)C2)c2ccccc2)cc1 ZINC000133948124 341202330 /nfs/dbraw/zinc/20/23/30/341202330.db2.gz PSAWBKZVMPEDJM-JRGCBEDISA-N 2 1 308.469 4.157 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cnc(C(C)C)s2)CC1 ZINC000134148198 341207731 /nfs/dbraw/zinc/20/77/31/341207731.db2.gz JCHYYVMSHHOBHO-UHFFFAOYSA-N 2 1 323.550 4.210 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CCCCC1 ZINC000237177549 341208589 /nfs/dbraw/zinc/20/85/89/341208589.db2.gz XQPYMWVTYPQXCT-UHFFFAOYSA-N 2 1 312.457 4.334 20 0 DIADMP c1csc([C@H]([NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)C2CCCC2)c1 ZINC000135276413 341235238 /nfs/dbraw/zinc/23/52/38/341235238.db2.gz WTYITBALPAWYGJ-LZLYRXPVSA-N 2 1 304.503 4.196 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+](CCCCc2ccccc2)CC1 ZINC000547831732 341236266 /nfs/dbraw/zinc/23/62/66/341236266.db2.gz BGBBCHLLTWJDMP-UHFFFAOYSA-N 2 1 302.506 4.062 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000136293048 341256328 /nfs/dbraw/zinc/25/63/28/341256328.db2.gz AOQGVECHBJLDIR-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000136293048 341256329 /nfs/dbraw/zinc/25/63/29/341256329.db2.gz AOQGVECHBJLDIR-UHFFFAOYSA-N 2 1 312.244 4.020 20 0 DIADMP C[C@H]([NH2+]CC1(C2CC2)CCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000548481912 341263192 /nfs/dbraw/zinc/26/31/92/341263192.db2.gz ODKADGBGCHLCJA-PKOBYXMFSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)C1(c2ccccc2)CCCC1 ZINC000548497107 341264260 /nfs/dbraw/zinc/26/42/60/341264260.db2.gz XYFGWGBGMXIOOT-QGZVFWFLSA-N 2 1 311.473 4.072 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245656430 341308088 /nfs/dbraw/zinc/30/80/88/341308088.db2.gz DSQACTBMAPFPTC-HHUCQEJWSA-N 2 1 300.490 4.206 20 0 DIADMP Cc1sccc1C[NH2+]C1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000550139539 341310988 /nfs/dbraw/zinc/31/09/88/341310988.db2.gz NBYSEBAEYPXRCB-OAHLLOKOSA-N 2 1 314.498 4.372 20 0 DIADMP Fc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000245736683 341312434 /nfs/dbraw/zinc/31/24/34/341312434.db2.gz QYPGBAMNWAUNRV-MZADTFQBSA-N 2 1 324.443 4.111 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@]2(C1)CCCN(C)C2 ZINC000550239155 341313070 /nfs/dbraw/zinc/31/30/70/341313070.db2.gz QUOJFVSAVPMKLV-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239155 341313071 /nfs/dbraw/zinc/31/30/71/341313071.db2.gz QUOJFVSAVPMKLV-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239155 341313072 /nfs/dbraw/zinc/31/30/72/341313072.db2.gz QUOJFVSAVPMKLV-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000550239155 341313073 /nfs/dbraw/zinc/31/30/73/341313073.db2.gz QUOJFVSAVPMKLV-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@@H](c1ccc2ccccc2c1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000550239155 341313074 /nfs/dbraw/zinc/31/30/74/341313074.db2.gz QUOJFVSAVPMKLV-LAUBAEHRSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@]2(C1)CCCN(C)C2 ZINC000550239154 341313148 /nfs/dbraw/zinc/31/31/48/341313148.db2.gz QUOJFVSAVPMKLV-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239154 341313149 /nfs/dbraw/zinc/31/31/49/341313149.db2.gz QUOJFVSAVPMKLV-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000550239154 341313150 /nfs/dbraw/zinc/31/31/50/341313150.db2.gz QUOJFVSAVPMKLV-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000550239154 341313151 /nfs/dbraw/zinc/31/31/51/341313151.db2.gz QUOJFVSAVPMKLV-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000550239154 341313152 /nfs/dbraw/zinc/31/31/52/341313152.db2.gz QUOJFVSAVPMKLV-DYESRHJHSA-N 2 1 308.469 4.319 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550610751 341319340 /nfs/dbraw/zinc/31/93/40/341319340.db2.gz RLWOKSFYOFRFTD-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 ZINC000550610751 341319341 /nfs/dbraw/zinc/31/93/41/341319341.db2.gz RLWOKSFYOFRFTD-RTBURBONSA-N 2 1 314.860 4.265 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000550610059 341319494 /nfs/dbraw/zinc/31/94/94/341319494.db2.gz LTPBXTXVLNNCFM-AYBZRNKSSA-N 2 1 314.498 4.104 20 0 DIADMP C[C@H](Cc1cccs1)[NH2+][C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000550610059 341319495 /nfs/dbraw/zinc/31/94/95/341319495.db2.gz LTPBXTXVLNNCFM-AYBZRNKSSA-N 2 1 314.498 4.104 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000551083651 341331068 /nfs/dbraw/zinc/33/10/68/341331068.db2.gz KIJLJIPUOOOWKP-SCWSEQNSSA-N 2 1 323.484 4.130 20 0 DIADMP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000551083651 341331069 /nfs/dbraw/zinc/33/10/69/341331069.db2.gz KIJLJIPUOOOWKP-SCWSEQNSSA-N 2 1 323.484 4.130 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CCCc2cccs2)C[C@H]1c1ccccc1 ZINC000551087615 341331363 /nfs/dbraw/zinc/33/13/63/341331363.db2.gz VEJCYHARWUXNAF-HKUYNNGSSA-N 2 1 314.498 4.106 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CCCc2cccs2)C[C@H]1c1ccccc1 ZINC000551087615 341331364 /nfs/dbraw/zinc/33/13/64/341331364.db2.gz VEJCYHARWUXNAF-HKUYNNGSSA-N 2 1 314.498 4.106 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]C2(c3ccccc3)CCC2)C[C@H]1c1ccccc1 ZINC000551114767 341332027 /nfs/dbraw/zinc/33/20/27/341332027.db2.gz HHHMARSDICFOSR-SFTDATJTSA-N 2 1 320.480 4.491 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]C2(c3ccccc3)CCC2)C[C@H]1c1ccccc1 ZINC000551114767 341332028 /nfs/dbraw/zinc/33/20/28/341332028.db2.gz HHHMARSDICFOSR-SFTDATJTSA-N 2 1 320.480 4.491 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@H]1c1ccccc1 ZINC000551176744 341333164 /nfs/dbraw/zinc/33/31/64/341333164.db2.gz CTWBOECGXNFULL-GJZGRUSLSA-N 2 1 314.395 4.000 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@H]1c1ccccc1 ZINC000551176744 341333165 /nfs/dbraw/zinc/33/31/65/341333165.db2.gz CTWBOECGXNFULL-GJZGRUSLSA-N 2 1 314.395 4.000 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@@H]1c1ccccc1 ZINC000551176745 341333232 /nfs/dbraw/zinc/33/32/32/341333232.db2.gz CTWBOECGXNFULL-HUUCEWRRSA-N 2 1 314.395 4.000 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+]CC(C)(C)C(F)(F)F)C[C@@H]1c1ccccc1 ZINC000551176745 341333233 /nfs/dbraw/zinc/33/32/33/341333233.db2.gz CTWBOECGXNFULL-HUUCEWRRSA-N 2 1 314.395 4.000 20 0 DIADMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCCc1ccc(Cl)s1 ZINC000551519895 341343662 /nfs/dbraw/zinc/34/36/62/341343662.db2.gz LBMFRXKEXSYDAF-VNHYZAJKSA-N 2 1 314.926 4.043 20 0 DIADMP CCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000551541664 341344744 /nfs/dbraw/zinc/34/47/44/341344744.db2.gz ULOVGIIVBGAXAY-MRXNPFEDSA-N 2 1 316.489 4.143 20 0 DIADMP C/C(=C\c1ccccc1)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246476792 341350153 /nfs/dbraw/zinc/35/01/53/341350153.db2.gz ORGHDKXWYYXBHH-DFHALEPISA-N 2 1 310.485 4.039 20 0 DIADMP C/C(=C\c1ccccc1)C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246476792 341350154 /nfs/dbraw/zinc/35/01/54/341350154.db2.gz ORGHDKXWYYXBHH-DFHALEPISA-N 2 1 310.485 4.039 20 0 DIADMP C/C(=C\c1ccccc1)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246476792 341350155 /nfs/dbraw/zinc/35/01/55/341350155.db2.gz ORGHDKXWYYXBHH-DFHALEPISA-N 2 1 310.485 4.039 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000247075177 341360659 /nfs/dbraw/zinc/36/06/59/341360659.db2.gz QJRWLBXFZHPECK-IAGOWNOFSA-N 2 1 311.473 4.006 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc3ccccc3n2)C1 ZINC000247075177 341360660 /nfs/dbraw/zinc/36/06/60/341360660.db2.gz QJRWLBXFZHPECK-IAGOWNOFSA-N 2 1 311.473 4.006 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(C(C)(C)C)nc2C)C1 ZINC000247160820 341361697 /nfs/dbraw/zinc/36/16/97/341361697.db2.gz UDRKKVJUIDNSBI-UKRRQHHQSA-N 2 1 323.550 4.132 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248408277 341376987 /nfs/dbraw/zinc/37/69/87/341376987.db2.gz VIPRKIAJZPYSKD-PMPSAXMXSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1ccccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248408277 341376988 /nfs/dbraw/zinc/37/69/88/341376988.db2.gz VIPRKIAJZPYSKD-PMPSAXMXSA-N 2 1 304.453 4.129 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000248409009 341377005 /nfs/dbraw/zinc/37/70/05/341377005.db2.gz WDEBHFPJDZCJIY-NBQZKYEYSA-N 2 1 316.464 4.056 20 0 DIADMP c1csc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CCC34CCCC4)C2)c1 ZINC000249152301 341394747 /nfs/dbraw/zinc/39/47/47/341394747.db2.gz XYGZKLIXBIIINW-AEFFLSMTSA-N 2 1 318.530 4.273 20 0 DIADMP c1csc(C[N@@H+]2CCC[C@H](C[NH2+][C@H]3CCC34CCCC4)C2)c1 ZINC000249152301 341394748 /nfs/dbraw/zinc/39/47/48/341394748.db2.gz XYGZKLIXBIIINW-AEFFLSMTSA-N 2 1 318.530 4.273 20 0 DIADMP CC(C)Oc1cccc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)c1 ZINC000261951335 341510225 /nfs/dbraw/zinc/51/02/25/341510225.db2.gz WHWGXFWATDWVAV-KPOBHBOGSA-N 2 1 310.441 4.269 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc(C)c(F)c(C)c1 ZINC000164710662 341707134 /nfs/dbraw/zinc/70/71/34/341707134.db2.gz DYDDFCSGAQDPKN-HNNXBMFYSA-N 2 1 303.425 4.078 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cccc2ccccc21 ZINC000177370379 341919146 /nfs/dbraw/zinc/91/91/46/341919146.db2.gz UCMSBZNGMOZBOG-INIZCTEOSA-N 2 1 307.441 4.476 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000236668234 519629096 /nfs/dbraw/zinc/62/90/96/519629096.db2.gz DLNLFGLLQWXPME-UHFFFAOYSA-N 2 1 321.468 4.298 20 0 DIADMP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2cnc3ccsc3c2)CC1 ZINC000131217742 519720726 /nfs/dbraw/zinc/72/07/26/519720726.db2.gz HOGSNPRJJSEFCC-CQSZACIVSA-N 2 1 317.502 4.067 20 0 DIADMP CC[C@H]([NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccncc1 ZINC000163714729 522693707 /nfs/dbraw/zinc/69/37/07/522693707.db2.gz LXKNWMBAQRCBSD-YWZLYKJASA-N 2 1 320.440 4.378 20 0 DIADMP C[C@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1 ZINC000188055472 524481544 /nfs/dbraw/zinc/48/15/44/524481544.db2.gz FPHZSIQEWTTYTH-TZUVLKIQSA-N 2 1 306.881 4.048 20 0 DIADMP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)o1 ZINC000158143221 525746084 /nfs/dbraw/zinc/74/60/84/525746084.db2.gz DMYBHOXZQCZOQB-HUUCEWRRSA-N 2 1 309.413 4.494 20 0 DIADMP Cc1ccc([C@H]([NH2+]CCCn2cc[nH+]c2C)C2CCCC2)o1 ZINC000338026090 525969094 /nfs/dbraw/zinc/96/90/94/525969094.db2.gz ZNBCEKMDSPUXFH-GOSISDBHSA-N 2 1 301.434 4.004 20 0 DIADMP Cc1cncc([C@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1 ZINC000364179702 526216167 /nfs/dbraw/zinc/21/61/67/526216167.db2.gz WMGVBFBRDGPLNV-KRWDZBQOSA-N 2 1 315.505 4.085 20 0 DIADMP Cc1nc2c(s1)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)CCC2 ZINC000157885842 527111649 /nfs/dbraw/zinc/11/16/49/527111649.db2.gz JYBFCQYSESVIDN-GOEBONIOSA-N 2 1 321.534 4.073 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000338008068 527422540 /nfs/dbraw/zinc/42/25/40/527422540.db2.gz OXUWBRHXMCUARG-OAHLLOKOSA-N 2 1 324.255 4.166 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000338009257 527422716 /nfs/dbraw/zinc/42/27/16/527422716.db2.gz BSAYIYVRIVTUQL-LLVKDONJSA-N 2 1 312.244 4.239 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H]1CCc2c1cc(Cl)cc2Cl ZINC000338011754 527425397 /nfs/dbraw/zinc/42/53/97/527425397.db2.gz OOIJBZRHOQDNGU-INIZCTEOSA-N 2 1 324.255 4.166 20 0 DIADMP CC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2C)nc1)c1cccc(C)c1 ZINC000286222804 535914778 /nfs/dbraw/zinc/91/47/78/535914778.db2.gz SMDJAXGOAKDUNR-IBGZPJMESA-N 2 1 320.440 4.125 20 0 DIADMP Cc1cc2ccccc2c(N2CCCC[C@H]2CC[NH+]2CCCC2)[nH+]1 ZINC001165046863 721973130 /nfs/dbraw/zinc/97/31/30/721973130.db2.gz CKNBIICXLPKVQT-IBGZPJMESA-N 2 1 323.484 4.388 20 0 DIADMP CCCCCC[C@H](CCC)[N@H+]1CC[C@H]([NH3+])[C@@H](C(F)(F)F)C1 ZINC001246941567 1059191562 /nfs/dbraw/zinc/19/15/62/1059191562.db2.gz WHCRDBNOWYYXTP-KKUMJFAQSA-N 2 1 308.432 4.337 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH2+]C3CCC4(CC4)CC3)C2)cc1 ZINC000683079281 1035513198 /nfs/dbraw/zinc/51/31/98/1035513198.db2.gz LXXVGOBZXAZRKA-LJQANCHMSA-N 2 1 312.501 4.211 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(Cl)cc1Cl ZINC000643545966 1035587901 /nfs/dbraw/zinc/58/79/01/1035587901.db2.gz GKIFLEYXWAVZQW-WCQYABFASA-N 2 1 313.272 4.319 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cc(Cl)cc(Cl)c1 ZINC000643546021 1035591261 /nfs/dbraw/zinc/59/12/61/1035591261.db2.gz HDAQXWNOEDBKOV-IAQYHMDHSA-N 2 1 313.272 4.319 20 0 DIADMP Clc1cccc2c1SCC[C@@H]2[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546091 1035591510 /nfs/dbraw/zinc/59/15/10/1035591510.db2.gz IEVSKVOFMYFOPB-WFASDCNBSA-N 2 1 322.905 4.141 20 0 DIADMP Cc1ccc([C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C2CCCC2)o1 ZINC000643548659 1035606748 /nfs/dbraw/zinc/60/67/48/1035606748.db2.gz SUCUWERXWKQLSB-AEFFLSMTSA-N 2 1 302.462 4.084 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc2cccc(F)c2o1 ZINC000530544646 1036164858 /nfs/dbraw/zinc/16/48/58/1036164858.db2.gz HGCHOYGFUNKHBA-CYBMUJFWSA-N 2 1 316.420 4.097 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccsc1 ZINC000398123900 1036243574 /nfs/dbraw/zinc/24/35/74/1036243574.db2.gz HSWQHDDKVNMQRG-JTDSTZFVSA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccsc1 ZINC000398123900 1036243596 /nfs/dbraw/zinc/24/35/96/1036243596.db2.gz HSWQHDDKVNMQRG-JTDSTZFVSA-N 2 1 314.498 4.309 20 0 DIADMP CCC[N@@H+](C)C[C@@H](C[NH+](C)Cc1ccccc1)c1ccccc1 ZINC001167199316 1036264916 /nfs/dbraw/zinc/26/49/16/1036264916.db2.gz LXJVVBIBRTXNGW-NRFANRHFSA-N 2 1 310.485 4.244 20 0 DIADMP CCC[NH+](C)C[C@@H](C[N@H+](C)Cc1ccccc1)c1ccccc1 ZINC001167199316 1036264929 /nfs/dbraw/zinc/26/49/29/1036264929.db2.gz LXJVVBIBRTXNGW-NRFANRHFSA-N 2 1 310.485 4.244 20 0 DIADMP CCC[NH+](C)C[C@@H](C[N@@H+](C)Cc1ccccc1)c1ccccc1 ZINC001167199316 1036264943 /nfs/dbraw/zinc/26/49/43/1036264943.db2.gz LXJVVBIBRTXNGW-NRFANRHFSA-N 2 1 310.485 4.244 20 0 DIADMP CC[C@@H](C)[N@H+](CCCn1cc[nH+]c1C)CCc1ccccc1F ZINC001167244714 1036313561 /nfs/dbraw/zinc/31/35/61/1036313561.db2.gz ZFXMZIJMJICWSY-MRXNPFEDSA-N 2 1 317.452 4.064 20 0 DIADMP CC[C@@H](C)[N@@H+](CCCn1cc[nH+]c1C)CCc1ccccc1F ZINC001167244714 1036313574 /nfs/dbraw/zinc/31/35/74/1036313574.db2.gz ZFXMZIJMJICWSY-MRXNPFEDSA-N 2 1 317.452 4.064 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@H+]([C@@H]3CCc4ccccc43)C2)CC1 ZINC001167256537 1036328779 /nfs/dbraw/zinc/32/87/79/1036328779.db2.gz ZDAZTIBYSQHTJG-WIYYLYMNSA-N 2 1 312.501 4.118 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+]([C@H]3CCc4ccccc43)C2)CC1 ZINC001167256536 1036330439 /nfs/dbraw/zinc/33/04/39/1036330439.db2.gz ZDAZTIBYSQHTJG-RXVVDRJESA-N 2 1 312.501 4.118 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(C2CC2)CCC1 ZINC000537952909 1036355802 /nfs/dbraw/zinc/35/58/02/1036355802.db2.gz XYBVSZBQKFMKFV-YLJYHZDGSA-N 2 1 312.501 4.067 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cccc(F)c1F ZINC000538453658 1036378351 /nfs/dbraw/zinc/37/83/51/1036378351.db2.gz BBWCRXIFBNLOLJ-HUUCEWRRSA-N 2 1 310.432 4.128 20 0 DIADMP C1C[C@@H]2C[C@@H]([NH2+]C3CCC(C4CCCCC4)CC3)CC[N@H+]2C1 ZINC000683471381 1036422122 /nfs/dbraw/zinc/42/21/22/1036422122.db2.gz HBSFVDZUHOCTJO-GHBBCFCZSA-N 2 1 304.522 4.342 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CS1 ZINC000655715671 1036498894 /nfs/dbraw/zinc/49/88/94/1036498894.db2.gz NBNMGFFAJWHTOI-WBTNSWJXSA-N 2 1 324.559 4.005 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)CS1 ZINC000655715671 1036498882 /nfs/dbraw/zinc/49/88/82/1036498882.db2.gz NBNMGFFAJWHTOI-WBTNSWJXSA-N 2 1 324.559 4.005 20 0 DIADMP Cc1cc(Cl)ccc1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC001648817126 1036579122 /nfs/dbraw/zinc/57/91/22/1036579122.db2.gz VWPUOULZRUQUCY-OAHLLOKOSA-N 2 1 308.897 4.250 20 0 DIADMP CCc1cccc(C[NH2+]C2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC001648826423 1036600572 /nfs/dbraw/zinc/60/05/72/1036600572.db2.gz GLRGZDKUOJUUCB-UHFFFAOYSA-N 2 1 322.496 4.312 20 0 DIADMP Cc1ccccc1C[NH+]1CCC([NH2+]C[C@@H]2CCCC[C@@H]2C)CC1 ZINC001648826618 1036604519 /nfs/dbraw/zinc/60/45/19/1036604519.db2.gz LVLJRLYAJOVLEJ-HKUYNNGSSA-N 2 1 314.517 4.375 20 0 DIADMP CCc1cccc2cc(C[NH2+]C[C@H](C)C[NH+]3CCCCC3)oc21 ZINC001648882378 1036669916 /nfs/dbraw/zinc/66/99/16/1036669916.db2.gz LOWUBRLQYHCKFR-INIZCTEOSA-N 2 1 314.473 4.207 20 0 DIADMP COCCC1(C[NH2+]C[C@@]2([NH+](C)C)CCC[C@H](C)C2)CCCCC1 ZINC001648895830 1036679791 /nfs/dbraw/zinc/67/97/91/1036679791.db2.gz ZREUMPKLFXRZIM-AZUAARDMSA-N 2 1 324.553 4.074 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)c1 ZINC000340472723 1036692384 /nfs/dbraw/zinc/69/23/84/1036692384.db2.gz AGVJGOAXPROCBI-HXUWFJFHSA-N 2 1 324.468 4.011 20 0 DIADMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006012 1036712958 /nfs/dbraw/zinc/71/29/58/1036712958.db2.gz HXQFVGXQEQUNBX-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006012 1036712968 /nfs/dbraw/zinc/71/29/68/1036712968.db2.gz HXQFVGXQEQUNBX-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006012 1036712984 /nfs/dbraw/zinc/71/29/84/1036712984.db2.gz HXQFVGXQEQUNBX-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000580006012 1036713004 /nfs/dbraw/zinc/71/30/04/1036713004.db2.gz HXQFVGXQEQUNBX-CRAIPNDOSA-N 2 1 314.498 4.187 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC(C)(C)C1 ZINC000398014166 1037083064 /nfs/dbraw/zinc/08/30/64/1037083064.db2.gz FJPYLHDIXVHKNN-NZSAHSFTSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCC(C)(C)C1 ZINC000398014166 1037083075 /nfs/dbraw/zinc/08/30/75/1037083075.db2.gz FJPYLHDIXVHKNN-NZSAHSFTSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398019148 1037083105 /nfs/dbraw/zinc/08/31/05/1037083105.db2.gz JCSKRLVSTIEYAJ-HNJRGHQBSA-N 2 1 300.490 4.065 20 0 DIADMP CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000398019148 1037083122 /nfs/dbraw/zinc/08/31/22/1037083122.db2.gz JCSKRLVSTIEYAJ-HNJRGHQBSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCCCCC1 ZINC000398020339 1037084265 /nfs/dbraw/zinc/08/42/65/1037084265.db2.gz JVUXGEFLWVMDQP-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C1CCCCCC1 ZINC000398020339 1037084279 /nfs/dbraw/zinc/08/42/79/1037084279.db2.gz JVUXGEFLWVMDQP-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP CCc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000398023178 1037084698 /nfs/dbraw/zinc/08/46/98/1037084698.db2.gz KWHYCSMFSXAMGL-PGRDOPGGSA-N 2 1 322.496 4.249 20 0 DIADMP C[C@H]([NH2+]CCCc1c(Cl)cccc1Cl)c1c[nH+]ccc1N ZINC000656200513 1037091888 /nfs/dbraw/zinc/09/18/88/1037091888.db2.gz NZTCHAKPQHBJBA-NSHDSACASA-N 2 1 324.255 4.084 20 0 DIADMP CC[C@H](CC(F)F)C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC001167424235 1037227930 /nfs/dbraw/zinc/22/79/30/1037227930.db2.gz FDUZZPJIDIYLKQ-ZACQAIPSSA-N 2 1 316.480 4.254 20 0 DIADMP CC[C@H](CC(F)F)C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC001167424235 1037227941 /nfs/dbraw/zinc/22/79/41/1037227941.db2.gz FDUZZPJIDIYLKQ-ZACQAIPSSA-N 2 1 316.480 4.254 20 0 DIADMP CC(C)Cc1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC001167429235 1037243908 /nfs/dbraw/zinc/24/39/08/1037243908.db2.gz HUPVNWUBXWWMCD-OAQYLSRUSA-N 2 1 314.517 4.193 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(C)c1 ZINC001167429872 1037247942 /nfs/dbraw/zinc/24/79/42/1037247942.db2.gz NRANUTTZTWQVCV-UXHICEINSA-N 2 1 314.517 4.481 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)C[C@@H]1C ZINC000398227133 1037296388 /nfs/dbraw/zinc/29/63/88/1037296388.db2.gz YIEOCDFQGJHQAK-WQBVUOOHSA-N 2 1 314.517 4.311 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C[C@@H]1C ZINC000398227133 1037296400 /nfs/dbraw/zinc/29/64/00/1037296400.db2.gz YIEOCDFQGJHQAK-WQBVUOOHSA-N 2 1 314.517 4.311 20 0 DIADMP CC[C@@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCCc1c[nH+]cn1C ZINC000581259097 1037502683 /nfs/dbraw/zinc/50/26/83/1037502683.db2.gz XVZALTDCBSPHMU-VQTJNVASSA-N 2 1 311.473 4.011 20 0 DIADMP CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1CCCc1c[nH+]cn1C ZINC000581259097 1037502698 /nfs/dbraw/zinc/50/26/98/1037502698.db2.gz XVZALTDCBSPHMU-VQTJNVASSA-N 2 1 311.473 4.011 20 0 DIADMP Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477559 1037888171 /nfs/dbraw/zinc/88/81/71/1037888171.db2.gz GHEOGMNNRANONF-YLJYHZDGSA-N 2 1 311.473 4.134 20 0 DIADMP Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2CCCc2c[nH+]cn2C)cc1 ZINC001167477559 1037888180 /nfs/dbraw/zinc/88/81/80/1037888180.db2.gz GHEOGMNNRANONF-YLJYHZDGSA-N 2 1 311.473 4.134 20 0 DIADMP CSCCCC[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000602556191 1038036677 /nfs/dbraw/zinc/03/66/77/1038036677.db2.gz JJHDDCNFECLFGD-PKOBYXMFSA-N 2 1 318.530 4.087 20 0 DIADMP CSCCCC[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000602556191 1038036695 /nfs/dbraw/zinc/03/66/95/1038036695.db2.gz JJHDDCNFECLFGD-PKOBYXMFSA-N 2 1 318.530 4.087 20 0 DIADMP c1[nH+]c(C2CC[NH+]([C@@H]3C=CCCCCC3)CC2)n2c1CCCC2 ZINC000559187278 1038043021 /nfs/dbraw/zinc/04/30/21/1038043021.db2.gz SAQROEDTLVJRLS-GOSISDBHSA-N 2 1 313.489 4.288 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2s1 ZINC000126482292 1038106959 /nfs/dbraw/zinc/10/69/59/1038106959.db2.gz ZYMPPUUGBSTVDG-UONOGXRCSA-N 2 1 300.471 4.036 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2s1 ZINC000126482040 1038107776 /nfs/dbraw/zinc/10/77/76/1038107776.db2.gz ZYMPPUUGBSTVDG-KGLIPLIRSA-N 2 1 300.471 4.036 20 0 DIADMP CCCC[C@H]([NH2+]CC[C@@H]1CCC[N@H+]1C)c1ccc(OC)cc1 ZINC000341796733 1038269371 /nfs/dbraw/zinc/26/93/71/1038269371.db2.gz JEKXZKZYGLUGAL-HKUYNNGSSA-N 2 1 304.478 4.000 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC000535685720 1038315595 /nfs/dbraw/zinc/31/55/95/1038315595.db2.gz LOPXWTBMDPXZRF-RDTXWAMCSA-N 2 1 306.881 4.039 20 0 DIADMP CCC[N@H+]1CC[C@@H](CN[C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000151113558 1038432015 /nfs/dbraw/zinc/43/20/15/1038432015.db2.gz TXWDIWQGJJNAES-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000151113558 1038432020 /nfs/dbraw/zinc/43/20/20/1038432020.db2.gz TXWDIWQGJJNAES-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000151113558 1038432024 /nfs/dbraw/zinc/43/20/24/1038432024.db2.gz TXWDIWQGJJNAES-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP CCc1cccc2cc(C[NH2+]C3CC[NH+](C4CCC4)CC3)oc21 ZINC000657334346 1038576102 /nfs/dbraw/zinc/57/61/02/1038576102.db2.gz WTRHUISBJAOWKP-UHFFFAOYSA-N 2 1 312.457 4.102 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccc(C)cc3[nH]2)c1 ZINC000657348372 1038592548 /nfs/dbraw/zinc/59/25/48/1038592548.db2.gz TYGZQZZZILHYDQ-UHFFFAOYSA-N 2 1 321.468 4.218 20 0 DIADMP CC(C)[NH2+]C1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000108369792 1038599429 /nfs/dbraw/zinc/59/94/29/1038599429.db2.gz FGLLSVZLRFMUDT-ZDUSSCGKSA-N 2 1 314.395 4.229 20 0 DIADMP CC(C)(C)c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000606447737 1038603085 /nfs/dbraw/zinc/60/30/85/1038603085.db2.gz BJNWNSZUTLUYCO-HXUWFJFHSA-N 2 1 314.517 4.434 20 0 DIADMP C1=C(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCC1 ZINC001167553655 1038608462 /nfs/dbraw/zinc/60/84/62/1038608462.db2.gz GVXCJYRIWHYADP-NRFANRHFSA-N 2 1 310.485 4.085 20 0 DIADMP C1=C(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)CCC1 ZINC001167553655 1038608465 /nfs/dbraw/zinc/60/84/65/1038608465.db2.gz GVXCJYRIWHYADP-NRFANRHFSA-N 2 1 310.485 4.085 20 0 DIADMP C1=C(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)CCC1 ZINC001167553655 1038608467 /nfs/dbraw/zinc/60/84/67/1038608467.db2.gz GVXCJYRIWHYADP-NRFANRHFSA-N 2 1 310.485 4.085 20 0 DIADMP C[N@@H+]1CCC[C@@H]1CC[NH+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599369 1038759409 /nfs/dbraw/zinc/75/94/09/1038759409.db2.gz TUWONCPJIJEIQG-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599369 1038759414 /nfs/dbraw/zinc/75/94/14/1038759414.db2.gz TUWONCPJIJEIQG-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599369 1038759421 /nfs/dbraw/zinc/75/94/21/1038759421.db2.gz TUWONCPJIJEIQG-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC001167599369 1038759429 /nfs/dbraw/zinc/75/94/29/1038759429.db2.gz TUWONCPJIJEIQG-QGZVFWFLSA-N 2 1 322.443 4.194 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC[N@H+]1C ZINC000608061589 1038761300 /nfs/dbraw/zinc/76/13/00/1038761300.db2.gz ZIYUBZVSTSXYTE-PKOBYXMFSA-N 2 1 323.484 4.027 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000608061142 1038761346 /nfs/dbraw/zinc/76/13/46/1038761346.db2.gz ABCQFCGHOYBLCI-XLIONFOSSA-N 2 1 308.469 4.234 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@@H+]1C ZINC000608061591 1038761983 /nfs/dbraw/zinc/76/19/83/1038761983.db2.gz ZJUQMEOIDQSMIR-CJNGLKHVSA-N 2 1 318.461 4.127 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC[N@H+]1C ZINC000608061591 1038761985 /nfs/dbraw/zinc/76/19/85/1038761985.db2.gz ZJUQMEOIDQSMIR-CJNGLKHVSA-N 2 1 318.461 4.127 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000342861621 1038927577 /nfs/dbraw/zinc/92/75/77/1038927577.db2.gz YILRDYQAUANEKR-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000342861621 1038927591 /nfs/dbraw/zinc/92/75/91/1038927591.db2.gz YILRDYQAUANEKR-KRWDZBQOSA-N 2 1 303.837 4.072 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC000342860556 1038928078 /nfs/dbraw/zinc/92/80/78/1038928078.db2.gz PEWNQIFWVHIQBZ-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC000342860556 1038928093 /nfs/dbraw/zinc/92/80/93/1038928093.db2.gz PEWNQIFWVHIQBZ-FQEVSTJZSA-N 2 1 311.473 4.069 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000342864766 1038930594 /nfs/dbraw/zinc/93/05/94/1038930594.db2.gz QJZAJLHXNCMDJX-AWEZNQCLSA-N 2 1 317.864 4.461 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000342864766 1038930609 /nfs/dbraw/zinc/93/06/09/1038930609.db2.gz QJZAJLHXNCMDJX-AWEZNQCLSA-N 2 1 317.864 4.461 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1CC1CCC(F)(F)CC1 ZINC001207346753 1039082737 /nfs/dbraw/zinc/08/27/37/1039082737.db2.gz AAROEWSSZFVYRL-IRXDYDNUSA-N 2 1 314.464 4.151 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000643346344 1039102089 /nfs/dbraw/zinc/10/20/89/1039102089.db2.gz XFSVPRKKKBEITC-FCLXEUQJSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000643346344 1039102096 /nfs/dbraw/zinc/10/20/96/1039102096.db2.gz XFSVPRKKKBEITC-FCLXEUQJSA-N 2 1 324.871 4.015 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000150766391 1039149020 /nfs/dbraw/zinc/14/90/20/1039149020.db2.gz IKJHXOPAXCPEIA-KRWDZBQOSA-N 2 1 318.464 4.174 20 0 DIADMP CC(C)[C@H]1CC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000561315273 1039206988 /nfs/dbraw/zinc/20/69/88/1039206988.db2.gz XQEMMFNEASVSTO-JAGQDSLRSA-N 2 1 312.501 4.206 20 0 DIADMP CO[C@H](CC(C)C)C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC001167659864 1039208747 /nfs/dbraw/zinc/20/87/47/1039208747.db2.gz VYCQIWFGUHBNPQ-AZUAARDMSA-N 2 1 324.553 4.024 20 0 DIADMP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cc2ccccc2o1 ZINC000539547083 1039286334 /nfs/dbraw/zinc/28/63/34/1039286334.db2.gz NTHFUBGDHFFWMU-DNVCBOLYSA-N 2 1 300.446 4.061 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756772 1039305942 /nfs/dbraw/zinc/30/59/42/1039305942.db2.gz IIOVFXRCUQXRQD-VQTJNVASSA-N 2 1 312.501 4.208 20 0 DIADMP CC(C)[C@@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)C1CC1 ZINC000657756772 1039305962 /nfs/dbraw/zinc/30/59/62/1039305962.db2.gz IIOVFXRCUQXRQD-VQTJNVASSA-N 2 1 312.501 4.208 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824073 1039341025 /nfs/dbraw/zinc/34/10/25/1039341025.db2.gz VEIIBWFBWKEUIY-KRWDZBQOSA-N 2 1 312.457 4.110 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824073 1039341047 /nfs/dbraw/zinc/34/10/47/1039341047.db2.gz VEIIBWFBWKEUIY-KRWDZBQOSA-N 2 1 312.457 4.110 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824073 1039341066 /nfs/dbraw/zinc/34/10/66/1039341066.db2.gz VEIIBWFBWKEUIY-KRWDZBQOSA-N 2 1 312.457 4.110 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000539824073 1039341074 /nfs/dbraw/zinc/34/10/74/1039341074.db2.gz VEIIBWFBWKEUIY-KRWDZBQOSA-N 2 1 312.457 4.110 20 0 DIADMP CC[N@H+](CCC1CCN(c2cc[nH+]cc2Cl)CC1)CC1CC1 ZINC000540026065 1039404083 /nfs/dbraw/zinc/40/40/83/1039404083.db2.gz XRGPVPAWSUHCDV-UHFFFAOYSA-N 2 1 321.896 4.073 20 0 DIADMP CC[N@@H+](CCC1CCN(c2cc[nH+]cc2Cl)CC1)CC1CC1 ZINC000540026065 1039404097 /nfs/dbraw/zinc/40/40/97/1039404097.db2.gz XRGPVPAWSUHCDV-UHFFFAOYSA-N 2 1 321.896 4.073 20 0 DIADMP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1 ZINC000540147523 1039426663 /nfs/dbraw/zinc/42/66/63/1039426663.db2.gz ADHDSBPTILNELM-MSOLQXFVSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC000540162269 1039440374 /nfs/dbraw/zinc/44/03/74/1039440374.db2.gz IBGPPHHTSKEILG-NXHRZFHOSA-N 2 1 322.443 4.207 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCCC(F)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC000540162269 1039440382 /nfs/dbraw/zinc/44/03/82/1039440382.db2.gz IBGPPHHTSKEILG-NXHRZFHOSA-N 2 1 322.443 4.207 20 0 DIADMP CC(C)[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Cl)cc1 ZINC000540261591 1039464315 /nfs/dbraw/zinc/46/43/15/1039464315.db2.gz JHORQZNOTKANCE-KDOFPFPSSA-N 2 1 306.881 4.111 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000540259874 1039464605 /nfs/dbraw/zinc/46/46/05/1039464605.db2.gz YLDBMNIHOYPHPX-PXNSSMCTSA-N 2 1 300.490 4.382 20 0 DIADMP Cc1cc([C@H]([NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)C2CC2)ccc1F ZINC000540299879 1039469008 /nfs/dbraw/zinc/46/90/08/1039469008.db2.gz UIRGMTMCAUOJOE-OXJNMPFZSA-N 2 1 318.480 4.295 20 0 DIADMP CCC[C@H](C[N@@H+](C)C1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000540507358 1039507455 /nfs/dbraw/zinc/50/74/55/1039507455.db2.gz MYHPOIZGLIARIM-LJQANCHMSA-N 2 1 302.506 4.375 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)C1 ZINC000540591702 1039520295 /nfs/dbraw/zinc/52/02/95/1039520295.db2.gz NKLJVEFBCTWQEW-QAPCUYQASA-N 2 1 306.469 4.234 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000540653105 1039535556 /nfs/dbraw/zinc/53/55/56/1039535556.db2.gz QWGOEGDTNKNSCC-UZLBHIALSA-N 2 1 314.473 4.451 20 0 DIADMP C[NH+]1CCC([NH2+][C@H]2CCCC[C@H]2c2ccccc2Cl)CC1 ZINC000657823904 1039587151 /nfs/dbraw/zinc/58/71/51/1039587151.db2.gz PYRVQSMELVHRBH-WMZOPIPTSA-N 2 1 306.881 4.050 20 0 DIADMP CC(C)C[C@H](C)C[NH2+]C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000708501029 1039678682 /nfs/dbraw/zinc/67/86/82/1039678682.db2.gz ARXWGDFCCLBLNJ-NLWGTHIKSA-N 2 1 302.506 4.026 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)C(C)(C)C(F)F)c1 ZINC000657858038 1039761064 /nfs/dbraw/zinc/76/10/64/1039761064.db2.gz WFBFUJINVMCAEA-CQSZACIVSA-N 2 1 312.448 4.296 20 0 DIADMP Cc1ccc(CC[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000492602778 1039987724 /nfs/dbraw/zinc/98/77/24/1039987724.db2.gz QOGVQMYDYFGZPV-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCSCC2)[C@@H]1c1cccs1 ZINC000657886381 1039997263 /nfs/dbraw/zinc/99/72/63/1039997263.db2.gz FJJHPQMQAZNKPF-BFYDXBDKSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCSCC2)[C@@H]1c1cccs1 ZINC000657886381 1039997279 /nfs/dbraw/zinc/99/72/79/1039997279.db2.gz FJJHPQMQAZNKPF-BFYDXBDKSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCSCC2)[C@H]1c1cccs1 ZINC000657886383 1039997371 /nfs/dbraw/zinc/99/73/71/1039997371.db2.gz FJJHPQMQAZNKPF-INMHGKMJSA-N 2 1 324.559 4.006 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCSCC2)[C@H]1c1cccs1 ZINC000657886383 1039997383 /nfs/dbraw/zinc/99/73/83/1039997383.db2.gz FJJHPQMQAZNKPF-INMHGKMJSA-N 2 1 324.559 4.006 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000309719926 1040089564 /nfs/dbraw/zinc/08/95/64/1040089564.db2.gz LWYAPIZADXLWQI-PZJWPPBQSA-N 2 1 308.469 4.249 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1 ZINC000309704558 1040090827 /nfs/dbraw/zinc/09/08/27/1040090827.db2.gz HJSNZNVLWBTRDJ-XYJFISCASA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccs1 ZINC000309751920 1040092820 /nfs/dbraw/zinc/09/28/20/1040092820.db2.gz ZRHOUEDQSMSNED-XYJFISCASA-N 2 1 314.498 4.309 20 0 DIADMP C[C@H]([NH2+][C@H]1CCCC[C@H]1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309749957 1040093838 /nfs/dbraw/zinc/09/38/38/1040093838.db2.gz ZAHBHBNFLGZDBW-BWPNAZKDSA-N 2 1 300.490 4.065 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000309868446 1040096291 /nfs/dbraw/zinc/09/62/91/1040096291.db2.gz QEZNLJWKXUKLJW-PKOBYXMFSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)C1(C)CC1 ZINC000309868443 1040098490 /nfs/dbraw/zinc/09/84/90/1040098490.db2.gz QEZNLJWKXUKLJW-HKUYNNGSSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901114 1040099179 /nfs/dbraw/zinc/09/91/79/1040099179.db2.gz NTMSVGBZAMDXAS-BFYDXBDKSA-N 2 1 324.459 4.309 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C(F)F ZINC000657901114 1040099201 /nfs/dbraw/zinc/09/92/01/1040099201.db2.gz NTMSVGBZAMDXAS-BFYDXBDKSA-N 2 1 324.459 4.309 20 0 DIADMP C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)C1 ZINC000309885435 1040099214 /nfs/dbraw/zinc/09/92/14/1040099214.db2.gz YVJCVHWPTQXCSY-HOJAQTOUSA-N 2 1 300.490 4.067 20 0 DIADMP C[C@H](CC1CC1)[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000309967468 1040102454 /nfs/dbraw/zinc/10/24/54/1040102454.db2.gz LTDOGYFNQAYQBY-XLIONFOSSA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@H](Cc1ccccc1)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310080404 1040105390 /nfs/dbraw/zinc/10/53/90/1040105390.db2.gz IUPZTYZXKGEZJJ-FGZHOGPDSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@H]([NH2+][C@H]1CCc2ccccc21)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310197481 1040112409 /nfs/dbraw/zinc/11/24/09/1040112409.db2.gz ASZVBOGXECCEQN-WEYGHZABSA-N 2 1 320.480 4.174 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)C1CCCC1 ZINC000309712038 1040210100 /nfs/dbraw/zinc/21/01/00/1040210100.db2.gz JQVXIZNJXFFEGY-YLJYHZDGSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1ccc(C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000309751380 1040249150 /nfs/dbraw/zinc/24/91/50/1040249150.db2.gz VXKAOSXLVZQNPM-IBGZPJMESA-N 2 1 314.498 4.058 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)cc1 ZINC000658218144 1040375220 /nfs/dbraw/zinc/37/52/20/1040375220.db2.gz CMPDWEVEVNOPTE-DYVFJYSZSA-N 2 1 319.399 4.267 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C1CC1 ZINC000658299958 1040410668 /nfs/dbraw/zinc/41/06/68/1040410668.db2.gz IQZXLTSLJKQSAI-MXEMCNAFSA-N 2 1 312.501 4.206 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000531140064 1040619771 /nfs/dbraw/zinc/61/97/71/1040619771.db2.gz HBRJNUWVCJMSHE-XJKSGUPXSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000531140064 1040619781 /nfs/dbraw/zinc/61/97/81/1040619781.db2.gz HBRJNUWVCJMSHE-XJKSGUPXSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000531140064 1040619788 /nfs/dbraw/zinc/61/97/88/1040619788.db2.gz HBRJNUWVCJMSHE-XJKSGUPXSA-N 2 1 314.395 4.010 20 0 DIADMP C[C@@H]1CCCCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC000309583006 1040709770 /nfs/dbraw/zinc/70/97/70/1040709770.db2.gz PFEJAESHZDFKQC-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Cl)c1Cl ZINC000161590393 1040723893 /nfs/dbraw/zinc/72/38/93/1040723893.db2.gz MUSNMWADQZDBRX-RWMBFGLXSA-N 2 1 313.272 4.271 20 0 DIADMP c1cc2c(o1)CCC[C@H]2[NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310078675 1040749344 /nfs/dbraw/zinc/74/93/44/1040749344.db2.gz HPSMSGIKMHUURX-UYAOXDASSA-N 2 1 324.468 4.159 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)[C@H]1C[C@H]1C ZINC000414131123 1040903258 /nfs/dbraw/zinc/90/32/58/1040903258.db2.gz XLEJQDDQNFESNO-IMPIEMTGSA-N 2 1 306.519 4.155 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)[C@H]1C[C@H]1C ZINC000414131123 1040903281 /nfs/dbraw/zinc/90/32/81/1040903281.db2.gz XLEJQDDQNFESNO-IMPIEMTGSA-N 2 1 306.519 4.155 20 0 DIADMP C[C@H]1C[C@@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)CC(C)(C)C1 ZINC000708833463 1040912606 /nfs/dbraw/zinc/91/26/06/1040912606.db2.gz CHPCXGWZMZVMAQ-DFQSSKMNSA-N 2 1 314.517 4.313 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)c1cc2ccccc2s1 ZINC000414173113 1040954497 /nfs/dbraw/zinc/95/44/97/1040954497.db2.gz FLDKPWJEINBQAQ-CABCVRRESA-N 2 1 302.487 4.284 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1 ZINC000414173000 1040956279 /nfs/dbraw/zinc/95/62/79/1040956279.db2.gz FXWXOOSIAIBEFU-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP Cc1c2ccccc2oc1[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000414175064 1040957546 /nfs/dbraw/zinc/95/75/46/1040957546.db2.gz IAQQKPCDWVPTDC-JKSUJKDBSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1ccc2cc([C@@H](C)[NH2+]CC[C@H]3CCC[N@@H+](C)C3)oc2c1 ZINC000414202404 1040994948 /nfs/dbraw/zinc/99/49/48/1040994948.db2.gz YNPLIOLZYNBXEE-HZPDHXFCSA-N 2 1 300.446 4.124 20 0 DIADMP Cc1occc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000414285268 1041082925 /nfs/dbraw/zinc/08/29/25/1041082925.db2.gz LPTTYPWSPBPYAY-UHFFFAOYSA-N 2 1 312.457 4.110 20 0 DIADMP C[NH+](C)Cc1cnc(C[NH+](CC(C)(C)C)CC(C)(C)C)s1 ZINC000809767866 1041235199 /nfs/dbraw/zinc/23/51/99/1041235199.db2.gz WGYWMPWTZBTQJG-UHFFFAOYSA-N 2 1 311.539 4.099 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc3occc3c2)cc1 ZINC000809738767 1041239485 /nfs/dbraw/zinc/23/94/85/1041239485.db2.gz ITGMSEQKFNGDCP-UHFFFAOYSA-N 2 1 308.425 4.126 20 0 DIADMP C[C@H](C1CC1)[NH+](C/C=C\C[N@H+]([C@@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615537 1041384814 /nfs/dbraw/zinc/38/48/14/1041384814.db2.gz BQCYIYVUHISCJG-SSGMOAHOSA-N 2 1 302.506 4.068 20 0 DIADMP C[C@H](C1CC1)[N@@H+](C/C=C\C[NH+]([C@@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615537 1041384826 /nfs/dbraw/zinc/38/48/26/1041384826.db2.gz BQCYIYVUHISCJG-SSGMOAHOSA-N 2 1 302.506 4.068 20 0 DIADMP C[C@H](C1CC1)[N@H+](C/C=C\C[NH+]([C@@H](C)C1CC1)C1CC1)C1CC1 ZINC000613615537 1041384837 /nfs/dbraw/zinc/38/48/37/1041384837.db2.gz BQCYIYVUHISCJG-SSGMOAHOSA-N 2 1 302.506 4.068 20 0 DIADMP CC[C@@H]([NH2+][C@H](C)c1ccc(-n2cc[nH+]c2C)cc1)c1ccncc1 ZINC000163715040 1041413921 /nfs/dbraw/zinc/41/39/21/1041413921.db2.gz LXKNWMBAQRCBSD-FOIQADDNSA-N 2 1 320.440 4.378 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236808493 1041499199 /nfs/dbraw/zinc/49/91/99/1041499199.db2.gz KSYUIZBCDDZFKA-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)C1 ZINC000236808493 1041499204 /nfs/dbraw/zinc/49/92/04/1041499204.db2.gz KSYUIZBCDDZFKA-KRWDZBQOSA-N 2 1 312.457 4.077 20 0 DIADMP Cc1ccc[nH+]c1N([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001170640752 1041556212 /nfs/dbraw/zinc/55/62/12/1041556212.db2.gz QQFMYLSULCQLDN-GHBBCFCZSA-N 2 1 321.468 4.022 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(Cl)c1F ZINC000364088280 1041660034 /nfs/dbraw/zinc/66/00/34/1041660034.db2.gz XJGJBPNNJJTSBI-WWGRRREGSA-N 2 1 310.844 4.147 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc(Cl)c1F ZINC000364088280 1041660037 /nfs/dbraw/zinc/66/00/37/1041660037.db2.gz XJGJBPNNJJTSBI-WWGRRREGSA-N 2 1 310.844 4.147 20 0 DIADMP CSc1cccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000660258089 1041691957 /nfs/dbraw/zinc/69/19/57/1041691957.db2.gz ZWOPQBSHPHGBEN-NVXWUHKLSA-N 2 1 318.530 4.151 20 0 DIADMP CC(C)[C@H](C)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000813881318 1041742472 /nfs/dbraw/zinc/74/24/72/1041742472.db2.gz OAIKSJJDHIUAKS-OHSMVPPVSA-N 2 1 300.490 4.206 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccc(F)cc1 ZINC000652136355 1041844860 /nfs/dbraw/zinc/84/48/60/1041844860.db2.gz MSEIFBAQEVMOIZ-IBGZPJMESA-N 2 1 304.453 4.129 20 0 DIADMP Cc1cc(C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)c(C)s1 ZINC000660679416 1041850754 /nfs/dbraw/zinc/85/07/54/1041850754.db2.gz PMZISWRWRYNAGI-UHFFFAOYSA-N 2 1 314.498 4.119 20 0 DIADMP Cc1sccc1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000815120099 1041914597 /nfs/dbraw/zinc/91/45/97/1041914597.db2.gz AOMONXGKKVGGPE-UHFFFAOYSA-N 2 1 306.519 4.191 20 0 DIADMP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808188 1041918318 /nfs/dbraw/zinc/91/83/18/1041918318.db2.gz IPPOMSAJAPTWRX-ZWKOTPCHSA-N 2 1 323.484 4.130 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651808188 1041918324 /nfs/dbraw/zinc/91/83/24/1041918324.db2.gz IPPOMSAJAPTWRX-ZWKOTPCHSA-N 2 1 323.484 4.130 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661435786 1041937485 /nfs/dbraw/zinc/93/74/85/1041937485.db2.gz HNEHITXNIRYBPN-GOSISDBHSA-N 2 1 313.445 4.182 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661435786 1041937491 /nfs/dbraw/zinc/93/74/91/1041937491.db2.gz HNEHITXNIRYBPN-GOSISDBHSA-N 2 1 313.445 4.182 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1ccco1 ZINC000164512410 1041993632 /nfs/dbraw/zinc/99/36/32/1041993632.db2.gz LANTXIBKZFOHIS-INIZCTEOSA-N 2 1 324.424 4.355 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(OC(C)C)cc1 ZINC000164672220 1042032630 /nfs/dbraw/zinc/03/26/30/1042032630.db2.gz UOEIOSANVUYZQP-MRXNPFEDSA-N 2 1 315.461 4.110 20 0 DIADMP CCCC[N@H+](Cc1ncc(C[NH+](C)C)s1)[C@H]1CCC[C@@H](C)C1 ZINC000816658430 1042075686 /nfs/dbraw/zinc/07/56/86/1042075686.db2.gz MPOGHJRFFURYOL-CVEARBPZSA-N 2 1 323.550 4.386 20 0 DIADMP CCCC[N@@H+](Cc1ncc(C[NH+](C)C)s1)[C@H]1CCC[C@@H](C)C1 ZINC000816658430 1042075693 /nfs/dbraw/zinc/07/56/93/1042075693.db2.gz MPOGHJRFFURYOL-CVEARBPZSA-N 2 1 323.550 4.386 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccccc1SC(C)(C)C ZINC000817970674 1042134563 /nfs/dbraw/zinc/13/45/63/1042134563.db2.gz BULFUBAPUJSKLO-QLFBSQMISA-N 2 1 306.519 4.368 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CCc2cccc(Cl)c2C1 ZINC001170896769 1042146290 /nfs/dbraw/zinc/14/62/90/1042146290.db2.gz IZXIBQBFBGYLRV-WBVHZDCISA-N 2 1 320.908 4.051 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001167824172 1042209749 /nfs/dbraw/zinc/20/97/49/1042209749.db2.gz CBUGBGQWNVNUFV-MJGOQNOKSA-N 2 1 320.546 4.287 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccc(OC)cc1 ZINC001167824689 1042212402 /nfs/dbraw/zinc/21/24/02/1042212402.db2.gz FKLPNUNJFKCPHY-YLJYHZDGSA-N 2 1 318.505 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001167825814 1042214128 /nfs/dbraw/zinc/21/41/28/1042214128.db2.gz KUWLLUMRIJJBAP-IAGOWNOFSA-N 2 1 306.469 4.126 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001167825812 1042214466 /nfs/dbraw/zinc/21/44/66/1042214466.db2.gz KUDZRFNSQBHYKS-UYAOXDASSA-N 2 1 302.506 4.377 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC001167825624 1042214772 /nfs/dbraw/zinc/21/47/72/1042214772.db2.gz KUDZRFNSQBHYKS-AZUAARDMSA-N 2 1 302.506 4.377 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001167825831 1042215066 /nfs/dbraw/zinc/21/50/66/1042215066.db2.gz KZDSXNMZYWOIQF-AZUAARDMSA-N 2 1 318.505 4.040 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001167825930 1042216091 /nfs/dbraw/zinc/21/60/91/1042216091.db2.gz LTDQSRBLXGWODO-ICSRJNTNSA-N 2 1 302.506 4.062 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC001167826953 1042217173 /nfs/dbraw/zinc/21/71/73/1042217173.db2.gz SIIFVQCZQZRGLV-KRWDZBQOSA-N 2 1 313.489 4.177 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000643521339 1042220423 /nfs/dbraw/zinc/22/04/23/1042220423.db2.gz ADWPXAYODWZPTC-IUODEOHRSA-N 2 1 301.261 4.176 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)[C@H](C)c1ccccc1OC ZINC001167836750 1042248566 /nfs/dbraw/zinc/24/85/66/1042248566.db2.gz GQXZVSPHKKTYFR-DLBZAZTESA-N 2 1 306.494 4.199 20 0 DIADMP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001167836361 1042248726 /nfs/dbraw/zinc/24/87/26/1042248726.db2.gz YMJCAPOKMQFQTQ-YLJYHZDGSA-N 2 1 320.496 4.343 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001167837862 1042250321 /nfs/dbraw/zinc/25/03/21/1042250321.db2.gz NDLGMNGDGLRUHM-FUHWJXTLSA-N 2 1 306.469 4.126 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1cccc(Cl)c1Cl ZINC000279050879 1042265271 /nfs/dbraw/zinc/26/52/71/1042265271.db2.gz YAEAWSBXOBXEPQ-NEPJUHHUSA-N 2 1 324.255 4.103 20 0 DIADMP CC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000390964813 1042285667 /nfs/dbraw/zinc/28/56/67/1042285667.db2.gz OMWFXQIFIXUVNW-GOSISDBHSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)CCC1 ZINC000390964813 1042285674 /nfs/dbraw/zinc/28/56/74/1042285674.db2.gz OMWFXQIFIXUVNW-GOSISDBHSA-N 2 1 300.490 4.067 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CCSc3ccc(F)cc32)CC(C)(C)[NH2+]1 ZINC000162695070 1042294430 /nfs/dbraw/zinc/29/44/30/1042294430.db2.gz IGHCGWVGWBHLDL-HNNXBMFYSA-N 2 1 322.493 4.261 20 0 DIADMP C[C@H](C[NH2+][C@H]1CCSc2ccc(Cl)cc21)C[NH+]1CCCC1 ZINC000062078761 1042314186 /nfs/dbraw/zinc/31/41/86/1042314186.db2.gz IMCFVPRNFWDTLL-CJNGLKHVSA-N 2 1 324.921 4.198 20 0 DIADMP CCc1ccc(C[N@H+](CCCCn2cc[nH+]c2C)C2CC2)cc1 ZINC000337682644 1042329780 /nfs/dbraw/zinc/32/97/80/1042329780.db2.gz WHJSBEVQHJWJHT-UHFFFAOYSA-N 2 1 311.473 4.199 20 0 DIADMP CCc1ccc(C[N@@H+](CCCCn2cc[nH+]c2C)C2CC2)cc1 ZINC000337682644 1042329788 /nfs/dbraw/zinc/32/97/88/1042329788.db2.gz WHJSBEVQHJWJHT-UHFFFAOYSA-N 2 1 311.473 4.199 20 0 DIADMP C[N@@H+](CCCNCc1cc(Cl)cs1)Cc1ccccc1 ZINC000093093144 1042358351 /nfs/dbraw/zinc/35/83/51/1042358351.db2.gz UMINGPGDWUVKKA-UHFFFAOYSA-N 2 1 308.878 4.013 20 0 DIADMP CN(CCC[NH2+]Cc1cc(Cl)cs1)Cc1ccccc1 ZINC000093093144 1042358357 /nfs/dbraw/zinc/35/83/57/1042358357.db2.gz UMINGPGDWUVKKA-UHFFFAOYSA-N 2 1 308.878 4.013 20 0 DIADMP C[N@H+](CCC[NH2+]Cc1cc(Cl)cs1)Cc1ccccc1 ZINC000093093144 1042358364 /nfs/dbraw/zinc/35/83/64/1042358364.db2.gz UMINGPGDWUVKKA-UHFFFAOYSA-N 2 1 308.878 4.013 20 0 DIADMP C[N@@H+](CCC[NH2+]Cc1cc(Cl)cs1)Cc1ccccc1 ZINC000093093144 1042358370 /nfs/dbraw/zinc/35/83/70/1042358370.db2.gz UMINGPGDWUVKKA-UHFFFAOYSA-N 2 1 308.878 4.013 20 0 DIADMP CC[N@@H+](Cc1ccncc1)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411431871 1042445704 /nfs/dbraw/zinc/44/57/04/1042445704.db2.gz VOBZHMHODIMQFE-UHFFFAOYSA-N 2 1 323.484 4.090 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)cc2)[C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC001167919168 1042460723 /nfs/dbraw/zinc/46/07/23/1042460723.db2.gz UOXPFLKCZKPQFC-MBBYRJAFSA-N 2 1 318.892 4.210 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2c1c(F)ccc2F ZINC000513524456 1042550070 /nfs/dbraw/zinc/55/00/70/1042550070.db2.gz GWQOYJWTLPDNLD-KDOFPFPSSA-N 2 1 322.443 4.196 20 0 DIADMP C[N@H+]1CC[C@H](NCc2cc(Cl)sc2Cl)[C@H]2CCC[C@@H]21 ZINC000513690692 1042569018 /nfs/dbraw/zinc/56/90/18/1042569018.db2.gz KYKHOAYLMPFFQL-WOPDTQHZSA-N 2 1 319.301 4.017 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@H]2CCC[C@@H]21 ZINC000513690692 1042569020 /nfs/dbraw/zinc/56/90/20/1042569020.db2.gz KYKHOAYLMPFFQL-WOPDTQHZSA-N 2 1 319.301 4.017 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)[C@H]2CCC[C@@H]21 ZINC000513690692 1042569024 /nfs/dbraw/zinc/56/90/24/1042569024.db2.gz KYKHOAYLMPFFQL-WOPDTQHZSA-N 2 1 319.301 4.017 20 0 DIADMP C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC[C@H]1CCC[NH2+]C1 ZINC000420300110 1042599030 /nfs/dbraw/zinc/59/90/30/1042599030.db2.gz HEKMFQJTJQTZQD-ZIAGYGMSSA-N 2 1 314.395 4.088 20 0 DIADMP c1ccc2c(c1)-c1ccccc1C2[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327628 1042599327 /nfs/dbraw/zinc/59/93/27/1042599327.db2.gz LPPWLPUPEJWZDO-DLBZAZTESA-N 2 1 318.464 4.078 20 0 DIADMP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000423379792 1042709179 /nfs/dbraw/zinc/70/91/79/1042709179.db2.gz NGRWMERROBKXMR-NVBFEUDRSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@@H]([NH2+][C@H](c1ccccc1)c1cccc2ccccc21)C1C[NH2+]C1 ZINC000422911267 1042692345 /nfs/dbraw/zinc/69/23/45/1042692345.db2.gz SNJRWPIAHINXOS-OPAMFIHVSA-N 2 1 316.448 4.127 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C2CCCCC2)cc1)c1c[nH+]ccc1N ZINC000423126502 1042698064 /nfs/dbraw/zinc/69/80/64/1042698064.db2.gz IXKWMVLCKQJPKR-HNNXBMFYSA-N 2 1 309.457 4.393 20 0 DIADMP C[C@@H]([NH2+]CC1([NH3+])CCCCC1)c1ccc(-c2ccncc2)cc1 ZINC000423183909 1042698822 /nfs/dbraw/zinc/69/88/22/1042698822.db2.gz SISUCMFNZBRCCH-MRXNPFEDSA-N 2 1 309.457 4.061 20 0 DIADMP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc2ccccc2c1 ZINC000423182485 1042699594 /nfs/dbraw/zinc/69/95/94/1042699594.db2.gz DYTQCIGYGDUNDO-QGZVFWFLSA-N 2 1 319.452 4.065 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@H](C[NH3+])C1CCCCC1 ZINC000423270881 1042705095 /nfs/dbraw/zinc/70/50/95/1042705095.db2.gz XDZICBYBHSPLTL-IUODEOHRSA-N 2 1 309.523 4.133 20 0 DIADMP [NH3+][C@H](C[NH2+][C@@H](Cc1ccccc1Cl)c1cccs1)C1CC1 ZINC000423319729 1042706006 /nfs/dbraw/zinc/70/60/06/1042706006.db2.gz LXJSLOYTJFWEAF-CVEARBPZSA-N 2 1 320.889 4.012 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc2cc(Cl)ccc2o1 ZINC000423339574 1042706856 /nfs/dbraw/zinc/70/68/56/1042706856.db2.gz LIYJIVNMGLGZIA-PXAZEXFGSA-N 2 1 306.837 4.127 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000423379793 1042709771 /nfs/dbraw/zinc/70/97/71/1042709771.db2.gz NGRWMERROBKXMR-WBIUFABUSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H](Cc1ccccc1Cl)c1cccs1 ZINC000423465032 1042714052 /nfs/dbraw/zinc/71/40/52/1042714052.db2.gz MJJRTCMVGKFEKT-HUBLWGQQSA-N 2 1 308.878 4.011 20 0 DIADMP C[C@@H]([NH2+][C@@H](Cc1ccccc1Cl)c1cccs1)[C@H](C)[NH3+] ZINC000423465040 1042714019 /nfs/dbraw/zinc/71/40/19/1042714019.db2.gz MJJRTCMVGKFEKT-ZOWXZIJZSA-N 2 1 308.878 4.011 20 0 DIADMP CC(C)c1nc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423505932 1042716081 /nfs/dbraw/zinc/71/60/81/1042716081.db2.gz IEHWUPIQBMMSLR-ZBFHGGJFSA-N 2 1 317.502 4.397 20 0 DIADMP COc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319164 1042733862 /nfs/dbraw/zinc/73/38/62/1042733862.db2.gz RTXRWHGJTZLCSA-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)c(Cl)c1 ZINC000424319164 1042733867 /nfs/dbraw/zinc/73/38/67/1042733867.db2.gz RTXRWHGJTZLCSA-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(Cl)c1 ZINC000424319164 1042733870 /nfs/dbraw/zinc/73/38/70/1042733870.db2.gz RTXRWHGJTZLCSA-HUUCEWRRSA-N 2 1 324.896 4.120 20 0 DIADMP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424377096 1042739001 /nfs/dbraw/zinc/73/90/01/1042739001.db2.gz QKVRUERLIXLPBA-APHBMKBZSA-N 2 1 315.486 4.039 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000514248545 1042777187 /nfs/dbraw/zinc/77/71/87/1042777187.db2.gz RTDCCQMNEBFQFE-HRCADAONSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@@H](C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1)c1ccccc1 ZINC000515556848 1042826228 /nfs/dbraw/zinc/82/62/28/1042826228.db2.gz NVUVFHUJSLMESQ-IBGZPJMESA-N 2 1 322.496 4.387 20 0 DIADMP C[C@@H](C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1)c1ccccc1 ZINC000515556848 1042826235 /nfs/dbraw/zinc/82/62/35/1042826235.db2.gz NVUVFHUJSLMESQ-IBGZPJMESA-N 2 1 322.496 4.387 20 0 DIADMP FC(F)c1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167962021 1042855793 /nfs/dbraw/zinc/85/57/93/1042855793.db2.gz SDFFAFXGSLBTSE-AYHJJNSGSA-N 2 1 320.427 4.119 20 0 DIADMP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H](C)C[NH+](C)C)cs2)cs1 ZINC000425947644 1042883054 /nfs/dbraw/zinc/88/30/54/1042883054.db2.gz VVMNKOMABQIBDM-RYUDHWBXSA-N 2 1 323.531 4.028 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167962458 1042883968 /nfs/dbraw/zinc/88/39/68/1042883968.db2.gz XZDPXCZDKZXPKM-WFZIFLONSA-N 2 1 323.484 4.239 20 0 DIADMP CCCCC/C(=C/c1ccccc1)C[NH2+]CCn1cc[nH+]c1C ZINC000517546199 1042886570 /nfs/dbraw/zinc/88/65/70/1042886570.db2.gz WQQDJZIWNZYSDC-SILNSSARSA-N 2 1 311.473 4.445 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(F)cc1 ZINC001167964505 1042919351 /nfs/dbraw/zinc/91/93/51/1042919351.db2.gz RJWPQDOPFDVVPO-NXEWRWPSSA-N 2 1 316.464 4.272 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@@H](C)CCc2ccccc2)CC1 ZINC000519224137 1042939487 /nfs/dbraw/zinc/93/94/87/1042939487.db2.gz PWTHIDARNMMMEH-IBGZPJMESA-N 2 1 316.533 4.452 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(C)cc1 ZINC001167966261 1042943776 /nfs/dbraw/zinc/94/37/76/1042943776.db2.gz SCLCKASXAANGMO-OTYNDTSQSA-N 2 1 312.501 4.441 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccc(C)cc1 ZINC001167966265 1042943955 /nfs/dbraw/zinc/94/39/55/1042943955.db2.gz SCLCKASXAANGMO-VTHDOGFWSA-N 2 1 312.501 4.441 20 0 DIADMP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)c1ccccc1 ZINC001167966683 1042949879 /nfs/dbraw/zinc/94/98/79/1042949879.db2.gz ZAOCOYZBEBNCFV-OTYNDTSQSA-N 2 1 312.501 4.379 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c2ccccc21 ZINC001167967902 1042955234 /nfs/dbraw/zinc/95/52/34/1042955234.db2.gz KONWITHECRGTAB-LPWIICIPSA-N 2 1 310.485 4.230 20 0 DIADMP Cc1cc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)ccc1F ZINC001167969483 1042959943 /nfs/dbraw/zinc/95/99/43/1042959943.db2.gz CUBNIOVHRYLTJQ-FMJMRLDVSA-N 2 1 316.464 4.190 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c(C)c1 ZINC001167970509 1042961804 /nfs/dbraw/zinc/96/18/04/1042961804.db2.gz LZYJJXVTNQKZEJ-OHSMVPPVSA-N 2 1 312.501 4.359 20 0 DIADMP Cc1cccc(C)c1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001167970933 1042962162 /nfs/dbraw/zinc/96/21/62/1042962162.db2.gz QHLKWPPFTRKSIZ-OHSMVPPVSA-N 2 1 312.501 4.359 20 0 DIADMP CC(C)C1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)CC1 ZINC001167973485 1042966529 /nfs/dbraw/zinc/96/65/29/1042966529.db2.gz LSGLPTSVLNIBOM-DXTJYYCRSA-N 2 1 304.522 4.196 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1C ZINC001167979298 1042973425 /nfs/dbraw/zinc/97/34/25/1042973425.db2.gz ZVNMVMPNZZHDQQ-VOBGVNJCSA-N 2 1 312.501 4.359 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167982038 1042974892 /nfs/dbraw/zinc/97/48/92/1042974892.db2.gz UFBABOPNCQNKDC-WCRBZPEASA-N 2 1 312.501 4.302 20 0 DIADMP CC(C)[NH+](Cc1ccccc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167982038 1042974895 /nfs/dbraw/zinc/97/48/95/1042974895.db2.gz UFBABOPNCQNKDC-WCRBZPEASA-N 2 1 312.501 4.302 20 0 DIADMP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)C1 ZINC000341719556 1042982474 /nfs/dbraw/zinc/98/24/74/1042982474.db2.gz CGBGIHMMPBBWTR-ZMSDIMECSA-N 2 1 322.880 4.016 20 0 DIADMP C[C@@H]1C[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)Cc2ccccc21 ZINC001167985090 1042983261 /nfs/dbraw/zinc/98/32/61/1042983261.db2.gz VFIAKNYFYHNIRZ-AZCLRUCKSA-N 2 1 310.485 4.011 20 0 DIADMP C[C@@H]1C[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)Cc2ccccc21 ZINC001167985090 1042983264 /nfs/dbraw/zinc/98/32/64/1042983264.db2.gz VFIAKNYFYHNIRZ-AZCLRUCKSA-N 2 1 310.485 4.011 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)cc2)C1 ZINC000520200714 1043024469 /nfs/dbraw/zinc/02/44/69/1043024469.db2.gz PKTNXMIVYHWZHR-IBGZPJMESA-N 2 1 308.469 4.175 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441355908 1043038790 /nfs/dbraw/zinc/03/87/90/1043038790.db2.gz LFLCEFYSHRHSNW-UKRRQHHQSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441355908 1043038793 /nfs/dbraw/zinc/03/87/93/1043038793.db2.gz LFLCEFYSHRHSNW-UKRRQHHQSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@H]1CCCC[N@@H+]1C ZINC000441355908 1043038797 /nfs/dbraw/zinc/03/87/97/1043038797.db2.gz LFLCEFYSHRHSNW-UKRRQHHQSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccc(F)c(Cl)c1)[NH+](C)CC[C@H]1CCCC[N@H+]1C ZINC000441355908 1043038800 /nfs/dbraw/zinc/03/88/00/1043038800.db2.gz LFLCEFYSHRHSNW-UKRRQHHQSA-N 2 1 312.860 4.346 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441402715 1043042669 /nfs/dbraw/zinc/04/26/69/1043042669.db2.gz BGGQCZNGVAFSAL-CLCXKQKWSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441402715 1043042673 /nfs/dbraw/zinc/04/26/73/1043042673.db2.gz BGGQCZNGVAFSAL-CLCXKQKWSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441402715 1043042681 /nfs/dbraw/zinc/04/26/81/1043042681.db2.gz BGGQCZNGVAFSAL-CLCXKQKWSA-N 2 1 318.892 4.350 20 0 DIADMP C[C@H](c1ccccc1Cl)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441402715 1043042684 /nfs/dbraw/zinc/04/26/84/1043042684.db2.gz BGGQCZNGVAFSAL-CLCXKQKWSA-N 2 1 318.892 4.350 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441411721 1043044952 /nfs/dbraw/zinc/04/49/52/1043044952.db2.gz HDWVUWASFNCXOC-AHRSYUTCSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000441411721 1043044959 /nfs/dbraw/zinc/04/49/59/1043044959.db2.gz HDWVUWASFNCXOC-AHRSYUTCSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000441411721 1043044969 /nfs/dbraw/zinc/04/49/69/1043044969.db2.gz HDWVUWASFNCXOC-AHRSYUTCSA-N 2 1 316.464 4.226 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441411721 1043044973 /nfs/dbraw/zinc/04/49/73/1043044973.db2.gz HDWVUWASFNCXOC-AHRSYUTCSA-N 2 1 316.464 4.226 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000112537906 1043048937 /nfs/dbraw/zinc/04/89/37/1043048937.db2.gz WECVGUHWMZLCFM-FQEVSTJZSA-N 2 1 300.490 4.083 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000112537906 1043048947 /nfs/dbraw/zinc/04/89/47/1043048947.db2.gz WECVGUHWMZLCFM-FQEVSTJZSA-N 2 1 300.490 4.083 20 0 DIADMP c1csc([C@@H]2CCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)c1 ZINC001167995870 1043079123 /nfs/dbraw/zinc/07/91/23/1043079123.db2.gz TYTQURQIOMYPGU-WFFDWFOESA-N 2 1 316.514 4.290 20 0 DIADMP c1csc([C@@H]2CCC[N@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995870 1043079135 /nfs/dbraw/zinc/07/91/35/1043079135.db2.gz TYTQURQIOMYPGU-WFFDWFOESA-N 2 1 316.514 4.290 20 0 DIADMP c1csc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995870 1043079144 /nfs/dbraw/zinc/07/91/44/1043079144.db2.gz TYTQURQIOMYPGU-WFFDWFOESA-N 2 1 316.514 4.290 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000178699405 1043136546 /nfs/dbraw/zinc/13/65/46/1043136546.db2.gz AFPJBXIFWIDWNI-HUBLWGQQSA-N 2 1 321.515 4.104 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccnc(Cl)c1 ZINC000120772368 1043141682 /nfs/dbraw/zinc/14/16/82/1043141682.db2.gz VLVJKUKIFZLKHT-CQSZACIVSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+](C)C1CCCCC1)c1ccnc(Cl)c1 ZINC000120772368 1043141692 /nfs/dbraw/zinc/14/16/92/1043141692.db2.gz VLVJKUKIFZLKHT-CQSZACIVSA-N 2 1 309.885 4.040 20 0 DIADMP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1cc2c(ccnc2Cl)o1 ZINC000866219211 1043160990 /nfs/dbraw/zinc/16/09/90/1043160990.db2.gz IVKWUCAZKOOHKS-ZDUSSCGKSA-N 2 1 321.852 4.008 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2sccc2OC)c1 ZINC000186153378 1043217432 /nfs/dbraw/zinc/21/74/32/1043217432.db2.gz AHZHCZHXBQTESI-AWEZNQCLSA-N 2 1 318.486 4.059 20 0 DIADMP CC[NH+](Cc1ccc(C)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001168004422 1043233693 /nfs/dbraw/zinc/23/36/93/1043233693.db2.gz VUDKPFLFKJQHGN-WCRBZPEASA-N 2 1 312.501 4.222 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+]CCC[N@@H+](C)C(C)C)CCS2 ZINC000427611576 1043244847 /nfs/dbraw/zinc/24/48/47/1043244847.db2.gz GSSZVOXJHNUWQW-QGZVFWFLSA-N 2 1 306.519 4.160 20 0 DIADMP Cc1cc2c(cc1C)[C@H]([NH2+]CCC[N@H+](C)C(C)C)CCS2 ZINC000427611576 1043244865 /nfs/dbraw/zinc/24/48/65/1043244865.db2.gz GSSZVOXJHNUWQW-QGZVFWFLSA-N 2 1 306.519 4.160 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCC[C@@H](F)C2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007337 1043261220 /nfs/dbraw/zinc/26/12/20/1043261220.db2.gz RKTCFMLVEYNGOD-QQXMDYFESA-N 2 1 318.480 4.298 20 0 DIADMP C[C@@H]1C[N@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC1(F)F ZINC000520906921 1043339238 /nfs/dbraw/zinc/33/92/38/1043339238.db2.gz XCBFOZRXXSNZRP-MRXNPFEDSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@@H]1C[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC1(F)F ZINC000520906921 1043339249 /nfs/dbraw/zinc/33/92/49/1043339249.db2.gz XCBFOZRXXSNZRP-MRXNPFEDSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@@H]1C[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CCC1(F)F ZINC000520906921 1043339262 /nfs/dbraw/zinc/33/92/62/1043339262.db2.gz XCBFOZRXXSNZRP-MRXNPFEDSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@@H]1C[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCC1(F)F ZINC000520906921 1043339276 /nfs/dbraw/zinc/33/92/76/1043339276.db2.gz XCBFOZRXXSNZRP-MRXNPFEDSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@H]1C[N@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC1(F)F ZINC000520906920 1043340433 /nfs/dbraw/zinc/34/04/33/1043340433.db2.gz XCBFOZRXXSNZRP-INIZCTEOSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@H]1C[N@@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CCC1(F)F ZINC000520906920 1043340443 /nfs/dbraw/zinc/34/04/43/1043340443.db2.gz XCBFOZRXXSNZRP-INIZCTEOSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@H]1C[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CCC1(F)F ZINC000520906920 1043340455 /nfs/dbraw/zinc/34/04/55/1043340455.db2.gz XCBFOZRXXSNZRP-INIZCTEOSA-N 2 1 324.459 4.122 20 0 DIADMP C[C@H]1C[NH+](CC(C)(C)C[N@@H+](C)Cc2ccccc2)CCC1(F)F ZINC000520906920 1043340464 /nfs/dbraw/zinc/34/04/64/1043340464.db2.gz XCBFOZRXXSNZRP-INIZCTEOSA-N 2 1 324.459 4.122 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cccc(Oc3ccccc3)c2)C1 ZINC000520944975 1043342263 /nfs/dbraw/zinc/34/22/63/1043342263.db2.gz ZQEXUHQUZWSLHT-LJQANCHMSA-N 2 1 324.468 4.300 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](C)Cc2cccc(-c3ccccn3)c2)CC1 ZINC000271051404 1043400302 /nfs/dbraw/zinc/40/03/02/1043400302.db2.gz WIHWKTNLGUSWNL-UHFFFAOYSA-N 2 1 323.484 4.053 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+]C1CCC(C(F)F)CC1 ZINC000442715188 1043412655 /nfs/dbraw/zinc/41/26/55/1043412655.db2.gz ZHPPYSSRGLDAKP-FHERZECASA-N 2 1 302.453 4.055 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000442776493 1043417192 /nfs/dbraw/zinc/41/71/92/1043417192.db2.gz HMTFJJIOTQBWAB-UHFFFAOYSA-N 2 1 324.459 4.440 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2S1 ZINC000872020811 1043422302 /nfs/dbraw/zinc/42/23/02/1043422302.db2.gz KPRZNZDKZHAILE-RHSMWYFYSA-N 2 1 316.514 4.076 20 0 DIADMP CC[C@H](CCC(F)(F)F)[NH2+][C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000872060442 1043444208 /nfs/dbraw/zinc/44/42/08/1043444208.db2.gz QBAUAASKJUTJEU-QLFBSQMISA-N 2 1 320.443 4.350 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@H]1CC[N@H+](C)C[C@H]1C ZINC000442853835 1043443877 /nfs/dbraw/zinc/44/38/77/1043443877.db2.gz JXXKCWLRCUVMDF-ABAIWWIYSA-N 2 1 322.905 4.293 20 0 DIADMP Cc1c2cc(Cl)ccc2sc1C[NH2+][C@@H]1CC[N@H+](C)C[C@H]1C ZINC000442853837 1043444363 /nfs/dbraw/zinc/44/43/63/1043444363.db2.gz JXXKCWLRCUVMDF-IAQYHMDHSA-N 2 1 322.905 4.293 20 0 DIADMP CC[C@H](CCC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000872060444 1043444458 /nfs/dbraw/zinc/44/44/58/1043444458.db2.gz QBAUAASKJUTJEU-RRFJBIMHSA-N 2 1 320.443 4.350 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000558161099 1043447845 /nfs/dbraw/zinc/44/78/45/1043447845.db2.gz WRLFCCCTKJCKKF-JJDSTIRJSA-N 2 1 312.501 4.478 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+]([C@H]2C=CCCCCC2)CC1 ZINC000339133576 1043454036 /nfs/dbraw/zinc/45/40/36/1043454036.db2.gz ZMAFWUHHFXFFHY-KRWDZBQOSA-N 2 1 300.446 4.122 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c[nH]c3c2cccc3F)CC1 ZINC001137060623 1043501051 /nfs/dbraw/zinc/50/10/51/1043501051.db2.gz XVYFCKROZAZGEJ-UHFFFAOYSA-N 2 1 317.452 4.003 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc(-c2ccc(C)cc2)o1 ZINC000349356655 1043504884 /nfs/dbraw/zinc/50/48/84/1043504884.db2.gz VYKHGDZJMZGVQY-UHFFFAOYSA-N 2 1 323.440 4.282 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc(-c2ccc(C)cc2)o1 ZINC000349356655 1043504893 /nfs/dbraw/zinc/50/48/93/1043504893.db2.gz VYKHGDZJMZGVQY-UHFFFAOYSA-N 2 1 323.440 4.282 20 0 DIADMP CSc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC000558486169 1043519732 /nfs/dbraw/zinc/51/97/32/1043519732.db2.gz RVNKSZNZXMSBJC-ZIAGYGMSSA-N 2 1 324.559 4.213 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1nccc2ccccc21)[NH+]1CCCCC1 ZINC000558506367 1043524065 /nfs/dbraw/zinc/52/40/65/1043524065.db2.gz ZIGYWOYIHJNAAG-SJORKVTESA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069268 1043568323 /nfs/dbraw/zinc/56/83/23/1043568323.db2.gz URDLHIYQAKDADX-YOEHRIQHSA-N 2 1 314.464 4.055 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](CC2CCCC2)C1)C1CCC(F)(F)CC1 ZINC000474069268 1043568332 /nfs/dbraw/zinc/56/83/32/1043568332.db2.gz URDLHIYQAKDADX-YOEHRIQHSA-N 2 1 314.464 4.055 20 0 DIADMP c1ccc(C(c2ccccc2)[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000558724892 1043581235 /nfs/dbraw/zinc/58/12/35/1043581235.db2.gz ILLYSBYWKIQLEG-LJQANCHMSA-N 2 1 320.480 4.194 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc3cccc(F)c3o2)CC1 ZINC000474097307 1043600991 /nfs/dbraw/zinc/60/09/91/1043600991.db2.gz NCGMLBPSRYVUNP-ZDUSSCGKSA-N 2 1 304.409 4.097 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccccc2-c2ccccc2C)C1 ZINC001648960305 1043620199 /nfs/dbraw/zinc/62/01/99/1043620199.db2.gz NQDKOJPLSXUWOH-IBGZPJMESA-N 2 1 322.496 4.484 20 0 DIADMP FC(F)(F)CCCC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000443629892 1043626562 /nfs/dbraw/zinc/62/65/62/1043626562.db2.gz ITQBFOWHMCHOPP-INIZCTEOSA-N 2 1 320.443 4.307 20 0 DIADMP FC(F)(F)CCCC[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000443629892 1043626569 /nfs/dbraw/zinc/62/65/69/1043626569.db2.gz ITQBFOWHMCHOPP-INIZCTEOSA-N 2 1 320.443 4.307 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)[C@H](C)c1ccccc1F ZINC000191495173 1043643976 /nfs/dbraw/zinc/64/39/76/1043643976.db2.gz OMTROHQKWGBQBK-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)[C@H](C)c1ccccc1F ZINC000191495173 1043643981 /nfs/dbraw/zinc/64/39/81/1043643981.db2.gz OMTROHQKWGBQBK-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)[C@H](C)c1ccccc1F ZINC000191495173 1043643988 /nfs/dbraw/zinc/64/39/88/1043643988.db2.gz OMTROHQKWGBQBK-OAHLLOKOSA-N 2 1 303.425 4.058 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876917752 1043724360 /nfs/dbraw/zinc/72/43/60/1043724360.db2.gz VMWJRVUNAUBNHI-MMOPVJDHSA-N 2 1 324.468 4.168 20 0 DIADMP C[C@H](Cc1ccco1)[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876917752 1043724373 /nfs/dbraw/zinc/72/43/73/1043724373.db2.gz VMWJRVUNAUBNHI-MMOPVJDHSA-N 2 1 324.468 4.168 20 0 DIADMP CSCC[C@H](C)[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877056555 1043739146 /nfs/dbraw/zinc/73/91/46/1043739146.db2.gz VITGLXOHELSARE-VDZJLULYSA-N 2 1 318.530 4.086 20 0 DIADMP CSCC[C@H](C)[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000877056555 1043739156 /nfs/dbraw/zinc/73/91/56/1043739156.db2.gz VITGLXOHELSARE-VDZJLULYSA-N 2 1 318.530 4.086 20 0 DIADMP CCCCN(C)c1ccc(N[C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000777683707 1043742018 /nfs/dbraw/zinc/74/20/18/1043742018.db2.gz GSAXHXLJFLHJIH-VQIMIIECSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@H+](C)c1ccc(N[C@@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000777683707 1043742034 /nfs/dbraw/zinc/74/20/34/1043742034.db2.gz GSAXHXLJFLHJIH-VQIMIIECSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[N@@H+](C)c1ccc(N[C@@H]2CC[NH+](CC)C[C@H]2C)cc1 ZINC000777683707 1043742046 /nfs/dbraw/zinc/74/20/46/1043742046.db2.gz GSAXHXLJFLHJIH-VQIMIIECSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000777683707 1043742058 /nfs/dbraw/zinc/74/20/58/1043742058.db2.gz GSAXHXLJFLHJIH-VQIMIIECSA-N 2 1 303.494 4.065 20 0 DIADMP CCCC[NH+](C)c1ccc(N[C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000777683707 1043742072 /nfs/dbraw/zinc/74/20/72/1043742072.db2.gz GSAXHXLJFLHJIH-VQIMIIECSA-N 2 1 303.494 4.065 20 0 DIADMP CC[C@H](C)[C@@H](C)Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000777692461 1043756414 /nfs/dbraw/zinc/75/64/14/1043756414.db2.gz BZOTWRHXBACIJD-DLBZAZTESA-N 2 1 317.521 4.311 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1)C1CCC1 ZINC001168033883 1043761619 /nfs/dbraw/zinc/76/16/19/1043761619.db2.gz MWLJIBPEKAWGSY-CLWJZODNSA-N 2 1 300.490 4.206 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039242 1043853273 /nfs/dbraw/zinc/85/32/73/1043853273.db2.gz CMFSTBDKGOGBHR-ALXJQNPVSA-N 2 1 322.443 4.159 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)CC2)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168039242 1043853288 /nfs/dbraw/zinc/85/32/88/1043853288.db2.gz CMFSTBDKGOGBHR-ALXJQNPVSA-N 2 1 322.443 4.159 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039245 1043853943 /nfs/dbraw/zinc/85/39/43/1043853943.db2.gz CMUPLSWZGFPHCP-BOSXTWCSSA-N 2 1 318.480 4.108 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@H+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC001168039245 1043853954 /nfs/dbraw/zinc/85/39/54/1043853954.db2.gz CMUPLSWZGFPHCP-BOSXTWCSSA-N 2 1 318.480 4.108 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H](C)c2ccc(Cl)cc2)C1 ZINC000474626390 1043859096 /nfs/dbraw/zinc/85/90/96/1043859096.db2.gz FBUGONHNCLPROP-BZUAXINKSA-N 2 1 308.897 4.154 20 0 DIADMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)c(Cl)c1 ZINC000034958906 1043893932 /nfs/dbraw/zinc/89/39/32/1043893932.db2.gz YYCBATNHNWCKMI-NDNKKMJESA-N 2 1 313.272 4.269 20 0 DIADMP CC(C)[C@H](C[NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000474713748 1043896037 /nfs/dbraw/zinc/89/60/37/1043896037.db2.gz PXZDOTRDVVRBOI-QUCCMNQESA-N 2 1 302.506 4.136 20 0 DIADMP C[C@H](C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1cccc(Cl)c1 ZINC000289947903 1043900094 /nfs/dbraw/zinc/90/00/94/1043900094.db2.gz YPFAVYNFVHWMAX-DTWYCDNDSA-N 2 1 306.881 4.001 20 0 DIADMP C[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(Cl)c1 ZINC000289947903 1043900101 /nfs/dbraw/zinc/90/01/01/1043900101.db2.gz YPFAVYNFVHWMAX-DTWYCDNDSA-N 2 1 306.881 4.001 20 0 DIADMP C[C@H](C[NH+](C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccc(Cl)c1 ZINC000289947903 1043900114 /nfs/dbraw/zinc/90/01/14/1043900114.db2.gz YPFAVYNFVHWMAX-DTWYCDNDSA-N 2 1 306.881 4.001 20 0 DIADMP C[C@@H](CC[NH2+][C@@H](C)C1CCSCC1)[N@@H+](C)Cc1ccccc1 ZINC000474811294 1043925167 /nfs/dbraw/zinc/92/51/67/1043925167.db2.gz VRYGSXYOJNZUOQ-IRXDYDNUSA-N 2 1 320.546 4.018 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474806638 1043927347 /nfs/dbraw/zinc/92/73/47/1043927347.db2.gz GDDRLUSOVJEQAA-QBJHELGDSA-N 2 1 320.908 4.437 20 0 DIADMP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)[C@@H](C)c1ccc(Cl)cc1 ZINC000474806638 1043927351 /nfs/dbraw/zinc/92/73/51/1043927351.db2.gz GDDRLUSOVJEQAA-QBJHELGDSA-N 2 1 320.908 4.437 20 0 DIADMP C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984408 1044042824 /nfs/dbraw/zinc/04/28/24/1044042824.db2.gz YNAAQUBTLZGSML-UWJYYQICSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984408 1044042832 /nfs/dbraw/zinc/04/28/32/1044042832.db2.gz YNAAQUBTLZGSML-UWJYYQICSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cccc(Oc2ccccc2)c1 ZINC000561984408 1044042843 /nfs/dbraw/zinc/04/28/43/1044042843.db2.gz YNAAQUBTLZGSML-UWJYYQICSA-N 2 1 324.468 4.251 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCCc2ccccc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000358475833 1044073939 /nfs/dbraw/zinc/07/39/39/1044073939.db2.gz WLIQCZZECXTJNC-DJPFJPOOSA-N 2 1 312.501 4.307 20 0 DIADMP Cc1csc(C[N@@H+](C)C2CC[NH+](C3CCCCC3)CC2)c1 ZINC001137161726 1044082892 /nfs/dbraw/zinc/08/28/92/1044082892.db2.gz RISMHDLXMFMHKI-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP Cc1csc(C[N@H+](C)C2CC[NH+](C3CCCCC3)CC2)c1 ZINC001137161726 1044082905 /nfs/dbraw/zinc/08/29/05/1044082905.db2.gz RISMHDLXMFMHKI-UHFFFAOYSA-N 2 1 306.519 4.285 20 0 DIADMP c1cnc2c(c1)cccc2C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001137175560 1044163136 /nfs/dbraw/zinc/16/31/36/1044163136.db2.gz CHYWKMMYARKNHF-FQEVSTJZSA-N 2 1 323.484 4.075 20 0 DIADMP C[N@@H+](CCC[NH2+][C@H]1CCCOc2ccccc21)Cc1ccccc1 ZINC000359617669 1044183514 /nfs/dbraw/zinc/18/35/14/1044183514.db2.gz DVGRPICPMXKAIM-FQEVSTJZSA-N 2 1 324.468 4.012 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H]2CCSc3ccccc32)C1 ZINC000359935480 1044216939 /nfs/dbraw/zinc/21/69/39/1044216939.db2.gz POUJYMVNKSIPJP-FUHWJXTLSA-N 2 1 318.530 4.325 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444208233 1044238151 /nfs/dbraw/zinc/23/81/51/1044238151.db2.gz CMBNIGREEZJWQS-HZPDHXFCSA-N 2 1 306.881 4.209 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000444208233 1044238166 /nfs/dbraw/zinc/23/81/66/1044238166.db2.gz CMBNIGREEZJWQS-HZPDHXFCSA-N 2 1 306.881 4.209 20 0 DIADMP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2ccsc2)c2ccc(Cl)cc2)C1 ZINC000563424253 1044258282 /nfs/dbraw/zinc/25/82/82/1044258282.db2.gz KDSZUGNUHBWEAG-IKGGRYGDSA-N 2 1 320.889 4.350 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](CCCCOC(C)(C)C)C1 ZINC000475066717 1044258678 /nfs/dbraw/zinc/25/86/78/1044258678.db2.gz LKPKBHXFEWCMTN-MOPGFXCFSA-N 2 1 324.553 4.168 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](CCCCOC(C)(C)C)C1 ZINC000475066717 1044258685 /nfs/dbraw/zinc/25/86/85/1044258685.db2.gz LKPKBHXFEWCMTN-MOPGFXCFSA-N 2 1 324.553 4.168 20 0 DIADMP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000475113657 1044279581 /nfs/dbraw/zinc/27/95/81/1044279581.db2.gz FAPGGXGHALNJPL-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]2Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000475113657 1044279597 /nfs/dbraw/zinc/27/95/97/1044279597.db2.gz FAPGGXGHALNJPL-UHFFFAOYSA-N 2 1 313.272 4.054 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC(C)(C)c2ccccc21 ZINC000360656780 1044296398 /nfs/dbraw/zinc/29/63/98/1044296398.db2.gz KSLSZUBYYFALTG-BEFAXECRSA-N 2 1 311.473 4.230 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000563720649 1044304760 /nfs/dbraw/zinc/30/47/60/1044304760.db2.gz BEXKSAAQFJPYMZ-GOSISDBHSA-N 2 1 317.864 4.233 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000563720649 1044304772 /nfs/dbraw/zinc/30/47/72/1044304772.db2.gz BEXKSAAQFJPYMZ-GOSISDBHSA-N 2 1 317.864 4.233 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CCCc2c3ccccc3sc21 ZINC000360941419 1044330988 /nfs/dbraw/zinc/33/09/88/1044330988.db2.gz KQCJDRWDXNNAEH-INIZCTEOSA-N 2 1 311.454 4.073 20 0 DIADMP C[C@H](c1ccccc1)[C@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475288299 1044346867 /nfs/dbraw/zinc/34/68/67/1044346867.db2.gz RNIPDZZDENWVSM-ZJOUEHCJSA-N 2 1 322.496 4.290 20 0 DIADMP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475288859 1044347774 /nfs/dbraw/zinc/34/77/74/1044347774.db2.gz UYUPPFQQJZOYRZ-UYAOXDASSA-N 2 1 300.490 4.233 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000361078470 1044357078 /nfs/dbraw/zinc/35/70/78/1044357078.db2.gz HWIDIJQRQIBAPM-APWZRJJASA-N 2 1 316.489 4.014 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000361079551 1044357630 /nfs/dbraw/zinc/35/76/30/1044357630.db2.gz LIQNLEKCCVDCSH-OXJNMPFZSA-N 2 1 316.489 4.014 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)c1ccc(C)cc1 ZINC000361507330 1044411687 /nfs/dbraw/zinc/41/16/87/1044411687.db2.gz DKJNOKSODUORGQ-FQEVSTJZSA-N 2 1 323.484 4.408 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(F)c2ccccc21 ZINC000294374949 1044413334 /nfs/dbraw/zinc/41/33/34/1044413334.db2.gz RDFGNOUHQOXXLA-GJZGRUSLSA-N 2 1 323.415 4.089 20 0 DIADMP CC(C)[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000361577589 1044418482 /nfs/dbraw/zinc/41/84/82/1044418482.db2.gz LOUOFUFWYKOOHH-MRXNPFEDSA-N 2 1 300.446 4.046 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000565257152 1044423076 /nfs/dbraw/zinc/42/30/76/1044423076.db2.gz DGLSJXGIAZJXIQ-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000565257152 1044423089 /nfs/dbraw/zinc/42/30/89/1044423089.db2.gz DGLSJXGIAZJXIQ-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000565257152 1044423091 /nfs/dbraw/zinc/42/30/91/1044423091.db2.gz DGLSJXGIAZJXIQ-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000565257152 1044423099 /nfs/dbraw/zinc/42/30/99/1044423099.db2.gz DGLSJXGIAZJXIQ-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000565257152 1044423107 /nfs/dbraw/zinc/42/31/07/1044423107.db2.gz DGLSJXGIAZJXIQ-QZTJIDSGSA-N 2 1 306.881 4.209 20 0 DIADMP CC1CC[NH+](CCC[NH2+][C@H]2CCSc3c(F)cccc32)CC1 ZINC000336850262 1044439586 /nfs/dbraw/zinc/43/95/86/1044439586.db2.gz QGQZVAAMGIAALJ-KRWDZBQOSA-N 2 1 322.493 4.074 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCSc3ccc(Cl)cc32)CC[N@@H+]1C ZINC000361753900 1044441853 /nfs/dbraw/zinc/44/18/53/1044441853.db2.gz LNUVJEBVTZDPMD-IVMMDQJWSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCSc3ccc(Cl)cc32)CC[N@H+]1C ZINC000361753900 1044441856 /nfs/dbraw/zinc/44/18/56/1044441856.db2.gz LNUVJEBVTZDPMD-IVMMDQJWSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1cccnc1 ZINC000112527750 1044443035 /nfs/dbraw/zinc/44/30/35/1044443035.db2.gz KLDMJIPIOAMFSH-MSOLQXFVSA-N 2 1 323.484 4.164 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@@H+]1C ZINC000565563622 1044443885 /nfs/dbraw/zinc/44/38/85/1044443885.db2.gz SRLDNCOYXKUSMF-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(C3CCCC3)cc2)CC[N@H+]1C ZINC000565563622 1044443891 /nfs/dbraw/zinc/44/38/91/1044443891.db2.gz SRLDNCOYXKUSMF-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563622 1044443897 /nfs/dbraw/zinc/44/38/97/1044443897.db2.gz SRLDNCOYXKUSMF-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(C3CCCC3)cc2)CC[NH+]1C ZINC000565563622 1044443905 /nfs/dbraw/zinc/44/39/05/1044443905.db2.gz SRLDNCOYXKUSMF-JXFKEZNVSA-N 2 1 300.490 4.259 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CC[C@@H](c2ccc(C)cc2C)C1 ZINC000348317687 1044503089 /nfs/dbraw/zinc/50/30/89/1044503089.db2.gz KTUDUVRGUMATOD-LJQANCHMSA-N 2 1 311.473 4.078 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CC[C@@H](c2ccc(C)cc2C)C1 ZINC000348317687 1044503103 /nfs/dbraw/zinc/50/31/03/1044503103.db2.gz KTUDUVRGUMATOD-LJQANCHMSA-N 2 1 311.473 4.078 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCC2(F)CCC2)cc1 ZINC000348321182 1044510392 /nfs/dbraw/zinc/51/03/92/1044510392.db2.gz MIQBRDYVKXGQHT-AWEZNQCLSA-N 2 1 301.409 4.114 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C)SC2)cc1 ZINC000655720923 1044539102 /nfs/dbraw/zinc/53/91/02/1044539102.db2.gz JEUTUTFGJJCSJD-JKIFEVAISA-N 2 1 315.486 4.115 20 0 DIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000567373753 1044559835 /nfs/dbraw/zinc/55/98/35/1044559835.db2.gz ZSCQHHOBMCBYRC-QZTJIDSGSA-N 2 1 314.498 4.024 20 0 DIADMP Cc1ccsc1CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000567373753 1044559850 /nfs/dbraw/zinc/55/98/50/1044559850.db2.gz ZSCQHHOBMCBYRC-QZTJIDSGSA-N 2 1 314.498 4.024 20 0 DIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000567373755 1044560881 /nfs/dbraw/zinc/56/08/81/1044560881.db2.gz ZSCQHHOBMCBYRC-ZWKOTPCHSA-N 2 1 314.498 4.024 20 0 DIADMP Cc1ccsc1CC[NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000567373755 1044560893 /nfs/dbraw/zinc/56/08/93/1044560893.db2.gz ZSCQHHOBMCBYRC-ZWKOTPCHSA-N 2 1 314.498 4.024 20 0 DIADMP Cc1ncc(CNc2ccc([N@H+]3CCCC[C@@H]3C)cc2C)n1C ZINC000567367834 1044561777 /nfs/dbraw/zinc/56/17/77/1044561777.db2.gz AVABJJPTHFQBNR-HNNXBMFYSA-N 2 1 312.461 4.028 20 0 DIADMP Cc1ncc(CNc2ccc([N@@H+]3CCCC[C@@H]3C)cc2C)n1C ZINC000567367834 1044561794 /nfs/dbraw/zinc/56/17/94/1044561794.db2.gz AVABJJPTHFQBNR-HNNXBMFYSA-N 2 1 312.461 4.028 20 0 DIADMP CCOc1ccc(Cl)cc1[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000295846469 1044567403 /nfs/dbraw/zinc/56/74/03/1044567403.db2.gz DQTSTWAJXZFTAN-WWTUQBGBSA-N 2 1 322.880 4.015 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCCC(C)(F)F)cc1 ZINC000296003263 1044581188 /nfs/dbraw/zinc/58/11/88/1044581188.db2.gz LBHWQPVQPNYMDV-CYBMUJFWSA-N 2 1 307.388 4.267 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000568166636 1044608105 /nfs/dbraw/zinc/60/81/05/1044608105.db2.gz PISBCDFXLPLNPI-NJDAHSKKSA-N 2 1 323.484 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000568166636 1044608117 /nfs/dbraw/zinc/60/81/17/1044608117.db2.gz PISBCDFXLPLNPI-NJDAHSKKSA-N 2 1 323.484 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000568166637 1044609259 /nfs/dbraw/zinc/60/92/59/1044609259.db2.gz PISBCDFXLPLNPI-NJYVYQBISA-N 2 1 323.484 4.011 20 0 DIADMP Cn1c[nH+]cc1CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000568166637 1044609268 /nfs/dbraw/zinc/60/92/68/1044609268.db2.gz PISBCDFXLPLNPI-NJYVYQBISA-N 2 1 323.484 4.011 20 0 DIADMP CC(C)[N@H+]1CC[C@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000568329662 1044616794 /nfs/dbraw/zinc/61/67/94/1044616794.db2.gz AVZFMJWJDWWNQH-UZLBHIALSA-N 2 1 316.464 4.082 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444788769 1044629770 /nfs/dbraw/zinc/62/97/70/1044629770.db2.gz ASVZVTRGIBFZGR-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444788769 1044629779 /nfs/dbraw/zinc/62/97/79/1044629779.db2.gz ASVZVTRGIBFZGR-SFHVURJKSA-N 2 1 317.864 4.462 20 0 DIADMP c1ccc2c(c1)cccc2CCC[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000523552948 1044657777 /nfs/dbraw/zinc/65/77/77/1044657777.db2.gz DQKPLOVDRKJMPK-IBGZPJMESA-N 2 1 322.496 4.190 20 0 DIADMP CC(C)CC[NH2+]CC1([N@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233900 1044670827 /nfs/dbraw/zinc/67/08/27/1044670827.db2.gz XPIOQOWGHXNTBI-UHFFFAOYSA-N 2 1 302.506 4.457 20 0 DIADMP CC(C)CC[NH2+]CC1([N@@H+](C)Cc2ccccc2)CCCCC1 ZINC000714233900 1044670835 /nfs/dbraw/zinc/67/08/35/1044670835.db2.gz XPIOQOWGHXNTBI-UHFFFAOYSA-N 2 1 302.506 4.457 20 0 DIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000445315729 1044702555 /nfs/dbraw/zinc/70/25/55/1044702555.db2.gz IVJAKSDGQLWYPE-ZWKOTPCHSA-N 2 1 324.468 4.423 20 0 DIADMP C[C@@H](c1ccc(Oc2ccccc2)cc1)[N@H+]1CC[C@H](C[NH+](C)C)C1 ZINC000445315729 1044702564 /nfs/dbraw/zinc/70/25/64/1044702564.db2.gz IVJAKSDGQLWYPE-ZWKOTPCHSA-N 2 1 324.468 4.423 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@@H]1c1ccccc1 ZINC000571424820 1044810817 /nfs/dbraw/zinc/81/08/17/1044810817.db2.gz UAXWVWWMEZCDIQ-FCHUYYIVSA-N 2 1 320.480 4.489 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)C[C@@H]1c1ccccc1 ZINC000571424820 1044810843 /nfs/dbraw/zinc/81/08/43/1044810843.db2.gz UAXWVWWMEZCDIQ-FCHUYYIVSA-N 2 1 320.480 4.489 20 0 DIADMP Cc1nccn1CCCC[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000371325860 1044871368 /nfs/dbraw/zinc/87/13/68/1044871368.db2.gz ITNVPKGJHMALIM-SFHVURJKSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000371325860 1044871384 /nfs/dbraw/zinc/87/13/84/1044871384.db2.gz ITNVPKGJHMALIM-SFHVURJKSA-N 2 1 319.399 4.087 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000371325860 1044871410 /nfs/dbraw/zinc/87/14/10/1044871410.db2.gz ITNVPKGJHMALIM-SFHVURJKSA-N 2 1 319.399 4.087 20 0 DIADMP C[C@H](C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890168 1044880390 /nfs/dbraw/zinc/88/03/90/1044880390.db2.gz QKADYBYNVRGXAA-WBVHZDCISA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890168 1044880412 /nfs/dbraw/zinc/88/04/12/1044880412.db2.gz QKADYBYNVRGXAA-WBVHZDCISA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890168 1044880444 /nfs/dbraw/zinc/88/04/44/1044880444.db2.gz QKADYBYNVRGXAA-WBVHZDCISA-N 2 1 320.908 4.107 20 0 DIADMP C[C@H](C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1)c1cccc(Cl)c1 ZINC000572890168 1044880460 /nfs/dbraw/zinc/88/04/60/1044880460.db2.gz QKADYBYNVRGXAA-WBVHZDCISA-N 2 1 320.908 4.107 20 0 DIADMP CC(C)[N@@H+](C)CC1CC[NH+]([C@H]2CCCc3ccccc32)CC1 ZINC000524596676 1044885731 /nfs/dbraw/zinc/88/57/31/1044885731.db2.gz PCFAJPYCRPVVHN-FQEVSTJZSA-N 2 1 300.490 4.116 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000524758103 1044917689 /nfs/dbraw/zinc/91/76/89/1044917689.db2.gz PRTRXUQGDIQGON-MAUKXSAKSA-N 2 1 306.881 4.209 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000524758103 1044917691 /nfs/dbraw/zinc/91/76/91/1044917691.db2.gz PRTRXUQGDIQGON-MAUKXSAKSA-N 2 1 306.881 4.209 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC000574561697 1044960378 /nfs/dbraw/zinc/96/03/78/1044960378.db2.gz SGHGIIOGUZPPPI-QWHCGFSZSA-N 2 1 302.915 4.041 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+][C@@H](C)CCc1ccc(Cl)s1 ZINC000574561697 1044960389 /nfs/dbraw/zinc/96/03/89/1044960389.db2.gz SGHGIIOGUZPPPI-QWHCGFSZSA-N 2 1 302.915 4.041 20 0 DIADMP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](CC)CC2)cc1 ZINC000575337125 1044995045 /nfs/dbraw/zinc/99/50/45/1044995045.db2.gz BULSITBGTYTLND-INIZCTEOSA-N 2 1 304.478 4.000 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](C[C@H]2CCC(F)(F)C2)C1 ZINC000575336983 1044995983 /nfs/dbraw/zinc/99/59/83/1044995983.db2.gz XJYSPCXZYMUARJ-IXDOHACOSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000575336983 1044995994 /nfs/dbraw/zinc/99/59/94/1044995994.db2.gz XJYSPCXZYMUARJ-IXDOHACOSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000575336983 1044996001 /nfs/dbraw/zinc/99/60/01/1044996001.db2.gz XJYSPCXZYMUARJ-IXDOHACOSA-N 2 1 314.464 4.008 20 0 DIADMP C[C@H](c1ccncc1)[N@@H+](C)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000411411917 1045005457 /nfs/dbraw/zinc/00/54/57/1045005457.db2.gz BIXUCVYMDCNMIP-GOSISDBHSA-N 2 1 323.484 4.261 20 0 DIADMP C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000411413295 1045006419 /nfs/dbraw/zinc/00/64/19/1045006419.db2.gz CYJMEGSAINEWAQ-GOSISDBHSA-N 2 1 323.484 4.261 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(-c3ccncc3)c2)C1 ZINC000151143095 1045015343 /nfs/dbraw/zinc/01/53/43/1045015343.db2.gz GCEOAVXMKOPBOR-ROUUACIJSA-N 2 1 323.484 4.131 20 0 DIADMP C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000525274300 1045023941 /nfs/dbraw/zinc/02/39/41/1045023941.db2.gz PBMQMTZHEYJWEM-MSOLQXFVSA-N 2 1 308.469 4.319 20 0 DIADMP Cc1ccc([C@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCCC2)cc1 ZINC000446755212 1045032089 /nfs/dbraw/zinc/03/20/89/1045032089.db2.gz YZQBRTQUSXEYNY-DYESRHJHSA-N 2 1 312.501 4.300 20 0 DIADMP CSc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)s1 ZINC000576263241 1045046365 /nfs/dbraw/zinc/04/63/65/1045046365.db2.gz YGTOQQLUNKSOJH-AWEZNQCLSA-N 2 1 312.548 4.072 20 0 DIADMP CSc1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)s1 ZINC000576263242 1045046808 /nfs/dbraw/zinc/04/68/08/1045046808.db2.gz YGTOQQLUNKSOJH-CQSZACIVSA-N 2 1 312.548 4.072 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H](c2ccccc2)C[C@H](C)C1)c1c[nH+]ccc1N ZINC000576576079 1045066145 /nfs/dbraw/zinc/06/61/45/1045066145.db2.gz GQWKZPTYWDWXMD-ONIAQPFYSA-N 2 1 309.457 4.117 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771717 1045078905 /nfs/dbraw/zinc/07/89/05/1045078905.db2.gz CGXTZCOYNDPYPH-FFZOFVMBSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000576771717 1045078912 /nfs/dbraw/zinc/07/89/12/1045078912.db2.gz CGXTZCOYNDPYPH-FFZOFVMBSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+](C)C1)C1CCC(C(F)(F)F)CC1 ZINC000459796031 1045117754 /nfs/dbraw/zinc/11/77/54/1045117754.db2.gz VYDFQKPDGSTQHK-QVOMUQBLSA-N 2 1 320.443 4.065 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)c(F)c1 ZINC000467839912 1045133903 /nfs/dbraw/zinc/13/39/03/1045133903.db2.gz FMBSBAWHMGHDPI-GJZGRUSLSA-N 2 1 310.432 4.270 20 0 DIADMP CC1(C)CC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000447583799 1045152640 /nfs/dbraw/zinc/15/26/40/1045152640.db2.gz CMTPOQALOMSFBO-LWYYNNOASA-N 2 1 312.501 4.350 20 0 DIADMP C[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)CC1 ZINC000447587488 1045152773 /nfs/dbraw/zinc/15/27/73/1045152773.db2.gz QLZCVMKXEBSJPH-OSYHSXPHSA-N 2 1 312.501 4.350 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000577918032 1045188003 /nfs/dbraw/zinc/18/80/03/1045188003.db2.gz ANOYDITZMCABTO-CQSZACIVSA-N 2 1 316.411 4.129 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@H](c2ccccn2)C2CCC2)C1 ZINC000924684146 1045189534 /nfs/dbraw/zinc/18/95/34/1045189534.db2.gz CEZIEPGKDQSGEH-PXNSSMCTSA-N 2 1 315.505 4.025 20 0 DIADMP C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(C[NH+](C)C)c1 ZINC000924722841 1045194579 /nfs/dbraw/zinc/19/45/79/1045194579.db2.gz WCIMSOFWIUSSQG-KGLIPLIRSA-N 2 1 318.411 4.438 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CCN(C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366419 1045218497 /nfs/dbraw/zinc/21/84/97/1045218497.db2.gz UYMHKFKQAZGLGH-HOTGVXAUSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366419 1045218502 /nfs/dbraw/zinc/21/85/02/1045218502.db2.gz UYMHKFKQAZGLGH-HOTGVXAUSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366419 1045218508 /nfs/dbraw/zinc/21/85/08/1045218508.db2.gz UYMHKFKQAZGLGH-HOTGVXAUSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366419 1045218515 /nfs/dbraw/zinc/21/85/15/1045218515.db2.gz UYMHKFKQAZGLGH-HOTGVXAUSA-N 2 1 308.897 4.107 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C[C@H](C)c2cccc(Cl)c2)C1 ZINC000527366419 1045218526 /nfs/dbraw/zinc/21/85/26/1045218526.db2.gz UYMHKFKQAZGLGH-HOTGVXAUSA-N 2 1 308.897 4.107 20 0 DIADMP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)ccc1F ZINC000578370140 1045235796 /nfs/dbraw/zinc/23/57/96/1045235796.db2.gz QYRMGOFPEZLXFE-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)ccc1F ZINC000578370140 1045235810 /nfs/dbraw/zinc/23/58/10/1045235810.db2.gz QYRMGOFPEZLXFE-UHFFFAOYSA-N 2 1 318.411 4.049 20 0 DIADMP Cc1cc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)ccn1 ZINC000527639080 1045242283 /nfs/dbraw/zinc/24/22/83/1045242283.db2.gz AZMOXPSZJAETJG-GOSISDBHSA-N 2 1 323.484 4.054 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)[C@H]1CC12CC2 ZINC000527872739 1045270975 /nfs/dbraw/zinc/27/09/75/1045270975.db2.gz YSRFJUPJYOXLDJ-OXQOHEQNSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H]1CCc2cc(F)c(Cl)cc21 ZINC000527871303 1045271016 /nfs/dbraw/zinc/27/10/16/1045271016.db2.gz UCPGUPICOMNDPA-KRWDZBQOSA-N 2 1 321.827 4.041 20 0 DIADMP Cn1c[nH+]cc1CCC[NH2+]C1(c2cccc(Cl)c2)CCCC1 ZINC000579240736 1045302156 /nfs/dbraw/zinc/30/21/56/1045302156.db2.gz ALHUHFSNENFUGD-UHFFFAOYSA-N 2 1 317.864 4.065 20 0 DIADMP CCc1nccn1[C@@H]1CCC[N@@H+](Cc2cccc3ccoc32)C1 ZINC000449025093 1045338023 /nfs/dbraw/zinc/33/80/23/1045338023.db2.gz GEBFDVSRRDEJKV-QGZVFWFLSA-N 2 1 309.413 4.029 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000449085913 1045342777 /nfs/dbraw/zinc/34/27/77/1045342777.db2.gz AQSCCZRTAPFZEW-VQTJNVASSA-N 2 1 320.480 4.378 20 0 DIADMP Cc1ccccc1-c1ccccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000449085911 1045343258 /nfs/dbraw/zinc/34/32/58/1045343258.db2.gz AQSCCZRTAPFZEW-UXHICEINSA-N 2 1 320.480 4.378 20 0 DIADMP Clc1ccc([C@@H]2CC[C@@H]([NH2+]C[C@@H]3CC[N@H+](C4CC4)C3)C2)cc1 ZINC000449078398 1045344960 /nfs/dbraw/zinc/34/49/60/1045344960.db2.gz UWQOBFWAKANCPW-YXJHDRRASA-N 2 1 318.892 4.050 20 0 DIADMP Cc1cccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1F ZINC000449099190 1045346356 /nfs/dbraw/zinc/34/63/56/1045346356.db2.gz MNNHGWJCBOLRSV-UHFFFAOYSA-N 2 1 314.448 4.264 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@H]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000449107423 1045347388 /nfs/dbraw/zinc/34/73/88/1045347388.db2.gz MJVGKVUYEGGTTB-SFHVURJKSA-N 2 1 315.848 4.071 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106933 1045347762 /nfs/dbraw/zinc/34/77/62/1045347762.db2.gz NTTMFBFPDYHIQG-CRAIPNDOSA-N 2 1 306.519 4.128 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCC1 ZINC000449106933 1045347770 /nfs/dbraw/zinc/34/77/70/1045347770.db2.gz NTTMFBFPDYHIQG-CRAIPNDOSA-N 2 1 306.519 4.128 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)C1 ZINC000449090195 1045348003 /nfs/dbraw/zinc/34/80/03/1045348003.db2.gz MKTSXCHGMVCCBV-DNVCBOLYSA-N 2 1 318.892 4.207 20 0 DIADMP Clc1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)C2)cc1 ZINC000449092877 1045349111 /nfs/dbraw/zinc/34/91/11/1045349111.db2.gz VNIIVKADQUJLSP-LULLPPNCSA-N 2 1 318.892 4.193 20 0 DIADMP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CCC3)[C@H]1c1cccs1 ZINC000449155576 1045353072 /nfs/dbraw/zinc/35/30/72/1045353072.db2.gz BHYSKLTXTHCMMD-NXHRZFHOSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC23CCC3)[C@H]1c1cccs1 ZINC000449155576 1045353081 /nfs/dbraw/zinc/35/30/81/1045353081.db2.gz BHYSKLTXTHCMMD-NXHRZFHOSA-N 2 1 318.530 4.443 20 0 DIADMP C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000697127635 1045393524 /nfs/dbraw/zinc/39/35/24/1045393524.db2.gz IVMQKHTVTFTVLF-NVXWUHKLSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@H]([NH2+]CC(C)(C)C(C)(F)F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000697127633 1045394007 /nfs/dbraw/zinc/39/40/07/1045394007.db2.gz IVMQKHTVTFTVLF-DOTOQJQBSA-N 2 1 324.459 4.168 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]Cc1nc2c(s1)C[N@@H+](C(C)C)CC2 ZINC000449443804 1045396832 /nfs/dbraw/zinc/39/68/32/1045396832.db2.gz VZAMLJYZDGRZTD-HNNXBMFYSA-N 2 1 321.534 4.134 20 0 DIADMP CC(C)=CCC[C@H](C)[NH2+]Cc1nc2c(s1)C[N@H+](C(C)C)CC2 ZINC000449443804 1045396836 /nfs/dbraw/zinc/39/68/36/1045396836.db2.gz VZAMLJYZDGRZTD-HNNXBMFYSA-N 2 1 321.534 4.134 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCCC2(F)F)cc1 ZINC000449505924 1045404792 /nfs/dbraw/zinc/40/47/92/1045404792.db2.gz ZQUFQTXSXIQFMO-XJKSGUPXSA-N 2 1 319.399 4.267 20 0 DIADMP Cc1cc(Cl)ccc1C1=CC[N@@H+](CCCn2ccnc2)CC1 ZINC000528741619 1045406531 /nfs/dbraw/zinc/40/65/31/1045406531.db2.gz OYZUZPNKPHZEQJ-UHFFFAOYSA-N 2 1 315.848 4.024 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000119256366 1045412513 /nfs/dbraw/zinc/41/25/13/1045412513.db2.gz NYPDMBHVGWPKTK-AWEZNQCLSA-N 2 1 305.853 4.318 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000119256366 1045412514 /nfs/dbraw/zinc/41/25/14/1045412514.db2.gz NYPDMBHVGWPKTK-AWEZNQCLSA-N 2 1 305.853 4.318 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)C1 ZINC000389742329 1045426947 /nfs/dbraw/zinc/42/69/47/1045426947.db2.gz SSRRRDPDYPHRTP-UFHDJZAFSA-N 2 1 300.490 4.031 20 0 DIADMP C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)C1 ZINC000389742329 1045426948 /nfs/dbraw/zinc/42/69/48/1045426948.db2.gz SSRRRDPDYPHRTP-UFHDJZAFSA-N 2 1 300.490 4.031 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]C[C@]2(C)CCCS2)cc1 ZINC000120449860 1045473120 /nfs/dbraw/zinc/47/31/20/1045473120.db2.gz ISHDICGGZZIICJ-KSSFIOAISA-N 2 1 315.486 4.117 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+][C@H](C)C2CC(F)(F)C2)cc1 ZINC000529540602 1045491063 /nfs/dbraw/zinc/49/10/63/1045491063.db2.gz FJDASEQFBGZWKY-CHWSQXEVSA-N 2 1 319.399 4.265 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)C1CC(F)(F)C1 ZINC000529547431 1045492848 /nfs/dbraw/zinc/49/28/48/1045492848.db2.gz YTRAUAJGRAVXBH-CQSZACIVSA-N 2 1 310.432 4.050 20 0 DIADMP C[C@H]([NH2+]CCc1ccc(Cl)cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450724602 1045555981 /nfs/dbraw/zinc/55/59/81/1045555981.db2.gz GRIFLYDUGZMGKV-RDJZCZTQSA-N 2 1 320.908 4.125 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2CCCCC2(F)F)CC1 ZINC000450865812 1045580076 /nfs/dbraw/zinc/58/00/76/1045580076.db2.gz DYZUAYYGTQNXHP-HNNXBMFYSA-N 2 1 324.415 4.059 20 0 DIADMP C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000381772227 1045583816 /nfs/dbraw/zinc/58/38/16/1045583816.db2.gz SWOIDUKWPLSEIO-RXVVDRJESA-N 2 1 308.469 4.249 20 0 DIADMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000381772228 1045584220 /nfs/dbraw/zinc/58/42/20/1045584220.db2.gz SWOIDUKWPLSEIO-WIYYLYMNSA-N 2 1 308.469 4.249 20 0 DIADMP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccccc1 ZINC000390846864 1045586280 /nfs/dbraw/zinc/58/62/80/1045586280.db2.gz FTPZJIDAAFCDFG-OAQYLSRUSA-N 2 1 322.496 4.119 20 0 DIADMP CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccccc1 ZINC000390846864 1045586296 /nfs/dbraw/zinc/58/62/96/1045586296.db2.gz FTPZJIDAAFCDFG-OAQYLSRUSA-N 2 1 322.496 4.119 20 0 DIADMP Cc1nccn1CCCC[N@H+]1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C ZINC000451191848 1045644659 /nfs/dbraw/zinc/64/46/59/1045644659.db2.gz UWSXLXKOJWDAKQ-UWVAXJGDSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C ZINC000451191848 1045644667 /nfs/dbraw/zinc/64/46/67/1045644667.db2.gz UWSXLXKOJWDAKQ-UWVAXJGDSA-N 2 1 311.473 4.238 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C ZINC000451191848 1045644671 /nfs/dbraw/zinc/64/46/71/1045644671.db2.gz UWSXLXKOJWDAKQ-UWVAXJGDSA-N 2 1 311.473 4.238 20 0 DIADMP [NH3+][C@H]1C[C@@H]([NH2+]Cc2ccccc2CC(F)(F)F)c2ccccc21 ZINC000629553607 1045678936 /nfs/dbraw/zinc/67/89/36/1045678936.db2.gz BCTOUDOCBGQDPQ-DLBZAZTESA-N 2 1 320.358 4.026 20 0 DIADMP [NH3+][C@H]1C[C@H]([NH2+][C@H]2CCCc3ccc(Cl)cc32)c2ccccc21 ZINC000629548931 1045679063 /nfs/dbraw/zinc/67/90/63/1045679063.db2.gz OPBCKYGYQKRKOI-FHWLQOOXSA-N 2 1 312.844 4.452 20 0 DIADMP COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000121998583 1045692164 /nfs/dbraw/zinc/69/21/64/1045692164.db2.gz KOVJBUMNQRYCMZ-GJZGRUSLSA-N 2 1 315.461 4.035 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000530667418 1045706671 /nfs/dbraw/zinc/70/66/71/1045706671.db2.gz LOCVOLQBCLZXED-IBGZPJMESA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000530667418 1045706690 /nfs/dbraw/zinc/70/66/90/1045706690.db2.gz LOCVOLQBCLZXED-IBGZPJMESA-N 2 1 308.469 4.127 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000530667418 1045706711 /nfs/dbraw/zinc/70/67/11/1045706711.db2.gz LOCVOLQBCLZXED-IBGZPJMESA-N 2 1 308.469 4.127 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2cccc(C(F)(F)F)c2)C[C@@H]1C ZINC000530905614 1045749909 /nfs/dbraw/zinc/74/99/09/1045749909.db2.gz PXAGAUKGYJKEKP-XJKSGUPXSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@@H]1C ZINC000530905614 1045749921 /nfs/dbraw/zinc/74/99/21/1045749921.db2.gz PXAGAUKGYJKEKP-XJKSGUPXSA-N 2 1 314.395 4.010 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(F)(F)F)c2)C[C@@H]1C ZINC000530905614 1045749935 /nfs/dbraw/zinc/74/99/35/1045749935.db2.gz PXAGAUKGYJKEKP-XJKSGUPXSA-N 2 1 314.395 4.010 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@@H]1c1ccc(F)cc1C ZINC000451984132 1045754092 /nfs/dbraw/zinc/75/40/92/1045754092.db2.gz HCICZZFEBFCFSJ-LJQANCHMSA-N 2 1 315.436 4.256 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@@H]1c1ccc(F)cc1C ZINC000451984132 1045754103 /nfs/dbraw/zinc/75/41/03/1045754103.db2.gz HCICZZFEBFCFSJ-LJQANCHMSA-N 2 1 315.436 4.256 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2CCCC24CC4)C3)cc1 ZINC000631665964 1045900713 /nfs/dbraw/zinc/90/07/13/1045900713.db2.gz VDGWASYYMZIGLK-YSTOQKLRSA-N 2 1 310.485 4.104 20 0 DIADMP CC(C)c1ccc(CCC[NH2+][C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1 ZINC000531713581 1045904432 /nfs/dbraw/zinc/90/44/32/1045904432.db2.gz CPMWBWRSZLXQDX-ABSDTBQOSA-N 2 1 302.506 4.061 20 0 DIADMP Cc1ncc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)s1 ZINC000631706563 1045906294 /nfs/dbraw/zinc/90/62/94/1045906294.db2.gz IDXJOJNYYSBTKT-GRDNDAEWSA-N 2 1 321.534 4.145 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C1CC1 ZINC000531723444 1045913364 /nfs/dbraw/zinc/91/33/64/1045913364.db2.gz AEKDUACSXOSLGG-AHRSYUTCSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)C1CC1 ZINC000531723444 1045913380 /nfs/dbraw/zinc/91/33/80/1045913380.db2.gz AEKDUACSXOSLGG-AHRSYUTCSA-N 2 1 300.490 4.064 20 0 DIADMP Clc1ccc([C@@H]([NH2+]C[C@H]2CC[N@H+](C3CC3)C2)C2CCC2)cc1 ZINC000453072729 1045918575 /nfs/dbraw/zinc/91/85/75/1045918575.db2.gz FWNKZZTVEDDAOK-KUHUBIRLSA-N 2 1 318.892 4.255 20 0 DIADMP CC[C@H]([NH2+]C1CC[NH+](Cc2ccccc2C)CC1)c1ccncc1 ZINC000453072939 1045918871 /nfs/dbraw/zinc/91/88/71/1045918871.db2.gz ZFZGNIOBMRIHAX-NRFANRHFSA-N 2 1 323.484 4.095 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2cc3ccccc3s2)CC1 ZINC001137685529 1045931994 /nfs/dbraw/zinc/93/19/94/1045931994.db2.gz ODQFRYHEQYBPSH-UHFFFAOYSA-N 2 1 316.514 4.454 20 0 DIADMP CC[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1ccncc1 ZINC000453126535 1045946105 /nfs/dbraw/zinc/94/61/05/1045946105.db2.gz QKUXFPHXUJZPNF-LAUBAEHRSA-N 2 1 323.484 4.348 20 0 DIADMP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cs1 ZINC000453193607 1045975580 /nfs/dbraw/zinc/97/55/80/1045975580.db2.gz FMKVCFIKWPOVIX-PMPSAXMXSA-N 2 1 306.519 4.360 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1 ZINC000453347522 1046050705 /nfs/dbraw/zinc/05/07/05/1046050705.db2.gz KPQNQCWUNKSARC-LNRIEFBSSA-N 2 1 304.503 4.074 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc(C(F)(F)F)s1 ZINC000902754659 1046060603 /nfs/dbraw/zinc/06/06/03/1046060603.db2.gz FSRPDJPCIFKESV-SNVBAGLBSA-N 2 1 317.380 4.013 20 0 DIADMP C[C@H]([NH2+]CCCC[N@@H+](C)C1CC1)c1ccc(-c2ccncc2)cc1 ZINC000453386186 1046062201 /nfs/dbraw/zinc/06/22/01/1046062201.db2.gz AGWYXCSWEPNULL-KRWDZBQOSA-N 2 1 323.484 4.274 20 0 DIADMP Cc1ccc([C@H]2CCC[C@@H]2[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000453386175 1046063218 /nfs/dbraw/zinc/06/32/18/1046063218.db2.gz AFQZJYYDQZTYOP-UXHICEINSA-N 2 1 300.490 4.095 20 0 DIADMP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000453386173 1046063273 /nfs/dbraw/zinc/06/32/73/1046063273.db2.gz AFQZJYYDQZTYOP-PMACEKPBSA-N 2 1 300.490 4.095 20 0 DIADMP CC(C)Cc1cccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000453376733 1046071921 /nfs/dbraw/zinc/07/19/21/1046071921.db2.gz YUOIIDJKIJVHDR-MIJOPJBOSA-N 2 1 300.490 4.161 20 0 DIADMP CC(C)Cc1cccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000453376732 1046072617 /nfs/dbraw/zinc/07/26/17/1046072617.db2.gz YUOIIDJKIJVHDR-FAXKSRBJSA-N 2 1 300.490 4.161 20 0 DIADMP CC[N@H+](CCC[NH+](C)C)Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001138053142 1046077426 /nfs/dbraw/zinc/07/74/26/1046077426.db2.gz HYKIJFJZRZFMJM-UHFFFAOYSA-N 2 1 322.802 4.132 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC001138053142 1046077440 /nfs/dbraw/zinc/07/74/40/1046077440.db2.gz HYKIJFJZRZFMJM-UHFFFAOYSA-N 2 1 322.802 4.132 20 0 DIADMP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453407522 1046079267 /nfs/dbraw/zinc/07/92/67/1046079267.db2.gz RZPKNRILYKNRSN-CYBMUJFWSA-N 2 1 309.523 4.100 20 0 DIADMP CSc1ccc([C@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)cc1F ZINC000453390029 1046081559 /nfs/dbraw/zinc/08/15/59/1046081559.db2.gz CSXCZCMQQQCCMD-ZDUSSCGKSA-N 2 1 310.482 4.073 20 0 DIADMP Cc1cc2c(cc1C)[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)CCS2 ZINC000453397801 1046085103 /nfs/dbraw/zinc/08/51/03/1046085103.db2.gz KAJQMDFQZFZQKJ-SFHVURJKSA-N 2 1 318.530 4.304 20 0 DIADMP C[N@@H+](CCCC[NH2+]Cc1ccc(-c2ccccc2F)o1)C1CC1 ZINC000453595664 1046091818 /nfs/dbraw/zinc/09/18/18/1046091818.db2.gz KJVKMBITHLINHY-UHFFFAOYSA-N 2 1 316.420 4.050 20 0 DIADMP C[N@@H+](CCCC[NH2+]C1CC(c2ccccc2Cl)C1)C1CC1 ZINC000453602501 1046098681 /nfs/dbraw/zinc/09/86/81/1046098681.db2.gz WDSFNEJFMRICHG-UHFFFAOYSA-N 2 1 306.881 4.050 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH2+]CC(c2ccccc2)c2ccccc2)[C@@H](C)C1 ZINC000532203439 1046114671 /nfs/dbraw/zinc/11/46/71/1046114671.db2.gz ZJFMGRUUYDUEDF-PGRDOPGGSA-N 2 1 322.496 4.138 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000532234941 1046123215 /nfs/dbraw/zinc/12/32/15/1046123215.db2.gz INKPGRCUEJOROG-BNEJOLLZSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)CC[N@H+]1C ZINC000532234941 1046123220 /nfs/dbraw/zinc/12/32/20/1046123220.db2.gz INKPGRCUEJOROG-BNEJOLLZSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)CC[N@@H+]1C ZINC000532234957 1046123438 /nfs/dbraw/zinc/12/34/38/1046123438.db2.gz INKPGRCUEJOROG-PILAGYSTSA-N 2 1 306.881 4.048 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)CC[N@H+]1C ZINC000532234957 1046123445 /nfs/dbraw/zinc/12/34/45/1046123445.db2.gz INKPGRCUEJOROG-PILAGYSTSA-N 2 1 306.881 4.048 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000532270226 1046126825 /nfs/dbraw/zinc/12/68/25/1046126825.db2.gz VAYUUUKYCBQNJC-QGZVFWFLSA-N 2 1 324.459 4.312 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1)c1cc(F)ccc1F ZINC000903120262 1046168311 /nfs/dbraw/zinc/16/83/11/1046168311.db2.gz MYIIGTYAAFGHJH-QGGWKKEGSA-N 2 1 320.427 4.163 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC1)c1cc(F)ccc1F ZINC000903120262 1046168315 /nfs/dbraw/zinc/16/83/15/1046168315.db2.gz MYIIGTYAAFGHJH-QGGWKKEGSA-N 2 1 320.427 4.163 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2sc3ccccc3c2C)CC1 ZINC001138460916 1046189494 /nfs/dbraw/zinc/18/94/94/1046189494.db2.gz WFCSXOPPWNZEOS-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2sc3ccccc3c2C)CC1 ZINC001138460916 1046189499 /nfs/dbraw/zinc/18/94/99/1046189499.db2.gz WFCSXOPPWNZEOS-UHFFFAOYSA-N 2 1 302.487 4.126 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001138463661 1046191422 /nfs/dbraw/zinc/19/14/22/1046191422.db2.gz KRPSESLXLREGRT-UHFFFAOYSA-N 2 1 314.498 4.127 20 0 DIADMP c1ccc([C@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC2)cc1 ZINC000903209044 1046194475 /nfs/dbraw/zinc/19/44/75/1046194475.db2.gz DRBJXNDQZXRRGT-KEAPPQJHSA-N 2 1 310.485 4.070 20 0 DIADMP CCCc1ccc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)s1 ZINC001138526496 1046211289 /nfs/dbraw/zinc/21/12/89/1046211289.db2.gz YORMXVCGKZQGEQ-UHFFFAOYSA-N 2 1 308.535 4.253 20 0 DIADMP CC[N@H+](Cc1ccccc1)Cc1ccc(-n2cc[nH+]c2C)cc1 ZINC001138543878 1046220534 /nfs/dbraw/zinc/22/05/34/1046220534.db2.gz YDBQCRSXUUQYID-UHFFFAOYSA-N 2 1 305.425 4.203 20 0 DIADMP CC[N@@H+](Cc1ccccc1)Cc1ccc(-n2cc[nH+]c2C)cc1 ZINC001138543878 1046220542 /nfs/dbraw/zinc/22/05/42/1046220542.db2.gz YDBQCRSXUUQYID-UHFFFAOYSA-N 2 1 305.425 4.203 20 0 DIADMP CCCC[N@@H+](CCCc1cncn1C)[C@@H](C)c1ccc(C)o1 ZINC000653522355 1046256146 /nfs/dbraw/zinc/25/61/46/1046256146.db2.gz FZUKCYMPLKIFRZ-INIZCTEOSA-N 2 1 303.450 4.117 20 0 DIADMP CCCC[N@H+](CCCc1c[nH+]cn1C)[C@@H](C)c1ccc(C)o1 ZINC000653522355 1046256156 /nfs/dbraw/zinc/25/61/56/1046256156.db2.gz FZUKCYMPLKIFRZ-INIZCTEOSA-N 2 1 303.450 4.117 20 0 DIADMP CCCC[N@@H+](CCCc1c[nH+]cn1C)[C@@H](C)c1ccc(C)o1 ZINC000653522355 1046256165 /nfs/dbraw/zinc/25/61/65/1046256165.db2.gz FZUKCYMPLKIFRZ-INIZCTEOSA-N 2 1 303.450 4.117 20 0 DIADMP c1csc(C[NH2+][C@@H]2CC[N@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000638280804 1046308256 /nfs/dbraw/zinc/30/82/56/1046308256.db2.gz KIZAJAOBJHHQQV-APWZRJJASA-N 2 1 312.482 4.206 20 0 DIADMP c1csc(C[NH2+][C@@H]2CC[N@@H+](C3CC3)[C@H](c3ccccc3)C2)c1 ZINC000638280804 1046308269 /nfs/dbraw/zinc/30/82/69/1046308269.db2.gz KIZAJAOBJHHQQV-APWZRJJASA-N 2 1 312.482 4.206 20 0 DIADMP CC1CCC([N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001168205728 1046421232 /nfs/dbraw/zinc/42/12/32/1046421232.db2.gz KMUSAZUTNOIPJX-YAEFEIELSA-N 2 1 300.490 4.337 20 0 DIADMP CC1CCC([N@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)CC1 ZINC001168219090 1046430876 /nfs/dbraw/zinc/43/08/76/1046430876.db2.gz DNKZBRXHDUBFFU-MNLRITNHSA-N 2 1 312.501 4.163 20 0 DIADMP CC1CCC([NH+]2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)CC1 ZINC001168219090 1046430881 /nfs/dbraw/zinc/43/08/81/1046430881.db2.gz DNKZBRXHDUBFFU-MNLRITNHSA-N 2 1 312.501 4.163 20 0 DIADMP CC1CCC([NH+]2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)CC1 ZINC001168219090 1046430889 /nfs/dbraw/zinc/43/08/89/1046430889.db2.gz DNKZBRXHDUBFFU-MNLRITNHSA-N 2 1 312.501 4.163 20 0 DIADMP CC1CCC([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)CC1 ZINC001168221848 1046431238 /nfs/dbraw/zinc/43/12/38/1046431238.db2.gz RLQWLELTJCIODO-UHFFFAOYSA-N 2 1 318.480 4.301 20 0 DIADMP CC1CCC([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)CC1 ZINC001168221848 1046431242 /nfs/dbraw/zinc/43/12/42/1046431242.db2.gz RLQWLELTJCIODO-UHFFFAOYSA-N 2 1 318.480 4.301 20 0 DIADMP c1cc(-c2ccccc2)sc1C[NH+]1CCC(N2CCC2)CC1 ZINC001139416124 1046447047 /nfs/dbraw/zinc/44/70/47/1046447047.db2.gz MBLYPYFIWZGGLS-UHFFFAOYSA-N 2 1 312.482 4.085 20 0 DIADMP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCSc3ccc(F)cc32)C1 ZINC000125724027 1046471655 /nfs/dbraw/zinc/47/16/55/1046471655.db2.gz DRLSVHJKMYEIKB-RHSMWYFYSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCSc3ccc(F)cc32)C1 ZINC000125724027 1046471663 /nfs/dbraw/zinc/47/16/63/1046471663.db2.gz DRLSVHJKMYEIKB-RHSMWYFYSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCSc3ccc(F)cc32)C1 ZINC000125724249 1046471884 /nfs/dbraw/zinc/47/18/84/1046471884.db2.gz DRLSVHJKMYEIKB-WMLDXEAASA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCSc3ccc(F)cc32)C1 ZINC000125724249 1046471887 /nfs/dbraw/zinc/47/18/87/1046471887.db2.gz DRLSVHJKMYEIKB-WMLDXEAASA-N 2 1 322.493 4.073 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000677237400 1046474767 /nfs/dbraw/zinc/47/47/67/1046474767.db2.gz FUXXEUVFRXXHAN-OALUTQOASA-N 2 1 322.452 4.195 20 0 DIADMP c1ccc(Oc2ccccc2C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000677237400 1046474770 /nfs/dbraw/zinc/47/47/70/1046474770.db2.gz FUXXEUVFRXXHAN-OALUTQOASA-N 2 1 322.452 4.195 20 0 DIADMP Fc1ccc([C@H]([NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)C2CCCC2)cc1 ZINC000677238241 1046476438 /nfs/dbraw/zinc/47/64/38/1046476438.db2.gz ZMOXGXOGLCEUJI-HSALFYBXSA-N 2 1 316.464 4.273 20 0 DIADMP c1csc(C2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@H]4C3)CCCCC2)c1 ZINC000677241145 1046476876 /nfs/dbraw/zinc/47/68/76/1046476876.db2.gz MJCZHERVEHHBCW-SJORKVTESA-N 2 1 318.530 4.166 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)c2)c1 ZINC000677238212 1046477066 /nfs/dbraw/zinc/47/70/66/1046477066.db2.gz YCVZYEWGCQTAMH-FCHUYYIVSA-N 2 1 320.480 4.378 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000677241689 1046477168 /nfs/dbraw/zinc/47/71/68/1046477168.db2.gz SWUJFTAQDRYTBI-VKJFTORMSA-N 2 1 306.881 4.254 20 0 DIADMP CC(C)[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccccc1Cl ZINC000677241689 1046477172 /nfs/dbraw/zinc/47/71/72/1046477172.db2.gz SWUJFTAQDRYTBI-VKJFTORMSA-N 2 1 306.881 4.254 20 0 DIADMP C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)CC1CC[NH+](C)CC1 ZINC000782183663 1046497609 /nfs/dbraw/zinc/49/76/09/1046497609.db2.gz OUURPHXFSIRKAI-ZDUSSCGKSA-N 2 1 314.395 4.040 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@@H+]1Cc2cccc(C)c2C1 ZINC001140023025 1046570816 /nfs/dbraw/zinc/57/08/16/1046570816.db2.gz IKHNLFXLGGMKBL-UHFFFAOYSA-N 2 1 303.409 4.005 20 0 DIADMP Cc1[nH+]ccn1-c1ccccc1C[N@H+]1Cc2cccc(C)c2C1 ZINC001140023025 1046570828 /nfs/dbraw/zinc/57/08/28/1046570828.db2.gz IKHNLFXLGGMKBL-UHFFFAOYSA-N 2 1 303.409 4.005 20 0 DIADMP CC[N@H+](Cc1cccc(F)c1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026598 1046571088 /nfs/dbraw/zinc/57/10/88/1046571088.db2.gz NLYAGTZHDLHGQI-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CC[N@@H+](Cc1cccc(F)c1)Cc1ccccc1-n1cc[nH+]c1C ZINC001140026598 1046571101 /nfs/dbraw/zinc/57/11/01/1046571101.db2.gz NLYAGTZHDLHGQI-UHFFFAOYSA-N 2 1 323.415 4.342 20 0 DIADMP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)[C@H]1C[C@@H]1C ZINC000322090847 1046583258 /nfs/dbraw/zinc/58/32/58/1046583258.db2.gz WIAHFTPATOIMPZ-RZKXHJHZSA-N 2 1 312.501 4.206 20 0 DIADMP C[N@H+](CCCc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000533060879 1046648017 /nfs/dbraw/zinc/64/80/17/1046648017.db2.gz WOQUCKLJQNAFAD-UHFFFAOYSA-N 2 1 322.496 4.216 20 0 DIADMP C[N@@H+](CCCc1ccccc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000533060879 1046648026 /nfs/dbraw/zinc/64/80/26/1046648026.db2.gz WOQUCKLJQNAFAD-UHFFFAOYSA-N 2 1 322.496 4.216 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cc2cc(Cl)ccc2o1 ZINC000643548694 1046673143 /nfs/dbraw/zinc/67/31/43/1046673143.db2.gz TWNGXMNXFWVKTB-WFASDCNBSA-N 2 1 318.848 4.412 20 0 DIADMP Cc1ccc([C@H]([NH2+][C@H]2CC[NH2+]C3(CCC3)C2)C2CCCC2)o1 ZINC000643548660 1046673164 /nfs/dbraw/zinc/67/31/64/1046673164.db2.gz SUCUWERXWKQLSB-FUHWJXTLSA-N 2 1 302.462 4.084 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533289078 1046686688 /nfs/dbraw/zinc/68/66/88/1046686688.db2.gz RLEDAYUQCAWFNL-HOTGVXAUSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533289078 1046686694 /nfs/dbraw/zinc/68/66/94/1046686694.db2.gz RLEDAYUQCAWFNL-HOTGVXAUSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533289077 1046687756 /nfs/dbraw/zinc/68/77/56/1046687756.db2.gz RLEDAYUQCAWFNL-CVEARBPZSA-N 2 1 306.881 4.351 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533289077 1046687761 /nfs/dbraw/zinc/68/77/61/1046687761.db2.gz RLEDAYUQCAWFNL-CVEARBPZSA-N 2 1 306.881 4.351 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]CCC[N@H+](C)C(C)C)cc1Cl ZINC000796678387 1046716188 /nfs/dbraw/zinc/71/61/88/1046716188.db2.gz NPCIWUXEPRNQMS-CQSZACIVSA-N 2 1 312.885 4.038 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]CCC[N@@H+](C)C(C)C)cc1Cl ZINC000796678387 1046716201 /nfs/dbraw/zinc/71/62/01/1046716201.db2.gz NPCIWUXEPRNQMS-CQSZACIVSA-N 2 1 312.885 4.038 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]CCCC[N@@H+](C)C2CC2)cc1Cl ZINC000834908049 1046718924 /nfs/dbraw/zinc/71/89/24/1046718924.db2.gz GOFJVXJQUXJNHF-CQSZACIVSA-N 2 1 324.896 4.182 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533426206 1046721024 /nfs/dbraw/zinc/72/10/24/1046721024.db2.gz PNKIBNSQUUPOKY-RBUKOAKNSA-N 2 1 304.453 4.227 20 0 DIADMP CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000533426206 1046721041 /nfs/dbraw/zinc/72/10/41/1046721041.db2.gz PNKIBNSQUUPOKY-RBUKOAKNSA-N 2 1 304.453 4.227 20 0 DIADMP CN1CCC([N@@H+](Cc2ccc3c(c2)CCC3)C2CCCC2)CC1 ZINC001203036102 1046724320 /nfs/dbraw/zinc/72/43/20/1046724320.db2.gz WCJGWRBGPHWDJL-UHFFFAOYSA-N 2 1 312.501 4.014 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1Cl ZINC000796800873 1046736959 /nfs/dbraw/zinc/73/69/59/1046736959.db2.gz YVEGHRNFOVQAQT-CQSZACIVSA-N 2 1 324.896 4.180 20 0 DIADMP C[C@H](N[C@@H]1CC[N@H+](CC2CC2)C1)c1ccc(F)c2ccccc21 ZINC000645406980 1046789471 /nfs/dbraw/zinc/78/94/71/1046789471.db2.gz UWYIDVXMLNZEJU-GOEBONIOSA-N 2 1 312.432 4.114 20 0 DIADMP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3ccc(F)cc32)C1 ZINC000246890193 1046817820 /nfs/dbraw/zinc/81/78/20/1046817820.db2.gz DRLSVHJKMYEIKB-YOEHRIQHSA-N 2 1 322.493 4.073 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCSc3ccc(F)cc32)C1 ZINC000246890193 1046817841 /nfs/dbraw/zinc/81/78/41/1046817841.db2.gz DRLSVHJKMYEIKB-YOEHRIQHSA-N 2 1 322.493 4.073 20 0 DIADMP Cc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)s1 ZINC000246828849 1046818811 /nfs/dbraw/zinc/81/88/11/1046818811.db2.gz BPEKUTXKICBKJZ-KGLIPLIRSA-N 2 1 309.523 4.065 20 0 DIADMP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1)c1ccncc1 ZINC000247493160 1046828762 /nfs/dbraw/zinc/82/87/62/1046828762.db2.gz WGRUHUUVUNZPQY-QZTJIDSGSA-N 2 1 323.484 4.164 20 0 DIADMP c1cc2ccncc2c(C[N@@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)c1 ZINC001140645491 1046829692 /nfs/dbraw/zinc/82/96/92/1046829692.db2.gz WRURWGVQCMYERO-HXUWFJFHSA-N 2 1 323.484 4.075 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccccc1C[NH2+]Cc1ccc(O)cc1 ZINC000679395336 1046836777 /nfs/dbraw/zinc/83/67/77/1046836777.db2.gz UUESSNGUVZMJNI-QGZVFWFLSA-N 2 1 324.468 4.056 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]C1(c2cccc(Cl)c2)CCC1 ZINC000646095434 1046854963 /nfs/dbraw/zinc/85/49/63/1046854963.db2.gz QVHDFTDZCTZUOO-UHFFFAOYSA-N 2 1 317.864 4.294 20 0 DIADMP Cn1c[nH+]c2cccc(Nc3ccc(C[NH2+]C(C)(C)C)cc3)c21 ZINC001204706519 1046905142 /nfs/dbraw/zinc/90/51/42/1046905142.db2.gz XBRMPYIFIRDJDN-UHFFFAOYSA-N 2 1 308.429 4.205 20 0 DIADMP CCCC[NH+]1CCC([NH2+][C@@H](C)c2sc(C(C)C)nc2C)CC1 ZINC000164450303 1046905669 /nfs/dbraw/zinc/90/56/69/1046905669.db2.gz CYESOUYDAISDLW-AWEZNQCLSA-N 2 1 323.550 4.490 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@H+]1CCC[C@H](CCc2ccccc2)C1 ZINC001140806349 1046908566 /nfs/dbraw/zinc/90/85/66/1046908566.db2.gz HCBMMTZBYBAXJL-GOSISDBHSA-N 2 1 319.452 4.408 20 0 DIADMP c1[nH]c2cc[nH+]cc2c1C[N@@H+]1CCC[C@H](CCc2ccccc2)C1 ZINC001140806349 1046908580 /nfs/dbraw/zinc/90/85/80/1046908580.db2.gz HCBMMTZBYBAXJL-GOSISDBHSA-N 2 1 319.452 4.408 20 0 DIADMP C[N@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1ccc2ccccc2c1 ZINC001140806111 1046908827 /nfs/dbraw/zinc/90/88/27/1046908827.db2.gz VTKPHVBPGRAISU-UHFFFAOYSA-N 2 1 301.393 4.348 20 0 DIADMP C[N@@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1ccc2ccccc2c1 ZINC001140806111 1046908843 /nfs/dbraw/zinc/90/88/43/1046908843.db2.gz VTKPHVBPGRAISU-UHFFFAOYSA-N 2 1 301.393 4.348 20 0 DIADMP C[N@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1cccc(C(F)(F)F)c1 ZINC001140807386 1046911541 /nfs/dbraw/zinc/91/15/41/1046911541.db2.gz XPTYCNXRGKKYSM-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP C[N@@H+](Cc1c[nH]c2cc[nH+]cc12)Cc1cccc(C(F)(F)F)c1 ZINC001140807386 1046911550 /nfs/dbraw/zinc/91/15/50/1046911550.db2.gz XPTYCNXRGKKYSM-UHFFFAOYSA-N 2 1 319.330 4.214 20 0 DIADMP C[C@H](c1ccco1)[N@@H+](C)C/C=C\C[NH+](C)[C@@H](C)c1ccco1 ZINC000255780641 1046926011 /nfs/dbraw/zinc/92/60/11/1046926011.db2.gz YXWYPCNKAGUWMS-HNXFAEETSA-N 2 1 302.418 4.115 20 0 DIADMP C[C@H](c1ccco1)[NH+](C)C/C=C\C[N@H+](C)[C@@H](C)c1ccco1 ZINC000255780641 1046926017 /nfs/dbraw/zinc/92/60/17/1046926017.db2.gz YXWYPCNKAGUWMS-HNXFAEETSA-N 2 1 302.418 4.115 20 0 DIADMP C[C@H](c1ccco1)[NH+](C)C/C=C\C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000255780641 1046926030 /nfs/dbraw/zinc/92/60/30/1046926030.db2.gz YXWYPCNKAGUWMS-HNXFAEETSA-N 2 1 302.418 4.115 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]C2CCC(F)(F)CC2)CC1 ZINC000647183997 1046951883 /nfs/dbraw/zinc/95/18/83/1046951883.db2.gz XDOVNZWXJYPDMY-HNNXBMFYSA-N 2 1 322.443 4.380 20 0 DIADMP Clc1scc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c1Cl ZINC000262030749 1046958143 /nfs/dbraw/zinc/95/81/43/1046958143.db2.gz XCFDTWUEINPANM-LBPRGKRZSA-N 2 1 319.301 4.019 20 0 DIADMP C[C@H](C[NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)CC(F)F ZINC000647319277 1046977422 /nfs/dbraw/zinc/97/74/22/1046977422.db2.gz UVGTYNRDTNIEOY-ZLPCBKJTSA-N 2 1 324.459 4.311 20 0 DIADMP Clc1cccc(C2([NH2+]C3CC[NH+](CC4CC4)CC3)CCC2)c1 ZINC000647349345 1046989537 /nfs/dbraw/zinc/98/95/37/1046989537.db2.gz KPJRUNREOKRDHD-UHFFFAOYSA-N 2 1 318.892 4.183 20 0 DIADMP CC(C)c1ccc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1 ZINC000798956868 1046992545 /nfs/dbraw/zinc/99/25/45/1046992545.db2.gz FMBJOZCPEHUZIT-UHFFFAOYSA-N 2 1 300.490 4.118 20 0 DIADMP C[NH+]1CCC2(CCC[N@H+]([C@H]3CCCc4ccc(F)cc43)C2)CC1 ZINC000799178105 1047007616 /nfs/dbraw/zinc/00/76/16/1047007616.db2.gz GEUSBALGOLXBCV-IBGZPJMESA-N 2 1 316.464 4.011 20 0 DIADMP C[C@@H](c1ccccc1Cl)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000799176746 1047008002 /nfs/dbraw/zinc/00/80/02/1047008002.db2.gz BHVMZSJNUYMOAA-HNNXBMFYSA-N 2 1 306.881 4.209 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1ccccc1-c1cccs1 ZINC001141097595 1047012766 /nfs/dbraw/zinc/01/27/66/1047012766.db2.gz QZXVFGHWNBDUQX-UHFFFAOYSA-N 2 1 302.487 4.189 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(SCC)cc2)C1 ZINC000533783171 1047018101 /nfs/dbraw/zinc/01/81/01/1047018101.db2.gz FNKZBCNDHOWFBO-HZPDHXFCSA-N 2 1 306.519 4.181 20 0 DIADMP CC(C)[N@@H+](C)Cc1ccccc1CNc1[nH+]ccc2[nH]ccc21 ZINC000647856681 1047019455 /nfs/dbraw/zinc/01/94/55/1047019455.db2.gz NAHSSUGYUXGFNP-UHFFFAOYSA-N 2 1 308.429 4.015 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661797 1047052101 /nfs/dbraw/zinc/05/21/01/1047052101.db2.gz FERIAAKVVDWDNI-AEFFLSMTSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661797 1047052121 /nfs/dbraw/zinc/05/21/21/1047052121.db2.gz FERIAAKVVDWDNI-AEFFLSMTSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661797 1047052138 /nfs/dbraw/zinc/05/21/38/1047052138.db2.gz FERIAAKVVDWDNI-AEFFLSMTSA-N 2 1 312.457 4.251 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)C[C@H]1C ZINC000536661797 1047052156 /nfs/dbraw/zinc/05/21/56/1047052156.db2.gz FERIAAKVVDWDNI-AEFFLSMTSA-N 2 1 312.457 4.251 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000536661829 1047052728 /nfs/dbraw/zinc/05/27/28/1047052728.db2.gz GLMSCEUFGMHVTG-WMLDXEAASA-N 2 1 302.487 4.063 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000536661829 1047052738 /nfs/dbraw/zinc/05/27/38/1047052738.db2.gz GLMSCEUFGMHVTG-WMLDXEAASA-N 2 1 302.487 4.063 20 0 DIADMP CCCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)cc1 ZINC000536662652 1047056072 /nfs/dbraw/zinc/05/60/72/1047056072.db2.gz OWRKNMMFTBZTAK-PXNSSMCTSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000536662652 1047056086 /nfs/dbraw/zinc/05/60/86/1047056086.db2.gz OWRKNMMFTBZTAK-PXNSSMCTSA-N 2 1 318.505 4.028 20 0 DIADMP CCCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000536662652 1047056101 /nfs/dbraw/zinc/05/61/01/1047056101.db2.gz OWRKNMMFTBZTAK-PXNSSMCTSA-N 2 1 318.505 4.028 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC(C)(C)C2)CC[N@@H+]1Cc1ccccc1 ZINC000379644482 1047089088 /nfs/dbraw/zinc/08/90/88/1047089088.db2.gz CIYIMEKMYMOVCX-NEWSRXKRSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000379644482 1047089101 /nfs/dbraw/zinc/08/91/01/1047089101.db2.gz CIYIMEKMYMOVCX-NEWSRXKRSA-N 2 1 300.490 4.208 20 0 DIADMP Cc1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379651975 1047090857 /nfs/dbraw/zinc/09/08/57/1047090857.db2.gz VOJPAGVKISWNKI-GHTZIAJQSA-N 2 1 308.469 4.138 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000379646256 1047091682 /nfs/dbraw/zinc/09/16/82/1047091682.db2.gz FBDVJWMAZBOWSF-LNXHZJMOSA-N 2 1 300.490 4.208 20 0 DIADMP CC1CCC([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC000379646256 1047091699 /nfs/dbraw/zinc/09/16/99/1047091699.db2.gz FBDVJWMAZBOWSF-LNXHZJMOSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379653609 1047092722 /nfs/dbraw/zinc/09/27/22/1047092722.db2.gz GKGQZBVJRNAUNV-LCLWPZTBSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379653609 1047092736 /nfs/dbraw/zinc/09/27/36/1047092736.db2.gz GKGQZBVJRNAUNV-LCLWPZTBSA-N 2 1 300.490 4.208 20 0 DIADMP CC(C)C1CC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379658527 1047093658 /nfs/dbraw/zinc/09/36/58/1047093658.db2.gz WPJZUPPSOJPRCO-VHBXLISGSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C1CC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)C1 ZINC000379658527 1047093674 /nfs/dbraw/zinc/09/36/74/1047093674.db2.gz WPJZUPPSOJPRCO-VHBXLISGSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C1CC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379658525 1047094128 /nfs/dbraw/zinc/09/41/28/1047094128.db2.gz WPJZUPPSOJPRCO-OTBHMBEGSA-N 2 1 300.490 4.064 20 0 DIADMP CC(C)C1CC([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)C1 ZINC000379658525 1047094142 /nfs/dbraw/zinc/09/41/42/1047094142.db2.gz WPJZUPPSOJPRCO-OTBHMBEGSA-N 2 1 300.490 4.064 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000379657115 1047097363 /nfs/dbraw/zinc/09/73/63/1047097363.db2.gz RSUASWGEEWRONX-ZNLUXHQJSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc32)CC[N@H+]1Cc1ccccc1 ZINC000379657115 1047097380 /nfs/dbraw/zinc/09/73/80/1047097380.db2.gz RSUASWGEEWRONX-ZNLUXHQJSA-N 2 1 320.480 4.317 20 0 DIADMP C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC000379657676 1047097493 /nfs/dbraw/zinc/09/74/93/1047097493.db2.gz UJABLMIHCPDBHJ-FUSPUOGNSA-N 2 1 320.480 4.343 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(OC)cc1 ZINC000536830581 1047103272 /nfs/dbraw/zinc/10/32/72/1047103272.db2.gz DMNYDFLDNKEIHJ-FXAWDEMLSA-N 2 1 318.505 4.104 20 0 DIADMP C[C@H]1C[C@@H](CC[NH2+]C(C2CC2)C2CC2)C[N@H+]1Cc1ccccc1 ZINC000536831466 1047113085 /nfs/dbraw/zinc/11/30/85/1047113085.db2.gz IUODFVSOGYCWRU-FUHWJXTLSA-N 2 1 312.501 4.065 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1cccc(-c2ccsc2)c1 ZINC001141386495 1047113154 /nfs/dbraw/zinc/11/31/54/1047113154.db2.gz KXFKPPGBLSKPQO-UHFFFAOYSA-N 2 1 302.487 4.189 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000121841560 1047118976 /nfs/dbraw/zinc/11/89/76/1047118976.db2.gz PJLQQELJEIIOJF-KBPBESRZSA-N 2 1 314.395 4.088 20 0 DIADMP CC[NH+](CC)c1ccc(Nc2c[nH+]ccc2N2CCCC2)cc1 ZINC001212970022 1047123487 /nfs/dbraw/zinc/12/34/87/1047123487.db2.gz PYZGIUSZENZKES-UHFFFAOYSA-N 2 1 310.445 4.272 20 0 DIADMP Cc1cc(C)cc(-c2ccc(C[NH2+]CCc3c[nH+]cn3C)cc2)c1 ZINC000681548071 1047130029 /nfs/dbraw/zinc/13/00/29/1047130029.db2.gz UNPWUTWTOKEDQK-UHFFFAOYSA-N 2 1 319.452 4.036 20 0 DIADMP CCSc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC)C2)cc1 ZINC001116387292 1047135756 /nfs/dbraw/zinc/13/57/56/1047135756.db2.gz DVCTYMQGVKUUAR-HOTGVXAUSA-N 2 1 306.519 4.181 20 0 DIADMP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000537123338 1047138129 /nfs/dbraw/zinc/13/81/29/1047138129.db2.gz NWKVOXPMFMKICC-KRWDZBQOSA-N 2 1 321.415 4.237 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](CSc2ccccc2)C(C)C)C1 ZINC001116505803 1047149788 /nfs/dbraw/zinc/14/97/88/1047149788.db2.gz SSXYNVDBGUMAAE-IEBWSBKVSA-N 2 1 320.546 4.125 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC001116604930 1047162031 /nfs/dbraw/zinc/16/20/31/1047162031.db2.gz YNAUDQLVXAQVHH-IRXDYDNUSA-N 2 1 318.505 4.246 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)C1 ZINC001116604931 1047162085 /nfs/dbraw/zinc/16/20/85/1047162085.db2.gz YNAUDQLVXAQVHH-SJORKVTESA-N 2 1 318.505 4.246 20 0 DIADMP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2(c3ccccc3)CC2)CC1 ZINC000537421590 1047182671 /nfs/dbraw/zinc/18/26/71/1047182671.db2.gz HBZOINQBYPUHSN-PXNSSMCTSA-N 2 1 312.501 4.308 20 0 DIADMP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2(c3ccccc3)CC2)CC1 ZINC000537421587 1047183637 /nfs/dbraw/zinc/18/36/37/1047183637.db2.gz HBZOINQBYPUHSN-FXAWDEMLSA-N 2 1 312.501 4.308 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2(c3ccccc3)CC2)CC1 ZINC000537421599 1047183676 /nfs/dbraw/zinc/18/36/76/1047183676.db2.gz HBZOINQBYPUHSN-YLJYHZDGSA-N 2 1 312.501 4.308 20 0 DIADMP Cc1ccc(C)c([C@H](N[C@H]2CC[N@@H+](C)[C@H](C)C2)c2ccccc2)c1 ZINC000325404460 1047187492 /nfs/dbraw/zinc/18/74/92/1047187492.db2.gz IBJUKPQKFKDQTC-KAGYGMCKSA-N 2 1 322.496 4.465 20 0 DIADMP Cc1ccc(C)c([C@H]([NH2+][C@H]2CCN(C)[C@H](C)C2)c2ccccc2)c1 ZINC000325404460 1047187501 /nfs/dbraw/zinc/18/75/01/1047187501.db2.gz IBJUKPQKFKDQTC-KAGYGMCKSA-N 2 1 322.496 4.465 20 0 DIADMP Cc1sccc1C[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000390798614 1047299006 /nfs/dbraw/zinc/29/90/06/1047299006.db2.gz MAOMDXFYJWKBOG-IBGZPJMESA-N 2 1 314.498 4.058 20 0 DIADMP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692628 1047322247 /nfs/dbraw/zinc/32/22/47/1047322247.db2.gz MEHAKQVWSXFRNS-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cn2)C1 ZINC000651692628 1047322261 /nfs/dbraw/zinc/32/22/61/1047322261.db2.gz MEHAKQVWSXFRNS-ZWKOTPCHSA-N 2 1 323.484 4.131 20 0 DIADMP COc1c(C)cc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000840809327 1047337951 /nfs/dbraw/zinc/33/79/51/1047337951.db2.gz JHNYWGFXAKNSQX-CABCVRRESA-N 2 1 324.896 4.040 20 0 DIADMP CC[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533394 1047345735 /nfs/dbraw/zinc/34/57/35/1047345735.db2.gz TYKHPPZOPQZFBB-BLLLJJGKSA-N 2 1 315.288 4.376 20 0 DIADMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1Cl ZINC000044533394 1047345747 /nfs/dbraw/zinc/34/57/47/1047345747.db2.gz TYKHPPZOPQZFBB-BLLLJJGKSA-N 2 1 315.288 4.376 20 0 DIADMP Cc1ccc(-c2ccc(C[NH+]3CCC([NH+](C)C)CC3)cc2)cc1 ZINC001142299745 1047423448 /nfs/dbraw/zinc/42/34/48/1047423448.db2.gz CMLWJWKAPDVFCG-UHFFFAOYSA-N 2 1 308.469 4.188 20 0 DIADMP CCCc1ccc(C[N@@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001142364590 1047436100 /nfs/dbraw/zinc/43/61/00/1047436100.db2.gz YYTAXQXEHIWVJT-UHFFFAOYSA-N 2 1 302.506 4.191 20 0 DIADMP CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617220 1047455753 /nfs/dbraw/zinc/45/57/53/1047455753.db2.gz WKDXYIOTFRXLRT-QFBILLFUSA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617220 1047455755 /nfs/dbraw/zinc/45/57/55/1047455755.db2.gz WKDXYIOTFRXLRT-QFBILLFUSA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617220 1047455756 /nfs/dbraw/zinc/45/57/56/1047455756.db2.gz WKDXYIOTFRXLRT-QFBILLFUSA-N 2 1 312.457 4.109 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)[C@@H](C)C1 ZINC000537617220 1047455758 /nfs/dbraw/zinc/45/57/58/1047455758.db2.gz WKDXYIOTFRXLRT-QFBILLFUSA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617218 1047455847 /nfs/dbraw/zinc/45/58/47/1047455847.db2.gz WKDXYIOTFRXLRT-APWZRJJASA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617218 1047455849 /nfs/dbraw/zinc/45/58/49/1047455849.db2.gz WKDXYIOTFRXLRT-APWZRJJASA-N 2 1 312.457 4.109 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617218 1047455851 /nfs/dbraw/zinc/45/58/51/1047455851.db2.gz WKDXYIOTFRXLRT-APWZRJJASA-N 2 1 312.457 4.109 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(-c3ccccc3)o2)[C@H](C)C1 ZINC000537617218 1047455854 /nfs/dbraw/zinc/45/58/54/1047455854.db2.gz WKDXYIOTFRXLRT-APWZRJJASA-N 2 1 312.457 4.109 20 0 DIADMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620494 1047461694 /nfs/dbraw/zinc/46/16/94/1047461694.db2.gz TXGSHMJKZRVLPE-QGZVFWFLSA-N 2 1 314.473 4.213 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620494 1047461703 /nfs/dbraw/zinc/46/17/03/1047461703.db2.gz TXGSHMJKZRVLPE-QGZVFWFLSA-N 2 1 314.473 4.213 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620494 1047461707 /nfs/dbraw/zinc/46/17/07/1047461707.db2.gz TXGSHMJKZRVLPE-QGZVFWFLSA-N 2 1 314.473 4.213 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc3cc(C)c(C)cc3o2)C1 ZINC000537620494 1047461710 /nfs/dbraw/zinc/46/17/10/1047461710.db2.gz TXGSHMJKZRVLPE-QGZVFWFLSA-N 2 1 314.473 4.213 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CC(C)(C)Cc3occc32)CC1 ZINC000089513092 1047485111 /nfs/dbraw/zinc/48/51/11/1047485111.db2.gz CRVKPUVSKHYEGP-INIZCTEOSA-N 2 1 304.478 4.146 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1oc2ccccc2c1C ZINC000121438491 1047519518 /nfs/dbraw/zinc/51/95/18/1047519518.db2.gz CCVMLQYBEAHQEL-HIFRSBDPSA-N 2 1 311.429 4.233 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2c(C)cc(OC)cc2C)CC1 ZINC001142950314 1047519739 /nfs/dbraw/zinc/51/97/39/1047519739.db2.gz SQKZKSLAHIGQSS-UHFFFAOYSA-N 2 1 318.505 4.008 20 0 DIADMP C[N@@H+](Cc1cc(C(F)(F)F)ccc1Cl)C1CCC([NH3+])CC1 ZINC000843055884 1047526040 /nfs/dbraw/zinc/52/60/40/1047526040.db2.gz RCPNBWQHQFEQBB-UHFFFAOYSA-N 2 1 320.786 4.061 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000537646884 1047557448 /nfs/dbraw/zinc/55/74/48/1047557448.db2.gz BPHNLSDBCQICPU-QGZVFWFLSA-N 2 1 312.457 4.110 20 0 DIADMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)o2)C1 ZINC000537646884 1047557454 /nfs/dbraw/zinc/55/74/54/1047557454.db2.gz BPHNLSDBCQICPU-QGZVFWFLSA-N 2 1 312.457 4.110 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649403 1047561078 /nfs/dbraw/zinc/56/10/78/1047561078.db2.gz KHNZJTNECDQUDQ-MRXNPFEDSA-N 2 1 320.546 4.209 20 0 DIADMP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649403 1047561089 /nfs/dbraw/zinc/56/10/89/1047561089.db2.gz KHNZJTNECDQUDQ-MRXNPFEDSA-N 2 1 320.546 4.209 20 0 DIADMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649403 1047561092 /nfs/dbraw/zinc/56/10/92/1047561092.db2.gz KHNZJTNECDQUDQ-MRXNPFEDSA-N 2 1 320.546 4.209 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649403 1047561099 /nfs/dbraw/zinc/56/10/99/1047561099.db2.gz KHNZJTNECDQUDQ-MRXNPFEDSA-N 2 1 320.546 4.209 20 0 DIADMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc(C(C)(C)C)s2)C1 ZINC000537649403 1047561101 /nfs/dbraw/zinc/56/11/01/1047561101.db2.gz KHNZJTNECDQUDQ-MRXNPFEDSA-N 2 1 320.546 4.209 20 0 DIADMP Cc1ccc(Oc2cccc(C[N@H+]3CCCC[C@H](C[NH3+])C3)c2)cc1 ZINC001206632131 1047567887 /nfs/dbraw/zinc/56/78/87/1047567887.db2.gz GKAGFQLGUMYHHH-LJQANCHMSA-N 2 1 324.468 4.348 20 0 DIADMP C[N@@H+]1CCC[C@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694166 1047577579 /nfs/dbraw/zinc/57/75/79/1047577579.db2.gz ASWCLUVVFKTRSD-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CCC[C@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694166 1047577584 /nfs/dbraw/zinc/57/75/84/1047577584.db2.gz ASWCLUVVFKTRSD-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@H+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694166 1047577587 /nfs/dbraw/zinc/57/75/87/1047577587.db2.gz ASWCLUVVFKTRSD-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@H]2C[N@@H+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694166 1047577591 /nfs/dbraw/zinc/57/75/91/1047577591.db2.gz ASWCLUVVFKTRSD-BBRMVZONSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694167 1047578139 /nfs/dbraw/zinc/57/81/39/1047578139.db2.gz ASWCLUVVFKTRSD-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694167 1047578149 /nfs/dbraw/zinc/57/81/49/1047578149.db2.gz ASWCLUVVFKTRSD-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694167 1047578153 /nfs/dbraw/zinc/57/81/53/1047578153.db2.gz ASWCLUVVFKTRSD-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3c(Cl)oc4ccccc43)CC[C@@H]21 ZINC000537694167 1047578157 /nfs/dbraw/zinc/57/81/57/1047578157.db2.gz ASWCLUVVFKTRSD-CJNGLKHVSA-N 2 1 318.848 4.002 20 0 DIADMP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000537944909 1047645822 /nfs/dbraw/zinc/64/58/22/1047645822.db2.gz SGHRKGHFOXIZNL-ZIFCJYIRSA-N 2 1 312.457 4.231 20 0 DIADMP CCOc1ccccc1[C@H](C)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946794 1047647704 /nfs/dbraw/zinc/64/77/04/1047647704.db2.gz TZMWYXBJTVKDRF-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000537946794 1047647706 /nfs/dbraw/zinc/64/77/06/1047647706.db2.gz TZMWYXBJTVKDRF-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946794 1047647708 /nfs/dbraw/zinc/64/77/08/1047647708.db2.gz TZMWYXBJTVKDRF-ZWKOTPCHSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@H](C)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946793 1047647777 /nfs/dbraw/zinc/64/77/77/1047647777.db2.gz TZMWYXBJTVKDRF-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000537946793 1047647780 /nfs/dbraw/zinc/64/77/80/1047647780.db2.gz TZMWYXBJTVKDRF-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP CCOc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000537946793 1047647784 /nfs/dbraw/zinc/64/77/84/1047647784.db2.gz TZMWYXBJTVKDRF-ROUUACIJSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H]1CCCc2ccc(Cl)cc21 ZINC000537967810 1047650632 /nfs/dbraw/zinc/65/06/32/1047650632.db2.gz AYHDLEZPFYCCDB-UGSOOPFHSA-N 2 1 317.864 4.148 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCCC[C@H]1c1ccccc1 ZINC000537968061 1047651431 /nfs/dbraw/zinc/65/14/31/1047651431.db2.gz OTYPFSWABHJHQH-LSTHTHJFSA-N 2 1 311.473 4.144 20 0 DIADMP C[C@H]1CCC[N@@H+](CCCC[NH2+][C@@H](c2ccc(F)cc2)C2CC2)C1 ZINC000538057889 1047656264 /nfs/dbraw/zinc/65/62/64/1047656264.db2.gz GTHVFTPZHCFIGJ-OXJNMPFZSA-N 2 1 318.480 4.379 20 0 DIADMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc2c(ccc3ccccc23)o1 ZINC000538406021 1047673237 /nfs/dbraw/zinc/67/32/37/1047673237.db2.gz MBLXPLCNYDFJHF-HNNXBMFYSA-N 2 1 320.436 4.499 20 0 DIADMP CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]CC1=CC[N@@H+](C)CC1 ZINC000538408815 1047676056 /nfs/dbraw/zinc/67/60/56/1047676056.db2.gz SBXRMVZQDZRUBW-HNNXBMFYSA-N 2 1 312.457 4.216 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2cc3ccccc3o2)C(C)C)C1 ZINC000538452017 1047678257 /nfs/dbraw/zinc/67/82/57/1047678257.db2.gz ZYVFTYMDTQMRRP-DNVCBOLYSA-N 2 1 300.446 4.061 20 0 DIADMP CC[C@@H](C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000538719203 1047698767 /nfs/dbraw/zinc/69/87/67/1047698767.db2.gz RPVDLEBAZVFMRY-AZUAARDMSA-N 2 1 300.490 4.131 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc3ccccc3s2)C1 ZINC000538723360 1047700901 /nfs/dbraw/zinc/70/09/01/1047700901.db2.gz YIKACMSXNLLWFD-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC000538723360 1047700904 /nfs/dbraw/zinc/70/09/04/1047700904.db2.gz YIKACMSXNLLWFD-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000538723360 1047700906 /nfs/dbraw/zinc/70/09/06/1047700906.db2.gz YIKACMSXNLLWFD-OAHLLOKOSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc3ccccc3s2)C1 ZINC000538723359 1047701291 /nfs/dbraw/zinc/70/12/91/1047701291.db2.gz YIKACMSXNLLWFD-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc3ccccc3s2)C1 ZINC000538723359 1047701294 /nfs/dbraw/zinc/70/12/94/1047701294.db2.gz YIKACMSXNLLWFD-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000538723359 1047701302 /nfs/dbraw/zinc/70/13/02/1047701302.db2.gz YIKACMSXNLLWFD-HNNXBMFYSA-N 2 1 302.487 4.065 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(OCC(C)C)cc2)C[C@H]1C ZINC000538738356 1047704570 /nfs/dbraw/zinc/70/45/70/1047704570.db2.gz QAKSICCJYWJIOG-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(OCC(C)C)cc2)C[C@H]1C ZINC000538738356 1047704576 /nfs/dbraw/zinc/70/45/76/1047704576.db2.gz QAKSICCJYWJIOG-IEBWSBKVSA-N 2 1 318.505 4.026 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3)s2)CCN1C ZINC000538738212 1047704885 /nfs/dbraw/zinc/70/48/85/1047704885.db2.gz GGGTVKAHDNJODO-NVXWUHKLSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3)s2)CC[N@@H+]1C ZINC000538738212 1047704887 /nfs/dbraw/zinc/70/48/87/1047704887.db2.gz GGGTVKAHDNJODO-NVXWUHKLSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3)s2)CC[N@H+]1C ZINC000538738212 1047704890 /nfs/dbraw/zinc/70/48/90/1047704890.db2.gz GGGTVKAHDNJODO-NVXWUHKLSA-N 2 1 314.498 4.330 20 0 DIADMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3)s2)CC[NH+]1C ZINC000538738212 1047704891 /nfs/dbraw/zinc/70/48/91/1047704891.db2.gz GGGTVKAHDNJODO-NVXWUHKLSA-N 2 1 314.498 4.330 20 0 DIADMP Cc1c[nH+]c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc1C ZINC001156318614 1047707903 /nfs/dbraw/zinc/70/79/03/1047707903.db2.gz WSRQKOVEYHHUOU-SLFFLAALSA-N 2 1 321.468 4.021 20 0 DIADMP CC[C@H](C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccccc1 ZINC000538796165 1047711044 /nfs/dbraw/zinc/71/10/44/1047711044.db2.gz STGCCZBGWICQBC-SLYNCCJLSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1ccccc1 ZINC000538796165 1047711049 /nfs/dbraw/zinc/71/10/49/1047711049.db2.gz STGCCZBGWICQBC-SLYNCCJLSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@H](C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccccc1 ZINC000538796165 1047711052 /nfs/dbraw/zinc/71/10/52/1047711052.db2.gz STGCCZBGWICQBC-SLYNCCJLSA-N 2 1 312.501 4.129 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1cc(C)ccc1OC ZINC000538985568 1047722984 /nfs/dbraw/zinc/72/29/84/1047722984.db2.gz NLSGXYSFRAGNNW-IEBWSBKVSA-N 2 1 318.505 4.165 20 0 DIADMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(OC)c1 ZINC000539052593 1047728458 /nfs/dbraw/zinc/72/84/58/1047728458.db2.gz JGHKCTRKDSORCI-YLJYHZDGSA-N 2 1 318.505 4.104 20 0 DIADMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1cccc(OC)c1 ZINC000539052588 1047728495 /nfs/dbraw/zinc/72/84/95/1047728495.db2.gz JGHKCTRKDSORCI-PXNSSMCTSA-N 2 1 318.505 4.104 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CCN(C(C)C)CC2)C2CCCC2)o1 ZINC000539394824 1047751367 /nfs/dbraw/zinc/75/13/67/1047751367.db2.gz WLZSTTDCHSMUIO-LJQANCHMSA-N 2 1 304.478 4.282 20 0 DIADMP Cc1ccc([C@H]([NH2+]C2CC[NH+](C(C)C)CC2)C2CCCC2)o1 ZINC000539394824 1047751372 /nfs/dbraw/zinc/75/13/72/1047751372.db2.gz WLZSTTDCHSMUIO-LJQANCHMSA-N 2 1 304.478 4.282 20 0 DIADMP Cc1cccc2cc[nH+]c(N(C3CCCC3)C3CC[NH+](C)CC3)c12 ZINC001158493852 1047786806 /nfs/dbraw/zinc/78/68/06/1047786806.db2.gz OVWDBDLNZPTRDE-UHFFFAOYSA-N 2 1 323.484 4.386 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000552923259 1047806621 /nfs/dbraw/zinc/80/66/21/1047806621.db2.gz KYFQSMNRVFURJV-BPQIPLTHSA-N 2 1 322.443 4.065 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+][C@H]1CCCC(F)(F)C1 ZINC000552923259 1047806630 /nfs/dbraw/zinc/80/66/30/1047806630.db2.gz KYFQSMNRVFURJV-BPQIPLTHSA-N 2 1 322.443 4.065 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@@H]2C[C@H](C)Sc3sccc32)CC1 ZINC001204714264 1047828384 /nfs/dbraw/zinc/82/83/84/1047828384.db2.gz PDIOIRNAWWXNST-XJKSGUPXSA-N 2 1 324.559 4.480 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@@H]2C[C@H](C)Sc3sccc32)CC1 ZINC001204714264 1047828393 /nfs/dbraw/zinc/82/83/93/1047828393.db2.gz PDIOIRNAWWXNST-XJKSGUPXSA-N 2 1 324.559 4.480 20 0 DIADMP CCc1[nH+]c2ccccc2c(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1C ZINC000553615984 1047893295 /nfs/dbraw/zinc/89/32/95/1047893295.db2.gz UGFFCBDHEDJBNB-SJPCQFCGSA-N 2 1 323.484 4.167 20 0 DIADMP C[C@H]1CN(c2cc[nH+]cc2)CC[N@H+]1Cc1cccc(C(C)(C)C)c1 ZINC001197929968 1047902679 /nfs/dbraw/zinc/90/26/79/1047902679.db2.gz NIDJIBDVRHZOMA-KRWDZBQOSA-N 2 1 323.484 4.090 20 0 DIADMP CCCc1cccc(C[NH2+]C2CCN(c3ccc(C)c[nH+]3)CC2)c1 ZINC000479470714 1047907831 /nfs/dbraw/zinc/90/78/31/1047907831.db2.gz LVTCVJLNYVKXEO-UHFFFAOYSA-N 2 1 323.484 4.101 20 0 DIADMP c1ccc(C[C@@]2(C[NH2+]C3CC[NH+](C4CC4)CC3)C=CCCC2)cc1 ZINC001183282937 1047917799 /nfs/dbraw/zinc/91/77/99/1047917799.db2.gz XFFIRYBGMZQDPY-JOCHJYFZSA-N 2 1 324.512 4.172 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2ccccc21 ZINC000479538102 1047922120 /nfs/dbraw/zinc/92/21/20/1047922120.db2.gz DLFPNOJOIDERMT-QGWLNKKWSA-N 2 1 312.501 4.478 20 0 DIADMP CC(C)C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccccc1 ZINC000479531953 1047925119 /nfs/dbraw/zinc/92/51/19/1047925119.db2.gz ZMGJHHFACAPMCQ-SOAGJPPSSA-N 2 1 300.490 4.380 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001183378719 1047926002 /nfs/dbraw/zinc/92/60/02/1047926002.db2.gz ATXPOVCAKHXJNY-OXJNMPFZSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001183378719 1047926006 /nfs/dbraw/zinc/92/60/06/1047926006.db2.gz ATXPOVCAKHXJNY-OXJNMPFZSA-N 2 1 318.480 4.143 20 0 DIADMP Cc1cc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc(C)c1F ZINC000479557415 1047929889 /nfs/dbraw/zinc/92/98/89/1047929889.db2.gz XSVSZARRZXBAPA-ZLPCBKJTSA-N 2 1 304.453 4.110 20 0 DIADMP C[N@H+](CCCC[NH+]1CCCCC1)Cc1cscc1Cl ZINC001183510860 1047940966 /nfs/dbraw/zinc/94/09/66/1047940966.db2.gz HRBLZTWIBSACIM-UHFFFAOYSA-N 2 1 300.899 4.099 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cscc1Cl ZINC001183510860 1047940971 /nfs/dbraw/zinc/94/09/71/1047940971.db2.gz HRBLZTWIBSACIM-UHFFFAOYSA-N 2 1 300.899 4.099 20 0 DIADMP CCC[C@@H](C)CC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC001183571142 1047945046 /nfs/dbraw/zinc/94/50/46/1047945046.db2.gz FMESUKBOIAPDJA-PMXSJFBMSA-N 2 1 314.517 4.455 20 0 DIADMP CC1CCC([NH2+]C[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)CC1 ZINC000553851013 1047952826 /nfs/dbraw/zinc/95/28/26/1047952826.db2.gz NGOAKMVLMINWBW-HDWXEKECSA-N 2 1 306.519 4.299 20 0 DIADMP CC1CCC([NH2+]C[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)CC1 ZINC000553851013 1047952832 /nfs/dbraw/zinc/95/28/32/1047952832.db2.gz NGOAKMVLMINWBW-HDWXEKECSA-N 2 1 306.519 4.299 20 0 DIADMP CCC[C@H]1CCC[N@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001198428887 1047955333 /nfs/dbraw/zinc/95/53/33/1047955333.db2.gz KPUZCVWRXSVGAE-FQEVSTJZSA-N 2 1 300.490 4.437 20 0 DIADMP c1cc2cc[nH+]cc2c(Nc2ccc(O[C@H]3CCC[NH2+]C3)cc2)c1 ZINC001159949434 1047955819 /nfs/dbraw/zinc/95/58/19/1047955819.db2.gz OBBFLVHGBSWPPU-SFHVURJKSA-N 2 1 319.408 4.109 20 0 DIADMP C[N@@H+](CCCF)C[C@@]1(C(C)(C)C)CC[NH+](Cc2ccccc2)C1 ZINC001183896771 1047977172 /nfs/dbraw/zinc/97/71/72/1047977172.db2.gz IUKCUYVIRBPNSC-FQEVSTJZSA-N 2 1 320.496 4.216 20 0 DIADMP C[NH+](CCCF)C[C@@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001183896771 1047977180 /nfs/dbraw/zinc/97/71/80/1047977180.db2.gz IUKCUYVIRBPNSC-FQEVSTJZSA-N 2 1 320.496 4.216 20 0 DIADMP C[NH+](CCCF)C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1 ZINC001183896771 1047977188 /nfs/dbraw/zinc/97/71/88/1047977188.db2.gz IUKCUYVIRBPNSC-FQEVSTJZSA-N 2 1 320.496 4.216 20 0 DIADMP C[C@H](CC[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1)[NH+](C)C ZINC001203269690 1047977480 /nfs/dbraw/zinc/97/74/80/1047977480.db2.gz BHJBBXKJOCIXQA-OAHLLOKOSA-N 2 1 316.420 4.048 20 0 DIADMP CCc1cccc2cc(C[NH+]3CCC(c4[nH]cc[nH+]4)CC3)oc21 ZINC000667563700 1047985316 /nfs/dbraw/zinc/98/53/16/1047985316.db2.gz NNTUMJSYLWQWPK-UHFFFAOYSA-N 2 1 309.413 4.098 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2ccc(SC)cc2)CC1 ZINC001204147109 1047988114 /nfs/dbraw/zinc/98/81/14/1047988114.db2.gz VSJVZYZNSBIOPF-UHFFFAOYSA-N 2 1 306.519 4.105 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC001184024242 1047990047 /nfs/dbraw/zinc/99/00/47/1047990047.db2.gz YBZCNCYYXNGYMN-OALUTQOASA-N 2 1 300.490 4.177 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878856 1047990627 /nfs/dbraw/zinc/99/06/27/1047990627.db2.gz DJLSDLYWIUORFR-OLZOCXBDSA-N 2 1 314.395 4.019 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000479878856 1047990633 /nfs/dbraw/zinc/99/06/33/1047990633.db2.gz DJLSDLYWIUORFR-OLZOCXBDSA-N 2 1 314.395 4.019 20 0 DIADMP CCCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC)CC2)cc1 ZINC000480031889 1048031822 /nfs/dbraw/zinc/03/18/22/1048031822.db2.gz ZXHQXMWETVBMAN-QGZVFWFLSA-N 2 1 318.505 4.391 20 0 DIADMP c1ccc2c(c1)cccc2C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001203271728 1048034603 /nfs/dbraw/zinc/03/46/03/1048034603.db2.gz XEGQADQKSKQBHE-GOSISDBHSA-N 2 1 308.469 4.051 20 0 DIADMP CC[NH+]1CCC([NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000480046433 1048036756 /nfs/dbraw/zinc/03/67/56/1048036756.db2.gz FUIBBAPFHMYZNG-KRWDZBQOSA-N 2 1 308.469 4.489 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205296697 1048036705 /nfs/dbraw/zinc/03/67/05/1048036705.db2.gz SNMAEKVYMGHHEW-OAHLLOKOSA-N 2 1 301.261 4.005 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205296697 1048036719 /nfs/dbraw/zinc/03/67/19/1048036719.db2.gz SNMAEKVYMGHHEW-OAHLLOKOSA-N 2 1 301.261 4.005 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+]C/C=C/c1cc(C)c(C)cc1C ZINC001199219769 1048046173 /nfs/dbraw/zinc/04/61/73/1048046173.db2.gz OIRXPFHIBPZQDO-LQYUOIDQSA-N 2 1 311.473 4.056 20 0 DIADMP C[C@@H]1CCCC[N@H+]1Cc1ccc(C[NH2+]CC2(C)CCC2)cc1 ZINC001199275159 1048049993 /nfs/dbraw/zinc/04/99/93/1048049993.db2.gz DOJJTEYOOXWRAL-QGZVFWFLSA-N 2 1 300.490 4.341 20 0 DIADMP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000480153038 1048070657 /nfs/dbraw/zinc/07/06/57/1048070657.db2.gz ZWZYILYXHMREBI-VKJFTORMSA-N 2 1 323.912 4.286 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000554362558 1048079989 /nfs/dbraw/zinc/07/99/89/1048079989.db2.gz VHRZEQVBPWLCTB-LEWJYISDSA-N 2 1 324.468 4.190 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000480189753 1048088050 /nfs/dbraw/zinc/08/80/50/1048088050.db2.gz COPZBGUSJKPXMG-KRWDZBQOSA-N 2 1 311.473 4.130 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC000480223789 1048094922 /nfs/dbraw/zinc/09/49/22/1048094922.db2.gz JEHQIYGYEANOOE-GJZGRUSLSA-N 2 1 308.432 4.209 20 0 DIADMP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H](C1CCCCC1)[NH+](C)C ZINC000480219149 1048095467 /nfs/dbraw/zinc/09/54/67/1048095467.db2.gz CIFDRHULGTVGDZ-HIFRSBDPSA-N 2 1 308.432 4.208 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CC3)CC1)CCCC2 ZINC000480244103 1048099386 /nfs/dbraw/zinc/09/93/86/1048099386.db2.gz VCFAKBKUAQNHTD-LJQANCHMSA-N 2 1 318.892 4.324 20 0 DIADMP C[C@@H](CCCC(F)(F)F)[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC000480234307 1048099775 /nfs/dbraw/zinc/09/97/75/1048099775.db2.gz WCFCZRDGACFSEZ-GJZGRUSLSA-N 2 1 308.432 4.352 20 0 DIADMP CCC(CC)[NH+]1CCC(Nc2ccc3c([nH+]2)CCCC3)CC1 ZINC001161099540 1048108676 /nfs/dbraw/zinc/10/86/76/1048108676.db2.gz XONFNECFKUSERB-UHFFFAOYSA-N 2 1 301.478 4.025 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCc3ccccc3C2)s1 ZINC000480278489 1048110839 /nfs/dbraw/zinc/11/08/39/1048110839.db2.gz OKTVFGPYAXCALQ-INIZCTEOSA-N 2 1 314.498 4.156 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCc3ccccc3C2)s1 ZINC000480278489 1048110845 /nfs/dbraw/zinc/11/08/45/1048110845.db2.gz OKTVFGPYAXCALQ-INIZCTEOSA-N 2 1 314.498 4.156 20 0 DIADMP CCc1ccc(C2CC[NH+](CCCn3cc[nH+]c3C)CC2)cc1 ZINC001175087696 1048138344 /nfs/dbraw/zinc/13/83/44/1048138344.db2.gz FEVFHOJPWLNWDB-UHFFFAOYSA-N 2 1 311.473 4.024 20 0 DIADMP CCCc1ccc(C[NH+]2CCC(CC)([NH+]3CCCC3)CC2)cc1 ZINC001175155927 1048147535 /nfs/dbraw/zinc/14/75/35/1048147535.db2.gz HREUKSSSUQLLBR-UHFFFAOYSA-N 2 1 314.517 4.480 20 0 DIADMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)ccc1F ZINC000480613770 1048191722 /nfs/dbraw/zinc/19/17/22/1048191722.db2.gz QBDRMEIQVZKRLW-GJZGRUSLSA-N 2 1 310.432 4.270 20 0 DIADMP CC(C)C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccccn1 ZINC000480606094 1048193735 /nfs/dbraw/zinc/19/37/35/1048193735.db2.gz DKRMPTUXWQOJJD-AZUAARDMSA-N 2 1 317.521 4.413 20 0 DIADMP C[C@@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1F ZINC000480625724 1048199475 /nfs/dbraw/zinc/19/94/75/1048199475.db2.gz NOTBYDKJFLMOJC-LSDHHAIUSA-N 2 1 310.432 4.270 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2ccsc2Cl)C1 ZINC000480659880 1048208988 /nfs/dbraw/zinc/20/89/88/1048208988.db2.gz GSICUWAPDRTMQJ-CYBMUJFWSA-N 2 1 300.899 4.003 20 0 DIADMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(-c2ccccc2)c1 ZINC000480741755 1048233135 /nfs/dbraw/zinc/23/31/35/1048233135.db2.gz ACDFYPNSBXPSPS-QZTJIDSGSA-N 2 1 320.480 4.489 20 0 DIADMP Clc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@H+]3CCC[C@H]3C1)CCCC2 ZINC000480743105 1048234178 /nfs/dbraw/zinc/23/41/78/1048234178.db2.gz FWKDPTHRDUBYIQ-JENIJYKNSA-N 2 1 318.892 4.324 20 0 DIADMP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](C3CC3)C1)CCCC2 ZINC000480770392 1048241349 /nfs/dbraw/zinc/24/13/49/1048241349.db2.gz RMPVGXRISFOKLQ-KUHUBIRLSA-N 2 1 318.892 4.181 20 0 DIADMP C(CC[N@H+]1CCC[C@H]1C1CCC1)C[NH+]1CCC[C@H]1C1CCC1 ZINC000555033325 1048256572 /nfs/dbraw/zinc/25/65/72/1048256572.db2.gz PKBLKPCQLJVOBS-PMACEKPBSA-N 2 1 304.522 4.296 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001201427996 1048264996 /nfs/dbraw/zinc/26/49/96/1048264996.db2.gz OWULSGJMLXAGCW-KRWDZBQOSA-N 2 1 316.464 4.078 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001201427996 1048265005 /nfs/dbraw/zinc/26/50/05/1048265005.db2.gz OWULSGJMLXAGCW-KRWDZBQOSA-N 2 1 316.464 4.078 20 0 DIADMP Cc1nc(N2CCCC2)cc(NCC[PH+](C(C)C)C(C)C)[nH+]1 ZINC001162359095 1048268147 /nfs/dbraw/zinc/26/81/47/1048268147.db2.gz WMRDCSSOMBJQIY-UHFFFAOYSA-N 2 1 322.437 4.096 20 0 DIADMP CC(C)[PH+](CCNc1ccc(C[N@@H+](C)C2CC2)cn1)C(C)C ZINC001162363615 1048269165 /nfs/dbraw/zinc/26/91/65/1048269165.db2.gz VJETYXGSFDVALH-UHFFFAOYSA-N 2 1 321.449 4.386 20 0 DIADMP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCC[C@@H](C)C2)C[N@H+]1Cc1ccccc1 ZINC001201491426 1048282333 /nfs/dbraw/zinc/28/23/33/1048282333.db2.gz JTDRPIYFFCVWMD-UKAVVXHISA-N 2 1 314.517 4.455 20 0 DIADMP CC[C@@H](C)C[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201501402 1048287264 /nfs/dbraw/zinc/28/72/64/1048287264.db2.gz JNYDCJBQAOOIPE-SJLPKXTDSA-N 2 1 304.478 4.002 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026112 1048293040 /nfs/dbraw/zinc/29/30/40/1048293040.db2.gz SBHUHBFYYONIMJ-IRXDYDNUSA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)C1 ZINC000481026112 1048293056 /nfs/dbraw/zinc/29/30/56/1048293056.db2.gz SBHUHBFYYONIMJ-IRXDYDNUSA-N 2 1 312.457 4.329 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030178 1048294770 /nfs/dbraw/zinc/29/47/70/1048294770.db2.gz AIVJOTNWLORECS-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(Cl)c2Cl)C1 ZINC000481030178 1048294783 /nfs/dbraw/zinc/29/47/83/1048294783.db2.gz AIVJOTNWLORECS-OLZOCXBDSA-N 2 1 315.288 4.376 20 0 DIADMP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044708 1048296845 /nfs/dbraw/zinc/29/68/45/1048296845.db2.gz YPUCYWNMIUVLJC-RHSMWYFYSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044708 1048296858 /nfs/dbraw/zinc/29/68/58/1048296858.db2.gz YPUCYWNMIUVLJC-RHSMWYFYSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044710 1048298396 /nfs/dbraw/zinc/29/83/96/1048298396.db2.gz YPUCYWNMIUVLJC-YOEHRIQHSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2OC)C1 ZINC000481044710 1048298408 /nfs/dbraw/zinc/29/84/08/1048298408.db2.gz YPUCYWNMIUVLJC-YOEHRIQHSA-N 2 1 324.896 4.121 20 0 DIADMP CCC[C@@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201544573 1048302571 /nfs/dbraw/zinc/30/25/71/1048302571.db2.gz YXDMSLQNHGPXCA-QGZVFWFLSA-N 2 1 320.546 4.472 20 0 DIADMP CCC[C@H](C)C[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001201544541 1048303621 /nfs/dbraw/zinc/30/36/21/1048303621.db2.gz YXDMSLQNHGPXCA-KRWDZBQOSA-N 2 1 320.546 4.472 20 0 DIADMP CCC[C@@H](C)C[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001201551718 1048304816 /nfs/dbraw/zinc/30/48/16/1048304816.db2.gz DOSKCZAFOVWZMZ-GOSISDBHSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[C@H](C)C[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001201551720 1048305725 /nfs/dbraw/zinc/30/57/25/1048305725.db2.gz DOSKCZAFOVWZMZ-SFHVURJKSA-N 2 1 302.506 4.267 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C3CCC3)cc2)C1 ZINC001201557454 1048315476 /nfs/dbraw/zinc/31/54/76/1048315476.db2.gz IUYGJPCYXUZCJA-IBGZPJMESA-N 2 1 314.517 4.412 20 0 DIADMP CCCC[N@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201706460 1048350755 /nfs/dbraw/zinc/35/07/55/1048350755.db2.gz NIQZFEPSKGYMCH-SZMVWBNQSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@H]([N@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201706460 1048350771 /nfs/dbraw/zinc/35/07/71/1048350771.db2.gz NIQZFEPSKGYMCH-SZMVWBNQSA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[NH+]1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3cccs3)[C@H]2C1 ZINC001201706460 1048350790 /nfs/dbraw/zinc/35/07/90/1048350790.db2.gz NIQZFEPSKGYMCH-SZMVWBNQSA-N 2 1 306.519 4.081 20 0 DIADMP CCCCC[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001201727902 1048357507 /nfs/dbraw/zinc/35/75/07/1048357507.db2.gz ZFQHQBRRROBFHU-SFHVURJKSA-N 2 1 304.478 4.146 20 0 DIADMP CCCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](CC)C2)cc1 ZINC000481319099 1048363880 /nfs/dbraw/zinc/36/38/80/1048363880.db2.gz FKFLOCGKPVSDIU-QZTJIDSGSA-N 2 1 318.505 4.248 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3c4ccccc4sc32)C1 ZINC000481321103 1048364276 /nfs/dbraw/zinc/36/42/76/1048364276.db2.gz KLRQRZJHLCXKKW-RHSMWYFYSA-N 2 1 314.498 4.210 20 0 DIADMP C[C@@H]([NH3+])c1ccc2c(ccn2-c2cc[nH+]cc2C(F)(F)F)c1 ZINC001162910475 1048386916 /nfs/dbraw/zinc/38/69/16/1048386916.db2.gz UUMGSLAWAJWBAI-SNVBAGLBSA-N 2 1 305.303 4.064 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc2c(s1)CCCC2 ZINC000481432589 1048402181 /nfs/dbraw/zinc/40/21/81/1048402181.db2.gz KSMHEYWCQKATFI-AWEZNQCLSA-N 2 1 318.530 4.294 20 0 DIADMP CCc1ccc(N[C@H]2CC3(CC[NH2+]CC3)c3ccc(C)cc32)[nH+]c1 ZINC001163034961 1048406055 /nfs/dbraw/zinc/40/60/55/1048406055.db2.gz YVPZCUYWPBRUOU-IBGZPJMESA-N 2 1 321.468 4.131 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH2+][C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)C1 ZINC001201947416 1048407031 /nfs/dbraw/zinc/40/70/31/1048407031.db2.gz YJBQKJTZMXEXCS-RDGPPVDQSA-N 2 1 306.538 4.445 20 0 DIADMP CSc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1 ZINC001201947255 1048407432 /nfs/dbraw/zinc/40/74/32/1048407432.db2.gz VOWVRSZZKDCDNL-NVXWUHKLSA-N 2 1 318.530 4.151 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CC[C@@H](c2ccc(C)cc2)C1(C)C ZINC001175714084 1048420738 /nfs/dbraw/zinc/42/07/38/1048420738.db2.gz FMYJTZZUERDBGF-IBGZPJMESA-N 2 1 302.506 4.295 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)C2CCN(C)CC2)cc(F)c1F ZINC001143611045 1048439158 /nfs/dbraw/zinc/43/91/58/1048439158.db2.gz NSNXGGFTTWTRIC-UHFFFAOYSA-N 2 1 322.443 4.112 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@@H+]1C ZINC000481717206 1048464365 /nfs/dbraw/zinc/46/43/65/1048464365.db2.gz JKVPPGDXJXIFAR-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)CC[N@H+]1C ZINC000481717206 1048464373 /nfs/dbraw/zinc/46/43/73/1048464373.db2.gz JKVPPGDXJXIFAR-FUHWJXTLSA-N 2 1 310.441 4.051 20 0 DIADMP CC[C@H](C[N@@H+](CC)CCCCn1ccnc1C)c1ccccc1 ZINC000481764477 1048480920 /nfs/dbraw/zinc/48/09/20/1048480920.db2.gz HBTCMLGOWMXKQV-LJQANCHMSA-N 2 1 313.489 4.487 20 0 DIADMP CC[C@H](C[N@H+](CC)CCCCn1cc[nH+]c1C)c1ccccc1 ZINC000481764477 1048480931 /nfs/dbraw/zinc/48/09/31/1048480931.db2.gz HBTCMLGOWMXKQV-LJQANCHMSA-N 2 1 313.489 4.487 20 0 DIADMP CC[C@H](C[N@@H+](CC)CCCCn1cc[nH+]c1C)c1ccccc1 ZINC000481764477 1048480935 /nfs/dbraw/zinc/48/09/35/1048480935.db2.gz HBTCMLGOWMXKQV-LJQANCHMSA-N 2 1 313.489 4.487 20 0 DIADMP C[N@H+]1CCC[C@H]1CC[NH+]1CCC(c2ccc(Cl)cc2)CC1 ZINC000481816981 1048492119 /nfs/dbraw/zinc/49/21/19/1048492119.db2.gz SARBTYJHUADOKI-SFHVURJKSA-N 2 1 306.881 4.004 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C1CCC2(CC2)CC1 ZINC001202288857 1048511714 /nfs/dbraw/zinc/51/17/14/1048511714.db2.gz KTIKGLWRNPLWFS-UHFFFAOYSA-N 2 1 314.517 4.457 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000556050494 1048526194 /nfs/dbraw/zinc/52/61/94/1048526194.db2.gz JACSNSGXCCXWBX-CQSZACIVSA-N 2 1 300.421 4.114 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@H]3CC[N@@H+](C)[C@H](C)C3)c2)c1 ZINC000481920655 1048529148 /nfs/dbraw/zinc/52/91/48/1048529148.db2.gz FSBZXTXRUBLLMD-UTKZUKDTSA-N 2 1 308.469 4.234 20 0 DIADMP Cc1cccc(-c2cccc(C[NH2+][C@@H]3CC[N@H+](C)C[C@@H]3C)c2)c1 ZINC000481935506 1048533721 /nfs/dbraw/zinc/53/37/21/1048533721.db2.gz YTRZFXARXLLPFB-LAUBAEHRSA-N 2 1 308.469 4.092 20 0 DIADMP CC(C)CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000482011510 1048543536 /nfs/dbraw/zinc/54/35/36/1048543536.db2.gz SRQKNWXQSJBBOF-ZIFCJYIRSA-N 2 1 318.505 4.245 20 0 DIADMP CCOCCC[N@H+]1CC[C@H]([NH2+][C@H](CC)C2CCCCC2)[C@H](C)C1 ZINC000482017703 1048549020 /nfs/dbraw/zinc/54/90/20/1048549020.db2.gz PFWMZBIXFZWRBC-RLLQIKCJSA-N 2 1 324.553 4.072 20 0 DIADMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000482106745 1048558433 /nfs/dbraw/zinc/55/84/33/1048558433.db2.gz CEHFMYNUAXFQMP-INIZCTEOSA-N 2 1 305.425 4.209 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(F)c(Cl)c2)C1 ZINC000482321588 1048587403 /nfs/dbraw/zinc/58/74/03/1048587403.db2.gz PSRCKKQKJQNGGJ-KGLIPLIRSA-N 2 1 312.860 4.250 20 0 DIADMP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CC(C)(C)c3ccccc32)C1 ZINC000482330514 1048590979 /nfs/dbraw/zinc/59/09/79/1048590979.db2.gz UTKVOPUYXPFVAE-APWZRJJASA-N 2 1 300.490 4.119 20 0 DIADMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H]2CCc3cc(Cl)ccc32)C1 ZINC000482339862 1048591806 /nfs/dbraw/zinc/59/18/06/1048591806.db2.gz XQIMPKMJACCLQF-KSSFIOAISA-N 2 1 306.881 4.037 20 0 DIADMP CCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000482357180 1048594426 /nfs/dbraw/zinc/59/44/26/1048594426.db2.gz KHDNYBPHZDXIEB-ZWKOTPCHSA-N 2 1 318.505 4.246 20 0 DIADMP Cc1cc(C)c(CSCC[N@@H+](C)Cc2ccccc2)c(C)[nH+]1 ZINC001189215866 1048609693 /nfs/dbraw/zinc/60/96/93/1048609693.db2.gz QXSMGQZNYQJFOI-UHFFFAOYSA-N 2 1 314.498 4.372 20 0 DIADMP Cc1cc(C)c(CSCC[N@H+](C)Cc2ccccc2)c(C)[nH+]1 ZINC001189215866 1048609701 /nfs/dbraw/zinc/60/97/01/1048609701.db2.gz QXSMGQZNYQJFOI-UHFFFAOYSA-N 2 1 314.498 4.372 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC001176282419 1048616970 /nfs/dbraw/zinc/61/69/70/1048616970.db2.gz XLZRGNUEWIFZKF-HUUCEWRRSA-N 2 1 315.848 4.007 20 0 DIADMP C[C@H](c1ccccc1Cl)[N@H+]1CCN(c2cc[nH+]cc2)C[C@H]1C ZINC001176282419 1048616976 /nfs/dbraw/zinc/61/69/76/1048616976.db2.gz XLZRGNUEWIFZKF-HUUCEWRRSA-N 2 1 315.848 4.007 20 0 DIADMP Cc1[nH+]ccn1Cc1ccc(Nc2ccc(C[NH+](C)C)cc2)cc1 ZINC001176292555 1048622253 /nfs/dbraw/zinc/62/22/53/1048622253.db2.gz WMUDJNYPCMFRGR-UHFFFAOYSA-N 2 1 320.440 4.045 20 0 DIADMP C[C@@H](C[N@@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1)C(C)(C)C ZINC001176263568 1048626939 /nfs/dbraw/zinc/62/69/39/1048626939.db2.gz RKRWAPSLHMQDKH-SXLOBPIMSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@@H](C[NH+]1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1)C(C)(C)C ZINC001176263568 1048626943 /nfs/dbraw/zinc/62/69/43/1048626943.db2.gz RKRWAPSLHMQDKH-SXLOBPIMSA-N 2 1 314.517 4.123 20 0 DIADMP C[C@@H](C[NH+]1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1)C(C)(C)C ZINC001176263568 1048626945 /nfs/dbraw/zinc/62/69/45/1048626945.db2.gz RKRWAPSLHMQDKH-SXLOBPIMSA-N 2 1 314.517 4.123 20 0 DIADMP CCCCCC[N@H+](CCn1cc[nH+]c1C)Cc1ccc(C)o1 ZINC001176321264 1048650694 /nfs/dbraw/zinc/65/06/94/1048650694.db2.gz AHXFOPGEWHOZHZ-UHFFFAOYSA-N 2 1 303.450 4.175 20 0 DIADMP CCCCCC[N@@H+](CCn1cc[nH+]c1C)Cc1ccc(C)o1 ZINC001176321264 1048650699 /nfs/dbraw/zinc/65/06/99/1048650699.db2.gz AHXFOPGEWHOZHZ-UHFFFAOYSA-N 2 1 303.450 4.175 20 0 DIADMP CC[N@H+]1CCCC[C@@H]1c1ccc(Nc2cccc(C[NH2+]C)c2)nc1 ZINC001165141181 1048660634 /nfs/dbraw/zinc/66/06/34/1048660634.db2.gz OIRQQKWOUYRNQU-LJQANCHMSA-N 2 1 324.472 4.092 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@@H]2CC[N@@H+](C3CCCCC3)C2)CC1 ZINC000850539049 1048686672 /nfs/dbraw/zinc/68/66/72/1048686672.db2.gz PYUGUMMFVRVMBM-YMAMQOFZSA-N 2 1 318.427 4.104 20 0 DIADMP FC(F)(F)C1CCC([NH2+][C@@H]2CC[N@H+](C3CCCCC3)C2)CC1 ZINC000850539049 1048686683 /nfs/dbraw/zinc/68/66/83/1048686683.db2.gz PYUGUMMFVRVMBM-YMAMQOFZSA-N 2 1 318.427 4.104 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+]([C@H]2CCc3c2cccc3F)CC1 ZINC001190405898 1048728978 /nfs/dbraw/zinc/72/89/78/1048728978.db2.gz CRERZSKUEZWHST-FQEVSTJZSA-N 2 1 318.480 4.257 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C[C@@H]2CC3CCC2CC3)CC1 ZINC001190407598 1048730958 /nfs/dbraw/zinc/73/09/58/1048730958.db2.gz PYBRZSWPEQIDRH-UUKMXZOPSA-N 2 1 306.538 4.257 20 0 DIADMP CC[C@H]([NH2+]C1CCN(c2cccc(C)[nH+]2)CC1)C1CCCCC1 ZINC000483147759 1048748493 /nfs/dbraw/zinc/74/84/93/1048748493.db2.gz CCNQUMFFKWYMLE-IBGZPJMESA-N 2 1 315.505 4.307 20 0 DIADMP Cc1cc(C)cc([C@@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000483165483 1048750653 /nfs/dbraw/zinc/75/06/53/1048750653.db2.gz CDZWASCBYRZKSY-GOSISDBHSA-N 2 1 323.484 4.326 20 0 DIADMP CCc1ccc([C@H](C)[NH2+]C2CCN(c3cccc(C)[nH+]3)CC2)cc1 ZINC000483168837 1048751302 /nfs/dbraw/zinc/75/13/02/1048751302.db2.gz NBYDFPYILSBSEZ-KRWDZBQOSA-N 2 1 323.484 4.272 20 0 DIADMP Cc1ccc(C[N@@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC001204174398 1048751899 /nfs/dbraw/zinc/75/18/99/1048751899.db2.gz QUCPFTPFHYSHSW-UHFFFAOYSA-N 2 1 322.496 4.339 20 0 DIADMP CC(C)C[N@@H+](CCC[NH+]1CCCCC1)CCc1ccccc1 ZINC001190551586 1048754431 /nfs/dbraw/zinc/75/44/31/1048754431.db2.gz WWWMFZUQVRIBSW-UHFFFAOYSA-N 2 1 302.506 4.063 20 0 DIADMP CCC[C@H](C)[C@H](CC)[NH2+]C1CCN(c2cccc(C)[nH+]2)CC1 ZINC000483202809 1048755275 /nfs/dbraw/zinc/75/52/75/1048755275.db2.gz RLGSFRXSYRGDCJ-YJBOKZPZSA-N 2 1 303.494 4.163 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c(C)c1 ZINC001190650743 1048772215 /nfs/dbraw/zinc/77/22/15/1048772215.db2.gz GCLQYHZZGUSNFP-FQEVSTJZSA-N 2 1 314.517 4.247 20 0 DIADMP CC[C@@H](CC(F)F)C[N@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001190650753 1048773030 /nfs/dbraw/zinc/77/30/30/1048773030.db2.gz GDILJWNMMKHYHF-DLBZAZTESA-N 2 1 316.480 4.112 20 0 DIADMP C[N@@H+](Cc1ccccc1C[NH2+]Cc1ccncc1)C1CCCCC1 ZINC000077589900 1048775911 /nfs/dbraw/zinc/77/59/11/1048775911.db2.gz JEXRPDWILLXPPQ-UHFFFAOYSA-N 2 1 323.484 4.136 20 0 DIADMP Cc1cccc(Cl)c1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC001190819490 1048789364 /nfs/dbraw/zinc/78/93/64/1048789364.db2.gz WWIDLKYYIHPRCP-UHFFFAOYSA-N 2 1 308.897 4.201 20 0 DIADMP C(C1CC2(CCC2)C1)[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190827858 1048791279 /nfs/dbraw/zinc/79/12/79/1048791279.db2.gz PYDZOQONYYFGHB-SFHVURJKSA-N 2 1 304.522 4.155 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000483507749 1048808162 /nfs/dbraw/zinc/80/81/62/1048808162.db2.gz ZOSSBJWFARRRGC-NXHRZFHOSA-N 2 1 306.881 4.207 20 0 DIADMP CC[C@H](c1ccc(Cl)cc1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000483507749 1048808175 /nfs/dbraw/zinc/80/81/75/1048808175.db2.gz ZOSSBJWFARRRGC-NXHRZFHOSA-N 2 1 306.881 4.207 20 0 DIADMP C[N@H+]1CCC[C@@H]2C[NH+](CCCc3cccc4ccccc43)CC[C@H]21 ZINC000483494396 1048809733 /nfs/dbraw/zinc/80/97/33/1048809733.db2.gz USAFJNDUOPKTFG-IFMALSPDSA-N 2 1 322.496 4.189 20 0 DIADMP C[NH+]1CCC[C@@H]2C[N@H+](CCCc3cccc4ccccc43)CC[C@H]21 ZINC000483494396 1048809742 /nfs/dbraw/zinc/80/97/42/1048809742.db2.gz USAFJNDUOPKTFG-IFMALSPDSA-N 2 1 322.496 4.189 20 0 DIADMP CC[C@@H](C[NH2+][C@@H]1CC[N@@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181185 1048843100 /nfs/dbraw/zinc/84/31/00/1048843100.db2.gz PHIGAHXVNVJEHT-PKOBYXMFSA-N 2 1 300.490 4.177 20 0 DIADMP CC[C@@H](C[NH2+][C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccccc1 ZINC001203181185 1048843124 /nfs/dbraw/zinc/84/31/24/1048843124.db2.gz PHIGAHXVNVJEHT-PKOBYXMFSA-N 2 1 300.490 4.177 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000483724066 1048845702 /nfs/dbraw/zinc/84/57/02/1048845702.db2.gz GBPCVQVJOUVGFW-POAQFYNOSA-N 2 1 318.505 4.245 20 0 DIADMP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000483724066 1048845714 /nfs/dbraw/zinc/84/57/14/1048845714.db2.gz GBPCVQVJOUVGFW-POAQFYNOSA-N 2 1 318.505 4.245 20 0 DIADMP CC(C)c1ccccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001191099241 1048849962 /nfs/dbraw/zinc/84/99/62/1048849962.db2.gz KSJSZWHFKLTIID-IBGZPJMESA-N 2 1 300.490 4.260 20 0 DIADMP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)C(C)(C)C ZINC000483735294 1048850691 /nfs/dbraw/zinc/85/06/91/1048850691.db2.gz YWJYEEGNGGZJFY-MRXNPFEDSA-N 2 1 314.473 4.436 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483737221 1048851929 /nfs/dbraw/zinc/85/19/29/1048851929.db2.gz UBIWGHYQEAGBOS-WBAXXEDZSA-N 2 1 308.897 4.500 20 0 DIADMP CC(C)C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483737221 1048851954 /nfs/dbraw/zinc/85/19/54/1048851954.db2.gz UBIWGHYQEAGBOS-WBAXXEDZSA-N 2 1 308.897 4.500 20 0 DIADMP CC(C)[C@H]1CCC[C@@H]([NH2+]CCC[N@@H+]2CCc3ccccc3C2)C1 ZINC001177245016 1048854116 /nfs/dbraw/zinc/85/41/16/1048854116.db2.gz KLHVFPOYPTWSLT-PZJWPPBQSA-N 2 1 314.517 4.239 20 0 DIADMP CC(C)[C@H]1CCC[C@@H]([NH2+]CCC[N@H+]2CCc3ccccc3C2)C1 ZINC001177245016 1048854125 /nfs/dbraw/zinc/85/41/25/1048854125.db2.gz KLHVFPOYPTWSLT-PZJWPPBQSA-N 2 1 314.517 4.239 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483746443 1048855411 /nfs/dbraw/zinc/85/54/11/1048855411.db2.gz OUHQMVAVSWKKGA-USJZOSNVSA-N 2 1 308.897 4.500 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000483746443 1048855429 /nfs/dbraw/zinc/85/54/29/1048855429.db2.gz OUHQMVAVSWKKGA-USJZOSNVSA-N 2 1 308.897 4.500 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483746442 1048855618 /nfs/dbraw/zinc/85/56/18/1048855618.db2.gz OUHQMVAVSWKKGA-JFTQMJAMSA-N 2 1 308.897 4.500 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483746442 1048855635 /nfs/dbraw/zinc/85/56/35/1048855635.db2.gz OUHQMVAVSWKKGA-JFTQMJAMSA-N 2 1 308.897 4.500 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483746440 1048856904 /nfs/dbraw/zinc/85/69/04/1048856904.db2.gz OUHQMVAVSWKKGA-DACLVMHWSA-N 2 1 308.897 4.500 20 0 DIADMP CC[C@H](C)[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1 ZINC000483746440 1048856915 /nfs/dbraw/zinc/85/69/15/1048856915.db2.gz OUHQMVAVSWKKGA-DACLVMHWSA-N 2 1 308.897 4.500 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cccc(C2CC2)c1 ZINC001177299419 1048861630 /nfs/dbraw/zinc/86/16/30/1048861630.db2.gz PPKVLKUJDDVXKL-QGZVFWFLSA-N 2 1 300.490 4.308 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001177299557 1048861981 /nfs/dbraw/zinc/86/19/81/1048861981.db2.gz VQCJGRAOARNREN-QHGAOEGBSA-N 2 1 306.538 4.447 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)C1(c2ccccc2)CCCC1 ZINC000483830725 1048867353 /nfs/dbraw/zinc/86/73/53/1048867353.db2.gz DXZHKIAGIOFIJK-KRWDZBQOSA-N 2 1 312.501 4.103 20 0 DIADMP CCc1nc2c(s1)[C@@H]([NH2+]CCC[NH+](C(C)C)C(C)C)CCC2 ZINC000483858158 1048876515 /nfs/dbraw/zinc/87/65/15/1048876515.db2.gz DGYXHWAHMJJJQX-HNNXBMFYSA-N 2 1 323.550 4.181 20 0 DIADMP CC(C)C1CCC(C[NH2+][C@@H](C)C[NH+]2C[C@H](C)C[C@@H](C)C2)CC1 ZINC001177458583 1048888839 /nfs/dbraw/zinc/88/88/39/1048888839.db2.gz DZYCDOJJYWLRSP-UYUJGIFYSA-N 2 1 308.554 4.405 20 0 DIADMP CC(C)[NH+]1CCC(C[N@H+](C)Cc2c(F)cccc2Cl)CC1 ZINC001203405691 1048890767 /nfs/dbraw/zinc/89/07/67/1048890767.db2.gz RWOUZWJDGJICAF-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2c(F)cccc2Cl)CC1 ZINC001203405691 1048890779 /nfs/dbraw/zinc/89/07/79/1048890779.db2.gz RWOUZWJDGJICAF-UHFFFAOYSA-N 2 1 312.860 4.031 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)[C@H]1C ZINC001191184317 1048891472 /nfs/dbraw/zinc/89/14/72/1048891472.db2.gz XHIQATGMLACDHP-MSOLQXFVSA-N 2 1 300.490 4.293 20 0 DIADMP C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001191184320 1048891578 /nfs/dbraw/zinc/89/15/78/1048891578.db2.gz XHIQATGMLACDHP-ZWKOTPCHSA-N 2 1 300.490 4.293 20 0 DIADMP Cc1cc(C)c([C@@H](C)[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c(C)c1 ZINC001191255186 1048895415 /nfs/dbraw/zinc/89/54/15/1048895415.db2.gz CECIOLBAVLARTH-RTBURBONSA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c(C)c1 ZINC001191255186 1048895432 /nfs/dbraw/zinc/89/54/32/1048895432.db2.gz CECIOLBAVLARTH-RTBURBONSA-N 2 1 302.506 4.479 20 0 DIADMP Cc1cc(C)c([C@@H](C)[NH+](C)CC[C@H]2CCCC[N@H+]2C)c(C)c1 ZINC001191255186 1048895447 /nfs/dbraw/zinc/89/54/47/1048895447.db2.gz CECIOLBAVLARTH-RTBURBONSA-N 2 1 302.506 4.479 20 0 DIADMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[nH+]c3ccccc32)C1 ZINC000484154333 1048908472 /nfs/dbraw/zinc/90/84/72/1048908472.db2.gz BMVKRVJBYOCGQS-MSOLQXFVSA-N 2 1 323.484 4.326 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCC2CC2)CC[N@@H+]1Cc1ccccc1 ZINC001191382391 1048929474 /nfs/dbraw/zinc/92/94/74/1048929474.db2.gz WQVJDEBPIKLVTI-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+](C)CCCC2CC2)CC[N@H+]1Cc1ccccc1 ZINC001191382391 1048929485 /nfs/dbraw/zinc/92/94/85/1048929485.db2.gz WQVJDEBPIKLVTI-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382391 1048929500 /nfs/dbraw/zinc/92/95/00/1048929500.db2.gz WQVJDEBPIKLVTI-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)CCCC2CC2)CC[NH+]1Cc1ccccc1 ZINC001191382391 1048929511 /nfs/dbraw/zinc/92/95/11/1048929511.db2.gz WQVJDEBPIKLVTI-XLIONFOSSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)CCC[N@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382373 1048930697 /nfs/dbraw/zinc/93/06/97/1048930697.db2.gz WPBRLVGERLIMKM-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[N@@H+](C)[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382373 1048930706 /nfs/dbraw/zinc/93/07/06/1048930706.db2.gz WPBRLVGERLIMKM-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382373 1048930719 /nfs/dbraw/zinc/93/07/19/1048930719.db2.gz WPBRLVGERLIMKM-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)CCC[NH+](C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001191382373 1048930732 /nfs/dbraw/zinc/93/07/32/1048930732.db2.gz WPBRLVGERLIMKM-AZUAARDMSA-N 2 1 302.506 4.408 20 0 DIADMP CSc1ccccc1[C@@H](C)[NH2+]C1CC[NH+](CC(C)C)CC1 ZINC000194843809 1048931417 /nfs/dbraw/zinc/93/14/17/1048931417.db2.gz ZNYZUBRPBLEVAE-OAHLLOKOSA-N 2 1 306.519 4.180 20 0 DIADMP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391675 1048932939 /nfs/dbraw/zinc/93/29/39/1048932939.db2.gz YVJGTVKSELYOEU-HNNXBMFYSA-N 2 1 316.876 4.267 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391675 1048932956 /nfs/dbraw/zinc/93/29/56/1048932956.db2.gz YVJGTVKSELYOEU-HNNXBMFYSA-N 2 1 316.876 4.267 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391675 1048932967 /nfs/dbraw/zinc/93/29/67/1048932967.db2.gz YVJGTVKSELYOEU-HNNXBMFYSA-N 2 1 316.876 4.267 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c3ccccc23)C1 ZINC001191391675 1048932980 /nfs/dbraw/zinc/93/29/80/1048932980.db2.gz YVJGTVKSELYOEU-HNNXBMFYSA-N 2 1 316.876 4.267 20 0 DIADMP CC[NH+](CC)C[C@@H](C)[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001177733555 1048936022 /nfs/dbraw/zinc/93/60/22/1048936022.db2.gz NTICDWSDQLNEBZ-ZWKOTPCHSA-N 2 1 318.549 4.483 20 0 DIADMP CC[NH+](CC)C[C@H](C)[NH2+]C[C@H](C)Cc1ccc(C(C)(C)C)cc1 ZINC001177733552 1048936311 /nfs/dbraw/zinc/93/63/11/1048936311.db2.gz NTICDWSDQLNEBZ-MSOLQXFVSA-N 2 1 318.549 4.483 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccccc2CC(C)C)C[C@H]1C ZINC001191417645 1048940825 /nfs/dbraw/zinc/94/08/25/1048940825.db2.gz QDFQKRKAFPUDBX-XLIONFOSSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccccc2CC(C)C)C[C@H]1C ZINC001191417645 1048940831 /nfs/dbraw/zinc/94/08/31/1048940831.db2.gz QDFQKRKAFPUDBX-XLIONFOSSA-N 2 1 302.506 4.190 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccccc2CC(C)C)C[C@H]1C ZINC001191417645 1048940840 /nfs/dbraw/zinc/94/08/40/1048940840.db2.gz QDFQKRKAFPUDBX-XLIONFOSSA-N 2 1 302.506 4.190 20 0 DIADMP Cc1cc(C[NH2+]C2CC[NH+]([C@@H](C)c3ccccc3)CC2)cc(C)n1 ZINC001177876321 1048949502 /nfs/dbraw/zinc/94/95/02/1048949502.db2.gz ZXOXSKKTIPNLAD-SFHVURJKSA-N 2 1 323.484 4.014 20 0 DIADMP CC[C@@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCC(F)(F)CC2)C1 ZINC001177835177 1048951901 /nfs/dbraw/zinc/95/19/01/1048951901.db2.gz KTWBOWAQRASEIO-CQSZACIVSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCC(F)(F)CC2)C1 ZINC001177835177 1048951916 /nfs/dbraw/zinc/95/19/16/1048951916.db2.gz KTWBOWAQRASEIO-CQSZACIVSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@H]1CCC[N@@H+](C(C)(C)C[NH2+]C2CCC(F)(F)CC2)C1 ZINC001177835176 1048952749 /nfs/dbraw/zinc/95/27/49/1048952749.db2.gz KTWBOWAQRASEIO-AWEZNQCLSA-N 2 1 302.453 4.055 20 0 DIADMP CC[C@H]1CCC[N@H+](C(C)(C)C[NH2+]C2CCC(F)(F)CC2)C1 ZINC001177835176 1048952754 /nfs/dbraw/zinc/95/27/54/1048952754.db2.gz KTWBOWAQRASEIO-AWEZNQCLSA-N 2 1 302.453 4.055 20 0 DIADMP C[N@H+](Cc1cccc(F)c1)C1CC[NH+](C2CCCCC2)CC1 ZINC001203788983 1048996770 /nfs/dbraw/zinc/99/67/70/1048996770.db2.gz UZWRVPBMZDPNIJ-UHFFFAOYSA-N 2 1 304.453 4.055 20 0 DIADMP C[N@@H+](Cc1cccc(F)c1)C1CC[NH+](C2CCCCC2)CC1 ZINC001203788983 1048996773 /nfs/dbraw/zinc/99/67/73/1048996773.db2.gz UZWRVPBMZDPNIJ-UHFFFAOYSA-N 2 1 304.453 4.055 20 0 DIADMP C[N@H+](Cc1cccc(Oc2ccccc2)c1)CC1CC[NH+](C)CC1 ZINC001203811622 1049006568 /nfs/dbraw/zinc/00/65/68/1049006568.db2.gz SADAMEPWEOMUKF-UHFFFAOYSA-N 2 1 324.468 4.253 20 0 DIADMP CC[N@@H+](c1ccc(N[C@@H](C)C2CC[NH+](C)CC2)cc1)C(C)C ZINC000776801792 1049022883 /nfs/dbraw/zinc/02/28/83/1049022883.db2.gz AAVAYPWUGMEAIT-INIZCTEOSA-N 2 1 303.494 4.064 20 0 DIADMP CC[N@H+](c1ccc(N[C@@H](C)C2CC[NH+](C)CC2)cc1)C(C)C ZINC000776801792 1049022895 /nfs/dbraw/zinc/02/28/95/1049022895.db2.gz AAVAYPWUGMEAIT-INIZCTEOSA-N 2 1 303.494 4.064 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(C)c(OC)cc2C)CC1 ZINC001203755110 1049072448 /nfs/dbraw/zinc/07/24/48/1049072448.db2.gz JKXMRXJOMZGYSE-UHFFFAOYSA-N 2 1 318.505 4.008 20 0 DIADMP Cc1csc(C[NH2+]CC(C)(C)C[N@H+](C)Cc2ccccc2)c1 ZINC001178754061 1049083011 /nfs/dbraw/zinc/08/30/11/1049083011.db2.gz AJOMKWJWUSMFMG-UHFFFAOYSA-N 2 1 316.514 4.304 20 0 DIADMP Cc1csc(C[NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)c1 ZINC001178754061 1049083027 /nfs/dbraw/zinc/08/30/27/1049083027.db2.gz AJOMKWJWUSMFMG-UHFFFAOYSA-N 2 1 316.514 4.304 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+]Cc2ccc(-c3ccccc3)s2)C1 ZINC001178916611 1049109793 /nfs/dbraw/zinc/10/97/93/1049109793.db2.gz JTHVLQNJEZCLQP-MRXNPFEDSA-N 2 1 314.498 4.237 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238649 1049119071 /nfs/dbraw/zinc/11/90/71/1049119071.db2.gz RCTMXAWVTCGMTA-MJUUVYJYSA-N 2 1 314.517 4.301 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238649 1049119079 /nfs/dbraw/zinc/11/90/79/1049119079.db2.gz RCTMXAWVTCGMTA-MJUUVYJYSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238649 1049119087 /nfs/dbraw/zinc/11/90/87/1049119087.db2.gz RCTMXAWVTCGMTA-MJUUVYJYSA-N 2 1 314.517 4.301 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)[C@@H]2CC[C@@](C)(c3ccccc3)C2)C[C@@H]1C ZINC001204238649 1049119094 /nfs/dbraw/zinc/11/90/94/1049119094.db2.gz RCTMXAWVTCGMTA-MJUUVYJYSA-N 2 1 314.517 4.301 20 0 DIADMP Cc1c(Cl)ccc(CN(C)C[C@H]2CCC[N@@H+](C)C2)c1Cl ZINC001204431357 1049161966 /nfs/dbraw/zinc/16/19/66/1049161966.db2.gz OHBATKGZTGBRNF-ZDUSSCGKSA-N 2 1 315.288 4.075 20 0 DIADMP CC[N@@H+](Cc1sc(C2CC[NH2+]CC2)nc1C)C1CCCCC1 ZINC001204598049 1049196900 /nfs/dbraw/zinc/19/69/00/1049196900.db2.gz FNHBODRMFFVHPX-UHFFFAOYSA-N 2 1 321.534 4.073 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC1CCC(C)(C)CC1 ZINC001193354741 1049201448 /nfs/dbraw/zinc/20/14/48/1049201448.db2.gz GPVGHLPARYEUFV-UHFFFAOYSA-N 2 1 305.510 4.374 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC1CCC(C)(C)CC1 ZINC001193354741 1049201456 /nfs/dbraw/zinc/20/14/56/1049201456.db2.gz GPVGHLPARYEUFV-UHFFFAOYSA-N 2 1 305.510 4.374 20 0 DIADMP CC(C)(C)c1cc(C[NH+]2CCC([NH3+])CC2)cc(C(C)(C)C)c1 ZINC001204646348 1049211960 /nfs/dbraw/zinc/21/19/60/1049211960.db2.gz PYCQSKTZEVSWJG-UHFFFAOYSA-N 2 1 302.506 4.205 20 0 DIADMP [NH3+]C1CC[NH+](Cc2ccccc2Oc2cccc(Cl)c2)CC1 ZINC001204646019 1049212066 /nfs/dbraw/zinc/21/20/66/1049212066.db2.gz HFVSYTLFVOTSDV-UHFFFAOYSA-N 2 1 316.832 4.055 20 0 DIADMP C[NH+](C)Cc1ccc(-c2ccc3[nH]c4cc[nH+]cc4c3c2)cc1 ZINC001204661287 1049216529 /nfs/dbraw/zinc/21/65/29/1049216529.db2.gz VMLVSSUJBYBOTL-UHFFFAOYSA-N 2 1 301.393 4.445 20 0 DIADMP c1ccc([C@@H]2CCC[C@H]([NH2+][C@H]3CC[N@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000858098518 1049217297 /nfs/dbraw/zinc/21/72/97/1049217297.db2.gz NQUYMSPQFVKCAW-IVAOSVALSA-N 2 1 312.501 4.319 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCN(C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107263 1049217914 /nfs/dbraw/zinc/21/79/14/1049217914.db2.gz MNIHORATMYDZMJ-QWHCGFSZSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107263 1049217923 /nfs/dbraw/zinc/21/79/23/1049217923.db2.gz MNIHORATMYDZMJ-QWHCGFSZSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1ccccc1C(F)(F)F ZINC000858107263 1049217935 /nfs/dbraw/zinc/21/79/35/1049217935.db2.gz MNIHORATMYDZMJ-QWHCGFSZSA-N 2 1 314.395 4.229 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1csc2ccccc12 ZINC000858128160 1049219443 /nfs/dbraw/zinc/21/94/43/1049219443.db2.gz CIRVMHXBTNFFBV-UONOGXRCSA-N 2 1 302.487 4.425 20 0 DIADMP c1ccc(CCCCCC[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1 ZINC000858223520 1049227902 /nfs/dbraw/zinc/22/79/02/1049227902.db2.gz USDUSPZZGZTHHA-UXHICEINSA-N 2 1 300.490 4.006 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)[C@H]2C[C@H](C)Sc3sccc32)CC1 ZINC001204714263 1049237139 /nfs/dbraw/zinc/23/71/39/1049237139.db2.gz PDIOIRNAWWXNST-BBRMVZONSA-N 2 1 324.559 4.480 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)[C@H]2C[C@H](C)Sc3sccc32)CC1 ZINC001204714263 1049237147 /nfs/dbraw/zinc/23/71/47/1049237147.db2.gz PDIOIRNAWWXNST-BBRMVZONSA-N 2 1 324.559 4.480 20 0 DIADMP CC(C)C[C@@H](C)[N@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485481775 1049264662 /nfs/dbraw/zinc/26/46/62/1049264662.db2.gz VEPRWBRRAXJNTD-LJQANCHMSA-N 2 1 314.517 4.409 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc3c(s2)CC[NH2+]C3)c1 ZINC001204848586 1049285093 /nfs/dbraw/zinc/28/50/93/1049285093.db2.gz OCWOXQDQVSHTTK-SFHVURJKSA-N 2 1 312.482 4.039 20 0 DIADMP C[N@H+](Cc1ccc2c(c1)C[NH2+]C2)Cc1ccc(Cl)cc1Cl ZINC001204870337 1049291712 /nfs/dbraw/zinc/29/17/12/1049291712.db2.gz PZNFOLAYJORPIP-UHFFFAOYSA-N 2 1 321.251 4.229 20 0 DIADMP C[N@@H+](Cc1ccc2c(c1)C[NH2+]C2)Cc1ccc(Cl)cc1Cl ZINC001204870337 1049291725 /nfs/dbraw/zinc/29/17/25/1049291725.db2.gz PZNFOLAYJORPIP-UHFFFAOYSA-N 2 1 321.251 4.229 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001193990348 1049295124 /nfs/dbraw/zinc/29/51/24/1049295124.db2.gz OHBAFDKLWRKBCT-BHIFYINESA-N 2 1 320.480 4.202 20 0 DIADMP CC[C@H](c1ccccc1)[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001193990348 1049295137 /nfs/dbraw/zinc/29/51/37/1049295137.db2.gz OHBAFDKLWRKBCT-BHIFYINESA-N 2 1 320.480 4.202 20 0 DIADMP CC[C@H](c1ccccc1)[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001193990348 1049295149 /nfs/dbraw/zinc/29/51/49/1049295149.db2.gz OHBAFDKLWRKBCT-BHIFYINESA-N 2 1 320.480 4.202 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)CCc2ccc(C(C)C)cc2)CC1 ZINC001180161700 1049303566 /nfs/dbraw/zinc/30/35/66/1049303566.db2.gz MSZWLWSQHZVLJE-UHFFFAOYSA-N 2 1 302.506 4.159 20 0 DIADMP Cc1occc1C[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC001180225155 1049309973 /nfs/dbraw/zinc/30/99/73/1049309973.db2.gz ONFJJSGIFBGWMB-MRXNPFEDSA-N 2 1 304.478 4.065 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(F)cc(Cl)c2)C1 ZINC000485692893 1049315199 /nfs/dbraw/zinc/31/51/99/1049315199.db2.gz GYYFZXIYYVGMCL-CQSZACIVSA-N 2 1 312.860 4.081 20 0 DIADMP C[C@@]1([NH3+])CCC[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001204937590 1049316411 /nfs/dbraw/zinc/31/64/11/1049316411.db2.gz FOKQVSXKVHSENM-OAQYLSRUSA-N 2 1 319.452 4.148 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001204937590 1049316423 /nfs/dbraw/zinc/31/64/23/1049316423.db2.gz FOKQVSXKVHSENM-OAQYLSRUSA-N 2 1 319.452 4.148 20 0 DIADMP C[C@]1([NH3+])CCC[N@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001204946862 1049320574 /nfs/dbraw/zinc/32/05/74/1049320574.db2.gz UBNSBSLJSBYXJI-IBGZPJMESA-N 2 1 314.860 4.320 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2ccccc2-c2ccc(Cl)cc2)C1 ZINC001204946862 1049320588 /nfs/dbraw/zinc/32/05/88/1049320588.db2.gz UBNSBSLJSBYXJI-IBGZPJMESA-N 2 1 314.860 4.320 20 0 DIADMP CC[N@@H+](CCC1CC[NH+](C[C@]2(C)CCCS2)CC1)CC1CC1 ZINC001204968852 1049325809 /nfs/dbraw/zinc/32/58/09/1049325809.db2.gz LQRWFQCJNBHYSA-IBGZPJMESA-N 2 1 324.578 4.106 20 0 DIADMP CC(C)(C)CC[NH2+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001180300786 1049327261 /nfs/dbraw/zinc/32/72/61/1049327261.db2.gz DVKAPIRESFAUMK-SLFFLAALSA-N 2 1 314.517 4.313 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](C[C@@H](C)Cc2ccc(C(C)(C)C)cc2)C1 ZINC001205001331 1049337612 /nfs/dbraw/zinc/33/76/12/1049337612.db2.gz PYARBZXURACKQB-PKOBYXMFSA-N 2 1 316.533 4.094 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc3oc4ccccc4c3c2)C1 ZINC001205009295 1049338887 /nfs/dbraw/zinc/33/88/87/1049338887.db2.gz MSBBIHIWYPYESG-MRXNPFEDSA-N 2 1 308.425 4.017 20 0 DIADMP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cccc3c4ccccc4sc32)C1 ZINC001205009300 1049339966 /nfs/dbraw/zinc/33/99/66/1049339966.db2.gz MWVOHGTXVPBZPO-HNNXBMFYSA-N 2 1 324.493 4.486 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc3sc4ccccc4c3c2)C1 ZINC001205015329 1049341238 /nfs/dbraw/zinc/34/12/38/1049341238.db2.gz AYUJBYWNYAKGPY-MRXNPFEDSA-N 2 1 324.493 4.486 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CCC[C@H](C[NH2+]C)C2)c1 ZINC001205018046 1049343692 /nfs/dbraw/zinc/34/36/92/1049343692.db2.gz QQICREJWGCHKOB-QGZVFWFLSA-N 2 1 308.535 4.302 20 0 DIADMP c1ccc(C[NH+]2CC[C@@]3(CC[N@H+](CCCC4CCC4)C3)C2)cc1 ZINC001194267729 1049353639 /nfs/dbraw/zinc/35/36/39/1049353639.db2.gz ACHSUJYQXJNEKK-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@]3(CC[NH+](CCCC4CCC4)C3)C2)cc1 ZINC001194267729 1049353642 /nfs/dbraw/zinc/35/36/42/1049353642.db2.gz ACHSUJYQXJNEKK-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](CCCC4CCC4)C3)C2)cc1 ZINC001194267729 1049353651 /nfs/dbraw/zinc/35/36/51/1049353651.db2.gz ACHSUJYQXJNEKK-OAQYLSRUSA-N 2 1 312.501 4.165 20 0 DIADMP Cc1cccc(C[NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)c1C ZINC001205075089 1049363554 /nfs/dbraw/zinc/36/35/54/1049363554.db2.gz NNFBRCKXPICDEL-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1cccc(C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)c1C ZINC001205075089 1049363570 /nfs/dbraw/zinc/36/35/70/1049363570.db2.gz NNFBRCKXPICDEL-UHFFFAOYSA-N 2 1 312.501 4.144 20 0 DIADMP Cc1cccc(C[NH+]2CCC([N@H+](C)Cc3ccccc3)CC2)c1C ZINC001205089493 1049371758 /nfs/dbraw/zinc/37/17/58/1049371758.db2.gz SBKDXXLIQYDIRN-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP Cc1cccc(C[NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)c1C ZINC001205089493 1049371770 /nfs/dbraw/zinc/37/17/70/1049371770.db2.gz SBKDXXLIQYDIRN-UHFFFAOYSA-N 2 1 322.496 4.400 20 0 DIADMP C[NH+]1CCC(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)CC1 ZINC001180558818 1049380908 /nfs/dbraw/zinc/38/09/08/1049380908.db2.gz WAMALNNXWXKHTE-UHFFFAOYSA-N 2 1 308.469 4.146 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@H]([NH3+])CC2)ccc1Oc1ccccc1 ZINC001205124640 1049386836 /nfs/dbraw/zinc/38/68/36/1049386836.db2.gz XAHKHHNEVLZYJB-GOSISDBHSA-N 2 1 310.441 4.101 20 0 DIADMP CC(C)[C@@](C)(Cc1ccc(Cl)cc1)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001194625029 1049397371 /nfs/dbraw/zinc/39/73/71/1049397371.db2.gz JNAFQTMPPZTOPV-RBUKOAKNSA-N 2 1 322.924 4.371 20 0 DIADMP Cc1ccc(-c2ccccc2C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c(C)c1 ZINC001180792796 1049405019 /nfs/dbraw/zinc/40/50/19/1049405019.db2.gz DWHWOPGHHWYPOG-IBGZPJMESA-N 2 1 322.496 4.354 20 0 DIADMP CC[C@H](Cc1cccs1)[NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001180795325 1049405148 /nfs/dbraw/zinc/40/51/48/1049405148.db2.gz VAOFBKHSIWGBLT-YESZJQIVSA-N 2 1 320.546 4.312 20 0 DIADMP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690713 1049412499 /nfs/dbraw/zinc/41/24/99/1049412499.db2.gz CSBRJZPGILLPKZ-IBGZPJMESA-N 2 1 314.860 4.021 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690713 1049412504 /nfs/dbraw/zinc/41/25/04/1049412504.db2.gz CSBRJZPGILLPKZ-IBGZPJMESA-N 2 1 314.860 4.021 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690713 1049412511 /nfs/dbraw/zinc/41/25/11/1049412511.db2.gz CSBRJZPGILLPKZ-IBGZPJMESA-N 2 1 314.860 4.021 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690713 1049412514 /nfs/dbraw/zinc/41/25/14/1049412514.db2.gz CSBRJZPGILLPKZ-IBGZPJMESA-N 2 1 314.860 4.021 20 0 DIADMP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690714 1049412866 /nfs/dbraw/zinc/41/28/66/1049412866.db2.gz CSBRJZPGILLPKZ-LJQANCHMSA-N 2 1 314.860 4.021 20 0 DIADMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690714 1049412869 /nfs/dbraw/zinc/41/28/69/1049412869.db2.gz CSBRJZPGILLPKZ-LJQANCHMSA-N 2 1 314.860 4.021 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690714 1049412873 /nfs/dbraw/zinc/41/28/73/1049412873.db2.gz CSBRJZPGILLPKZ-LJQANCHMSA-N 2 1 314.860 4.021 20 0 DIADMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccc(Cl)c4ccccc34)C2)C1 ZINC001194690714 1049412876 /nfs/dbraw/zinc/41/28/76/1049412876.db2.gz CSBRJZPGILLPKZ-LJQANCHMSA-N 2 1 314.860 4.021 20 0 DIADMP C[C@]1([NH3+])CCC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC1 ZINC001205263846 1049419751 /nfs/dbraw/zinc/41/97/51/1049419751.db2.gz CPVUJGPKUYUYON-FQEVSTJZSA-N 2 1 310.441 4.182 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC001205263897 1049419809 /nfs/dbraw/zinc/41/98/09/1049419809.db2.gz FKODMXGKDQSJPP-CQSZACIVSA-N 2 1 318.408 4.002 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205266996 1049421917 /nfs/dbraw/zinc/42/19/17/1049421917.db2.gz ZOQNJXYSMDBHPD-HXUWFJFHSA-N 2 1 318.505 4.349 20 0 DIADMP C[C@@]1([NH3+])CCC[N@@H+](Cc2cccc(SC(F)(F)F)c2)CC1 ZINC001205281326 1049426527 /nfs/dbraw/zinc/42/65/27/1049426527.db2.gz SJXBAGMBWIYGTQ-CQSZACIVSA-N 2 1 318.408 4.002 20 0 DIADMP c1cc2c(cccc2C[N@@H+]2CCCC[C@H]2CC[NH+]2CCCC2)[nH]1 ZINC001205281963 1049427210 /nfs/dbraw/zinc/42/72/10/1049427210.db2.gz KEWQOKQAVKDXCL-SFHVURJKSA-N 2 1 311.473 4.008 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)cc2)c1 ZINC001205288543 1049428491 /nfs/dbraw/zinc/42/84/91/1049428491.db2.gz LIINVNFUGZLBAH-OAQYLSRUSA-N 2 1 308.469 4.365 20 0 DIADMP Cc1cccc(-c2ccc(C[N@H+]3CCC[C@](C)([NH3+])CC3)cn2)c1C ZINC001205288360 1049428725 /nfs/dbraw/zinc/42/87/25/1049428725.db2.gz JOZDMGSNYPOOOP-NRFANRHFSA-N 2 1 323.484 4.069 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCC[C@@](C)([NH3+])CC3)c2)cc1 ZINC001205288139 1049429016 /nfs/dbraw/zinc/42/90/16/1049429016.db2.gz GSAXEGSUPILYHY-OAQYLSRUSA-N 2 1 308.469 4.365 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@](C)([NH3+])CC2)cccc1-c1ccccc1 ZINC001205289554 1049429171 /nfs/dbraw/zinc/42/91/71/1049429171.db2.gz YXFYJACUOLLKNU-NRFANRHFSA-N 2 1 308.469 4.365 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@H+]1CCC[C@@](C)([NH3+])CC1 ZINC001205295964 1049431416 /nfs/dbraw/zinc/43/14/16/1049431416.db2.gz DLJONLLEUZBPGM-OAQYLSRUSA-N 2 1 324.468 4.491 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC001205296368 1049431581 /nfs/dbraw/zinc/43/15/81/1049431581.db2.gz NQMBNCRCTIZGSW-MJGOQNOKSA-N 2 1 318.505 4.062 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3Cl)o2)C[C@H]1C[NH3+] ZINC001205303771 1049432403 /nfs/dbraw/zinc/43/24/03/1049432403.db2.gz JYBWQOAPMKUPHW-ZIAGYGMSSA-N 2 1 318.848 4.017 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc(Cl)c3)o2)C[C@@H]1C[NH3+] ZINC001205305899 1049432737 /nfs/dbraw/zinc/43/27/37/1049432737.db2.gz UDYUHPJOARPQMR-HIFRSBDPSA-N 2 1 318.848 4.017 20 0 DIADMP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC001181155135 1049447869 /nfs/dbraw/zinc/44/78/69/1049447869.db2.gz ZEJLAXGMZAECPX-ZCNNSNEGSA-N 2 1 314.517 4.311 20 0 DIADMP CC(C)[C@@H]1CC[C@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC001181155135 1049447877 /nfs/dbraw/zinc/44/78/77/1049447877.db2.gz ZEJLAXGMZAECPX-ZCNNSNEGSA-N 2 1 314.517 4.311 20 0 DIADMP C[N@@H+]1CCC[C@@H](C[NH2+]C2CCC3(CC3)CC2)[C@@H]1c1cccs1 ZINC000486690259 1049455099 /nfs/dbraw/zinc/45/50/99/1049455099.db2.gz FEIUVZUKWSKQPO-MAUKXSAKSA-N 2 1 318.530 4.443 20 0 DIADMP C[N@H+]1CCC[C@@H](C[NH2+]C2CCC3(CC3)CC2)[C@@H]1c1cccs1 ZINC000486690259 1049455103 /nfs/dbraw/zinc/45/51/03/1049455103.db2.gz FEIUVZUKWSKQPO-MAUKXSAKSA-N 2 1 318.530 4.443 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc3ccccc3[nH]2)c1 ZINC000775630345 1049468825 /nfs/dbraw/zinc/46/88/25/1049468825.db2.gz YUFRLJXKSZQXPA-MRXNPFEDSA-N 2 1 321.468 4.470 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CCCC[C@H]1C ZINC001181349607 1049469909 /nfs/dbraw/zinc/46/99/09/1049469909.db2.gz LNIHDQUAUQOQEB-JYRKZWEQSA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cc(Cl)cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC001181486979 1049485566 /nfs/dbraw/zinc/48/55/66/1049485566.db2.gz OANOKVKGMCJUDZ-UHFFFAOYSA-N 2 1 316.876 4.342 20 0 DIADMP C[NH+](C)CCC[N@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001181556445 1049489991 /nfs/dbraw/zinc/48/99/91/1049489991.db2.gz WTHDJXDCBLBHMP-UHFFFAOYSA-N 2 1 316.876 4.391 20 0 DIADMP C[NH+](C)CCC[N@@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC001181556445 1049489998 /nfs/dbraw/zinc/48/99/98/1049489998.db2.gz WTHDJXDCBLBHMP-UHFFFAOYSA-N 2 1 316.876 4.391 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001205554474 1049497159 /nfs/dbraw/zinc/49/71/59/1049497159.db2.gz GPGLBOVKVKPOFJ-UZLBHIALSA-N 2 1 318.480 4.143 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[NH2+]C[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001205554468 1049497894 /nfs/dbraw/zinc/49/78/94/1049497894.db2.gz GPGLBOVKVKPOFJ-JXFKEZNVSA-N 2 1 318.480 4.143 20 0 DIADMP [NH3+]C[C@]1(F)CCC[N@@H+](Cc2ccccc2-c2cccs2)CC1 ZINC001205571426 1049501465 /nfs/dbraw/zinc/50/14/65/1049501465.db2.gz ULZQGCGYFXUXAE-SFHVURJKSA-N 2 1 318.461 4.068 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1ccc2[nH]ccc2c1 ZINC001205599116 1049507698 /nfs/dbraw/zinc/50/76/98/1049507698.db2.gz LSPIYVHREYCHKI-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1ccc2[nH]ccc2c1 ZINC001205599116 1049507714 /nfs/dbraw/zinc/50/77/14/1049507714.db2.gz LSPIYVHREYCHKI-RBUKOAKNSA-N 2 1 311.473 4.007 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC[C@H]1C[NH3+] ZINC001205603509 1049508286 /nfs/dbraw/zinc/50/82/86/1049508286.db2.gz PPROREPWACDNTN-HKUYNNGSSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@H](C)[C@H](C[NH3+])CC1)c1cccc2ccccc21 ZINC001205604428 1049508376 /nfs/dbraw/zinc/50/83/76/1049508376.db2.gz VNPIVKUSXJMWAS-LMMKCTJWSA-N 2 1 310.485 4.250 20 0 DIADMP C[C@H](C[N@H+]1CC[C@@H](C)[C@@H](C[NH3+])CC1)c1cccc2ccccc21 ZINC001205604436 1049508552 /nfs/dbraw/zinc/50/85/52/1049508552.db2.gz VNPIVKUSXJMWAS-ZHALLVOQSA-N 2 1 310.485 4.250 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cccc(Oc3ccccc3)c2)CC[C@@H]1C[NH3+] ZINC001205603512 1049510017 /nfs/dbraw/zinc/51/00/17/1049510017.db2.gz PPROREPWACDNTN-PKOBYXMFSA-N 2 1 324.468 4.286 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC[C@H]1C[NH3+] ZINC001205625350 1049514797 /nfs/dbraw/zinc/51/47/97/1049514797.db2.gz BBYDDHXRLPSFQG-QAPCUYQASA-N 2 1 314.498 4.222 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccccc2-c2ccccc2)CC[C@@H]1C[NH3+] ZINC001205626734 1049514820 /nfs/dbraw/zinc/51/48/20/1049514820.db2.gz IRQUZQQVTMVZLB-IEBWSBKVSA-N 2 1 308.469 4.160 20 0 DIADMP Cc1cc(Cl)c(C[N@H+]2CC[C@@H](C[NH3+])[C@@H](C)CC2)c(Cl)c1 ZINC001205639447 1049518087 /nfs/dbraw/zinc/51/80/87/1049518087.db2.gz ZAMVSLCNOPTXBY-STQMWFEESA-N 2 1 315.288 4.109 20 0 DIADMP C[C@H]1CC[N@@H+](Cc2cc(-c3ccsc3)cs2)CC[C@@H]1C[NH3+] ZINC001205638678 1049519093 /nfs/dbraw/zinc/51/90/93/1049519093.db2.gz QQXKVQFEGGZPDH-UONOGXRCSA-N 2 1 320.527 4.283 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@@H](C)[C@@H](C[NH3+])CC3)cc2)o1 ZINC001205636822 1049519216 /nfs/dbraw/zinc/51/92/16/1049519216.db2.gz FGXZCPCKYIIWDW-DNVCBOLYSA-N 2 1 312.457 4.062 20 0 DIADMP CC[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001205677450 1049531133 /nfs/dbraw/zinc/53/11/33/1049531133.db2.gz CPAVCSWIVJZFTL-UXHICEINSA-N 2 1 302.506 4.396 20 0 DIADMP C[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccccc2)CC1)[C@@H]1CC1(C)C ZINC000487278375 1049542639 /nfs/dbraw/zinc/54/26/39/1049542639.db2.gz SYYGMSCEKVLEAY-BXWFABGCSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1C[N@H+](CCC[NH+]2CCCCC2)CCc2ccc(Cl)cc21 ZINC001195767327 1049565122 /nfs/dbraw/zinc/56/51/22/1049565122.db2.gz JZAFEXMJQGFCNS-MRXNPFEDSA-N 2 1 320.908 4.178 20 0 DIADMP C[C@@H]1C[N@@H+](CCC[NH+]2CCCCC2)CCc2ccc(Cl)cc21 ZINC001195767327 1049565132 /nfs/dbraw/zinc/56/51/32/1049565132.db2.gz JZAFEXMJQGFCNS-MRXNPFEDSA-N 2 1 320.908 4.178 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@H](C)CC[C@@H]1C[NH3+] ZINC001205826928 1049575988 /nfs/dbraw/zinc/57/59/88/1049575988.db2.gz DMXNXRIUUBAYRI-VQIMIIECSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+]1C[C@H](C)CC[C@@H]1C[NH3+] ZINC001205826928 1049576000 /nfs/dbraw/zinc/57/60/00/1049576000.db2.gz DMXNXRIUUBAYRI-VQIMIIECSA-N 2 1 308.469 4.221 20 0 DIADMP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1ccc(Oc2ccccc2)cc1 ZINC001205901244 1049594955 /nfs/dbraw/zinc/59/49/55/1049594955.db2.gz BZQKNARNCRBSCU-SJLPKXTDSA-N 2 1 310.441 4.038 20 0 DIADMP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001205904483 1049596137 /nfs/dbraw/zinc/59/61/37/1049596137.db2.gz VOYXVNLQQJFNKW-LSDHHAIUSA-N 2 1 313.489 4.025 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001205903706 1049597855 /nfs/dbraw/zinc/59/78/55/1049597855.db2.gz QVJDAQGJEQHSEI-KBPBESRZSA-N 2 1 318.848 4.159 20 0 DIADMP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1sccc1Oc1ccccc1 ZINC001205912844 1049599975 /nfs/dbraw/zinc/59/99/75/1049599975.db2.gz DBAARMHMWPAIJM-GJZGRUSLSA-N 2 1 316.470 4.100 20 0 DIADMP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cc(-c2ccsc2)cs1 ZINC001205915141 1049601394 /nfs/dbraw/zinc/60/13/94/1049601394.db2.gz OONCVWORQORHMX-OLZOCXBDSA-N 2 1 306.500 4.036 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1CCC[C@@H](C[NH3+])[C@@H]1C ZINC001205915873 1049601831 /nfs/dbraw/zinc/60/18/31/1049601831.db2.gz RFJIBKFTSGMXHP-ROUUACIJSA-N 2 1 308.469 4.221 20 0 DIADMP CC(C)C[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccccc1 ZINC001205925689 1049605257 /nfs/dbraw/zinc/60/52/57/1049605257.db2.gz YFPVIBRFNNTWDN-UHFFFAOYSA-N 2 1 314.498 4.052 20 0 DIADMP Cc1ccccc1N(C)c1ccc(C[N@@H+]2CCCC[C@H]([NH3+])C2)cc1 ZINC001205937589 1049606629 /nfs/dbraw/zinc/60/66/29/1049606629.db2.gz ASYATYMWLDQBLZ-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP Cc1ccccc1N(C)c1ccc(C[N@H+]2CCCC[C@H]([NH3+])C2)cc1 ZINC001205937589 1049606636 /nfs/dbraw/zinc/60/66/36/1049606636.db2.gz ASYATYMWLDQBLZ-IBGZPJMESA-N 2 1 323.484 4.076 20 0 DIADMP [NH3+][C@H]1CCCC[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001205933097 1049606729 /nfs/dbraw/zinc/60/67/29/1049606729.db2.gz YDAWSMZCGKRHMG-KRWDZBQOSA-N 2 1 319.452 4.148 20 0 DIADMP [NH3+][C@H]1CCCC[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001205933097 1049606734 /nfs/dbraw/zinc/60/67/34/1049606734.db2.gz YDAWSMZCGKRHMG-KRWDZBQOSA-N 2 1 319.452 4.148 20 0 DIADMP CC(C)C[N@@H+](Cc1ccccc1)C1CC[NH+](CC2CC2)CC1 ZINC001168374303 1049607561 /nfs/dbraw/zinc/60/75/61/1049607561.db2.gz YOIWYBJWYKEOFI-UHFFFAOYSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1cccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CCCC2)c1 ZINC000774169041 1049617355 /nfs/dbraw/zinc/61/73/55/1049617355.db2.gz MRFCDQSPFCLWJB-IHWFROFDSA-N 2 1 312.501 4.022 20 0 DIADMP C[C@H]1C[N@@H+](CC(c2ccccc2)c2ccccc2)CCC[C@@H]1C[NH3+] ZINC001205981908 1049619476 /nfs/dbraw/zinc/61/94/76/1049619476.db2.gz IYXQNPPANKNSCH-GHTZIAJQSA-N 2 1 322.496 4.125 20 0 DIADMP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)C(C)(C)C ZINC000774188853 1049619735 /nfs/dbraw/zinc/61/97/35/1049619735.db2.gz JVSDLMAVLULZER-FRYIKTPZSA-N 2 1 314.517 4.454 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3)cc2)CCC[C@H]1C[NH3+] ZINC001205996177 1049622531 /nfs/dbraw/zinc/62/25/31/1049622531.db2.gz VSWUNPHHODJHTB-UTKZUKDTSA-N 2 1 308.469 4.160 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc3c4ccccc4oc32)CCC[C@H]1C[NH3+] ZINC001206003603 1049625937 /nfs/dbraw/zinc/62/59/37/1049625937.db2.gz KDNHJNPGQSTTHB-HOTGVXAUSA-N 2 1 322.452 4.393 20 0 DIADMP C[C@H]1C[N@@H+](Cc2cccc(-c3ccsc3)c2)CCC[C@H]1C[NH3+] ZINC001206004985 1049626637 /nfs/dbraw/zinc/62/66/37/1049626637.db2.gz WFVAUBQSKDRPKF-YJBOKZPZSA-N 2 1 314.498 4.222 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3cccs3)cc2)CCC[C@@H]1C[NH3+] ZINC001206012018 1049629312 /nfs/dbraw/zinc/62/93/12/1049629312.db2.gz IBFOVBKGWQWZIL-MAUKXSAKSA-N 2 1 314.498 4.222 20 0 DIADMP CC1(C)CCC[C@@H]1[C@H]1CC[N@@H+](Cc2cc3c(s2)CC[NH2+]C3)C1 ZINC000864049271 1049638426 /nfs/dbraw/zinc/63/84/26/1049638426.db2.gz CYXXXGSHERKCEL-WMLDXEAASA-N 2 1 318.530 4.042 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001206056127 1049642307 /nfs/dbraw/zinc/64/23/07/1049642307.db2.gz PIACNGRPOBCMED-HOJAQTOUSA-N 2 1 302.506 4.108 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC001206056127 1049642315 /nfs/dbraw/zinc/64/23/15/1049642315.db2.gz PIACNGRPOBCMED-HOJAQTOUSA-N 2 1 302.506 4.108 20 0 DIADMP C[C@@H]1CCC[N@@H+](CCCC[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)C1 ZINC000488436760 1049653169 /nfs/dbraw/zinc/65/31/69/1049653169.db2.gz VHQFQPBBDUYBSE-ZACQAIPSSA-N 2 1 312.567 4.008 20 0 DIADMP CCCC[N@@H+](C[C@@H](OC)C1CCC1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545104 1049669251 /nfs/dbraw/zinc/66/92/51/1049669251.db2.gz KVGKZIYTJKJYEY-GOSISDBHSA-N 2 1 324.553 4.213 20 0 DIADMP C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000488584477 1049680852 /nfs/dbraw/zinc/68/08/52/1049680852.db2.gz RNGLALDLDGCGFS-UIBIWLFHSA-N 2 1 324.578 4.149 20 0 DIADMP C[N@H+]1C[C@@H](C[NH2+]C2CCC(=C3CCC3)CC2)[C@H](c2ccccc2)C1 ZINC001182545056 1049685609 /nfs/dbraw/zinc/68/56/09/1049685609.db2.gz UJGQDPQJKJEWDW-IRLDBZIGSA-N 2 1 324.512 4.345 20 0 DIADMP C[C@H]1C[NH2+]CCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001206257882 1049691806 /nfs/dbraw/zinc/69/18/06/1049691806.db2.gz LLJLDAWOAUKWPZ-INIZCTEOSA-N 2 1 319.452 4.019 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC[N@@H+]1C ZINC001206263637 1049693224 /nfs/dbraw/zinc/69/32/24/1049693224.db2.gz POZCCAVAMNUPNM-IWKCEXAMSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H](c3cccc(Cl)c3)C2)CC[N@H+]1C ZINC001206263637 1049693228 /nfs/dbraw/zinc/69/32/28/1049693228.db2.gz POZCCAVAMNUPNM-IWKCEXAMSA-N 2 1 320.908 4.439 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)sc2Cl)CC1 ZINC001206311535 1049708043 /nfs/dbraw/zinc/70/80/43/1049708043.db2.gz QLXGSCMTEPUPEK-CYBMUJFWSA-N 2 1 307.290 4.006 20 0 DIADMP CC[N@@H+](CCC[NH2+]C[C@@H](OC)C1CCCCC1)C1CCCCC1 ZINC001182743332 1049709601 /nfs/dbraw/zinc/70/96/01/1049709601.db2.gz OXQXBTWORWOPIE-HXUWFJFHSA-N 2 1 324.553 4.216 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)c(Cl)cc1Cl ZINC001206324780 1049711174 /nfs/dbraw/zinc/71/11/74/1049711174.db2.gz DIJYQLMNIAQWLL-INIZCTEOSA-N 2 1 315.288 4.253 20 0 DIADMP Cc1cc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)cc(C)c1OC(C)C ZINC001206326206 1049713818 /nfs/dbraw/zinc/71/38/18/1049713818.db2.gz LHEXIHWFWRAAPV-HXUWFJFHSA-N 2 1 318.505 4.042 20 0 DIADMP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206360749 1049720876 /nfs/dbraw/zinc/72/08/76/1049720876.db2.gz AMZFPZQFPVMHOK-FQEVSTJZSA-N 2 1 312.432 4.007 20 0 DIADMP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2ccccc2-c2ccccc2)C1 ZINC001206360750 1049721152 /nfs/dbraw/zinc/72/11/52/1049721152.db2.gz AMZFPZQFPVMHOK-HXUWFJFHSA-N 2 1 312.432 4.007 20 0 DIADMP C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001197284385 1049737590 /nfs/dbraw/zinc/73/75/90/1049737590.db2.gz ILYVWLLPEZFWCW-HNNXBMFYSA-N 2 1 310.432 4.224 20 0 DIADMP Cc1sc2ccccc2c1C[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206565563 1049756474 /nfs/dbraw/zinc/75/64/74/1049756474.db2.gz ULFAOWJWJCYZBH-SFHVURJKSA-N 2 1 302.487 4.161 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(Cc3ccccc3)cc2)C1 ZINC001206566301 1049756844 /nfs/dbraw/zinc/75/68/44/1049756844.db2.gz ZHDJBDRSAWGIBE-QFIPXVFZSA-N 2 1 322.496 4.228 20 0 DIADMP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2ccc(-c3cccs3)cc2)C1 ZINC001206563728 1049757138 /nfs/dbraw/zinc/75/71/38/1049757138.db2.gz IBJNSQYCEVZLRG-IBGZPJMESA-N 2 1 314.498 4.366 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206575336 1049761036 /nfs/dbraw/zinc/76/10/36/1049761036.db2.gz WBHQOGWQJYEGGP-INIZCTEOSA-N 2 1 315.288 4.253 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCCC[C@@](C)(C[NH3+])C1 ZINC001206575336 1049761043 /nfs/dbraw/zinc/76/10/43/1049761043.db2.gz WBHQOGWQJYEGGP-INIZCTEOSA-N 2 1 315.288 4.253 20 0 DIADMP CCCCOc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001206582061 1049762057 /nfs/dbraw/zinc/76/20/57/1049762057.db2.gz LLLXRHPXXOQCMY-IBGZPJMESA-N 2 1 318.505 4.218 20 0 DIADMP CC(C)[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CCC[NH2+]CC1 ZINC001206581489 1049762344 /nfs/dbraw/zinc/76/23/44/1049762344.db2.gz JLOYCAUAZBZKJW-INIZCTEOSA-N 2 1 314.395 4.058 20 0 DIADMP CC(C)c1ccc(CC[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001206582968 1049762537 /nfs/dbraw/zinc/76/25/37/1049762537.db2.gz QYTLHQSGWPKALX-FQEVSTJZSA-N 2 1 302.506 4.205 20 0 DIADMP CCn1ccc2c1cccc2C[N@@H+](C(C)C)[C@H]1CCC[NH2+]CC1 ZINC001206589550 1049763553 /nfs/dbraw/zinc/76/35/53/1049763553.db2.gz HZJJENRVGMOLQI-SFHVURJKSA-N 2 1 313.489 4.014 20 0 DIADMP CC(C)[N@@H+](Cc1ccc(-c2cccnc2)cc1)[C@H]1CCC[NH2+]CC1 ZINC001206591823 1049764034 /nfs/dbraw/zinc/76/40/34/1049764034.db2.gz WLWXZPANLYTTEN-NRFANRHFSA-N 2 1 323.484 4.101 20 0 DIADMP CCOc1ccc(C[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c(Cl)c1 ZINC001206597404 1049765362 /nfs/dbraw/zinc/76/53/62/1049765362.db2.gz CBTNGBKIRGZOGV-INIZCTEOSA-N 2 1 324.896 4.091 20 0 DIADMP CCOc1ccc(C[N@@H+](C(C)C)[C@H]2CCC[NH2+]CC2)c(Cl)c1 ZINC001206597404 1049765377 /nfs/dbraw/zinc/76/53/77/1049765377.db2.gz CBTNGBKIRGZOGV-INIZCTEOSA-N 2 1 324.896 4.091 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1Cl ZINC001206606098 1049768879 /nfs/dbraw/zinc/76/88/79/1049768879.db2.gz DBNJCYGTKPTMSM-MRXNPFEDSA-N 2 1 312.860 4.140 20 0 DIADMP Cc1cc(F)cc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)c1Cl ZINC001206606098 1049768884 /nfs/dbraw/zinc/76/88/84/1049768884.db2.gz DBNJCYGTKPTMSM-MRXNPFEDSA-N 2 1 312.860 4.140 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC001206622573 1049772459 /nfs/dbraw/zinc/77/24/59/1049772459.db2.gz GBYAPQDQTTWYPZ-CQSZACIVSA-N 2 1 318.848 4.161 20 0 DIADMP [NH3+]C[C@H]1CCCC[N@@H+](Cc2cccc3c4ccccc4oc32)C1 ZINC001206622798 1049772582 /nfs/dbraw/zinc/77/25/82/1049772582.db2.gz HBSNVETVPISYKR-OAHLLOKOSA-N 2 1 308.425 4.147 20 0 DIADMP C1CCC2(C1)CCCC[C@@H]2[NH2+][C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001206715754 1049783276 /nfs/dbraw/zinc/78/32/76/1049783276.db2.gz WWIKCATXIPGCDV-HKUYNNGSSA-N 2 1 304.522 4.486 20 0 DIADMP C1CCC2(C1)CCCC[C@@H]2[NH2+][C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001206715754 1049783284 /nfs/dbraw/zinc/78/32/84/1049783284.db2.gz WWIKCATXIPGCDV-HKUYNNGSSA-N 2 1 304.522 4.486 20 0 DIADMP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1ccc(-c2ccccc2Cl)o1 ZINC001206767812 1049795346 /nfs/dbraw/zinc/79/53/46/1049795346.db2.gz FLLGDWCKABZBCR-KBPBESRZSA-N 2 1 318.848 4.159 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3C[C@@H](C[NH3+])CC[C@H]3C)cc2)cc1 ZINC001206769670 1049795486 /nfs/dbraw/zinc/79/54/86/1049795486.db2.gz PEIRKWYGUANVRK-IEBWSBKVSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccc([C@H]2C[C@@H](C)[N@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000490046287 1049796757 /nfs/dbraw/zinc/79/67/57/1049796757.db2.gz UJCMTNDHCQOVAY-QUCCMNQESA-N 2 1 300.490 4.049 20 0 DIADMP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1ccccc1Oc1ccccc1 ZINC001206769709 1049796902 /nfs/dbraw/zinc/79/69/02/1049796902.db2.gz POBNLZHIHNDXRW-DLBZAZTESA-N 2 1 310.441 4.038 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@@H](C[NH3+])CC[C@@H]1C ZINC001206772213 1049797307 /nfs/dbraw/zinc/79/73/07/1049797307.db2.gz ZHAXKSCAZVASRG-ZWKOTPCHSA-N 2 1 308.469 4.221 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)[N@H+](CC[C@@H]3CCCC[NH+]3C)C2)cc1 ZINC000490105579 1049798972 /nfs/dbraw/zinc/79/89/72/1049798972.db2.gz XBPWEQSPNAXYPY-RLLQIKCJSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)[NH+](CC[C@@H]3CCCC[N@@H+]3C)C2)cc1 ZINC000490105579 1049798980 /nfs/dbraw/zinc/79/89/80/1049798980.db2.gz XBPWEQSPNAXYPY-RLLQIKCJSA-N 2 1 300.490 4.047 20 0 DIADMP Cc1ccc([C@@H]2C[C@@H](C)[NH+](CC[C@@H]3CCCC[N@H+]3C)C2)cc1 ZINC000490105579 1049798985 /nfs/dbraw/zinc/79/89/85/1049798985.db2.gz XBPWEQSPNAXYPY-RLLQIKCJSA-N 2 1 300.490 4.047 20 0 DIADMP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC001206799789 1049802540 /nfs/dbraw/zinc/80/25/40/1049802540.db2.gz GBFYBYJYGLAZEE-CWJKEVGVSA-N 2 1 314.517 4.232 20 0 DIADMP CC(C)[C@H](CSc1ccccc1)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000490145562 1049802777 /nfs/dbraw/zinc/80/27/77/1049802777.db2.gz VFVVWEQAKVMYSV-LNLFQRSKSA-N 2 1 318.530 4.020 20 0 DIADMP CC(C)[C@H](CSc1ccccc1)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000490145560 1049803319 /nfs/dbraw/zinc/80/33/19/1049803319.db2.gz VFVVWEQAKVMYSV-AOIWGVFYSA-N 2 1 318.530 4.020 20 0 DIADMP Cc1cc(C[N@@H+]2C[C@H](C[NH3+])CC[C@H]2C)ccc1Oc1ccccc1 ZINC001206806214 1049804587 /nfs/dbraw/zinc/80/45/87/1049804587.db2.gz FZLPXXKZQJRKDS-MJGOQNOKSA-N 2 1 324.468 4.347 20 0 DIADMP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc(Cl)c1 ZINC001206828369 1049808761 /nfs/dbraw/zinc/80/87/61/1049808761.db2.gz WLJRMDBBCJCZEI-WBVHZDCISA-N 2 1 320.908 4.155 20 0 DIADMP C[N@@H+]1CC[C@@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174676 1049851848 /nfs/dbraw/zinc/85/18/48/1049851848.db2.gz NITZUYFURQVNGR-MOPGFXCFSA-N 2 1 304.522 4.153 20 0 DIADMP C[N@H+]1CC[C@@H]2C[NH+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174676 1049851877 /nfs/dbraw/zinc/85/18/77/1049851877.db2.gz NITZUYFURQVNGR-MOPGFXCFSA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@H+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174676 1049851908 /nfs/dbraw/zinc/85/19/08/1049851908.db2.gz NITZUYFURQVNGR-MOPGFXCFSA-N 2 1 304.522 4.153 20 0 DIADMP C[NH+]1CC[C@@H]2C[N@@H+](CC3CCC4(CCCCC4)CC3)CC[C@@H]21 ZINC001207174676 1049851928 /nfs/dbraw/zinc/85/19/28/1049851928.db2.gz NITZUYFURQVNGR-MOPGFXCFSA-N 2 1 304.522 4.153 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)C[C@@H]1C[C@@H]1c1ccc(Cl)cc1 ZINC001207189373 1049855803 /nfs/dbraw/zinc/85/58/03/1049855803.db2.gz AVMYOBRBDLFTHC-FUHWJXTLSA-N 2 1 308.897 4.107 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001207252301 1049868825 /nfs/dbraw/zinc/86/88/25/1049868825.db2.gz DMUDEOHRFSRGCS-AZUAARDMSA-N 2 1 306.538 4.279 20 0 DIADMP C[NH+](C)CC(C)(C)C[N@@H+](C)C(c1ccccc1)c1ccccc1 ZINC001207275796 1049873132 /nfs/dbraw/zinc/87/31/32/1049873132.db2.gz PPUUINSAMFJPFJ-UHFFFAOYSA-N 2 1 310.485 4.296 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207285039 1049874199 /nfs/dbraw/zinc/87/41/99/1049874199.db2.gz YHRMJTPAJNEVQO-HDICACEKSA-N 2 1 300.490 4.162 20 0 DIADMP CC(C)[N@@H+](CC1CC1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207290757 1049875516 /nfs/dbraw/zinc/87/55/16/1049875516.db2.gz FPTPVSKSZLIBPI-UHFFFAOYSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCCC[N@@H+](CC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC001207288025 1049876723 /nfs/dbraw/zinc/87/67/23/1049876723.db2.gz ZEDCWSUFWYEHMW-GOSISDBHSA-N 2 1 300.490 4.021 20 0 DIADMP CC1([NH+]2CCC2)CC[NH+](Cc2cccc(CC3CCC3)c2)CC1 ZINC001207294720 1049877354 /nfs/dbraw/zinc/87/73/54/1049877354.db2.gz UKXHQFWVJBXNNK-UHFFFAOYSA-N 2 1 312.501 4.089 20 0 DIADMP CC(C)[C@H]1CCC[N@H+]1CC1CC[NH+](Cc2ccccc2)CC1 ZINC001207294816 1049878066 /nfs/dbraw/zinc/87/80/66/1049878066.db2.gz UWYQLFAVBRHJCM-HXUWFJFHSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1ccc(CC[N@@H+](C)CCCC[NH+]2CCCCC2)cc1C ZINC001207302922 1049878860 /nfs/dbraw/zinc/87/88/60/1049878860.db2.gz VOOOYLZPQIVPFU-UHFFFAOYSA-N 2 1 302.506 4.044 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2CC2CC[NH+](C)CC2)cc1C ZINC001207399848 1049887556 /nfs/dbraw/zinc/88/75/56/1049887556.db2.gz WLCLOEBMHXWWIZ-FQEVSTJZSA-N 2 1 300.490 4.172 20 0 DIADMP Cc1cccc(CC[NH+]2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC001207537583 1049908135 /nfs/dbraw/zinc/90/81/35/1049908135.db2.gz GRCRIYZRAXVLFB-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP Cc1cccc(CC[NH+]2CCC([N@@H+](C)Cc3ccccc3)CC2)c1 ZINC001207537583 1049908141 /nfs/dbraw/zinc/90/81/41/1049908141.db2.gz GRCRIYZRAXVLFB-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP C[C@H](CC1CCCCC1)C[N@H+]1C[C@@H]2CC[C@@H]([NH+](C)C)C[C@H]2C1 ZINC001207783033 1049938990 /nfs/dbraw/zinc/93/89/90/1049938990.db2.gz AGDMHTBORVDEPF-BTHPGYMESA-N 2 1 306.538 4.255 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1CC1(c2ccccc2)CC1 ZINC001207839683 1049942939 /nfs/dbraw/zinc/94/29/39/1049942939.db2.gz TWQWWBOTPROXFP-VQTJNVASSA-N 2 1 312.501 4.057 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1CC1(c2ccccc2)CC1 ZINC001207839683 1049942944 /nfs/dbraw/zinc/94/29/44/1049942944.db2.gz TWQWWBOTPROXFP-VQTJNVASSA-N 2 1 312.501 4.057 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1CC1(c2ccccc2)CC1 ZINC001207839683 1049942950 /nfs/dbraw/zinc/94/29/50/1049942950.db2.gz TWQWWBOTPROXFP-VQTJNVASSA-N 2 1 312.501 4.057 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168380743 1049945203 /nfs/dbraw/zinc/94/52/03/1049945203.db2.gz SZOSZRRUFDKQQF-HXUWFJFHSA-N 2 1 316.464 4.227 20 0 DIADMP Fc1ccccc1[C@H]1CCCC[N@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168380743 1049945209 /nfs/dbraw/zinc/94/52/09/1049945209.db2.gz SZOSZRRUFDKQQF-HXUWFJFHSA-N 2 1 316.464 4.227 20 0 DIADMP C[C@H](C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1)c1ccccc1 ZINC001207904040 1049952631 /nfs/dbraw/zinc/95/26/31/1049952631.db2.gz URCJDKNIMUQHHV-GOSISDBHSA-N 2 1 312.501 4.131 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@H+](C)C2CC[NH+](C)CC2)cc1 ZINC001207932995 1049957897 /nfs/dbraw/zinc/95/78/97/1049957897.db2.gz TZVWATMEYAYQAV-KRWDZBQOSA-N 2 1 302.506 4.015 20 0 DIADMP CC(C)c1ccc(C[C@H](C)C[N@@H+](C)C2CC[NH+](C)CC2)cc1 ZINC001207932995 1049957900 /nfs/dbraw/zinc/95/79/00/1049957900.db2.gz TZVWATMEYAYQAV-KRWDZBQOSA-N 2 1 302.506 4.015 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)CC1 ZINC001207937130 1049959159 /nfs/dbraw/zinc/95/91/59/1049959159.db2.gz HAGZEQUXYYIVGY-SFTDATJTSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937130 1049959161 /nfs/dbraw/zinc/95/91/61/1049959161.db2.gz HAGZEQUXYYIVGY-SFTDATJTSA-N 2 1 316.533 4.487 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)CC1 ZINC001207937130 1049959165 /nfs/dbraw/zinc/95/91/65/1049959165.db2.gz HAGZEQUXYYIVGY-SFTDATJTSA-N 2 1 316.533 4.487 20 0 DIADMP CC[N@@H+]1C[C@@H]2C[NH+](C[C@@H]3CC=C(CCC=C(C)C)CC3)C[C@@H]2C1 ZINC001207936622 1049959759 /nfs/dbraw/zinc/95/97/59/1049959759.db2.gz AWJVDAMMIZCERR-NJYVYQBISA-N 2 1 316.533 4.343 20 0 DIADMP CC[NH+]1C[C@@H]2C[N@@H+](C[C@@H]3CC=C(CCC=C(C)C)CC3)C[C@@H]2C1 ZINC001207936622 1049959767 /nfs/dbraw/zinc/95/97/67/1049959767.db2.gz AWJVDAMMIZCERR-NJYVYQBISA-N 2 1 316.533 4.343 20 0 DIADMP CC[NH+]1C[C@@H]2C[N@H+](C[C@@H]3CC=C(CCC=C(C)C)CC3)C[C@@H]2C1 ZINC001207936622 1049959778 /nfs/dbraw/zinc/95/97/78/1049959778.db2.gz AWJVDAMMIZCERR-NJYVYQBISA-N 2 1 316.533 4.343 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCC[N@@H+]1CCc2ccccc2C1 ZINC000588177498 1049973015 /nfs/dbraw/zinc/97/30/15/1049973015.db2.gz YWIYQZXOWFQDNB-MNDPQUGUSA-N 2 1 320.480 4.128 20 0 DIADMP C/C(=C/c1ccccc1)C[NH2+]CCC[N@H+]1CCc2ccccc2C1 ZINC000588177498 1049973017 /nfs/dbraw/zinc/97/30/17/1049973017.db2.gz YWIYQZXOWFQDNB-MNDPQUGUSA-N 2 1 320.480 4.128 20 0 DIADMP C[N@@H+](Cc1cccc(Cl)c1Cl)CC1(C)CC[NH+](C)CC1 ZINC001208114598 1049974364 /nfs/dbraw/zinc/97/43/64/1049974364.db2.gz ZLYUNXZNFQHQTA-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C[N@H+](Cc1c(Cl)cccc1Cl)CC1(C)CC[NH+](C)CC1 ZINC001208111043 1049974477 /nfs/dbraw/zinc/97/44/77/1049974477.db2.gz AUCFPTSQGXWQHY-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP C[N@@H+](Cc1c(Cl)cccc1Cl)CC1(C)CC[NH+](C)CC1 ZINC001208111043 1049974487 /nfs/dbraw/zinc/97/44/87/1049974487.db2.gz AUCFPTSQGXWQHY-UHFFFAOYSA-N 2 1 315.288 4.157 20 0 DIADMP CC/C=C\CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208135339 1049976419 /nfs/dbraw/zinc/97/64/19/1049976419.db2.gz DAAHWACILXETNZ-BBIZLLLXSA-N 2 1 300.490 4.187 20 0 DIADMP CC/C=C\CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208135339 1049976422 /nfs/dbraw/zinc/97/64/22/1049976422.db2.gz DAAHWACILXETNZ-BBIZLLLXSA-N 2 1 300.490 4.187 20 0 DIADMP CC/C=C\CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208135339 1049976427 /nfs/dbraw/zinc/97/64/27/1049976427.db2.gz DAAHWACILXETNZ-BBIZLLLXSA-N 2 1 300.490 4.187 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)CC1 ZINC001208166237 1049980368 /nfs/dbraw/zinc/98/03/68/1049980368.db2.gz AHPSLGHIXKZGDG-UYAOXDASSA-N 2 1 316.533 4.319 20 0 DIADMP COC(C)(C)CCC[C@@H](C)CC[NH+]1CCC([N@@H+](C)C2CC2)CC1 ZINC001208219594 1049987733 /nfs/dbraw/zinc/98/77/33/1049987733.db2.gz PWTUQHSQKUOTMQ-QGZVFWFLSA-N 2 1 324.553 4.167 20 0 DIADMP Clc1cccc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1 ZINC000045195680 1049993470 /nfs/dbraw/zinc/99/34/70/1049993470.db2.gz BBBCIOPVPDZVFS-UHFFFAOYSA-N 2 1 320.908 4.474 20 0 DIADMP C[C@H](C[NH+]1CCC([NH+]2CCC2)CC1)c1cccc2ccccc21 ZINC001208710407 1050005744 /nfs/dbraw/zinc/00/57/44/1050005744.db2.gz HNRVPRUCYRUWEP-QGZVFWFLSA-N 2 1 308.469 4.113 20 0 DIADMP Clc1ccc(CC[N@H+]2CCCC[C@@H]2CC[NH+]2CCCC2)cc1 ZINC001208741264 1050007944 /nfs/dbraw/zinc/00/79/44/1050007944.db2.gz VOJJQFKUFMCIMR-LJQANCHMSA-N 2 1 320.908 4.223 20 0 DIADMP Clc1ccc(CC[N@H+]2CCCC[C@H]2CC[NH+]2CCCC2)cc1 ZINC001208741262 1050008613 /nfs/dbraw/zinc/00/86/13/1050008613.db2.gz VOJJQFKUFMCIMR-IBGZPJMESA-N 2 1 320.908 4.223 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929849 1050023914 /nfs/dbraw/zinc/02/39/14/1050023914.db2.gz VLKNGMQETVLFFG-QFIPXVFZSA-N 2 1 322.496 4.421 20 0 DIADMP CC[N@H+](Cc1ccccc1)C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208929849 1050023921 /nfs/dbraw/zinc/02/39/21/1050023921.db2.gz VLKNGMQETVLFFG-QFIPXVFZSA-N 2 1 322.496 4.421 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208929849 1050023926 /nfs/dbraw/zinc/02/39/26/1050023926.db2.gz VLKNGMQETVLFFG-QFIPXVFZSA-N 2 1 322.496 4.421 20 0 DIADMP CC[NH+](Cc1ccccc1)C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208929849 1050023930 /nfs/dbraw/zinc/02/39/30/1050023930.db2.gz VLKNGMQETVLFFG-QFIPXVFZSA-N 2 1 322.496 4.421 20 0 DIADMP Clc1cccc([C@@H]2CC[N@@H+](C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC001168387730 1050023980 /nfs/dbraw/zinc/02/39/80/1050023980.db2.gz RPYGTSIYOFZCHC-QGZVFWFLSA-N 2 1 318.892 4.004 20 0 DIADMP Clc1cccc([C@@H]2CC[N@H+](C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC001168387730 1050023984 /nfs/dbraw/zinc/02/39/84/1050023984.db2.gz RPYGTSIYOFZCHC-QGZVFWFLSA-N 2 1 318.892 4.004 20 0 DIADMP C[C@]1(F)CCCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931769 1050024660 /nfs/dbraw/zinc/02/46/60/1050024660.db2.gz MIIAQHZZUPACCN-UXHICEINSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931769 1050024663 /nfs/dbraw/zinc/02/46/63/1050024663.db2.gz MIIAQHZZUPACCN-UXHICEINSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931769 1050024666 /nfs/dbraw/zinc/02/46/66/1050024666.db2.gz MIIAQHZZUPACCN-UXHICEINSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931771 1050025166 /nfs/dbraw/zinc/02/51/66/1050025166.db2.gz MIIAQHZZUPACCN-WOJBJXKFSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931771 1050025174 /nfs/dbraw/zinc/02/51/74/1050025174.db2.gz MIIAQHZZUPACCN-WOJBJXKFSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@]1(F)CCCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931771 1050025180 /nfs/dbraw/zinc/02/51/80/1050025180.db2.gz MIIAQHZZUPACCN-WOJBJXKFSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@@H]1CCCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935118 1050025322 /nfs/dbraw/zinc/02/53/22/1050025322.db2.gz IHOBOLGXQQBLNS-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccccc2)C1 ZINC001208935118 1050025325 /nfs/dbraw/zinc/02/53/25/1050025325.db2.gz IHOBOLGXQQBLNS-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001208935118 1050025329 /nfs/dbraw/zinc/02/53/29/1050025329.db2.gz IHOBOLGXQQBLNS-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@@H]1CCCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001208935118 1050025333 /nfs/dbraw/zinc/02/53/33/1050025333.db2.gz IHOBOLGXQQBLNS-UYAOXDASSA-N 2 1 300.490 4.163 20 0 DIADMP C[C@]1(F)CCCC[N@@H+](C[C@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208931768 1050025363 /nfs/dbraw/zinc/02/53/63/1050025363.db2.gz MIIAQHZZUPACCN-PMACEKPBSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCCC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208931768 1050025365 /nfs/dbraw/zinc/02/53/65/1050025365.db2.gz MIIAQHZZUPACCN-PMACEKPBSA-N 2 1 318.480 4.113 20 0 DIADMP C[C@]1(F)CCCC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208931768 1050025366 /nfs/dbraw/zinc/02/53/66/1050025366.db2.gz MIIAQHZZUPACCN-PMACEKPBSA-N 2 1 318.480 4.113 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCC34CCCCC4)C2)cc1 ZINC001208934287 1050025582 /nfs/dbraw/zinc/02/55/82/1050025582.db2.gz YOEVTNJUEWYOTL-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC34CCCCC4)C2)cc1 ZINC001208934287 1050025588 /nfs/dbraw/zinc/02/55/88/1050025588.db2.gz YOEVTNJUEWYOTL-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCC34CCCCC4)C2)cc1 ZINC001208934287 1050025592 /nfs/dbraw/zinc/02/55/92/1050025592.db2.gz YOEVTNJUEWYOTL-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCC34CCCCC4)C2)cc1 ZINC001208934287 1050025600 /nfs/dbraw/zinc/02/56/00/1050025600.db2.gz YOEVTNJUEWYOTL-FQEVSTJZSA-N 2 1 312.501 4.307 20 0 DIADMP CC[C@H]1CCC[N@@H+](C[C@@H]2CCC[NH+](Cc3ccccc3)C2)C1 ZINC001208938321 1050026616 /nfs/dbraw/zinc/02/66/16/1050026616.db2.gz ASZZZTXZUVEMMF-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H]1CCC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)C1 ZINC001208938321 1050026619 /nfs/dbraw/zinc/02/66/19/1050026619.db2.gz ASZZZTXZUVEMMF-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP CC[C@H]1CCC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)C1 ZINC001208938321 1050026624 /nfs/dbraw/zinc/02/66/24/1050026624.db2.gz ASZZZTXZUVEMMF-ICSRJNTNSA-N 2 1 300.490 4.021 20 0 DIADMP CC(C)C[NH+](CC(C)C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208945810 1050027123 /nfs/dbraw/zinc/02/71/23/1050027123.db2.gz DNZZUAPHSNQCGO-HXUWFJFHSA-N 2 1 302.506 4.123 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC[C@H]4CCC[C@H]43)C2)cc1 ZINC001208939921 1050027851 /nfs/dbraw/zinc/02/78/51/1050027851.db2.gz LHPPAQALTNZKKE-PWRODBHTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCC[C@H]4CCC[C@H]43)C2)cc1 ZINC001208939921 1050027856 /nfs/dbraw/zinc/02/78/56/1050027856.db2.gz LHPPAQALTNZKKE-PWRODBHTSA-N 2 1 312.501 4.163 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCC[C@H]4CCC[C@H]43)C2)cc1 ZINC001208939921 1050027863 /nfs/dbraw/zinc/02/78/63/1050027863.db2.gz LHPPAQALTNZKKE-PWRODBHTSA-N 2 1 312.501 4.163 20 0 DIADMP CCC[N@H+](Cc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001208950531 1050029919 /nfs/dbraw/zinc/02/99/19/1050029919.db2.gz TZDXVYFKBFWEJG-JOCHJYFZSA-N 2 1 322.496 4.421 20 0 DIADMP CCC[NH+](Cc1ccccc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001208950531 1050029925 /nfs/dbraw/zinc/02/99/25/1050029925.db2.gz TZDXVYFKBFWEJG-JOCHJYFZSA-N 2 1 322.496 4.421 20 0 DIADMP CCC[NH+](Cc1ccccc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001208950531 1050029932 /nfs/dbraw/zinc/02/99/32/1050029932.db2.gz TZDXVYFKBFWEJG-JOCHJYFZSA-N 2 1 322.496 4.421 20 0 DIADMP Clc1cc2c(s1)CC[C@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000572891644 1050046124 /nfs/dbraw/zinc/04/61/24/1050046124.db2.gz LKSOCFQSVMTBKT-OAHLLOKOSA-N 2 1 324.921 4.385 20 0 DIADMP COc1ccc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c(Cl)c1 ZINC000589837063 1050060200 /nfs/dbraw/zinc/06/02/00/1050060200.db2.gz ZNYPYXWJGFLXFH-HNNXBMFYSA-N 2 1 324.896 4.093 20 0 DIADMP COc1cccc([C@@H]2CCCC[N@@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209449022 1050060583 /nfs/dbraw/zinc/06/05/83/1050060583.db2.gz PQUPQTWXMUITJN-FQEVSTJZSA-N 2 1 316.489 4.098 20 0 DIADMP COc1cccc([C@@H]2CCCC[N@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209449022 1050060584 /nfs/dbraw/zinc/06/05/84/1050060584.db2.gz PQUPQTWXMUITJN-FQEVSTJZSA-N 2 1 316.489 4.098 20 0 DIADMP COc1cccc([C@H]2CCCC[N@@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209449024 1050060620 /nfs/dbraw/zinc/06/06/20/1050060620.db2.gz PQUPQTWXMUITJN-HXUWFJFHSA-N 2 1 316.489 4.098 20 0 DIADMP COc1cccc([C@H]2CCCC[N@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209449024 1050060622 /nfs/dbraw/zinc/06/06/22/1050060622.db2.gz PQUPQTWXMUITJN-HXUWFJFHSA-N 2 1 316.489 4.098 20 0 DIADMP C[N@H+](CCC[NH+]1CCCCC1)Cc1cccc(C(F)(F)F)c1 ZINC001209448783 1050060791 /nfs/dbraw/zinc/06/07/91/1050060791.db2.gz HPNKARLWVJPNKZ-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCCC1)Cc1cccc(C(F)(F)F)c1 ZINC001209448783 1050060797 /nfs/dbraw/zinc/06/07/97/1050060797.db2.gz HPNKARLWVJPNKZ-UHFFFAOYSA-N 2 1 314.395 4.013 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209452665 1050061141 /nfs/dbraw/zinc/06/11/41/1050061141.db2.gz QNHLAWIOHBGOCW-SFHVURJKSA-N 2 1 306.881 4.353 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209452665 1050061142 /nfs/dbraw/zinc/06/11/42/1050061142.db2.gz QNHLAWIOHBGOCW-SFHVURJKSA-N 2 1 306.881 4.353 20 0 DIADMP Clc1cccc([C@H]2CCC[N@@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209452664 1050061618 /nfs/dbraw/zinc/06/16/18/1050061618.db2.gz QNHLAWIOHBGOCW-GOSISDBHSA-N 2 1 306.881 4.353 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2CCC[NH+]2CCCCC2)c1 ZINC001209452664 1050061625 /nfs/dbraw/zinc/06/16/25/1050061625.db2.gz QNHLAWIOHBGOCW-GOSISDBHSA-N 2 1 306.881 4.353 20 0 DIADMP CCOc1ccc([C@@H]2CCC[N@H+]2CCC[NH+]2CCCCC2)cc1 ZINC001209451041 1050061724 /nfs/dbraw/zinc/06/17/24/1050061724.db2.gz RNSDOTIPMVDILR-FQEVSTJZSA-N 2 1 316.489 4.098 20 0 DIADMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC000590011901 1050069961 /nfs/dbraw/zinc/06/99/61/1050069961.db2.gz XQOGQOLKDDNLTE-UHFFFAOYSA-N 2 1 308.469 4.031 20 0 DIADMP C(=C/C[N@H+]1CCC[C@@H]1C1CCC1)\C[NH+]1CCC[C@@H]1C1CCC1 ZINC000590598449 1050098874 /nfs/dbraw/zinc/09/88/74/1050098874.db2.gz BTUWNVJLHGUENQ-RHZFVVMASA-N 2 1 302.506 4.072 20 0 DIADMP C[NH+](C)CCCOc1ccc(Nc2ccc3c[nH+]ccc3c2)cc1 ZINC001210046939 1050129344 /nfs/dbraw/zinc/12/93/44/1050129344.db2.gz ACBAPTKBTYBBQW-UHFFFAOYSA-N 2 1 321.424 4.309 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+](Cc1ccccc1F)C(C)C ZINC000348082196 1050175363 /nfs/dbraw/zinc/17/53/63/1050175363.db2.gz PKSISFRBADHLGB-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+](Cc1ccccc1F)C(C)C ZINC000348082196 1050175368 /nfs/dbraw/zinc/17/53/68/1050175368.db2.gz PKSISFRBADHLGB-UHFFFAOYSA-N 2 1 303.425 4.021 20 0 DIADMP CCC[N@H+](CCCCn1cc[nH+]c1C)[C@@H]1CCc2ccccc21 ZINC000348070224 1050175497 /nfs/dbraw/zinc/17/54/97/1050175497.db2.gz IQOVLHVRVQSCLE-HXUWFJFHSA-N 2 1 311.473 4.371 20 0 DIADMP CCC[N@@H+](CCCCn1cc[nH+]c1C)[C@@H]1CCc2ccccc21 ZINC000348070224 1050175502 /nfs/dbraw/zinc/17/55/02/1050175502.db2.gz IQOVLHVRVQSCLE-HXUWFJFHSA-N 2 1 311.473 4.371 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+]C/C(C)=C/c2ccccc2)c1 ZINC000591709821 1050200956 /nfs/dbraw/zinc/20/09/56/1050200956.db2.gz YETBNGKVEWQNKA-QGOAFFKASA-N 2 1 308.469 4.331 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H](C[NH3+])C(C)(C)C ZINC001246347113 1050245839 /nfs/dbraw/zinc/24/58/39/1050245839.db2.gz SUKHNUYJXVVYQV-ABAIWWIYSA-N 2 1 317.304 4.278 20 0 DIADMP CC1(C[N@@H+](Cc2ccccc2)C2CCCCC2)CC[NH2+]CC1 ZINC001210580052 1050303555 /nfs/dbraw/zinc/30/35/55/1050303555.db2.gz DFZPHVRKTJQDGQ-UHFFFAOYSA-N 2 1 300.490 4.211 20 0 DIADMP C[C@@H](c1nc2ccccc2s1)[N@@H+](C)CCCCCCC[NH3+] ZINC000844220291 1050373539 /nfs/dbraw/zinc/37/35/39/1050373539.db2.gz CSPQYXBGGYDWOX-AWEZNQCLSA-N 2 1 305.491 4.198 20 0 DIADMP F[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC000574452389 1050477241 /nfs/dbraw/zinc/47/72/41/1050477241.db2.gz FVECYSWYZGVAJJ-WAPOTWQKSA-N 2 1 316.464 4.052 20 0 DIADMP CC(C)CCC[C@@H](C)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170057551 1050479168 /nfs/dbraw/zinc/47/91/68/1050479168.db2.gz LMVHSBXHKAYJRG-QUCCMNQESA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)CCC[C@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170057549 1050479557 /nfs/dbraw/zinc/47/95/57/1050479557.db2.gz LMVHSBXHKAYJRG-AZUAARDMSA-N 2 1 302.506 4.313 20 0 DIADMP CC(C)CCC[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001170057552 1050479873 /nfs/dbraw/zinc/47/98/73/1050479873.db2.gz LMVHSBXHKAYJRG-UYAOXDASSA-N 2 1 302.506 4.313 20 0 DIADMP CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)C1 ZINC000766223736 1050504450 /nfs/dbraw/zinc/50/44/50/1050504450.db2.gz LWIINITWCSIJBS-QANKJYHBSA-N 2 1 315.486 4.115 20 0 DIADMP CC[N@@H+](Cc1sccc1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000574726190 1050505798 /nfs/dbraw/zinc/50/57/98/1050505798.db2.gz LEIRSVWYXBLMHT-UHFFFAOYSA-N 2 1 302.487 4.140 20 0 DIADMP CN(CCC[N@@H+](C)CC1CCC2(CC2)CC1)Cc1ccco1 ZINC001170062344 1050506839 /nfs/dbraw/zinc/50/68/39/1050506839.db2.gz QOHHPQLNIDHQTG-UHFFFAOYSA-N 2 1 304.478 4.004 20 0 DIADMP Cc1ccc[nH+]c1N1CCC([NH2+][C@H](C)CCCC(C)C)CC1 ZINC001170068771 1050556184 /nfs/dbraw/zinc/55/61/84/1050556184.db2.gz JQWKQTXIHIOIOE-QGZVFWFLSA-N 2 1 303.494 4.163 20 0 DIADMP CCC[N@@H+](C)C[C@@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000574782667 1050568802 /nfs/dbraw/zinc/56/88/02/1050568802.db2.gz MFVUTWRDHNCAQK-IBGZPJMESA-N 2 1 322.496 4.440 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000574782667 1050568817 /nfs/dbraw/zinc/56/88/17/1050568817.db2.gz MFVUTWRDHNCAQK-IBGZPJMESA-N 2 1 322.496 4.440 20 0 DIADMP CCC[NH+](C)C[C@@H]1CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000574782667 1050568831 /nfs/dbraw/zinc/56/88/31/1050568831.db2.gz MFVUTWRDHNCAQK-IBGZPJMESA-N 2 1 322.496 4.440 20 0 DIADMP CC(C)CCC[C@H](C)[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170071453 1050581198 /nfs/dbraw/zinc/58/11/98/1050581198.db2.gz OODMBGXYPLZPEE-IHPCNDPISA-N 2 1 317.521 4.368 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H](C)CCCC(C)C)CC1 ZINC001170079375 1050628450 /nfs/dbraw/zinc/62/84/50/1050628450.db2.gz CXBXSHKMCNPOIS-MRXNPFEDSA-N 2 1 303.494 4.144 20 0 DIADMP CCc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000595624022 1050651655 /nfs/dbraw/zinc/65/16/55/1050651655.db2.gz BUCIVBLTPUAKAK-IYBDPMFKSA-N 2 1 308.535 4.158 20 0 DIADMP c1cc2cccc(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c2[nH]1 ZINC001144717013 1050667797 /nfs/dbraw/zinc/66/77/97/1050667797.db2.gz VGOBDYAGBFFFGS-IBGZPJMESA-N 2 1 311.473 4.008 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc2cc[nH]c21 ZINC001144718626 1050668484 /nfs/dbraw/zinc/66/84/84/1050668484.db2.gz UFRWLYAOHGYGDZ-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc2cc[nH]c21 ZINC001144718626 1050668489 /nfs/dbraw/zinc/66/84/89/1050668489.db2.gz UFRWLYAOHGYGDZ-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@H+]1Cc1cccc2cc[nH]c21 ZINC001144718626 1050668493 /nfs/dbraw/zinc/66/84/93/1050668493.db2.gz UFRWLYAOHGYGDZ-OALUTQOASA-N 2 1 311.473 4.007 20 0 DIADMP CCc1ccc([C@@H]2CCCCC[N@H+]2CC2CC[NH+](C)CC2)o1 ZINC000788480125 1050688068 /nfs/dbraw/zinc/68/80/68/1050688068.db2.gz IFTLOUQJMMLGJD-SFHVURJKSA-N 2 1 304.478 4.101 20 0 DIADMP Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[NH+](C)[C@H](C)C1 ZINC000180011770 1050716703 /nfs/dbraw/zinc/71/67/03/1050716703.db2.gz LNOKQYWPXXVYIL-KSZLIROESA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[NH+](C)[C@H](C)C1 ZINC000180011770 1050716714 /nfs/dbraw/zinc/71/67/14/1050716714.db2.gz LNOKQYWPXXVYIL-KSZLIROESA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000180011770 1050716728 /nfs/dbraw/zinc/71/67/28/1050716728.db2.gz LNOKQYWPXXVYIL-KSZLIROESA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cc([NH+]2CCCC[C@@H]2C)ccc1N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000180011770 1050716739 /nfs/dbraw/zinc/71/67/39/1050716739.db2.gz LNOKQYWPXXVYIL-KSZLIROESA-N 2 1 315.505 4.268 20 0 DIADMP Cc1cccc(N([C@@H](C)CCCC(C)C)C2CC[NH2+]CC2)[nH+]1 ZINC001170089768 1050755418 /nfs/dbraw/zinc/75/54/18/1050755418.db2.gz DMFKKFDFRVRJOR-KRWDZBQOSA-N 2 1 303.494 4.163 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](Cc2cccc(F)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170117314 1050876715 /nfs/dbraw/zinc/87/67/15/1050876715.db2.gz JXAQKQVZSXRWDJ-QZHFEQFPSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001170121079 1050887161 /nfs/dbraw/zinc/88/71/61/1050887161.db2.gz KZVKYUOQXOVFSP-AXUOBQJMSA-N 2 1 304.453 4.086 20 0 DIADMP Cc1ccccc1C[N@H+]([C@H]1CC[C@H](C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170121721 1050891157 /nfs/dbraw/zinc/89/11/57/1050891157.db2.gz NREREZHVEGJVGA-KNTRFNDTSA-N 2 1 300.490 4.256 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccoc2)cc1 ZINC000348099905 1050985387 /nfs/dbraw/zinc/98/53/87/1050985387.db2.gz XOJHTYCHTHHAPE-GJZGRUSLSA-N 2 1 309.413 4.056 20 0 DIADMP C[C@@H]1CC[C@H]([N@H+]2CCC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001170158330 1051071723 /nfs/dbraw/zinc/07/17/23/1051071723.db2.gz NTXAKTYCLNRZIN-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158330 1051071733 /nfs/dbraw/zinc/07/17/33/1051071733.db2.gz NTXAKTYCLNRZIN-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001170158330 1051071741 /nfs/dbraw/zinc/07/17/41/1051071741.db2.gz NTXAKTYCLNRZIN-HLAWJBBLSA-N 2 1 312.501 4.163 20 0 DIADMP CCC(CC)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccccc2Cl)C1 ZINC001170260299 1051166233 /nfs/dbraw/zinc/16/62/33/1051166233.db2.gz HQIGEGQWPGNZSO-ZBFHGGJFSA-N 2 1 308.897 4.124 20 0 DIADMP CCC(CC)[N@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccccc2Cl)C1 ZINC001170260299 1051166236 /nfs/dbraw/zinc/16/62/36/1051166236.db2.gz HQIGEGQWPGNZSO-ZBFHGGJFSA-N 2 1 308.897 4.124 20 0 DIADMP Cc1cccc2c1[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)CCO2 ZINC001171614050 1051177011 /nfs/dbraw/zinc/17/70/11/1051177011.db2.gz UKLDBNMZXPYSFE-MRXNPFEDSA-N 2 1 316.489 4.060 20 0 DIADMP CC(=O)c1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171624481 1051179567 /nfs/dbraw/zinc/17/95/67/1051179567.db2.gz SPEXSPKQRFFELU-AWEZNQCLSA-N 2 1 316.489 4.191 20 0 DIADMP COc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1F ZINC001171624335 1051180483 /nfs/dbraw/zinc/18/04/83/1051180483.db2.gz QKPXQYNFSREUMO-ZDUSSCGKSA-N 2 1 322.468 4.136 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+]2CCCC[C@@H](CCC[NH3+])C2)cc1 ZINC001171664476 1051187217 /nfs/dbraw/zinc/18/72/17/1051187217.db2.gz AKDQHQJPNJLFHL-QUCCMNQESA-N 2 1 302.506 4.157 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171643032 1051197455 /nfs/dbraw/zinc/19/74/55/1051197455.db2.gz PTGWRKTZHCAOKS-UHFFFAOYSA-N 2 1 306.469 4.299 20 0 DIADMP C[NH+]1C(C)(C)CC([N@@H+](Cc2ccccc2)C2CC2)CC1(C)C ZINC001171643455 1051197978 /nfs/dbraw/zinc/19/79/78/1051197978.db2.gz TZASHCYORNSAPO-UHFFFAOYSA-N 2 1 300.490 4.302 20 0 DIADMP C[C@@H]1C[C@H](NC(=[NH2+])C2CCCCCC2)C[N@@H+]1Cc1ccccc1 ZINC001171730867 1051201514 /nfs/dbraw/zinc/20/15/14/1051201514.db2.gz ZUGAKHRIEVZIHK-APWZRJJASA-N 2 1 313.489 4.187 20 0 DIADMP C[C@@H]1C[C@H](NC(=[NH2+])C2CCCCCC2)C[N@H+]1Cc1ccccc1 ZINC001171730867 1051201523 /nfs/dbraw/zinc/20/15/23/1051201523.db2.gz ZUGAKHRIEVZIHK-APWZRJJASA-N 2 1 313.489 4.187 20 0 DIADMP C[C@H]1C[C@@H](NC(=[NH2+])C2CCCCCC2)C[N@@H+]1Cc1ccccc1 ZINC001171730871 1051202189 /nfs/dbraw/zinc/20/21/89/1051202189.db2.gz ZUGAKHRIEVZIHK-QFBILLFUSA-N 2 1 313.489 4.187 20 0 DIADMP C[C@H]1C[C@@H](NC(=[NH2+])C2CCCCCC2)C[N@H+]1Cc1ccccc1 ZINC001171730871 1051202203 /nfs/dbraw/zinc/20/22/03/1051202203.db2.gz ZUGAKHRIEVZIHK-QFBILLFUSA-N 2 1 313.489 4.187 20 0 DIADMP CC1(C)C[C@H]([NH2+]C[C@@H]2CC[C@@H](F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171963184 1051249568 /nfs/dbraw/zinc/24/95/68/1051249568.db2.gz GZYDGCJDXDWGRR-GUDVDZBRSA-N 2 1 318.480 4.157 20 0 DIADMP CC(C)C[C@@H](C)[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171971334 1051260356 /nfs/dbraw/zinc/26/03/56/1051260356.db2.gz GXQKKVFOIMTION-MJGOQNOKSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976344 1051262640 /nfs/dbraw/zinc/26/26/40/1051262640.db2.gz KEPOPQUBXSUUFD-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976344 1051262652 /nfs/dbraw/zinc/26/26/52/1051262652.db2.gz KEPOPQUBXSUUFD-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976344 1051262667 /nfs/dbraw/zinc/26/26/67/1051262667.db2.gz KEPOPQUBXSUUFD-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171976344 1051262675 /nfs/dbraw/zinc/26/26/75/1051262675.db2.gz KEPOPQUBXSUUFD-MJGOQNOKSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2CCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976048 1051263512 /nfs/dbraw/zinc/26/35/12/1051263512.db2.gz HURXBSTZPMCCIN-ICSRJNTNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2CCC[C@](C)(F)C2)CC[NH+]1Cc1ccccc1 ZINC001171976048 1051263524 /nfs/dbraw/zinc/26/35/24/1051263524.db2.gz HURXBSTZPMCCIN-ICSRJNTNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@](C)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976048 1051263535 /nfs/dbraw/zinc/26/35/35/1051263535.db2.gz HURXBSTZPMCCIN-ICSRJNTNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@@H]([NH+]2CCC[C@](C)(F)C2)CC[N@H+]1Cc1ccccc1 ZINC001171976048 1051263546 /nfs/dbraw/zinc/26/35/46/1051263546.db2.gz HURXBSTZPMCCIN-ICSRJNTNSA-N 2 1 318.480 4.254 20 0 DIADMP CC1(C)C[C@H]([NH2+][C@H]2CC23CCCC3)CC[N@H+]1Cc1ccccc1 ZINC001171976086 1051263747 /nfs/dbraw/zinc/26/37/47/1051263747.db2.gz PJCRTPFNPWIXME-MOPGFXCFSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974592 1051264742 /nfs/dbraw/zinc/26/47/42/1051264742.db2.gz ADBMPHNEDRDPRY-BHIYHBOVSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974592 1051264759 /nfs/dbraw/zinc/26/47/59/1051264759.db2.gz ADBMPHNEDRDPRY-BHIYHBOVSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974592 1051264772 /nfs/dbraw/zinc/26/47/72/1051264772.db2.gz ADBMPHNEDRDPRY-BHIYHBOVSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C[C@H]1F ZINC001171974592 1051264779 /nfs/dbraw/zinc/26/47/79/1051264779.db2.gz ADBMPHNEDRDPRY-BHIYHBOVSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975416 1051265539 /nfs/dbraw/zinc/26/55/39/1051265539.db2.gz CTTYJRDRLRHVBS-IEBWSBKVSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171975416 1051265551 /nfs/dbraw/zinc/26/55/51/1051265551.db2.gz CTTYJRDRLRHVBS-IEBWSBKVSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975416 1051265563 /nfs/dbraw/zinc/26/55/63/1051265563.db2.gz CTTYJRDRLRHVBS-IEBWSBKVSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171975416 1051265572 /nfs/dbraw/zinc/26/55/72/1051265572.db2.gz CTTYJRDRLRHVBS-IEBWSBKVSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975746 1051265932 /nfs/dbraw/zinc/26/59/32/1051265932.db2.gz FEEWDXFCJWUJRI-UHOSZYNNSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@H]1C[C@@H](CF)[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975746 1051265943 /nfs/dbraw/zinc/26/59/43/1051265943.db2.gz FEEWDXFCJWUJRI-UHOSZYNNSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@H]1C[C@@H](CF)[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975746 1051265949 /nfs/dbraw/zinc/26/59/49/1051265949.db2.gz FEEWDXFCJWUJRI-UHOSZYNNSA-N 2 1 318.480 4.110 20 0 DIADMP C[C@H]1C[C@@H](CF)[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171975746 1051265959 /nfs/dbraw/zinc/26/59/59/1051265959.db2.gz FEEWDXFCJWUJRI-UHOSZYNNSA-N 2 1 318.480 4.110 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984173 1051267073 /nfs/dbraw/zinc/26/70/73/1051267073.db2.gz SHTPWEAMDZSAEZ-LJQANCHMSA-N 2 1 312.457 4.121 20 0 DIADMP Cc1occc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171984173 1051267081 /nfs/dbraw/zinc/26/70/81/1051267081.db2.gz SHTPWEAMDZSAEZ-LJQANCHMSA-N 2 1 312.457 4.121 20 0 DIADMP CC1(C)CC[N@@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984796 1051267274 /nfs/dbraw/zinc/26/72/74/1051267274.db2.gz OUSGALORQXPFQU-GOSISDBHSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[N@H+]([C@@H]2CC[NH+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984796 1051267302 /nfs/dbraw/zinc/26/73/02/1051267302.db2.gz OUSGALORQXPFQU-GOSISDBHSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984796 1051267315 /nfs/dbraw/zinc/26/73/15/1051267315.db2.gz OUSGALORQXPFQU-GOSISDBHSA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)CC[NH+]([C@@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)C1 ZINC001171984796 1051267325 /nfs/dbraw/zinc/26/73/25/1051267325.db2.gz OUSGALORQXPFQU-GOSISDBHSA-N 2 1 300.490 4.162 20 0 DIADMP CC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171978200 1051267359 /nfs/dbraw/zinc/26/73/59/1051267359.db2.gz XBTQVUYQLGNVKT-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP CC1CC[NH+]([C@H]2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171978200 1051267367 /nfs/dbraw/zinc/26/73/67/1051267367.db2.gz XBTQVUYQLGNVKT-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP CC1(C)C[C@@H]([NH2+]C2(CC3CC3)CC2)CC[N@H+]1Cc1ccccc1 ZINC001171980481 1051267895 /nfs/dbraw/zinc/26/78/95/1051267895.db2.gz VNWSQKVICDRONP-IBGZPJMESA-N 2 1 312.501 4.352 20 0 DIADMP CC1(C)C[C@H]([NH+]2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171978070 1051268597 /nfs/dbraw/zinc/26/85/97/1051268597.db2.gz WGNWJPAPUKZYNJ-OAQYLSRUSA-N 2 1 320.480 4.445 20 0 DIADMP CC1(C)C[C@H]([NH+]2Cc3ccccc3C2)CC[N@H+]1Cc1ccccc1 ZINC001171978070 1051268608 /nfs/dbraw/zinc/26/86/08/1051268608.db2.gz WGNWJPAPUKZYNJ-OAQYLSRUSA-N 2 1 320.480 4.445 20 0 DIADMP CC1(C)C[C@@H]([NH+]2C[C@@H]3CCC[C@@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001171978166 1051269543 /nfs/dbraw/zinc/26/95/43/1051269543.db2.gz WTHLHWSODMOVRC-ZCNNSNEGSA-N 2 1 312.501 4.162 20 0 DIADMP CC1(C)C[C@@H]([N@@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171978166 1051269550 /nfs/dbraw/zinc/26/95/50/1051269550.db2.gz WTHLHWSODMOVRC-ZCNNSNEGSA-N 2 1 312.501 4.162 20 0 DIADMP CC1(C)C[C@@H]([N@H+]2C[C@@H]3CCC[C@@H]3C2)CC[NH+]1Cc1ccccc1 ZINC001171978166 1051269558 /nfs/dbraw/zinc/26/95/58/1051269558.db2.gz WTHLHWSODMOVRC-ZCNNSNEGSA-N 2 1 312.501 4.162 20 0 DIADMP C[N@@H+](CCC1CC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171988097 1051270991 /nfs/dbraw/zinc/27/09/91/1051270991.db2.gz ORDYTANYVWGUSG-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CCC1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171988097 1051270996 /nfs/dbraw/zinc/27/09/96/1051270996.db2.gz ORDYTANYVWGUSG-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP C[NH+](CCC1CC1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171988097 1051271002 /nfs/dbraw/zinc/27/10/02/1051271002.db2.gz ORDYTANYVWGUSG-IBGZPJMESA-N 2 1 300.490 4.162 20 0 DIADMP C[N@H+](C1CCCC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985354 1051272778 /nfs/dbraw/zinc/27/27/78/1051272778.db2.gz VQZPGNHJRNPONK-IBGZPJMESA-N 2 1 300.490 4.304 20 0 DIADMP C[N@@H+](C1CCCC1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171985354 1051272797 /nfs/dbraw/zinc/27/27/97/1051272797.db2.gz VQZPGNHJRNPONK-IBGZPJMESA-N 2 1 300.490 4.304 20 0 DIADMP C[NH+](C1CCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985354 1051272812 /nfs/dbraw/zinc/27/28/12/1051272812.db2.gz VQZPGNHJRNPONK-IBGZPJMESA-N 2 1 300.490 4.304 20 0 DIADMP C[NH+](C1CCCC1)[C@H]1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171985354 1051272831 /nfs/dbraw/zinc/27/28/31/1051272831.db2.gz VQZPGNHJRNPONK-IBGZPJMESA-N 2 1 300.490 4.304 20 0 DIADMP CCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172073233 1051273719 /nfs/dbraw/zinc/27/37/19/1051273719.db2.gz PKZKOFNFFDLKEW-AFYVEPGGSA-N 2 1 300.490 4.350 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2C4CCC2CC4)C3)cc1 ZINC001172073825 1051275789 /nfs/dbraw/zinc/27/57/89/1051275789.db2.gz CRRHBKLHUXPBDZ-ZHLPAPNQSA-N 2 1 310.485 4.199 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH+]2C4CCC2CC4)C3)cc1 ZINC001172073825 1051275804 /nfs/dbraw/zinc/27/58/04/1051275804.db2.gz CRRHBKLHUXPBDZ-ZHLPAPNQSA-N 2 1 310.485 4.199 20 0 DIADMP CC[C@H]1CCC[N@@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076095 1051277334 /nfs/dbraw/zinc/27/73/34/1051277334.db2.gz VGKCQFNVDVSBOI-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076095 1051277349 /nfs/dbraw/zinc/27/73/49/1051277349.db2.gz VGKCQFNVDVSBOI-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172076095 1051277359 /nfs/dbraw/zinc/27/73/59/1051277359.db2.gz VGKCQFNVDVSBOI-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP CC[C@H]1CCC[NH+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172076095 1051277373 /nfs/dbraw/zinc/27/73/73/1051277373.db2.gz VGKCQFNVDVSBOI-BURNTYAHSA-N 2 1 312.501 4.447 20 0 DIADMP C[N@@H+](CCC1CC1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172083842 1051277446 /nfs/dbraw/zinc/27/74/46/1051277446.db2.gz SMBMCQQAURWCHU-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CCC1CC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172083842 1051277457 /nfs/dbraw/zinc/27/74/57/1051277457.db2.gz SMBMCQQAURWCHU-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CCC1CC1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172083842 1051277471 /nfs/dbraw/zinc/27/74/71/1051277471.db2.gz SMBMCQQAURWCHU-AERCQKQUSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078547 1051278056 /nfs/dbraw/zinc/27/80/56/1051278056.db2.gz HVZDMBZRWNREPD-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078547 1051278070 /nfs/dbraw/zinc/27/80/70/1051278070.db2.gz HVZDMBZRWNREPD-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172078547 1051278084 /nfs/dbraw/zinc/27/80/84/1051278084.db2.gz HVZDMBZRWNREPD-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172078547 1051278098 /nfs/dbraw/zinc/27/80/98/1051278098.db2.gz HVZDMBZRWNREPD-PBASOCQRSA-N 2 1 312.501 4.304 20 0 DIADMP CC(C)C[N@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079700 1051278134 /nfs/dbraw/zinc/27/81/34/1051278134.db2.gz PNICIPPWPCOECJ-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[N@@H+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172079700 1051278145 /nfs/dbraw/zinc/27/81/45/1051278145.db2.gz PNICIPPWPCOECJ-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172079700 1051278155 /nfs/dbraw/zinc/27/81/55/1051278155.db2.gz PNICIPPWPCOECJ-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)C[NH+](C)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172079700 1051278168 /nfs/dbraw/zinc/27/81/68/1051278168.db2.gz PNICIPPWPCOECJ-ACDBMABISA-N 2 1 300.490 4.160 20 0 DIADMP C[C@H]1C[N@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082436 1051278288 /nfs/dbraw/zinc/27/82/88/1051278288.db2.gz JYCMSDIWZSUNDN-PBASOCQRSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@H]1C[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082436 1051278297 /nfs/dbraw/zinc/27/82/97/1051278297.db2.gz JYCMSDIWZSUNDN-PBASOCQRSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082436 1051278306 /nfs/dbraw/zinc/27/83/06/1051278306.db2.gz JYCMSDIWZSUNDN-PBASOCQRSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@H]1C[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001172082436 1051278313 /nfs/dbraw/zinc/27/83/13/1051278313.db2.gz JYCMSDIWZSUNDN-PBASOCQRSA-N 2 1 324.512 4.447 20 0 DIADMP C[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078545 1051278436 /nfs/dbraw/zinc/27/84/36/1051278436.db2.gz HVZDMBZRWNREPD-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078545 1051278443 /nfs/dbraw/zinc/27/84/43/1051278443.db2.gz HVZDMBZRWNREPD-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172078545 1051278446 /nfs/dbraw/zinc/27/84/46/1051278446.db2.gz HVZDMBZRWNREPD-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172078545 1051278448 /nfs/dbraw/zinc/27/84/48/1051278448.db2.gz HVZDMBZRWNREPD-AYWYSENESA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078548 1051279183 /nfs/dbraw/zinc/27/91/83/1051279183.db2.gz HVZDMBZRWNREPD-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[N@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172078548 1051279196 /nfs/dbraw/zinc/27/91/96/1051279196.db2.gz HVZDMBZRWNREPD-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172078548 1051279210 /nfs/dbraw/zinc/27/92/10/1051279210.db2.gz HVZDMBZRWNREPD-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[C@H]1CCC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001172078548 1051279218 /nfs/dbraw/zinc/27/92/18/1051279218.db2.gz HVZDMBZRWNREPD-WJMWBRGCSA-N 2 1 312.501 4.304 20 0 DIADMP C[N@@H+](CCC1CC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172083843 1051279913 /nfs/dbraw/zinc/27/99/13/1051279913.db2.gz SMBMCQQAURWCHU-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CCC1CC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172083843 1051279923 /nfs/dbraw/zinc/27/99/23/1051279923.db2.gz SMBMCQQAURWCHU-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP C[NH+](CCC1CC1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001172083843 1051279934 /nfs/dbraw/zinc/27/99/34/1051279934.db2.gz SMBMCQQAURWCHU-WKCHPHFGSA-N 2 1 312.501 4.304 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C(C2CC2)C2CC2)C3)cc1 ZINC001172066885 1051284245 /nfs/dbraw/zinc/28/42/45/1051284245.db2.gz FUFBYNIQKKNTSL-MZADTFQBSA-N 2 1 324.512 4.350 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2CC24CCC4)C3)cc1 ZINC001172065841 1051285593 /nfs/dbraw/zinc/28/55/93/1051285593.db2.gz ACPDCHXUSSISLW-YRPNKDGESA-N 2 1 310.485 4.104 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccc(F)cc1F)C2 ZINC001172131229 1051292971 /nfs/dbraw/zinc/29/29/71/1051292971.db2.gz VIFMMRLWOZGZKJ-MKSNKDDYSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccc(F)cc1F)C2 ZINC001172131229 1051292975 /nfs/dbraw/zinc/29/29/75/1051292975.db2.gz VIFMMRLWOZGZKJ-MKSNKDDYSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccc(F)cc1F)C2 ZINC001172131229 1051292982 /nfs/dbraw/zinc/29/29/82/1051292982.db2.gz VIFMMRLWOZGZKJ-MKSNKDDYSA-N 2 1 320.427 4.117 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1 ZINC001172131091 1051293321 /nfs/dbraw/zinc/29/33/21/1051293321.db2.gz UPOBFHDZRZAJQJ-WOZUAGRISA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[NH+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC001172131091 1051293333 /nfs/dbraw/zinc/29/33/33/1051293333.db2.gz UPOBFHDZRZAJQJ-WOZUAGRISA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172131091 1051293351 /nfs/dbraw/zinc/29/33/51/1051293351.db2.gz UPOBFHDZRZAJQJ-WOZUAGRISA-N 2 1 312.501 4.456 20 0 DIADMP Cc1cc(C)cc([C@@H]2CCC[N@@H+]2[C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)c1 ZINC001172131091 1051293363 /nfs/dbraw/zinc/29/33/63/1051293363.db2.gz UPOBFHDZRZAJQJ-WOZUAGRISA-N 2 1 312.501 4.456 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130992 1051294097 /nfs/dbraw/zinc/29/40/97/1051294097.db2.gz SRPUEHICLHWENW-KRXQYRFLSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130992 1051294109 /nfs/dbraw/zinc/29/41/09/1051294109.db2.gz SRPUEHICLHWENW-KRXQYRFLSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130992 1051294122 /nfs/dbraw/zinc/29/41/22/1051294122.db2.gz SRPUEHICLHWENW-KRXQYRFLSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCC[C@H]1c1c(F)cccc1F)C2 ZINC001172130992 1051294129 /nfs/dbraw/zinc/29/41/29/1051294129.db2.gz SRPUEHICLHWENW-KRXQYRFLSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105025 1051295246 /nfs/dbraw/zinc/29/52/46/1051295246.db2.gz HOLYEDMGYJRYSY-AKHDSKFASA-N 2 1 300.490 4.379 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccccc1)C(C)(C)C)C2 ZINC001172105025 1051295253 /nfs/dbraw/zinc/29/52/53/1051295253.db2.gz HOLYEDMGYJRYSY-AKHDSKFASA-N 2 1 300.490 4.379 20 0 DIADMP CCCC[C@H](CC)COCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172107878 1051295919 /nfs/dbraw/zinc/29/59/19/1051295919.db2.gz LCTVGHSSRIERHH-LWYYNNOASA-N 2 1 324.553 4.214 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)C2 ZINC001172103420 1051296627 /nfs/dbraw/zinc/29/66/27/1051296627.db2.gz ULPMRWJBKXFOCM-PHZGNYQRSA-N 2 1 313.272 4.098 20 0 DIADMP CCCCc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1 ZINC001172102613 1051296384 /nfs/dbraw/zinc/29/63/84/1051296384.db2.gz NKQRXDBUCMCYQV-OWZKRDHZSA-N 2 1 300.490 4.134 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(F)c(C)c1 ZINC001172108549 1051297025 /nfs/dbraw/zinc/29/70/25/1051297025.db2.gz BGLMSPHUFMLNIQ-ZMMAXQRCSA-N 2 1 304.453 4.190 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(F)c(C)c1 ZINC001172108549 1051297033 /nfs/dbraw/zinc/29/70/33/1051297033.db2.gz BGLMSPHUFMLNIQ-ZMMAXQRCSA-N 2 1 304.453 4.190 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)C2 ZINC001172103419 1051297756 /nfs/dbraw/zinc/29/77/56/1051297756.db2.gz ULPMRWJBKXFOCM-MUJYYYPQSA-N 2 1 313.272 4.098 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccccc3)CCCCC1)C2 ZINC001172106885 1051297810 /nfs/dbraw/zinc/29/78/10/1051297810.db2.gz QSZXWKVHUHLKAO-OWZKRDHZSA-N 2 1 312.501 4.451 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1(c3ccccc3)CCCCC1)C2 ZINC001172106885 1051297824 /nfs/dbraw/zinc/29/78/24/1051297824.db2.gz QSZXWKVHUHLKAO-OWZKRDHZSA-N 2 1 312.501 4.451 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103103 1051298344 /nfs/dbraw/zinc/29/83/44/1051298344.db2.gz RWQFEVKJUYBCNI-OLSLZXJASA-N 2 1 316.533 4.196 20 0 DIADMP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)C12CC3CC(CC(C3)C1)C2 ZINC001172103103 1051298352 /nfs/dbraw/zinc/29/83/52/1051298352.db2.gz RWQFEVKJUYBCNI-OLSLZXJASA-N 2 1 316.533 4.196 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cccc(F)c1Cl ZINC001172111893 1051299582 /nfs/dbraw/zinc/29/95/82/1051299582.db2.gz XXEKXBTXQBBEQD-SYQHCUMBSA-N 2 1 310.844 4.145 20 0 DIADMP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cccc(F)c1Cl ZINC001172111893 1051299597 /nfs/dbraw/zinc/29/95/97/1051299597.db2.gz XXEKXBTXQBBEQD-SYQHCUMBSA-N 2 1 310.844 4.145 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(F)cc(F)c1 ZINC001172109625 1051300994 /nfs/dbraw/zinc/30/09/94/1051300994.db2.gz IBYJJOAPXPIOEU-ZJPYXAASSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)cc(F)c1 ZINC001172109625 1051301005 /nfs/dbraw/zinc/30/10/05/1051301005.db2.gz IBYJJOAPXPIOEU-ZJPYXAASSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1c(F)cccc1F ZINC001172110875 1051301767 /nfs/dbraw/zinc/30/17/67/1051301767.db2.gz QHNMWJHEHVMIFN-LOUJCGABSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1c(F)cccc1F ZINC001172110875 1051301778 /nfs/dbraw/zinc/30/17/78/1051301778.db2.gz QHNMWJHEHVMIFN-LOUJCGABSA-N 2 1 308.416 4.021 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110314 1051302055 /nfs/dbraw/zinc/30/20/55/1051302055.db2.gz MKYWHGLZIDHXFK-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccc(F)cc1)C1CCC1)C2 ZINC001172110314 1051302064 /nfs/dbraw/zinc/30/20/64/1051302064.db2.gz MKYWHGLZIDHXFK-YRPNKDGESA-N 2 1 316.464 4.272 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001172112683 1051302124 /nfs/dbraw/zinc/30/21/24/1051302124.db2.gz YUDQZSSMPFKWRF-OAFZBRQQSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001172112683 1051302129 /nfs/dbraw/zinc/30/21/29/1051302129.db2.gz YUDQZSSMPFKWRF-OAFZBRQQSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CC1)c1ccccc1F)C2 ZINC001172110190 1051302420 /nfs/dbraw/zinc/30/24/20/1051302420.db2.gz ISNYQGCKKVKQPG-LJCCNALRSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccccc1F)C1CCC1)C2 ZINC001172111037 1051302603 /nfs/dbraw/zinc/30/26/03/1051302603.db2.gz PVVXJHLIUGLWRD-AXVVYFOYSA-N 2 1 316.464 4.272 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccccc1F)C1CCC1)C2 ZINC001172111037 1051302613 /nfs/dbraw/zinc/30/26/13/1051302613.db2.gz PVVXJHLIUGLWRD-AXVVYFOYSA-N 2 1 316.464 4.272 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(C)cc1 ZINC001172110451 1051302679 /nfs/dbraw/zinc/30/26/79/1051302679.db2.gz MXTMBSGAWZCZGZ-YSTOQKLRSA-N 2 1 300.490 4.441 20 0 DIADMP CCC[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(C)cc1 ZINC001172110451 1051302689 /nfs/dbraw/zinc/30/26/89/1051302689.db2.gz MXTMBSGAWZCZGZ-YSTOQKLRSA-N 2 1 300.490 4.441 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121780 1051304257 /nfs/dbraw/zinc/30/42/57/1051304257.db2.gz MLIBZZVJJLZRRQ-AXVVYFOYSA-N 2 1 316.464 4.368 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121780 1051304269 /nfs/dbraw/zinc/30/42/69/1051304269.db2.gz MLIBZZVJJLZRRQ-AXVVYFOYSA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@@H+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121780 1051304279 /nfs/dbraw/zinc/30/42/79/1051304279.db2.gz MLIBZZVJJLZRRQ-AXVVYFOYSA-N 2 1 316.464 4.368 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@H]([N@H+]1CCCC[C@@H]1c1ccccc1F)C2 ZINC001172121780 1051304285 /nfs/dbraw/zinc/30/42/85/1051304285.db2.gz MLIBZZVJJLZRRQ-AXVVYFOYSA-N 2 1 316.464 4.368 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001172121546 1051305408 /nfs/dbraw/zinc/30/54/08/1051305408.db2.gz KOSBPJMTMZRVRV-MKSNKDDYSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001172121546 1051305419 /nfs/dbraw/zinc/30/54/19/1051305419.db2.gz KOSBPJMTMZRVRV-MKSNKDDYSA-N 2 1 318.892 4.492 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1ccccc1Cl)C2 ZINC001172121546 1051305432 /nfs/dbraw/zinc/30/54/32/1051305432.db2.gz KOSBPJMTMZRVRV-MKSNKDDYSA-N 2 1 318.892 4.492 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(C=Cc4ccccc43)CC1)C2 ZINC001172121662 1051305470 /nfs/dbraw/zinc/30/54/70/1051305470.db2.gz SBRSVRBYUCPLQY-PMOLBWCYSA-N 2 1 322.496 4.062 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1cc(F)ccc1F)C2 ZINC001172124353 1051306278 /nfs/dbraw/zinc/30/62/78/1051306278.db2.gz KTNJFEUGUWBKEK-PASDCYSWSA-N 2 1 320.427 4.117 20 0 DIADMP C[NH+]1[C@@H]2CCC[C@H]1C[C@@H]([N@@H+]1CCC[C@@H]1c1cc(F)ccc1F)C2 ZINC001172124353 1051306293 /nfs/dbraw/zinc/30/62/93/1051306293.db2.gz KTNJFEUGUWBKEK-PASDCYSWSA-N 2 1 320.427 4.117 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C(C)(C)c1ccccc1Cl)C2 ZINC001172119022 1051307160 /nfs/dbraw/zinc/30/71/60/1051307160.db2.gz VFAAFQQRLQDJHJ-QDMKHBRRSA-N 2 1 306.881 4.180 20 0 DIADMP Fc1cc(Nc2c[nH+]c3ccccn23)ccc1C[NH+]1CCCCC1 ZINC001215709663 1051316394 /nfs/dbraw/zinc/31/63/94/1051316394.db2.gz ACDGKYRNROYMMM-UHFFFAOYSA-N 2 1 324.403 4.203 20 0 DIADMP CCCCC[NH+](CCCCC)C1CC[NH+](CCCOC)CC1 ZINC001172253128 1051330264 /nfs/dbraw/zinc/33/02/64/1051330264.db2.gz CWISGMWCUGJCEB-UHFFFAOYSA-N 2 1 312.542 4.170 20 0 DIADMP Cc1[nH+]c2ccccn2c1Nc1ccc(C[NH2+]CC(C)C)cc1 ZINC001215743718 1051337793 /nfs/dbraw/zinc/33/77/93/1051337793.db2.gz HMUNPYYTECWGBL-UHFFFAOYSA-N 2 1 308.429 4.132 20 0 DIADMP C[C@@H]1CC[C@H]([NH+]2CCC3(CCC[N@H+]3CC3CC3)CC2)C[C@H]1C ZINC001172372808 1051352172 /nfs/dbraw/zinc/35/21/72/1051352172.db2.gz JFTXRHNQOXMVSX-LMMKCTJWSA-N 2 1 304.522 4.152 20 0 DIADMP CC[C@H](C)OCC[C@@H](C)[N@@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172337927 1051360900 /nfs/dbraw/zinc/36/09/00/1051360900.db2.gz XHSOSRNUNZGLLD-AJYBTWMASA-N 2 1 324.553 4.485 20 0 DIADMP C[C@H]([NH2+]C1CCC([N@@H+](C)Cc2ccccc2)CC1)C1(C)CC1 ZINC000796870141 1051371385 /nfs/dbraw/zinc/37/13/85/1051371385.db2.gz BTEMRUHXVWITCJ-IVMQYODDSA-N 2 1 300.490 4.208 20 0 DIADMP C[C@@H]1CC[C@@H]([NH2+]C2(C)CC[NH+](Cc3ccccc3)CC2)C[C@@H]1C ZINC001172370116 1051377992 /nfs/dbraw/zinc/37/79/92/1051377992.db2.gz VOAGHUARVYUKMA-WSTZPKSXSA-N 2 1 314.517 4.455 20 0 DIADMP CCCCCC[C@@H](CCC)[NH+]1CCC([NH3+])(c2cccnc2)CC1 ZINC001172391612 1051394254 /nfs/dbraw/zinc/39/42/54/1051394254.db2.gz RTELCZIUNKZICK-LJQANCHMSA-N 2 1 317.521 4.471 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172390607 1051394582 /nfs/dbraw/zinc/39/45/82/1051394582.db2.gz WHMFOMVCGCPMSF-MISYRCLQSA-N 2 1 302.506 4.454 20 0 DIADMP CC[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001172390607 1051394592 /nfs/dbraw/zinc/39/45/92/1051394592.db2.gz WHMFOMVCGCPMSF-MISYRCLQSA-N 2 1 302.506 4.454 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC001172550019 1051432197 /nfs/dbraw/zinc/43/21/97/1051432197.db2.gz AWEPJAXKUADXRO-RLLQIKCJSA-N 2 1 300.490 4.177 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC001172550016 1051432546 /nfs/dbraw/zinc/43/25/46/1051432546.db2.gz AWEPJAXKUADXRO-MISYRCLQSA-N 2 1 300.490 4.177 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([NH2+][C@@H]3CC[N@@H+](C4CCCCC4)C3)C2)cc1 ZINC001172554801 1051436777 /nfs/dbraw/zinc/43/67/77/1051436777.db2.gz CERADKAESCMRKY-VAMGGRTRSA-N 2 1 312.501 4.319 20 0 DIADMP c1ccc([C@@H]2CC[C@@H]([NH2+][C@@H]3CC[N@H+](C4CCCCC4)C3)C2)cc1 ZINC001172554801 1051436781 /nfs/dbraw/zinc/43/67/81/1051436781.db2.gz CERADKAESCMRKY-VAMGGRTRSA-N 2 1 312.501 4.319 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172557795 1051438441 /nfs/dbraw/zinc/43/84/41/1051438441.db2.gz QRMMUEGNTTYTOZ-NCYKPQTJSA-N 2 1 312.501 4.305 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172561349 1051443299 /nfs/dbraw/zinc/44/32/99/1051443299.db2.gz QCIOEWQBSXZNNL-RTWAWAEBSA-N 2 1 314.517 4.375 20 0 DIADMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(C)c(F)c1 ZINC001168824633 1051445899 /nfs/dbraw/zinc/44/58/99/1051445899.db2.gz BTAZDACWKZDKNR-GOSISDBHSA-N 2 1 303.425 4.160 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCCCc2ccccc2)cc1 ZINC001168838103 1051450441 /nfs/dbraw/zinc/45/04/41/1051450441.db2.gz MTIADOLSTVWFIF-UHFFFAOYSA-N 2 1 310.485 4.203 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)C1 ZINC001172538089 1051452496 /nfs/dbraw/zinc/45/24/96/1051452496.db2.gz LUEKXFJCVWUAQA-RLLQIKCJSA-N 2 1 300.490 4.034 20 0 DIADMP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1C1CC(C)(C)OC(C)(C)C1 ZINC001172659137 1051474294 /nfs/dbraw/zinc/47/42/94/1051474294.db2.gz NIORLHQAGUEZGE-DLBZAZTESA-N 2 1 322.537 4.061 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1C1CC(C)(C)OC(C)(C)C1 ZINC001172659137 1051474298 /nfs/dbraw/zinc/47/42/98/1051474298.db2.gz NIORLHQAGUEZGE-DLBZAZTESA-N 2 1 322.537 4.061 20 0 DIADMP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@H+]1C1CC(C)(C)OC(C)(C)C1 ZINC001172659137 1051474303 /nfs/dbraw/zinc/47/43/03/1051474303.db2.gz NIORLHQAGUEZGE-DLBZAZTESA-N 2 1 322.537 4.061 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc(F)cc1 ZINC001169099575 1051508472 /nfs/dbraw/zinc/50/84/72/1051508472.db2.gz BTENAESUJNSTES-FCGDIQPGSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCCCCCCCCCCCO)C2 ZINC001169102248 1051511349 /nfs/dbraw/zinc/51/13/49/1051511349.db2.gz YGOGLFLCQFUSGN-OWZKRDHZSA-N 2 1 324.553 4.095 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccccc1F ZINC001169101632 1051511930 /nfs/dbraw/zinc/51/19/30/1051511930.db2.gz USCKXQJOSUXHQT-OAFZBRQQSA-N 2 1 304.453 4.128 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001169101632 1051511940 /nfs/dbraw/zinc/51/19/40/1051511940.db2.gz USCKXQJOSUXHQT-OAFZBRQQSA-N 2 1 304.453 4.128 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]Cc1ccccc1-c1ccccc1)C2 ZINC001169081787 1051513685 /nfs/dbraw/zinc/51/36/85/1051513685.db2.gz WQLBJGSILTWDOF-ACDBMABISA-N 2 1 306.453 4.068 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC(c1ccccc1)c1ccccc1)C2 ZINC001169079716 1051515079 /nfs/dbraw/zinc/51/50/79/1051515079.db2.gz KQTAGXMJSXDBAA-WKCHPHFGSA-N 2 1 320.480 4.033 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1)C2 ZINC001169081269 1051515506 /nfs/dbraw/zinc/51/55/06/1051515506.db2.gz PNHAHCQELJAGRW-KJJMTIBFSA-N 2 1 320.480 4.185 20 0 DIADMP CC(C)C[C@H](Cc1ccccc1)[N@@H+](C(C)C)C1CCN(C)CC1 ZINC001169086965 1051520678 /nfs/dbraw/zinc/52/06/78/1051520678.db2.gz ZKLURWPRXKLTOP-OAQYLSRUSA-N 2 1 316.533 4.448 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@@H]2CCc3ccc(C)cc3C2)CC1 ZINC001172840080 1051527957 /nfs/dbraw/zinc/52/79/57/1051527957.db2.gz WNYMYCJVWNIRNQ-OAQYLSRUSA-N 2 1 314.517 4.049 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)[C@H]2CCc3ccc(C)cc3C2)CC1 ZINC001172840078 1051528859 /nfs/dbraw/zinc/52/88/59/1051528859.db2.gz WNYMYCJVWNIRNQ-NRFANRHFSA-N 2 1 314.517 4.049 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172843044 1051530199 /nfs/dbraw/zinc/53/01/99/1051530199.db2.gz UJINZWLCCPULNQ-XQLPTFJDSA-N 2 1 324.871 4.015 20 0 DIADMP C[C@@H](Cc1c(F)cccc1Cl)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172843044 1051530210 /nfs/dbraw/zinc/53/02/10/1051530210.db2.gz UJINZWLCCPULNQ-XQLPTFJDSA-N 2 1 324.871 4.015 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(c3ccccc3Cl)CC1)C2 ZINC001169155398 1051537878 /nfs/dbraw/zinc/53/78/78/1051537878.db2.gz OSRNBVCTRUVDAP-BJWYYQGGSA-N 2 1 318.892 4.145 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169155648 1051539169 /nfs/dbraw/zinc/53/91/69/1051539169.db2.gz UDCOQLOMXPTCAR-DFGXFYAUSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169155648 1051539179 /nfs/dbraw/zinc/53/91/79/1051539179.db2.gz UDCOQLOMXPTCAR-DFGXFYAUSA-N 2 1 316.514 4.171 20 0 DIADMP CSc1ccccc1[C@@H]1CCC[NH+]1[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001169155648 1051539195 /nfs/dbraw/zinc/53/91/95/1051539195.db2.gz UDCOQLOMXPTCAR-DFGXFYAUSA-N 2 1 316.514 4.171 20 0 DIADMP C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001169156229 1051540920 /nfs/dbraw/zinc/54/09/20/1051540920.db2.gz WJZCLPLKOJIMQN-MLHJIOFPSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001169156229 1051540936 /nfs/dbraw/zinc/54/09/36/1051540936.db2.gz WJZCLPLKOJIMQN-MLHJIOFPSA-N 2 1 304.865 4.102 20 0 DIADMP C[NH+]1[C@@H]2CC[C@H]1C[C@@H]([N@H+]1CCC[C@H]1c1cccc(Cl)c1)C2 ZINC001169156229 1051540955 /nfs/dbraw/zinc/54/09/55/1051540955.db2.gz WJZCLPLKOJIMQN-MLHJIOFPSA-N 2 1 304.865 4.102 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001169266607 1051559408 /nfs/dbraw/zinc/55/94/08/1051559408.db2.gz YELZCQJTSYQGCP-UHFFFAOYSA-N 2 1 324.468 4.395 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC1 ZINC001169266607 1051559417 /nfs/dbraw/zinc/55/94/17/1051559417.db2.gz YELZCQJTSYQGCP-UHFFFAOYSA-N 2 1 324.468 4.395 20 0 DIADMP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000178254242 1051565101 /nfs/dbraw/zinc/56/51/01/1051565101.db2.gz ZOYSPOKOFAUEMS-ZDUSSCGKSA-N 2 1 321.534 4.100 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234343 1051565158 /nfs/dbraw/zinc/56/51/58/1051565158.db2.gz NULAEJDPPSRDSH-LSDHHAIUSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccsc1 ZINC000178234343 1051565168 /nfs/dbraw/zinc/56/51/68/1051565168.db2.gz NULAEJDPPSRDSH-LSDHHAIUSA-N 2 1 320.527 4.372 20 0 DIADMP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc2ccccc2n1 ZINC000178371410 1051568171 /nfs/dbraw/zinc/56/81/71/1051568171.db2.gz WOYAMCCBIGKPFZ-IRXDYDNUSA-N 2 1 311.473 4.150 20 0 DIADMP C[C@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1ccc2ccccc2n1 ZINC000178371410 1051568180 /nfs/dbraw/zinc/56/81/80/1051568180.db2.gz WOYAMCCBIGKPFZ-IRXDYDNUSA-N 2 1 311.473 4.150 20 0 DIADMP [NH3+][C@@H]1CC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)CC[C@H]1F ZINC001206185415 1051588661 /nfs/dbraw/zinc/58/86/61/1051588661.db2.gz NOFVMTCUUMSCMM-DZEXYBDGSA-N 2 1 324.443 4.118 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CC[C@H](c3ccccc3)C2)CC1 ZINC001173110834 1051609722 /nfs/dbraw/zinc/60/97/22/1051609722.db2.gz ZEFSDSGHZSZTPZ-HDYDNRTBSA-N 2 1 300.490 4.129 20 0 DIADMP CC[NH+](CC)C1CCC([N@H+]2CCc3ccc(Cl)cc3C2)CC1 ZINC001173107986 1051610473 /nfs/dbraw/zinc/61/04/73/1051610473.db2.gz ADGDQGIVWQJLFV-UHFFFAOYSA-N 2 1 320.908 4.351 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1CCC3(CCCCC3)CC1)C2 ZINC001173116066 1051613412 /nfs/dbraw/zinc/61/34/12/1051613412.db2.gz OMEUUTFCIAOZKO-LDLYASANSA-N 2 1 304.522 4.484 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C1CCC3(CCCCC3)CC1)C2 ZINC001173116066 1051613417 /nfs/dbraw/zinc/61/34/17/1051613417.db2.gz OMEUUTFCIAOZKO-LDLYASANSA-N 2 1 304.522 4.484 20 0 DIADMP C[NH+]1CCC2(CC[N@H+](C3CCC4(CCCCC4)CC3)C2)CC1 ZINC001173121586 1051614732 /nfs/dbraw/zinc/61/47/32/1051614732.db2.gz SHZBPOMMBDQVEF-UHFFFAOYSA-N 2 1 304.522 4.297 20 0 DIADMP c1[nH+]cn(C2CCC3(CCCCC3)CC2)c1C1CC[NH2+]CC1 ZINC001173122121 1051615566 /nfs/dbraw/zinc/61/55/66/1051615566.db2.gz ZPWJHIGRNYYOAT-UHFFFAOYSA-N 2 1 301.478 4.416 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1CCC[C@H]([NH3+])C1 ZINC001173204036 1051626850 /nfs/dbraw/zinc/62/68/50/1051626850.db2.gz BZGSZXKEQRJMQJ-PXNSSMCTSA-N 2 1 308.469 4.020 20 0 DIADMP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]([NH3+])C1 ZINC001173204036 1051626856 /nfs/dbraw/zinc/62/68/56/1051626856.db2.gz BZGSZXKEQRJMQJ-PXNSSMCTSA-N 2 1 308.469 4.020 20 0 DIADMP CCC[N@@H+](CCC[NH+](C)C)C1CCC(Oc2ccccc2)CC1 ZINC001173205376 1051642773 /nfs/dbraw/zinc/64/27/73/1051642773.db2.gz HDEMLKWHSRJKAN-UHFFFAOYSA-N 2 1 318.505 4.040 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H](C[NH3+])[C@@H](C)C2)c(Cl)c1Cl ZINC001206013101 1051650438 /nfs/dbraw/zinc/65/04/38/1051650438.db2.gz PFCBTCANWFVLAZ-QWHCGFSZSA-N 2 1 315.288 4.109 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2F)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272206 1051668925 /nfs/dbraw/zinc/66/89/25/1051668925.db2.gz UAPBFTAJONPKPM-DSLXNQLJSA-N 2 1 318.480 4.476 20 0 DIADMP CC[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001173271016 1051668959 /nfs/dbraw/zinc/66/89/59/1051668959.db2.gz OYIGDZFUXCYPRE-LSDHHAIUSA-N 2 1 306.881 4.169 20 0 DIADMP Cc1csc2sc(C[N@H+]3CCC[C@@H](C[NH3+])[C@H](C)C3)c(C)c12 ZINC001206014570 1051670417 /nfs/dbraw/zinc/67/04/17/1051670417.db2.gz XSNAVRNQCRNJII-RISCZKNCSA-N 2 1 322.543 4.386 20 0 DIADMP CC[C@@H]1CC[C@H]([N@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001173296126 1051677709 /nfs/dbraw/zinc/67/77/09/1051677709.db2.gz SHTAGCZPPRCKBH-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001173296126 1051677718 /nfs/dbraw/zinc/67/77/18/1051677718.db2.gz SHTAGCZPPRCKBH-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP CC[C@@H]1CC[C@H]([NH+]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)C1 ZINC001173296126 1051677728 /nfs/dbraw/zinc/67/77/28/1051677728.db2.gz SHTAGCZPPRCKBH-WLRLJWMZSA-N 2 1 312.501 4.019 20 0 DIADMP CCSC[C@H](C)[N@@H+](Cc1ccccc1C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173297972 1051677975 /nfs/dbraw/zinc/67/79/75/1051677975.db2.gz IWMYLGRJLRMTDW-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP CCSC[C@@H](C)[N@@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173296630 1051678271 /nfs/dbraw/zinc/67/82/71/1051678271.db2.gz VIGGLPDGWQUSRU-KBAYOESNSA-N 2 1 312.567 4.280 20 0 DIADMP Cc1[nH+]ccc(N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1Cl ZINC000494020516 1051680312 /nfs/dbraw/zinc/68/03/12/1051680312.db2.gz NGRKJSSKHTYIGZ-ZBFHGGJFSA-N 2 1 321.896 4.134 20 0 DIADMP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342445 1051700638 /nfs/dbraw/zinc/70/06/38/1051700638.db2.gz YHWUWQOWGBPIBN-MKXGPGLRSA-N 2 1 304.522 4.484 20 0 DIADMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCC3(CCCCC3)C1)C2 ZINC001173342445 1051700655 /nfs/dbraw/zinc/70/06/55/1051700655.db2.gz YHWUWQOWGBPIBN-MKXGPGLRSA-N 2 1 304.522 4.484 20 0 DIADMP CCC[N@@H+]1C[C@@H]2C[NH+]([C@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173348701 1051706123 /nfs/dbraw/zinc/70/61/23/1051706123.db2.gz KRSIAAKNRNRAQG-OTWHNJEPSA-N 2 1 304.522 4.153 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@H+]([C@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173348701 1051706137 /nfs/dbraw/zinc/70/61/37/1051706137.db2.gz KRSIAAKNRNRAQG-OTWHNJEPSA-N 2 1 304.522 4.153 20 0 DIADMP CCC[NH+]1C[C@@H]2C[N@@H+]([C@H]3CCCC4(CCCCC4)C3)C[C@@H]2C1 ZINC001173348701 1051706146 /nfs/dbraw/zinc/70/61/46/1051706146.db2.gz KRSIAAKNRNRAQG-OTWHNJEPSA-N 2 1 304.522 4.153 20 0 DIADMP C[C@H](CCc1ccccc1)[NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183192277 1051711412 /nfs/dbraw/zinc/71/14/12/1051711412.db2.gz KXZSJJQURGJYMZ-QWFCFKBJSA-N 2 1 314.517 4.250 20 0 DIADMP Cc1ccccc1[C@H](C)[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001169899517 1051725839 /nfs/dbraw/zinc/72/58/39/1051725839.db2.gz IMJGKHLDUOBHFE-SESVDKBCSA-N 2 1 320.480 4.120 20 0 DIADMP Cc1ccccc1[C@H](C)[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC001169899517 1051725852 /nfs/dbraw/zinc/72/58/52/1051725852.db2.gz IMJGKHLDUOBHFE-SESVDKBCSA-N 2 1 320.480 4.120 20 0 DIADMP Cc1ccccc1[C@H](C)[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC001169899517 1051725863 /nfs/dbraw/zinc/72/58/63/1051725863.db2.gz IMJGKHLDUOBHFE-SESVDKBCSA-N 2 1 320.480 4.120 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+](C)CCC[NH+](C)C ZINC001173547787 1051748972 /nfs/dbraw/zinc/74/89/72/1051748972.db2.gz SWLALDVLVGUTKR-CYBMUJFWSA-N 2 1 317.304 4.198 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000494460608 1051896195 /nfs/dbraw/zinc/89/61/95/1051896195.db2.gz ZYPAUZIIUWEUKB-RDTXWAMCSA-N 2 1 306.519 4.189 20 0 DIADMP Cc1cscc1C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000494460607 1051897259 /nfs/dbraw/zinc/89/72/59/1051897259.db2.gz ZYPAUZIIUWEUKB-KSSFIOAISA-N 2 1 306.519 4.189 20 0 DIADMP C[C@@H](c1ccc(F)cc1F)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768269350 1051911322 /nfs/dbraw/zinc/91/13/22/1051911322.db2.gz RMJNNNGNFGPABL-AWEZNQCLSA-N 2 1 318.411 4.219 20 0 DIADMP C[C@@H](c1ccc(F)cc1F)[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768269350 1051911332 /nfs/dbraw/zinc/91/13/32/1051911332.db2.gz RMJNNNGNFGPABL-AWEZNQCLSA-N 2 1 318.411 4.219 20 0 DIADMP Cc1ccc(Cl)c(C[N@H+]2CCC[C@@H](C[NH3+])[C@@H](C)C2)c1Cl ZINC001206027321 1051934415 /nfs/dbraw/zinc/93/44/15/1051934415.db2.gz WDQQWDHGKGDYIU-STQMWFEESA-N 2 1 315.288 4.109 20 0 DIADMP C[C@@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C2CC(C(F)F)C2)C1 ZINC000768679749 1051952001 /nfs/dbraw/zinc/95/20/01/1051952001.db2.gz VUOZIYHEVDCFLU-RWBZWWBESA-N 2 1 322.443 4.052 20 0 DIADMP C[C@H]1CCC[N@@H+](Cc2ccccc2C[NH2+]C2CC(C(F)F)C2)C1 ZINC000768679746 1051952687 /nfs/dbraw/zinc/95/26/87/1051952687.db2.gz VUOZIYHEVDCFLU-NNGSBXSVSA-N 2 1 322.443 4.052 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000195139604 1052036169 /nfs/dbraw/zinc/03/61/69/1052036169.db2.gz LOGPTBMMDQRVDR-AEFFLSMTSA-N 2 1 312.457 4.015 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000195139604 1052036180 /nfs/dbraw/zinc/03/61/80/1052036180.db2.gz LOGPTBMMDQRVDR-AEFFLSMTSA-N 2 1 312.457 4.015 20 0 DIADMP CCCCCCOc1cccc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c1 ZINC000769404909 1052042005 /nfs/dbraw/zinc/04/20/05/1052042005.db2.gz SNWBOQYDMHWISM-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP CCCCCCOc1cccc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)c1 ZINC000769404909 1052042015 /nfs/dbraw/zinc/04/20/15/1052042015.db2.gz SNWBOQYDMHWISM-LJQANCHMSA-N 2 1 318.505 4.029 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CCN1C ZINC000769484133 1052052175 /nfs/dbraw/zinc/05/21/75/1052052175.db2.gz DLCCGGUJSKHLIA-PXNSSMCTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@@H+]1C ZINC000769484133 1052052188 /nfs/dbraw/zinc/05/21/88/1052052188.db2.gz DLCCGGUJSKHLIA-PXNSSMCTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2-c2ccccc2)CC[N@H+]1C ZINC000769484133 1052052192 /nfs/dbraw/zinc/05/21/92/1052052192.db2.gz DLCCGGUJSKHLIA-PXNSSMCTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484133 1052052200 /nfs/dbraw/zinc/05/22/00/1052052200.db2.gz DLCCGGUJSKHLIA-PXNSSMCTSA-N 2 1 308.469 4.268 20 0 DIADMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2-c2ccccc2)CC[NH+]1C ZINC000769484133 1052052211 /nfs/dbraw/zinc/05/22/11/1052052211.db2.gz DLCCGGUJSKHLIA-PXNSSMCTSA-N 2 1 308.469 4.268 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+]Cc1cc(-c2ccccc2)cs1 ZINC000226180725 1052054135 /nfs/dbraw/zinc/05/41/35/1052054135.db2.gz DYSHCROSTANTHF-UHFFFAOYSA-N 2 1 302.487 4.235 20 0 DIADMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2C)C2CCCC2)C1 ZINC000494890690 1052157811 /nfs/dbraw/zinc/15/78/11/1052157811.db2.gz OAJFQHGPMOOBGJ-YLJYHZDGSA-N 2 1 300.490 4.158 20 0 DIADMP CC[C@@H](Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1)c1ccccc1 ZINC001218177452 1052203639 /nfs/dbraw/zinc/20/36/39/1052203639.db2.gz MSRZEZWEOCKBCU-OAQYLSRUSA-N 2 1 324.468 4.140 20 0 DIADMP CCCCC[C@@H](CC)Oc1ccccc1C[NH+]1CCC([NH3+])CC1 ZINC001218224238 1052210269 /nfs/dbraw/zinc/21/02/69/1052210269.db2.gz STWDGPDBBNILLY-LJQANCHMSA-N 2 1 318.505 4.347 20 0 DIADMP CC[C@H](C)CC[C@@H](C)Oc1ccc(C[NH+]2CCC([NH3+])CC2)cc1 ZINC001218358204 1052230874 /nfs/dbraw/zinc/23/08/74/1052230874.db2.gz PYKZSKBQTXYYDP-DLBZAZTESA-N 2 1 318.505 4.203 20 0 DIADMP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309671830 1052232381 /nfs/dbraw/zinc/23/23/81/1052232381.db2.gz TWMYTTMJEQYOJB-MISYRCLQSA-N 2 1 314.517 4.313 20 0 DIADMP CC(C)CCC[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000309951688 1052252723 /nfs/dbraw/zinc/25/27/23/1052252723.db2.gz GMKMWPOOEAXKKM-FQEVSTJZSA-N 2 1 302.506 4.315 20 0 DIADMP Cc1cccc(C)c1C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310340984 1052266406 /nfs/dbraw/zinc/26/64/06/1052266406.db2.gz CSVPGJWLAJYFMC-NRFANRHFSA-N 2 1 322.496 4.305 20 0 DIADMP C[C@@H](NCCC[N@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000230407406 1052268332 /nfs/dbraw/zinc/26/83/32/1052268332.db2.gz WUMSNLMFPAEURA-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000230407406 1052268342 /nfs/dbraw/zinc/26/83/42/1052268342.db2.gz WUMSNLMFPAEURA-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP C[C@@H]([NH2+]CCC[N@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000230407406 1052268350 /nfs/dbraw/zinc/26/83/50/1052268350.db2.gz WUMSNLMFPAEURA-QWHCGFSZSA-N 2 1 300.899 4.317 20 0 DIADMP c1ccc(CC2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCCC2)cc1 ZINC000495401275 1052335935 /nfs/dbraw/zinc/33/59/35/1052335935.db2.gz KQJZVEVWTQLXNW-WOJBJXKFSA-N 2 1 312.501 4.006 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000237531499 1052441913 /nfs/dbraw/zinc/44/19/13/1052441913.db2.gz RYMNUSNPZLTGIO-IBGZPJMESA-N 2 1 322.496 4.353 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cc1 ZINC001222141087 1052449614 /nfs/dbraw/zinc/44/96/14/1052449614.db2.gz DPGIIWDYFCBUIJ-NQIIRXRSSA-N 2 1 314.517 4.064 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@H+]3CC[C@]4(C3)CCC[NH2+]C4)cc12 ZINC001222148738 1052450572 /nfs/dbraw/zinc/45/05/72/1052450572.db2.gz SDBPVDCNEWCLNN-OAQYLSRUSA-N 2 1 320.436 4.162 20 0 DIADMP Clc1sc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc12 ZINC001222153960 1052451802 /nfs/dbraw/zinc/45/18/02/1052451802.db2.gz DOBSAFSEFUSQDP-QGZVFWFLSA-N 2 1 320.889 4.130 20 0 DIADMP Clc1sc(C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc12 ZINC001222153960 1052451809 /nfs/dbraw/zinc/45/18/09/1052451809.db2.gz DOBSAFSEFUSQDP-QGZVFWFLSA-N 2 1 320.889 4.130 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CC[C@@]4(C3)CCC[NH2+]C4)c2)cc1 ZINC001222154444 1052452717 /nfs/dbraw/zinc/45/27/17/1052452717.db2.gz MMJABODLBXVVOF-QFIPXVFZSA-N 2 1 320.480 4.238 20 0 DIADMP CCCCc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)cc1 ZINC000315842933 1052452927 /nfs/dbraw/zinc/45/29/27/1052452927.db2.gz KVFSYOOEWWFPGN-MRXNPFEDSA-N 2 1 300.490 4.307 20 0 DIADMP Clc1ccsc1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222161063 1052453539 /nfs/dbraw/zinc/45/35/39/1052453539.db2.gz JZBKQAXXXURDAX-MRXNPFEDSA-N 2 1 312.910 4.147 20 0 DIADMP Clc1ccsc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222161063 1052453545 /nfs/dbraw/zinc/45/35/45/1052453545.db2.gz JZBKQAXXXURDAX-MRXNPFEDSA-N 2 1 312.910 4.147 20 0 DIADMP Fc1ccc(CCC[N@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222161164 1052453666 /nfs/dbraw/zinc/45/36/66/1052453666.db2.gz MDLWWJBVRRXQHI-FQEVSTJZSA-N 2 1 318.480 4.004 20 0 DIADMP Clc1ccccc1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222162130 1052453814 /nfs/dbraw/zinc/45/38/14/1052453814.db2.gz ZEYFHPGDWOSFFU-GOSISDBHSA-N 2 1 306.881 4.086 20 0 DIADMP Clc1ccccc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222162130 1052453819 /nfs/dbraw/zinc/45/38/19/1052453819.db2.gz ZEYFHPGDWOSFFU-GOSISDBHSA-N 2 1 306.881 4.086 20 0 DIADMP Fc1ccc(CCC[N@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)cc1 ZINC001222161165 1052454298 /nfs/dbraw/zinc/45/42/98/1052454298.db2.gz MDLWWJBVRRXQHI-HXUWFJFHSA-N 2 1 318.480 4.004 20 0 DIADMP c1ccc(-c2cccc(C[N@@H+]3CCC[C@]34CCC[NH2+]C4)c2)cc1 ZINC001222247454 1052469202 /nfs/dbraw/zinc/46/92/02/1052469202.db2.gz FTUWVPXJECPJHT-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCC[C@]34CCC[NH2+]C4)c2)cc1 ZINC001222247454 1052469208 /nfs/dbraw/zinc/46/92/08/1052469208.db2.gz FTUWVPXJECPJHT-NRFANRHFSA-N 2 1 306.453 4.072 20 0 DIADMP c1csc(-c2ccccc2C[N@@H+]2CCC[C@@]23CCC[NH2+]C3)c1 ZINC001222247645 1052469347 /nfs/dbraw/zinc/46/93/47/1052469347.db2.gz HFMBOQPNIBQCIK-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP c1csc(-c2ccccc2C[N@H+]2CCC[C@@]23CCC[NH2+]C3)c1 ZINC001222247645 1052469350 /nfs/dbraw/zinc/46/93/50/1052469350.db2.gz HFMBOQPNIBQCIK-LJQANCHMSA-N 2 1 312.482 4.133 20 0 DIADMP C[C@H](C[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1)c1cccc2ccccc21 ZINC001222259781 1052470262 /nfs/dbraw/zinc/47/02/62/1052470262.db2.gz ZCKTZWQSDRYKRI-XMSQKQJNSA-N 2 1 322.496 4.409 20 0 DIADMP C1C[C@@H]2C[C@@H]([NH2+][C@H]3CCCC[C@H]3C3CCCCC3)CC[N@H+]2C1 ZINC000316720167 1052470980 /nfs/dbraw/zinc/47/09/80/1052470980.db2.gz FISYUDXQHLSSMH-YRPNKDGESA-N 2 1 304.522 4.342 20 0 DIADMP c1cc(-c2ccccc2)sc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000316726745 1052471182 /nfs/dbraw/zinc/47/11/82/1052471182.db2.gz GDNLXGUQLANAMO-IAGOWNOFSA-N 2 1 312.482 4.132 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000316783439 1052472385 /nfs/dbraw/zinc/47/23/85/1052472385.db2.gz MXWHIDMSFVFRCC-QLFBSQMISA-N 2 1 300.446 4.129 20 0 DIADMP CCc1c2ccccc2oc1[C@H](C)N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000316783439 1052472391 /nfs/dbraw/zinc/47/23/91/1052472391.db2.gz MXWHIDMSFVFRCC-QLFBSQMISA-N 2 1 300.446 4.129 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001168498574 1052475076 /nfs/dbraw/zinc/47/50/76/1052475076.db2.gz URCAVKRXBBBFAU-FFZOFVMBSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001168498574 1052475083 /nfs/dbraw/zinc/47/50/83/1052475083.db2.gz URCAVKRXBBBFAU-FFZOFVMBSA-N 2 1 318.480 4.096 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001168498574 1052475087 /nfs/dbraw/zinc/47/50/87/1052475087.db2.gz URCAVKRXBBBFAU-FFZOFVMBSA-N 2 1 318.480 4.096 20 0 DIADMP Fc1cccc2c(C[NH+]3CCC4(CCCC[NH2+]4)CC3)cccc12 ZINC001222297523 1052476088 /nfs/dbraw/zinc/47/60/88/1052476088.db2.gz GTDQTZXSXALRNF-UHFFFAOYSA-N 2 1 312.432 4.087 20 0 DIADMP Clc1ccc(Cl)c(C[N@@H+]2CCC[C@@]23CCC[NH2+]CC3)c1 ZINC001222309221 1052478940 /nfs/dbraw/zinc/47/89/40/1052478940.db2.gz OILMFVQHFUVVRW-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP Clc1ccc(Cl)c(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c1 ZINC001222309221 1052478947 /nfs/dbraw/zinc/47/89/47/1052478947.db2.gz OILMFVQHFUVVRW-MRXNPFEDSA-N 2 1 313.272 4.102 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222314532 1052480007 /nfs/dbraw/zinc/48/00/07/1052480007.db2.gz HCGHORJEQCMPCV-HXUWFJFHSA-N 2 1 310.441 4.055 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@@]23CCC[NH2+]CC3)c1 ZINC001222314231 1052480026 /nfs/dbraw/zinc/48/00/26/1052480026.db2.gz DDSSQSBGRCKMSJ-HXUWFJFHSA-N 2 1 300.490 4.092 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222314097 1052480065 /nfs/dbraw/zinc/48/00/65/1052480065.db2.gz CIPVQJPLUBRFMJ-LJQANCHMSA-N 2 1 314.498 4.318 20 0 DIADMP c1ccc(-c2ccccc2C[N@@H+]2CCC[C@]3(CCC[NH2+]3)C2)cc1 ZINC001222353826 1052490049 /nfs/dbraw/zinc/49/00/49/1052490049.db2.gz IJFHGPQJBZDGCO-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(-c2ccccc2C[N@H+]2CCC[C@]3(CCC[NH2+]3)C2)cc1 ZINC001222353826 1052490051 /nfs/dbraw/zinc/49/00/51/1052490051.db2.gz IJFHGPQJBZDGCO-OAQYLSRUSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc(CCCCC[N@@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385651 1052494280 /nfs/dbraw/zinc/49/42/80/1052494280.db2.gz SNSWGERYFMLLTE-HXUWFJFHSA-N 2 1 300.490 4.008 20 0 DIADMP c1ccc(CCCCC[N@H+]2CCC[C@]3(CCCC[NH2+]3)C2)cc1 ZINC001222385651 1052494282 /nfs/dbraw/zinc/49/42/82/1052494282.db2.gz SNSWGERYFMLLTE-HXUWFJFHSA-N 2 1 300.490 4.008 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222390330 1052495133 /nfs/dbraw/zinc/49/51/33/1052495133.db2.gz NHZHDTRSVXRADJ-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222390330 1052495141 /nfs/dbraw/zinc/49/51/41/1052495141.db2.gz NHZHDTRSVXRADJ-OAQYLSRUSA-N 2 1 308.469 4.256 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@]3(CCC[NH2+]3)C2)CC1 ZINC001222465570 1052502717 /nfs/dbraw/zinc/50/27/17/1052502717.db2.gz VGECNVGANXMAQF-VQTJNVASSA-N 2 1 302.506 4.287 20 0 DIADMP CC(C)=CCCC1=CC[C@@H](C[N@H+]2CC[C@@]3(CCC[NH2+]3)C2)CC1 ZINC001222465569 1052502876 /nfs/dbraw/zinc/50/28/76/1052502876.db2.gz VGECNVGANXMAQF-UXHICEINSA-N 2 1 302.506 4.287 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@H]4C[NH2+]CC[C@H]43)cc12 ZINC001222620690 1052518882 /nfs/dbraw/zinc/51/88/82/1052518882.db2.gz XMFYQFCTFWAWFU-MAUKXSAKSA-N 2 1 322.477 4.238 20 0 DIADMP Cc1ccc(-c2ccc(C[N@@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)cc2)cc1 ZINC001222629502 1052520183 /nfs/dbraw/zinc/52/01/83/1052520183.db2.gz KKGGCOYIJCZYGR-SZPZYZBQSA-N 2 1 320.480 4.093 20 0 DIADMP Cc1c(C[N@@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)cccc1-c1ccccc1 ZINC001222629796 1052520590 /nfs/dbraw/zinc/52/05/90/1052520590.db2.gz PGLODTTYIUKOOW-BGYRXZFFSA-N 2 1 320.480 4.093 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000398024651 1052562955 /nfs/dbraw/zinc/56/29/55/1052562955.db2.gz LONIPBNYVRKZLP-UGKGYDQZSA-N 2 1 322.496 4.119 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCCc1ccccc1 ZINC000398024651 1052562958 /nfs/dbraw/zinc/56/29/58/1052562958.db2.gz LONIPBNYVRKZLP-UGKGYDQZSA-N 2 1 322.496 4.119 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000537968062 1052573660 /nfs/dbraw/zinc/57/36/60/1052573660.db2.gz OTYPFSWABHJHQH-NSISKUIASA-N 2 1 311.473 4.144 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCCC[C@H]1c1ccccc1 ZINC000537968063 1052574354 /nfs/dbraw/zinc/57/43/54/1052574354.db2.gz OTYPFSWABHJHQH-UXPWSPDFSA-N 2 1 311.473 4.144 20 0 DIADMP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](CC)C1)c1ccc(Cl)c(Cl)c1 ZINC000037644465 1052628392 /nfs/dbraw/zinc/62/83/92/1052628392.db2.gz ZBAXFELYDGROSV-WBMJQRKESA-N 2 1 315.288 4.376 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(C)s2)c1 ZINC000123881184 1052635018 /nfs/dbraw/zinc/63/50/18/1052635018.db2.gz LOOPTROSRVXZFC-OAHLLOKOSA-N 2 1 302.487 4.359 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)o1 ZINC000124012961 1052636295 /nfs/dbraw/zinc/63/62/95/1052636295.db2.gz JGGIMBARPYBUAV-OAHLLOKOSA-N 2 1 300.446 4.145 20 0 DIADMP CC[N@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1Cl ZINC000125461866 1052649139 /nfs/dbraw/zinc/64/91/39/1052649139.db2.gz VLARMVBGEUDSSJ-UHFFFAOYSA-N 2 1 305.853 4.147 20 0 DIADMP CC[N@@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1Cl ZINC000125461866 1052649142 /nfs/dbraw/zinc/64/91/42/1052649142.db2.gz VLARMVBGEUDSSJ-UHFFFAOYSA-N 2 1 305.853 4.147 20 0 DIADMP CC[C@H]1c2ccsc2CC[N@H+]1CCCCn1cc[nH+]c1C ZINC000125468590 1052649520 /nfs/dbraw/zinc/64/95/20/1052649520.db2.gz GKJHVQWYZYSHIT-INIZCTEOSA-N 2 1 303.475 4.043 20 0 DIADMP CC[C@H]1c2ccsc2CC[N@@H+]1CCCCn1cc[nH+]c1C ZINC000125468590 1052649524 /nfs/dbraw/zinc/64/95/24/1052649524.db2.gz GKJHVQWYZYSHIT-INIZCTEOSA-N 2 1 303.475 4.043 20 0 DIADMP c1ccc(C(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000126646741 1052672452 /nfs/dbraw/zinc/67/24/52/1052672452.db2.gz SYEXMGFSHWIBHT-NHCUHLMSSA-N 2 1 320.480 4.035 20 0 DIADMP C[C@H]1CC([NH2+]C2CC[NH+](CCc3ccccc3)CC2)C[C@H](C)C1 ZINC000321335306 1052674098 /nfs/dbraw/zinc/67/40/98/1052674098.db2.gz QGHAQJVOQFGLTI-QZTJIDSGSA-N 2 1 314.517 4.108 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126887819 1052683526 /nfs/dbraw/zinc/68/35/26/1052683526.db2.gz GVOGDTWVSBVWCE-HOTGVXAUSA-N 2 1 306.519 4.128 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2cccs2)C1)C1CCCC1 ZINC000126887819 1052683528 /nfs/dbraw/zinc/68/35/28/1052683528.db2.gz GVOGDTWVSBVWCE-HOTGVXAUSA-N 2 1 306.519 4.128 20 0 DIADMP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)C[C@@H]1c1ccccc1 ZINC000556063005 1052795369 /nfs/dbraw/zinc/79/53/69/1052795369.db2.gz YTYVYKZDFQWFHY-CEWLAPEOSA-N 2 1 324.443 4.238 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3cc(F)ccc32)C[C@@H]1c1ccccc1 ZINC000556063005 1052795375 /nfs/dbraw/zinc/79/53/75/1052795375.db2.gz YTYVYKZDFQWFHY-CEWLAPEOSA-N 2 1 324.443 4.238 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1 ZINC000556062249 1052795482 /nfs/dbraw/zinc/79/54/82/1052795482.db2.gz RKWSUBMAWIOFFZ-LHDHZVESSA-N 2 1 300.490 4.236 20 0 DIADMP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+][C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1 ZINC000556062249 1052795485 /nfs/dbraw/zinc/79/54/85/1052795485.db2.gz RKWSUBMAWIOFFZ-LHDHZVESSA-N 2 1 300.490 4.236 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]CCC[N@H+](C)Cc1ccccc1 ZINC000070089657 1052814234 /nfs/dbraw/zinc/81/42/34/1052814234.db2.gz BMUXWOBBGQWQPC-INIZCTEOSA-N 2 1 302.487 4.229 20 0 DIADMP Cc1ccsc1[C@H](C)[NH2+]CCC[N@@H+](C)Cc1ccccc1 ZINC000070089657 1052814238 /nfs/dbraw/zinc/81/42/38/1052814238.db2.gz BMUXWOBBGQWQPC-INIZCTEOSA-N 2 1 302.487 4.229 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCCCF)CC[N@@H+]1Cc1ccccc1 ZINC000556497907 1052857283 /nfs/dbraw/zinc/85/72/83/1052857283.db2.gz QVMATDIHKAZPBJ-PKOBYXMFSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)CCCCCF)CC[N@H+]1Cc1ccccc1 ZINC000556497907 1052857287 /nfs/dbraw/zinc/85/72/87/1052857287.db2.gz QVMATDIHKAZPBJ-PKOBYXMFSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497907 1052857292 /nfs/dbraw/zinc/85/72/92/1052857292.db2.gz QVMATDIHKAZPBJ-PKOBYXMFSA-N 2 1 306.469 4.111 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)CCCCCF)CC[NH+]1Cc1ccccc1 ZINC000556497907 1052857296 /nfs/dbraw/zinc/85/72/96/1052857296.db2.gz QVMATDIHKAZPBJ-PKOBYXMFSA-N 2 1 306.469 4.111 20 0 DIADMP CCC[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCC1 ZINC000322361540 1052882252 /nfs/dbraw/zinc/88/22/52/1052882252.db2.gz HDFQHXQGBYOWBF-ICSRJNTNSA-N 2 1 300.490 4.067 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3cccs3)C2)CC1 ZINC000556817981 1052886985 /nfs/dbraw/zinc/88/69/85/1052886985.db2.gz WNGBYFBDFIWBPB-IRXDYDNUSA-N 2 1 304.503 4.049 20 0 DIADMP CC1=CC[C@H]([NH2+]C[C@@H]2CCC[N@@H+](Cc3cccs3)C2)CC1 ZINC000556817981 1052886987 /nfs/dbraw/zinc/88/69/87/1052886987.db2.gz WNGBYFBDFIWBPB-IRXDYDNUSA-N 2 1 304.503 4.049 20 0 DIADMP COc1c(C)cc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc1C ZINC000920179705 1052925523 /nfs/dbraw/zinc/92/55/23/1052925523.db2.gz NTOGVHMAIWEWMT-SFHVURJKSA-N 2 1 318.505 4.056 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+]c1ccc(N2CCC([NH+](C)C)CC2)cc1 ZINC000179841549 1053031038 /nfs/dbraw/zinc/03/10/38/1053031038.db2.gz YEPBTZFWNUYJDF-HOTGVXAUSA-N 2 1 303.494 4.064 20 0 DIADMP CC(C)C[N@@H+](Cc1csc(Cl)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236552426 1053062824 /nfs/dbraw/zinc/06/28/24/1053062824.db2.gz QDKGEFCZUNKYJV-HDJSIYSDSA-N 2 1 300.899 4.129 20 0 DIADMP Cc1ccc(-c2cccc(C[NH+]3CCC4(CCC[NH2+]4)CC3)c2)cc1 ZINC001228556273 1053133692 /nfs/dbraw/zinc/13/36/92/1053133692.db2.gz NBCWVWYIYCOFSN-UHFFFAOYSA-N 2 1 320.480 4.380 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)cc1 ZINC000251449594 1053232686 /nfs/dbraw/zinc/23/26/86/1053232686.db2.gz CFXKMYBLAGPAOW-UYAOXDASSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1 ZINC000251449594 1053232697 /nfs/dbraw/zinc/23/26/97/1053232697.db2.gz CFXKMYBLAGPAOW-UYAOXDASSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000251449594 1053232706 /nfs/dbraw/zinc/23/27/06/1053232706.db2.gz CFXKMYBLAGPAOW-UYAOXDASSA-N 2 1 300.490 4.081 20 0 DIADMP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cc1 ZINC000251449594 1053232716 /nfs/dbraw/zinc/23/27/16/1053232716.db2.gz CFXKMYBLAGPAOW-UYAOXDASSA-N 2 1 300.490 4.081 20 0 DIADMP CC[N@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC001319685170 1053263466 /nfs/dbraw/zinc/26/34/66/1053263466.db2.gz MSNZMHFDEXLAQF-KBXCAEBGSA-N 2 1 306.881 4.039 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1 ZINC001319685173 1053263545 /nfs/dbraw/zinc/26/35/45/1053263545.db2.gz MSNZMHFDEXLAQF-RDTXWAMCSA-N 2 1 306.881 4.039 20 0 DIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC)C1 ZINC001319754869 1053269663 /nfs/dbraw/zinc/26/96/63/1053269663.db2.gz MHQUVRYSBUOFOP-GJZGRUSLSA-N 2 1 324.896 4.121 20 0 DIADMP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC)C1 ZINC001319754869 1053269670 /nfs/dbraw/zinc/26/96/70/1053269670.db2.gz MHQUVRYSBUOFOP-GJZGRUSLSA-N 2 1 324.896 4.121 20 0 DIADMP CC[C@H](C)[C@H](C)[NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001474744498 1053297001 /nfs/dbraw/zinc/29/70/01/1053297001.db2.gz IJAFCJTYGXJVJO-WJRACZLCSA-N 2 1 314.517 4.311 20 0 DIADMP C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1cc(-n2ccnc2)cs1 ZINC001320091050 1053304791 /nfs/dbraw/zinc/30/47/91/1053304791.db2.gz GFSGWMBUJQAZIX-UHFFFAOYSA-N 2 1 322.437 4.047 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC001320599096 1053348326 /nfs/dbraw/zinc/34/83/26/1053348326.db2.gz VJHMTEKMODWKRF-RDTXWAMCSA-N 2 1 306.881 4.113 20 0 DIADMP CC[N@H+]1CCC[C@H](C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1 ZINC001320599090 1053348611 /nfs/dbraw/zinc/34/86/11/1053348611.db2.gz VJHMTEKMODWKRF-KDOFPFPSSA-N 2 1 306.881 4.113 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169718 1053398311 /nfs/dbraw/zinc/39/83/11/1053398311.db2.gz ICLGBMMUXAAJND-NWDGAFQWSA-N 2 1 301.261 4.115 20 0 DIADMP c1c2ccccc2sc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000093563744 1053426877 /nfs/dbraw/zinc/42/68/77/1053426877.db2.gz IERTXUOQZPMQIZ-QGZVFWFLSA-N 2 1 314.498 4.352 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(C)c1 ZINC001200255899 1053502911 /nfs/dbraw/zinc/50/29/11/1053502911.db2.gz RCDGSJDADHNVGW-NSDNCLLMSA-N 2 1 314.517 4.335 20 0 DIADMP C[N@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCSc3c(Cl)cccc32)C1 ZINC000414170851 1053672288 /nfs/dbraw/zinc/67/22/88/1053672288.db2.gz CLDANKWFWROPPA-XJKSGUPXSA-N 2 1 324.921 4.198 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccccc2C)cc1F ZINC000153720551 1053709791 /nfs/dbraw/zinc/70/97/91/1053709791.db2.gz DKURQHGWYUHYOH-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(C)cc2)cc1F ZINC000153730661 1053711628 /nfs/dbraw/zinc/71/16/28/1053711628.db2.gz KRMZZYMDLQVGOS-OAHLLOKOSA-N 2 1 323.415 4.479 20 0 DIADMP C[NH2+][C@@H](C)CC[NH2+][C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC001326035938 1053745109 /nfs/dbraw/zinc/74/51/09/1053745109.db2.gz MSFHUULLRVKMDL-KSSFIOAISA-N 2 1 302.849 4.017 20 0 DIADMP CC1(C)CCCC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309762166 1053751026 /nfs/dbraw/zinc/75/10/26/1053751026.db2.gz YKDZFXCVMRZJTF-RBUKOAKNSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2cccs2)cc1 ZINC000155588642 1053783045 /nfs/dbraw/zinc/78/30/45/1053783045.db2.gz GMRZNOCJMJKDLS-CQSZACIVSA-N 2 1 311.454 4.136 20 0 DIADMP COc1cc(C)c(C[N@H+](C)CCC[NH+]2CCCC2)cc1C(C)C ZINC001231625769 1053805170 /nfs/dbraw/zinc/80/51/70/1053805170.db2.gz APOPDKHBLSSCGL-UHFFFAOYSA-N 2 1 318.505 4.045 20 0 DIADMP COc1cc(C)c(C[N@@H+](C)CCC[NH+]2CCCC2)cc1C(C)C ZINC001231625769 1053805179 /nfs/dbraw/zinc/80/51/79/1053805179.db2.gz APOPDKHBLSSCGL-UHFFFAOYSA-N 2 1 318.505 4.045 20 0 DIADMP CSc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001327616480 1053868497 /nfs/dbraw/zinc/86/84/97/1053868497.db2.gz MLASSWCULNZZBS-RDJZCZTQSA-N 2 1 318.530 4.181 20 0 DIADMP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)s1 ZINC000157853135 1053871579 /nfs/dbraw/zinc/87/15/79/1053871579.db2.gz WWJKVJIXCKMAHL-LSDHHAIUSA-N 2 1 323.550 4.319 20 0 DIADMP CS[C@H]1CCC[C@@H]([NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)C1 ZINC001200672147 1053874017 /nfs/dbraw/zinc/87/40/17/1053874017.db2.gz LWDHNADNGCOPSJ-MOPGFXCFSA-N 2 1 320.546 4.291 20 0 DIADMP C[N@H+]1CC[C@]2(CC[NH+](Cc3ccccc3-c3ccc(F)cc3)C2)C1 ZINC001231824440 1053878577 /nfs/dbraw/zinc/87/85/77/1053878577.db2.gz DSSIBKMCHMVMEV-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@H+](Cc3ccccc3-c3ccc(F)cc3)C2)C1 ZINC001231824440 1053878590 /nfs/dbraw/zinc/87/85/90/1053878590.db2.gz DSSIBKMCHMVMEV-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3ccccc3-c3ccc(F)cc3)C2)C1 ZINC001231824440 1053878599 /nfs/dbraw/zinc/87/85/99/1053878599.db2.gz DSSIBKMCHMVMEV-NRFANRHFSA-N 2 1 324.443 4.020 20 0 DIADMP CC[N@@H+](CCC[NH+](C)C)Cc1sc2scc(C)c2c1C ZINC001231832359 1053887070 /nfs/dbraw/zinc/88/70/70/1053887070.db2.gz NNIFXHSQLXWBCW-UHFFFAOYSA-N 2 1 310.532 4.353 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CCC([NH+]2CCC(F)CC2)CC1 ZINC001231877835 1053902115 /nfs/dbraw/zinc/90/21/15/1053902115.db2.gz WVBWPANOPBQHLP-UHFFFAOYSA-N 2 1 318.480 4.208 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+]Cc1cccc(C2CCCC2)c1 ZINC001200713609 1053916279 /nfs/dbraw/zinc/91/62/79/1053916279.db2.gz DZHKXGNPFUMPSB-UHFFFAOYSA-N 2 1 311.473 4.419 20 0 DIADMP c1c2c[nH+]ccc2[nH]c1C[N@@H+]1CCC[C@H](CCc2ccccc2)C1 ZINC001232019149 1053942747 /nfs/dbraw/zinc/94/27/47/1053942747.db2.gz WSZZJAZYKQNFAC-GOSISDBHSA-N 2 1 319.452 4.408 20 0 DIADMP c1c2c[nH+]ccc2[nH]c1C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC001232015451 1053945485 /nfs/dbraw/zinc/94/54/85/1053945485.db2.gz JBASZDQUNPWFNK-QGZVFWFLSA-N 2 1 305.425 4.333 20 0 DIADMP CC[N@@H+](Cc1ccc(C(C)(C)CC)cc1)C1CCN(C)CC1 ZINC001232080128 1053956615 /nfs/dbraw/zinc/95/66/15/1053956615.db2.gz ASWKYHUGBBGUGL-UHFFFAOYSA-N 2 1 302.506 4.290 20 0 DIADMP CC[NH+]1CCC([N@H+](C)Cc2ccc(C(C)(C)CC)cc2)CC1 ZINC001232081199 1053958508 /nfs/dbraw/zinc/95/85/08/1053958508.db2.gz STNFUEWJCFNVBJ-UHFFFAOYSA-N 2 1 302.506 4.290 20 0 DIADMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(C(C)(C)CC)cc2)CC1 ZINC001232081199 1053958516 /nfs/dbraw/zinc/95/85/16/1053958516.db2.gz STNFUEWJCFNVBJ-UHFFFAOYSA-N 2 1 302.506 4.290 20 0 DIADMP C[NH+](C)Cc1cc(F)cc(C[N@@H+](C)Cc2cccc(Cl)c2)c1 ZINC001232147334 1053971648 /nfs/dbraw/zinc/97/16/48/1053971648.db2.gz OXVDJARINQFXEU-UHFFFAOYSA-N 2 1 320.839 4.173 20 0 DIADMP CC[C@@H](c1ccccc1)[N@@H+](C)Cc1cc(F)cc(C[NH+](C)C)c1 ZINC001232145932 1053971843 /nfs/dbraw/zinc/97/18/43/1053971843.db2.gz FNVBTFDQQCMPTH-FQEVSTJZSA-N 2 1 314.448 4.470 20 0 DIADMP C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@@H]2CC2(F)F)CC1 ZINC000621767879 1054012775 /nfs/dbraw/zinc/01/27/75/1054012775.db2.gz KLQQYYKJCKBZEK-WWDZGPRUSA-N 2 1 322.443 4.065 20 0 DIADMP Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000159215253 1054017841 /nfs/dbraw/zinc/01/78/41/1054017841.db2.gz SXVMAZMDHNUYCQ-LBPRGKRZSA-N 2 1 309.816 4.067 20 0 DIADMP Cc1[nH+]ccn1CCC[N@H+](C)[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000159215253 1054017849 /nfs/dbraw/zinc/01/78/49/1054017849.db2.gz SXVMAZMDHNUYCQ-LBPRGKRZSA-N 2 1 309.816 4.067 20 0 DIADMP C(C1CCCC1)[N@@H+]1CC[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001200837554 1054024542 /nfs/dbraw/zinc/02/45/42/1054024542.db2.gz BWSYNLYFYCPDFH-LJQANCHMSA-N 2 1 304.522 4.344 20 0 DIADMP C(C1CCCC1)[N@H+]1CC[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001200837554 1054024559 /nfs/dbraw/zinc/02/45/59/1054024559.db2.gz BWSYNLYFYCPDFH-LJQANCHMSA-N 2 1 304.522 4.344 20 0 DIADMP CS[C@H]1CC[C@@H]([NH2+]CC(C)(C)C[N@@H+](C)Cc2ccccc2)C1 ZINC001200855328 1054042368 /nfs/dbraw/zinc/04/23/68/1054042368.db2.gz YJVLJKYSXICNQQ-MSOLQXFVSA-N 2 1 320.546 4.018 20 0 DIADMP C[N@@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C(C1CC1)C1CC1 ZINC000164495491 1054057154 /nfs/dbraw/zinc/05/71/54/1054057154.db2.gz KVEKBQPSVJLVDS-UHFFFAOYSA-N 2 1 324.468 4.190 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](CC(C)C)c1cccs1 ZINC000164664405 1054061734 /nfs/dbraw/zinc/06/17/34/1054061734.db2.gz UAUCECPCSICDMA-MRXNPFEDSA-N 2 1 305.491 4.410 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCCC(F)(F)F)CC1 ZINC001334099065 1054182963 /nfs/dbraw/zinc/18/29/63/1054182963.db2.gz YKLGLNMBEYITAL-HNNXBMFYSA-N 2 1 320.443 4.305 20 0 DIADMP CCCC[NH+]1CCC([N@H+](C)Cc2cc(Cl)ccc2C)CC1 ZINC001233251350 1054217147 /nfs/dbraw/zinc/21/71/47/1054217147.db2.gz YAXQPPIHVGTQLN-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(Cl)ccc2C)CC1 ZINC001233251350 1054217160 /nfs/dbraw/zinc/21/71/60/1054217160.db2.gz YAXQPPIHVGTQLN-UHFFFAOYSA-N 2 1 308.897 4.345 20 0 DIADMP CC[C@@H]([NH2+]CCn1cc[nH+]c1C)c1ccc(Cl)cc1Cl ZINC000336839536 1054331286 /nfs/dbraw/zinc/33/12/86/1054331286.db2.gz OWGOHXPFOGJQLX-OAHLLOKOSA-N 2 1 312.244 4.239 20 0 DIADMP CC[C@H](C)c1ccc(NC(=[NH2+])NCC[N@H+]2CCCC[C@@H]2C)cc1 ZINC000849062169 1054369158 /nfs/dbraw/zinc/36/91/58/1054369158.db2.gz JFNAJUGUXKLTBN-HOTGVXAUSA-N 2 1 316.493 4.011 20 0 DIADMP C[C@H](CC[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000379849447 1054425294 /nfs/dbraw/zinc/42/52/94/1054425294.db2.gz GIVOUSLPMPYLOX-TZIWHRDSSA-N 2 1 322.496 4.292 20 0 DIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000339293403 1054495519 /nfs/dbraw/zinc/49/55/19/1054495519.db2.gz MYETZFMHPYFXLC-DNVCBOLYSA-N 2 1 314.498 4.199 20 0 DIADMP Cc1sccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000339293403 1054495525 /nfs/dbraw/zinc/49/55/25/1054495525.db2.gz MYETZFMHPYFXLC-DNVCBOLYSA-N 2 1 314.498 4.199 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000671309301 1054554204 /nfs/dbraw/zinc/55/42/04/1054554204.db2.gz SBMRLSJVTBEGPG-RTBURBONSA-N 2 1 320.908 4.440 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267228 1054561472 /nfs/dbraw/zinc/56/14/72/1054561472.db2.gz WGDUCIZWVNVASS-JKSUJKDBSA-N 2 1 308.535 4.232 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CCC[N@@H+](Cc2cccs2)C1)C(C)(C)C ZINC000670267228 1054561488 /nfs/dbraw/zinc/56/14/88/1054561488.db2.gz WGDUCIZWVNVASS-JKSUJKDBSA-N 2 1 308.535 4.232 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1cccc(C(F)(F)F)c1 ZINC000623335742 1054561746 /nfs/dbraw/zinc/56/17/46/1054561746.db2.gz BTDFYVYUBVBPAQ-DOMZBBRYSA-N 2 1 314.395 4.229 20 0 DIADMP C[N@H+]1CC[C@@H](N[C@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344393 1054564347 /nfs/dbraw/zinc/56/43/47/1054564347.db2.gz KRTMMDCRRMCKDR-HIFRSBDPSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@@H+]1CC[C@@H]([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344393 1054564382 /nfs/dbraw/zinc/56/43/82/1054564382.db2.gz KRTMMDCRRMCKDR-HIFRSBDPSA-N 2 1 324.921 4.339 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@H]2CCSc3ccc(Cl)cc32)CC1(C)C ZINC000623344393 1054564395 /nfs/dbraw/zinc/56/43/95/1054564395.db2.gz KRTMMDCRRMCKDR-HIFRSBDPSA-N 2 1 324.921 4.339 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409763 1054587691 /nfs/dbraw/zinc/58/76/91/1054587691.db2.gz OCUDWENNWWETKE-UKRRQHHQSA-N 2 1 302.487 4.425 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409763 1054587702 /nfs/dbraw/zinc/58/77/02/1054587702.db2.gz OCUDWENNWWETKE-UKRRQHHQSA-N 2 1 302.487 4.425 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409762 1054587952 /nfs/dbraw/zinc/58/79/52/1054587952.db2.gz OCUDWENNWWETKE-HIFRSBDPSA-N 2 1 302.487 4.425 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1cc2ccccc2s1 ZINC000623409762 1054587971 /nfs/dbraw/zinc/58/79/71/1054587971.db2.gz OCUDWENNWWETKE-HIFRSBDPSA-N 2 1 302.487 4.425 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)c1ccc(-c2cccnc2)cc1 ZINC000623439081 1054594112 /nfs/dbraw/zinc/59/41/12/1054594112.db2.gz VAIHHAORRBRFFE-UZLBHIALSA-N 2 1 323.484 4.272 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc2ccccc2c1 ZINC000177370423 1054619627 /nfs/dbraw/zinc/61/96/27/1054619627.db2.gz GNJHEPTVGPFYTD-INIZCTEOSA-N 2 1 307.441 4.476 20 0 DIADMP c1ccc(Oc2ccc(C[N@@H+]3CCC[C@@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234992564 1054638885 /nfs/dbraw/zinc/63/88/85/1054638885.db2.gz KMQRYKUKICTXOR-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP c1ccc(Oc2ccc(C[N@H+]3CCC[C@@]4(CC[NH2+]C4)C3)cc2)cc1 ZINC001234992564 1054638888 /nfs/dbraw/zinc/63/88/88/1054638888.db2.gz KMQRYKUKICTXOR-NRFANRHFSA-N 2 1 322.452 4.054 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCC[C@]4(CC[NH2+]C4)C3)c2)cc1 ZINC001235000274 1054640371 /nfs/dbraw/zinc/64/03/71/1054640371.db2.gz QCTZOQKSULBAJY-JOCHJYFZSA-N 2 1 320.480 4.238 20 0 DIADMP Fc1ccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1-c1ccccc1 ZINC001235002043 1054640640 /nfs/dbraw/zinc/64/06/40/1054640640.db2.gz WYGLZYRNYUAFPB-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP Fc1ccc(C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cc1-c1ccccc1 ZINC001235002043 1054640646 /nfs/dbraw/zinc/64/06/46/1054640646.db2.gz WYGLZYRNYUAFPB-NRFANRHFSA-N 2 1 324.443 4.068 20 0 DIADMP CCCCCCc1csc(C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001235036268 1054643009 /nfs/dbraw/zinc/64/30/09/1054643009.db2.gz KGWBJHOBCWEYKR-GOSISDBHSA-N 2 1 306.519 4.056 20 0 DIADMP c1ccc(CCCCC[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)cc1 ZINC001235039971 1054644096 /nfs/dbraw/zinc/64/40/96/1054644096.db2.gz JTMIVYMFRYZGME-FQEVSTJZSA-N 2 1 300.490 4.008 20 0 DIADMP Fc1cccc2c(C[N@H+]3CCC[C@]4(CCC[NH2+]4)CC3)cccc12 ZINC001235038407 1054644288 /nfs/dbraw/zinc/64/42/88/1054644288.db2.gz IZNQXPGTWIVZFN-HXUWFJFHSA-N 2 1 312.432 4.087 20 0 DIADMP c1cc2c(cccc2C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)s1 ZINC001235036699 1054644421 /nfs/dbraw/zinc/64/44/21/1054644421.db2.gz AWHKCEIAFHJITL-SFHVURJKSA-N 2 1 300.471 4.009 20 0 DIADMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)CC2)c1 ZINC001235046295 1054646374 /nfs/dbraw/zinc/64/63/74/1054646374.db2.gz PCJVLEAATOUBPW-FQEVSTJZSA-N 2 1 300.490 4.092 20 0 DIADMP COC(C)(C)CCC[C@H](C)CC[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235041712 1054647583 /nfs/dbraw/zinc/64/75/83/1054647583.db2.gz RWVPATXWLUXCQV-ICSRJNTNSA-N 2 1 324.553 4.216 20 0 DIADMP Fc1ccc(-c2ccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)cc2)cc1 ZINC001235092494 1054653603 /nfs/dbraw/zinc/65/36/03/1054653603.db2.gz KDFAAAKIAUEYHW-UHFFFAOYSA-N 2 1 324.443 4.068 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3CCC4(C3)CC[NH2+]CC4)c2)cc1 ZINC001235092268 1054654405 /nfs/dbraw/zinc/65/44/05/1054654405.db2.gz KEWVUPHZEUCEBG-UHFFFAOYSA-N 2 1 320.480 4.238 20 0 DIADMP Fc1ccc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)cc1-c1ccccc1 ZINC001235092307 1054654891 /nfs/dbraw/zinc/65/48/91/1054654891.db2.gz LQIJNUZUMQONCO-UHFFFAOYSA-N 2 1 324.443 4.068 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)s1 ZINC001235094194 1054656953 /nfs/dbraw/zinc/65/69/53/1054656953.db2.gz IEDSDLNGVSGFLL-UHFFFAOYSA-N 2 1 320.546 4.446 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@@H+]3CCC34CC[NH2+]CC4)cc12 ZINC001235102986 1054657030 /nfs/dbraw/zinc/65/70/30/1054657030.db2.gz PJEALCDBGIIPQI-UHFFFAOYSA-N 2 1 322.477 4.382 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CCC34CC[NH2+]CC4)cc12 ZINC001235102986 1054657039 /nfs/dbraw/zinc/65/70/39/1054657039.db2.gz PJEALCDBGIIPQI-UHFFFAOYSA-N 2 1 322.477 4.382 20 0 DIADMP C[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)Cc1ccco1)c1ccoc1 ZINC000178782615 1054660338 /nfs/dbraw/zinc/66/03/38/1054660338.db2.gz SVTLUQOGPNTNHY-INIZCTEOSA-N 2 1 324.424 4.355 20 0 DIADMP c1ccc(-c2cccc(C[N@H+]3CCCC34CC[NH2+]CC4)c2)cc1 ZINC001235144459 1054664547 /nfs/dbraw/zinc/66/45/47/1054664547.db2.gz LMCZEUTYNSJKAX-UHFFFAOYSA-N 2 1 306.453 4.072 20 0 DIADMP c1ccc2c(c1)oc1ccc(C[N@H+]3CCCC34CC[NH2+]CC4)cc12 ZINC001235140209 1054664596 /nfs/dbraw/zinc/66/45/96/1054664596.db2.gz GMYKMPXWNSXJIE-UHFFFAOYSA-N 2 1 320.436 4.304 20 0 DIADMP CC(C)c1ccc(C[C@@H](C)C[N@H+]2CCCC23CC[NH2+]CC3)cc1 ZINC001235141788 1054665399 /nfs/dbraw/zinc/66/53/99/1054665399.db2.gz YXBAXMJHTUPGJD-GOSISDBHSA-N 2 1 314.517 4.207 20 0 DIADMP Cc1ccc(C[N@H+]2CCCC[C@H]2C2CC[NH2+]CC2)cc1Cl ZINC001235160717 1054669590 /nfs/dbraw/zinc/66/95/90/1054669590.db2.gz QJMFTGAROSDSGS-SFHVURJKSA-N 2 1 306.881 4.003 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)CC1 ZINC001235187188 1054677970 /nfs/dbraw/zinc/67/79/70/1054677970.db2.gz SSMQAUBMDJQFRX-ZCNNSNEGSA-N 2 1 302.506 4.001 20 0 DIADMP Cc1ccc(-c2ccc(C[N@H+]3CCCCC34CC[NH2+]CC4)cc2)o1 ZINC001235189515 1054680581 /nfs/dbraw/zinc/68/05/81/1054680581.db2.gz KWMRNMDHIJTCHN-UHFFFAOYSA-N 2 1 324.468 4.363 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235189588 1054681095 /nfs/dbraw/zinc/68/10/95/1054681095.db2.gz MUKAQWWCNXXTAJ-UHFFFAOYSA-N 2 1 308.469 4.256 20 0 DIADMP CC1=C[C@@H](C)[C@@H](C[N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)CC1 ZINC001235247244 1054692681 /nfs/dbraw/zinc/69/26/81/1054692681.db2.gz BQBPPVUIGRFQCF-ZHHKINOHSA-N 2 1 324.512 4.200 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cccc(OC(C)C)c1 ZINC000179664567 1054694653 /nfs/dbraw/zinc/69/46/53/1054694653.db2.gz RXTKLMIGTZXQNJ-MRXNPFEDSA-N 2 1 315.461 4.110 20 0 DIADMP CCCCCCc1ccc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)s1 ZINC001235266061 1054695477 /nfs/dbraw/zinc/69/54/77/1054695477.db2.gz XFIJKIOFTAORKY-QAPCUYQASA-N 2 1 306.519 4.055 20 0 DIADMP CCCCCCc1ccc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)s1 ZINC001235266061 1054695480 /nfs/dbraw/zinc/69/54/80/1054695480.db2.gz XFIJKIOFTAORKY-QAPCUYQASA-N 2 1 306.519 4.055 20 0 DIADMP c1ccc2c(c1)sc1c2cccc1C[N@H+]1CC[C@@H]2[NH2+]CC[C@H]2C1 ZINC001235272729 1054697711 /nfs/dbraw/zinc/69/77/11/1054697711.db2.gz QVDPMNUJIPGRFG-KSSFIOAISA-N 2 1 322.477 4.238 20 0 DIADMP Cc1ccc(-c2cccc(C[NH+]3C[C@H]4CC[N@H+](C)C[C@H]4C3)c2)cc1 ZINC001235310322 1054697949 /nfs/dbraw/zinc/69/79/49/1054697949.db2.gz IKEVQODIUASBQG-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccc(-c2cccc(C[N@H+]3C[C@H]4CC[NH+](C)C[C@H]4C3)c2)cc1 ZINC001235310322 1054697957 /nfs/dbraw/zinc/69/79/57/1054697957.db2.gz IKEVQODIUASBQG-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP Cc1ccc(-c2cccc(C[N@@H+]3C[C@H]4CC[NH+](C)C[C@H]4C3)c2)cc1 ZINC001235310322 1054697963 /nfs/dbraw/zinc/69/79/63/1054697963.db2.gz IKEVQODIUASBQG-YADHBBJMSA-N 2 1 320.480 4.046 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)cc12 ZINC001235274109 1054698086 /nfs/dbraw/zinc/69/80/86/1054698086.db2.gz UUZMJAGTTWBEIB-CRAIPNDOSA-N 2 1 322.477 4.238 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3CC[C@H]4[NH2+]CC[C@@H]4C3)cc12 ZINC001235274109 1054698092 /nfs/dbraw/zinc/69/80/92/1054698092.db2.gz UUZMJAGTTWBEIB-CRAIPNDOSA-N 2 1 322.477 4.238 20 0 DIADMP Cc1ccc(-c2cccc(C[NH+]3CCC([NH+]4CCC4)CC3)c2)cc1 ZINC001235321989 1054700732 /nfs/dbraw/zinc/70/07/32/1054700732.db2.gz YJGUWKGKOCMFNK-UHFFFAOYSA-N 2 1 320.480 4.332 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)CC1 ZINC001235348092 1054706483 /nfs/dbraw/zinc/70/64/83/1054706483.db2.gz AAUQAUXURIWSEM-BDKRGJGYSA-N 2 1 324.512 4.058 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@@]23CC[N@H+](CCCC2CCCC2)C3)cc1 ZINC001235350227 1054706820 /nfs/dbraw/zinc/70/68/20/1054706820.db2.gz XKYDKMIVEIEGAN-NHCUHLMSSA-N 2 1 312.501 4.036 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)CC12CC([NH3+])(C1)C2 ZINC001235350870 1054707125 /nfs/dbraw/zinc/70/71/25/1054707125.db2.gz VFWRINGFALPFPP-RPCJCACASA-N 2 1 306.453 4.131 20 0 DIADMP c1ccc([C@H]2C[NH2+]C[C@@]23CC[N@H+](CCC2CCCCC2)C3)cc1 ZINC001235349638 1054707295 /nfs/dbraw/zinc/70/72/95/1054707295.db2.gz SIGXHKQSHAXJCF-NHCUHLMSSA-N 2 1 312.501 4.036 20 0 DIADMP c1cc(C2CCC2)ccc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235427752 1054716102 /nfs/dbraw/zinc/71/61/02/1054716102.db2.gz ODOPRYREGUUDJV-LEWJYISDSA-N 2 1 312.501 4.166 20 0 DIADMP c1ccc2cc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)ccc2c1 ZINC001235426708 1054716321 /nfs/dbraw/zinc/71/63/21/1054716321.db2.gz QNIBDDZHBIZNGX-NHCUHLMSSA-N 2 1 308.469 4.051 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235428607 1054717360 /nfs/dbraw/zinc/71/73/60/1054717360.db2.gz OPNIDBIPNZJDLG-WOJBJXKFSA-N 2 1 322.496 4.360 20 0 DIADMP c1cc(-c2ccccc2)oc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC001235431732 1054718953 /nfs/dbraw/zinc/71/89/53/1054718953.db2.gz VRHUEKAPRUJWNO-OALUTQOASA-N 2 1 324.468 4.158 20 0 DIADMP Cc1ccc2ccccc2c1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235428588 1054719277 /nfs/dbraw/zinc/71/92/77/1054719277.db2.gz OPNIDBIPNZJDLG-UXHICEINSA-N 2 1 322.496 4.360 20 0 DIADMP C[N@H+](Cc1c(Cl)cc(Cl)cc1Cl)CC1CC[NH2+]CC1 ZINC001235433816 1054719779 /nfs/dbraw/zinc/71/97/79/1054719779.db2.gz RPVXWTAOGFKTJC-UHFFFAOYSA-N 2 1 321.679 4.078 20 0 DIADMP C[N@H+](Cc1ccc(/C=C/c2ccccc2)cc1)CC1CC[NH2+]CC1 ZINC001235433971 1054720019 /nfs/dbraw/zinc/72/00/19/1054720019.db2.gz UBRJRWMBGCDMQD-BQYQJAHWSA-N 2 1 320.480 4.288 20 0 DIADMP Cc1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c(C)c1Cl ZINC001235430091 1054720186 /nfs/dbraw/zinc/72/01/86/1054720186.db2.gz DFOSFTBXEXKXHL-AEFFLSMTSA-N 2 1 320.908 4.168 20 0 DIADMP Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001235427808 1054720214 /nfs/dbraw/zinc/72/02/14/1054720214.db2.gz OHUFHLXTWYLEJQ-IAGOWNOFSA-N 2 1 320.908 4.168 20 0 DIADMP C[N@@H+](Cc1c2ccccc2[nH]c1-c1ccccc1)C1CC[NH2+]CC1 ZINC001235464357 1054729713 /nfs/dbraw/zinc/72/97/13/1054729713.db2.gz DLCGMKPUGADWFI-UHFFFAOYSA-N 2 1 319.452 4.019 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000180113860 1054735514 /nfs/dbraw/zinc/73/55/14/1054735514.db2.gz DSQACTBMAPFPTC-SVPXJYONSA-N 2 1 300.490 4.206 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000180132497 1054736028 /nfs/dbraw/zinc/73/60/28/1054736028.db2.gz SWSJMZIQKGAQOT-GOSISDBHSA-N 2 1 317.864 4.366 20 0 DIADMP Cc1ccc2c(C)cc(NC3CC[NH+](CC4CC4)CC3)[nH+]c2c1 ZINC000515555287 1054750494 /nfs/dbraw/zinc/75/04/94/1054750494.db2.gz YXBQDBRZWYPSJC-UHFFFAOYSA-N 2 1 309.457 4.138 20 0 DIADMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCCCOC(C)C)cc1 ZINC000180464067 1054757903 /nfs/dbraw/zinc/75/79/03/1054757903.db2.gz BXPDVUGETYCINE-INIZCTEOSA-N 2 1 315.461 4.037 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](CCC[NH2+]C3CCCCC3)C2)cc1 ZINC001235665694 1054762740 /nfs/dbraw/zinc/76/27/40/1054762740.db2.gz QFOGUQXPIKYEIT-IBGZPJMESA-N 2 1 300.490 4.178 20 0 DIADMP C[NH+](C)CCc1ccc(CNc2[nH+]ccc3cc(F)ccc32)cc1 ZINC000519147922 1054765071 /nfs/dbraw/zinc/76/50/71/1054765071.db2.gz ZWFNBXHUIFLJEO-UHFFFAOYSA-N 2 1 323.415 4.090 20 0 DIADMP C[N@@H+](Cc1ccc2c(c1)C[NH2+]CC2)Cc1cccc2ccccc21 ZINC001235661954 1054765303 /nfs/dbraw/zinc/76/53/03/1054765303.db2.gz AZMKJGVYBHHXQQ-UHFFFAOYSA-N 2 1 316.448 4.118 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccccc2-c2ccccc2Cl)C1 ZINC001235675330 1054769343 /nfs/dbraw/zinc/76/93/43/1054769343.db2.gz VROZMGSMEGTSBQ-OAHLLOKOSA-N 2 1 314.860 4.178 20 0 DIADMP [NH3+]C[C@H]1CCC[N@@H+](Cc2ccc(/C=C/c3ccccc3)cc2)C1 ZINC001235674533 1054772272 /nfs/dbraw/zinc/77/22/72/1054772272.db2.gz GRVWAQMINJTWLH-MHNQQFQPSA-N 2 1 306.453 4.028 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccc2c(c1)CC[NH2+]C2 ZINC001235677872 1054772419 /nfs/dbraw/zinc/77/24/19/1054772419.db2.gz JGWJJMHQGNTVCP-NRFANRHFSA-N 2 1 324.443 4.199 20 0 DIADMP CCCCCOc1ccc(C[N@@H+](C)CCC2CC[NH2+]CC2)cc1 ZINC001235715151 1054784683 /nfs/dbraw/zinc/78/46/83/1054784683.db2.gz PVZMWVJFMGFURJ-UHFFFAOYSA-N 2 1 318.505 4.077 20 0 DIADMP CC(C)c1cc(C[N@@H+](C)CCC2CC[NH2+]CC2)ccc1Cl ZINC001235717425 1054789905 /nfs/dbraw/zinc/78/99/05/1054789905.db2.gz FNAUBOVGBGXZPP-UHFFFAOYSA-N 2 1 308.897 4.285 20 0 DIADMP CCC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(C)sc1C ZINC000623866235 1054794671 /nfs/dbraw/zinc/79/46/71/1054794671.db2.gz PHSNVHFKEBFCFP-JZXOWHBKSA-N 2 1 306.519 4.423 20 0 DIADMP Cc1cc(C[NH+]2CCC(C)([NH3+])CC2)ccc1Oc1ccccc1 ZINC001235751965 1054798083 /nfs/dbraw/zinc/79/80/83/1054798083.db2.gz GHSQIIGXUNVQMS-UHFFFAOYSA-N 2 1 310.441 4.101 20 0 DIADMP CC[N@@H+](Cc1cccc(Oc2ccc(C)cc2)c1)C1CC[NH2+]CC1 ZINC001235762263 1054800943 /nfs/dbraw/zinc/80/09/43/1054800943.db2.gz QXQYUCNUCRLWJM-UHFFFAOYSA-N 2 1 324.468 4.361 20 0 DIADMP [NH3+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2oc3ccccc3c2c1 ZINC001235774537 1054803204 /nfs/dbraw/zinc/80/32/04/1054803204.db2.gz BEDHJSOSQSCZFP-MQVJKMGUSA-N 2 1 306.409 4.040 20 0 DIADMP C[N@H+](Cc1ccc2c(c1)C[NH2+]C2)Cc1cccc(Cl)c1Cl ZINC001235790294 1054806105 /nfs/dbraw/zinc/80/61/05/1054806105.db2.gz JUCBJYMIKBNKFA-UHFFFAOYSA-N 2 1 321.251 4.229 20 0 DIADMP C[N@@H+](Cc1ccc2c(c1)C[NH2+]C2)Cc1cccc(Cl)c1Cl ZINC001235790294 1054806112 /nfs/dbraw/zinc/80/61/12/1054806112.db2.gz JUCBJYMIKBNKFA-UHFFFAOYSA-N 2 1 321.251 4.229 20 0 DIADMP C[NH2+]C1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CC1 ZINC001235788055 1054806455 /nfs/dbraw/zinc/80/64/55/1054806455.db2.gz BJOVEEGLQOGMDV-UHFFFAOYSA-N 2 1 314.860 4.191 20 0 DIADMP c1ccc([C@H]2c3ccccc3CC[N@@H+]2CC[C@@H]2CCCC[NH2+]2)cc1 ZINC001235796652 1054807277 /nfs/dbraw/zinc/80/72/77/1054807277.db2.gz UFQYIAAQEZTXAH-UNMCSNQZSA-N 2 1 320.480 4.166 20 0 DIADMP CC(C)(C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH3+])C2)Sc1ccc(Cl)cc1 ZINC001235808269 1054810257 /nfs/dbraw/zinc/81/02/57/1054810257.db2.gz ADWRXBZMEADZSL-QDMKHBRRSA-N 2 1 324.921 4.165 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)cc1 ZINC001235808421 1054811327 /nfs/dbraw/zinc/81/13/27/1054811327.db2.gz DAYZUVFJYXLIHT-REPLKXPHSA-N 2 1 316.489 4.100 20 0 DIADMP Cc1cc(Oc2ccccc2)ccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH3+])C2 ZINC001235812442 1054812642 /nfs/dbraw/zinc/81/26/42/1054812642.db2.gz WARFAFXMILWGFV-REPLKXPHSA-N 2 1 322.452 4.241 20 0 DIADMP [NH3+]CCCC[N@H+]1CCCC[C@H]1C(c1ccccc1)c1ccccc1 ZINC001235825017 1054816163 /nfs/dbraw/zinc/81/61/63/1054816163.db2.gz GIADCTGHXRRYDM-NRFANRHFSA-N 2 1 322.496 4.412 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2Cc2ccc3c(c2)C[NH2+]C3)s1 ZINC001235839222 1054818486 /nfs/dbraw/zinc/81/84/86/1054818486.db2.gz OBPQPJZGMXXKPY-OAHLLOKOSA-N 2 1 318.873 4.342 20 0 DIADMP CC(C)C[C@@H](C)C[C@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001474595446 1054837059 /nfs/dbraw/zinc/83/70/59/1054837059.db2.gz LJHBBUCJECKALF-JYRKZWEQSA-N 2 1 316.533 4.382 20 0 DIADMP CC(C)C[C@H](C)C[C@@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001474595453 1054837170 /nfs/dbraw/zinc/83/71/70/1054837170.db2.gz LJHBBUCJECKALF-ZSXPUABSSA-N 2 1 316.533 4.382 20 0 DIADMP CC(C)(C[N@H+]1CCC[C@H]1CC[NH3+])Sc1ccc(Cl)cc1 ZINC001235925696 1054849663 /nfs/dbraw/zinc/84/96/63/1054849663.db2.gz XQVXLGQOTLZSEP-AWEZNQCLSA-N 2 1 312.910 4.024 20 0 DIADMP c1ccc2c(c1)sc1ccc(C[N@H+]3C[C@@H]4CC[NH2+]C[C@@H]4C3)cc12 ZINC001235940335 1054858587 /nfs/dbraw/zinc/85/85/87/1054858587.db2.gz SJOQTZHQCWGDEL-JKSUJKDBSA-N 2 1 322.477 4.096 20 0 DIADMP c1ccc(CC[N@H+](CCC2CC[NH2+]CC2)Cc2ccccc2)cc1 ZINC001235949144 1054863571 /nfs/dbraw/zinc/86/35/71/1054863571.db2.gz XZORQXQSPQWXIK-UHFFFAOYSA-N 2 1 322.496 4.121 20 0 DIADMP [NH3+]C12CC(CC[N@@H+](CCc3ccccc3)Cc3ccccc3)(C1)C2 ZINC001235948882 1054864333 /nfs/dbraw/zinc/86/43/33/1054864333.db2.gz VJYYNOFSIIGDAI-UHFFFAOYSA-N 2 1 320.480 4.003 20 0 DIADMP C[C@H](Cc1ccc(C(C)(C)C)cc1)C[N@@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC001235950842 1054866452 /nfs/dbraw/zinc/86/64/52/1054866452.db2.gz NWUVJWKQSLDZQY-IEBWSBKVSA-N 2 1 316.533 4.094 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C[C@H]1CCC[NH2+]C1 ZINC001235952487 1054867215 /nfs/dbraw/zinc/86/72/15/1054867215.db2.gz YANHDCSJRPHKEJ-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C[C@H]1CCC[NH2+]C1 ZINC001235952487 1054867219 /nfs/dbraw/zinc/86/72/19/1054867219.db2.gz YANHDCSJRPHKEJ-AWEZNQCLSA-N 2 1 318.848 4.031 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC001235951330 1054868144 /nfs/dbraw/zinc/86/81/44/1054868144.db2.gz QEJVUKAVZLXCBR-LJQANCHMSA-N 2 1 318.505 4.077 20 0 DIADMP c1ccc(C[N@H+](Cc2ccc3c(c2)C[NH2+]C3)C2CCCCC2)nc1 ZINC001235962902 1054872195 /nfs/dbraw/zinc/87/21/95/1054872195.db2.gz QEOZFJJSCLOPPL-UHFFFAOYSA-N 2 1 321.468 4.020 20 0 DIADMP C[C@@H](CCc1ccc(Cl)s1)[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000624121987 1054883419 /nfs/dbraw/zinc/88/34/19/1054883419.db2.gz HHRWXAAMCMBQCO-KBPBESRZSA-N 2 1 314.926 4.044 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045328 1054913277 /nfs/dbraw/zinc/91/32/77/1054913277.db2.gz BXKMKSXOWGYJNI-RDJZCZTQSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@H]1C[C@H]([NH3+])C[N@@H+](Cc2c3ccccc3[nH]c2-c2ccccc2)C1 ZINC001236045328 1054913292 /nfs/dbraw/zinc/91/32/92/1054913292.db2.gz BXKMKSXOWGYJNI-RDJZCZTQSA-N 2 1 319.452 4.004 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051693 1054915699 /nfs/dbraw/zinc/91/56/99/1054915699.db2.gz XZPALSMNFPPSFT-RHSMWYFYSA-N 2 1 314.860 4.176 20 0 DIADMP C[C@@H]1C[C@@H]([NH3+])C[N@@H+](Cc2ccc(-c3ccccc3Cl)cc2)C1 ZINC001236051693 1054915704 /nfs/dbraw/zinc/91/57/04/1054915704.db2.gz XZPALSMNFPPSFT-RHSMWYFYSA-N 2 1 314.860 4.176 20 0 DIADMP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001236068265 1054924024 /nfs/dbraw/zinc/92/40/24/1054924024.db2.gz XFDCMWQMMOXVNL-MRXNPFEDSA-N 2 1 314.860 4.048 20 0 DIADMP C[C@H]1C[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CCC[NH2+]1 ZINC001236100072 1054943902 /nfs/dbraw/zinc/94/39/02/1054943902.db2.gz CQPRYOHAHBURHL-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP C[C@H]1C[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)CCC[NH2+]1 ZINC001236100072 1054943910 /nfs/dbraw/zinc/94/39/10/1054943910.db2.gz CQPRYOHAHBURHL-HNNXBMFYSA-N 2 1 314.860 4.191 20 0 DIADMP CCC[N@@H+](Cc1cc(Cl)ccc1SC)C1CC[NH2+]CC1 ZINC001236184772 1054983946 /nfs/dbraw/zinc/98/39/46/1054983946.db2.gz ONLIJWZXSJTTBP-UHFFFAOYSA-N 2 1 312.910 4.026 20 0 DIADMP CCC[N@@H+](Cc1cc(-c2ccsc2)cs1)C1CC[NH2+]CC1 ZINC001236183929 1054984503 /nfs/dbraw/zinc/98/45/03/1054984503.db2.gz BWTXFQVDDSXHII-UHFFFAOYSA-N 2 1 320.527 4.441 20 0 DIADMP CCC[N@@H+](Cc1cc(Cl)c(F)c(Cl)c1)C1CC[NH2+]CC1 ZINC001236184406 1054984809 /nfs/dbraw/zinc/98/48/09/1054984809.db2.gz KYUZDHVREMWTMS-UHFFFAOYSA-N 2 1 319.251 4.097 20 0 DIADMP CC[N@@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1cccc(Cl)c1 ZINC001236191678 1054990034 /nfs/dbraw/zinc/99/00/34/1054990034.db2.gz CDPSEPSQGHFKAZ-UHFFFAOYSA-N 2 1 320.889 4.069 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@H]2c2c[nH]c3ccccc23)CC1 ZINC001236194697 1054994273 /nfs/dbraw/zinc/99/42/73/1054994273.db2.gz WNTUODPESRNSSG-FQEVSTJZSA-N 2 1 311.473 4.037 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+](C)[C@@]1(C)CCC[NH2+]C1 ZINC001236206715 1054998921 /nfs/dbraw/zinc/99/89/21/1054998921.db2.gz LGOWGZXVIRBNLE-NRFANRHFSA-N 2 1 308.469 4.236 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@H+](C)[C@@]1(C)CCC[NH2+]C1 ZINC001236206715 1054998932 /nfs/dbraw/zinc/99/89/32/1054998932.db2.gz LGOWGZXVIRBNLE-NRFANRHFSA-N 2 1 308.469 4.236 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2ccc(Cl)c(C(C)C)c2)CC1 ZINC001236214914 1055000707 /nfs/dbraw/zinc/00/07/07/1055000707.db2.gz KWLCLZLYEQXQKP-UHFFFAOYSA-N 2 1 308.897 4.426 20 0 DIADMP COc1ccccc1-c1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2[NH3+])cc1 ZINC001236215247 1055000904 /nfs/dbraw/zinc/00/09/04/1055000904.db2.gz GDDHFWZQTZDBQZ-UXHICEINSA-N 2 1 324.468 4.064 20 0 DIADMP COc1ccccc1-c1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2[NH3+])cc1 ZINC001236215247 1055000917 /nfs/dbraw/zinc/00/09/17/1055000917.db2.gz GDDHFWZQTZDBQZ-UXHICEINSA-N 2 1 324.468 4.064 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)CC[C@@H](C)CCCC(C)(C)OC)CC1 ZINC001236213947 1055001761 /nfs/dbraw/zinc/00/17/61/1055001761.db2.gz ZKKTUALCRDPLSV-AOCRQIFASA-N 2 1 312.542 4.070 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236218446 1055004022 /nfs/dbraw/zinc/00/40/22/1055004022.db2.gz RXSQBYQXPDJFPC-UXHICEINSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccc(F)cc2)cc1)[C@H]1CCCC[C@H]1[NH3+] ZINC001236218446 1055004034 /nfs/dbraw/zinc/00/40/34/1055004034.db2.gz RXSQBYQXPDJFPC-UXHICEINSA-N 2 1 312.432 4.194 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1cccs1)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236216621 1055005067 /nfs/dbraw/zinc/00/50/67/1055005067.db2.gz KVQVCEBLKSODAJ-IRXDYDNUSA-N 2 1 300.471 4.117 20 0 DIADMP C[NH2+]C1CCC([N@@H+](C)Cc2cc(-c3ccsc3)cs2)CC1 ZINC001236216308 1055005440 /nfs/dbraw/zinc/00/54/40/1055005440.db2.gz XYOLGILTJOSTLT-UHFFFAOYSA-N 2 1 320.527 4.439 20 0 DIADMP C[N@@H+](Cc1ccccc1-c1cccs1)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236216620 1055006173 /nfs/dbraw/zinc/00/61/73/1055006173.db2.gz KVQVCEBLKSODAJ-IAGOWNOFSA-N 2 1 300.471 4.117 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2)s1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236219809 1055007853 /nfs/dbraw/zinc/00/78/53/1055007853.db2.gz XUMYKPPITTVMGK-DLBZAZTESA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2)s1)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236219809 1055007869 /nfs/dbraw/zinc/00/78/69/1055007869.db2.gz XUMYKPPITTVMGK-DLBZAZTESA-N 2 1 300.471 4.117 20 0 DIADMP C[N@@H+](Cc1cc(C(F)(F)F)ccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236223932 1055014840 /nfs/dbraw/zinc/01/48/40/1055014840.db2.gz RCPNBWQHQFEQBB-JOCQHMNTSA-N 2 1 320.786 4.061 20 0 DIADMP CCCCCCOc1ccc(C[N@@H+](C)C2(C)CC[NH2+]CC2)cc1 ZINC001236223357 1055014954 /nfs/dbraw/zinc/01/49/54/1055014954.db2.gz NDVUYCFWZQBDPR-UHFFFAOYSA-N 2 1 318.505 4.220 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@H+](C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236224776 1055015233 /nfs/dbraw/zinc/01/52/33/1055015233.db2.gz WPRSQZGSMVINDT-JOCQHMNTSA-N 2 1 301.261 4.004 20 0 DIADMP C[N@H+](Cc1ccc(-c2ccccc2Cl)o1)C1(C)CC[NH2+]CC1 ZINC001236224842 1055015418 /nfs/dbraw/zinc/01/54/18/1055015418.db2.gz XTXFNIAXWVIUQE-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)C1(C)CC[NH2+]CC1 ZINC001236224842 1055015431 /nfs/dbraw/zinc/01/54/31/1055015431.db2.gz XTXFNIAXWVIUQE-UHFFFAOYSA-N 2 1 318.848 4.174 20 0 DIADMP COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CC[C@H]([NH3+])CC3)cc2)cc1 ZINC001236224376 1055015776 /nfs/dbraw/zinc/01/57/76/1055015776.db2.gz TZAJQYWWTVJMNO-MXVIHJGJSA-N 2 1 324.468 4.064 20 0 DIADMP Cc1cccc(CC[N@@H+](Cc2ccccc2)C2CCC([NH3+])CC2)c1 ZINC001236227700 1055017163 /nfs/dbraw/zinc/01/71/63/1055017163.db2.gz JTBYYOLXBCPNKO-UHFFFAOYSA-N 2 1 322.496 4.310 20 0 DIADMP COc1cc(C)[nH+]cc1-c1ccc(C[NH+]2CCCCC2)c(F)c1 ZINC001236250652 1055032918 /nfs/dbraw/zinc/03/29/18/1055032918.db2.gz IUZYCXPNVATWFX-UHFFFAOYSA-N 2 1 314.404 4.191 20 0 DIADMP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCOc3cc(Cl)ccc32)CC1 ZINC000183165858 1055033834 /nfs/dbraw/zinc/03/38/34/1055033834.db2.gz WDNWMOVLJSACHA-QGZVFWFLSA-N 2 1 322.880 4.016 20 0 DIADMP Cc1ccccc1-c1ccccc1C[N@@H+]1C[C@@H]2CC[NH2+]CC[C@@H]2C1 ZINC001236321878 1055054958 /nfs/dbraw/zinc/05/49/58/1055054958.db2.gz OJGLRNFSVQBXFC-KDURUIRLSA-N 2 1 320.480 4.093 20 0 DIADMP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1cnc2ccsc2c1 ZINC000183948860 1055063368 /nfs/dbraw/zinc/06/33/68/1055063368.db2.gz PIWAOJKMFYMBJM-AWEZNQCLSA-N 2 1 317.502 4.069 20 0 DIADMP Cc1ccc([C@@H](C)CC[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)o1 ZINC001236371232 1055077761 /nfs/dbraw/zinc/07/77/61/1055077761.db2.gz IICZYVFYJONOGK-FUHWJXTLSA-N 2 1 318.505 4.326 20 0 DIADMP C[C@H](CC[NH2+][C@@H](C)c1cnc2ccsc2c1)[NH+]1CCCCC1 ZINC000184512998 1055078107 /nfs/dbraw/zinc/07/81/07/1055078107.db2.gz PSOFOOBKTGYASK-CABCVRRESA-N 2 1 317.502 4.211 20 0 DIADMP Cc1cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc(F)c1F ZINC001236374122 1055078475 /nfs/dbraw/zinc/07/84/75/1055078475.db2.gz BKXSGEMSPUELNH-OAHLLOKOSA-N 2 1 322.443 4.017 20 0 DIADMP CC1=C[C@H](C)[C@@H](C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)CC1 ZINC001236372590 1055078743 /nfs/dbraw/zinc/07/87/43/1055078743.db2.gz QPURLUCQEAZENY-IPMKNSEASA-N 2 1 304.522 4.223 20 0 DIADMP Cc1cccc(C)c1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236374089 1055079921 /nfs/dbraw/zinc/07/99/21/1055079921.db2.gz OYGWJNFUADJXOF-GOSISDBHSA-N 2 1 300.490 4.048 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236373667 1055080157 /nfs/dbraw/zinc/08/01/57/1055080157.db2.gz JAQYRBDZYSPNAR-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP Fc1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(Cl)c1 ZINC001236374000 1055080939 /nfs/dbraw/zinc/08/09/39/1055080939.db2.gz NQGKFMVXIQPFOF-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c(Cl)c1 ZINC001236374000 1055080947 /nfs/dbraw/zinc/08/09/47/1055080947.db2.gz NQGKFMVXIQPFOF-CQSZACIVSA-N 2 1 324.871 4.223 20 0 DIADMP Fc1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)cc1Cl ZINC001236375129 1055081445 /nfs/dbraw/zinc/08/14/45/1055081445.db2.gz XAGAWTPQRPEGBP-OAHLLOKOSA-N 2 1 324.871 4.223 20 0 DIADMP Cc1c(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)ccc(F)c1F ZINC001236376650 1055082207 /nfs/dbraw/zinc/08/22/07/1055082207.db2.gz UVIGXCZCLYNJJN-OAHLLOKOSA-N 2 1 322.443 4.017 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236375288 1055082341 /nfs/dbraw/zinc/08/23/41/1055082341.db2.gz KBGMZAYXSQDULN-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236375963 1055083090 /nfs/dbraw/zinc/08/30/90/1055083090.db2.gz OJGJKPQILGAPOW-INIZCTEOSA-N 2 1 320.908 4.393 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1 ZINC001236375291 1055083774 /nfs/dbraw/zinc/08/37/74/1055083774.db2.gz KBGMZAYXSQDULN-MRXNPFEDSA-N 2 1 320.908 4.393 20 0 DIADMP C[C@H]([NH2+]CCCc1cccc(F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185755476 1055097117 /nfs/dbraw/zinc/09/71/17/1055097117.db2.gz PXVHMGZPXPNHIT-WMZOPIPTSA-N 2 1 318.480 4.001 20 0 DIADMP CCCCCCOc1ccccc1C[N@H+](CC)C[C@H]1CC[NH2+]C1 ZINC001236407345 1055098735 /nfs/dbraw/zinc/09/87/35/1055098735.db2.gz DIRLEXAFSAYBSG-SFHVURJKSA-N 2 1 318.505 4.077 20 0 DIADMP CCCCCCOc1ccccc1C[N@@H+](CC)C[C@H]1CC[NH2+]C1 ZINC001236407345 1055098748 /nfs/dbraw/zinc/09/87/48/1055098748.db2.gz DIRLEXAFSAYBSG-SFHVURJKSA-N 2 1 318.505 4.077 20 0 DIADMP CC[N@H+](Cc1ccc(-c2cccc(Cl)c2)o1)C[C@@H]1CC[NH2+]C1 ZINC001236408454 1055100585 /nfs/dbraw/zinc/10/05/85/1055100585.db2.gz MRKPSGSQJJXMKB-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP CC[N@H+](Cc1ccc(-c2ccccc2Cl)o1)C[C@@H]1CC[NH2+]C1 ZINC001236409020 1055100765 /nfs/dbraw/zinc/10/07/65/1055100765.db2.gz RBIGKPMDOPXJMX-CQSZACIVSA-N 2 1 318.848 4.031 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236416179 1055104281 /nfs/dbraw/zinc/10/42/81/1055104281.db2.gz BLGPDBTYEJWFLQ-QGZVFWFLSA-N 2 1 319.452 4.019 20 0 DIADMP C[NH2+]C[C@H]1CCC[N@H+]1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001236416179 1055104283 /nfs/dbraw/zinc/10/42/83/1055104283.db2.gz BLGPDBTYEJWFLQ-QGZVFWFLSA-N 2 1 319.452 4.019 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420835 1055104986 /nfs/dbraw/zinc/10/49/86/1055104986.db2.gz ONNSMMPYTFVNNG-CXAGYDPISA-N 2 1 310.466 4.366 20 0 DIADMP C[C@@H]1[C@H]([NH3+])CCC[N@H+]1Cc1cccc2c3ccccc3sc21 ZINC001236420835 1055104993 /nfs/dbraw/zinc/10/49/93/1055104993.db2.gz ONNSMMPYTFVNNG-CXAGYDPISA-N 2 1 310.466 4.366 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420832 1055105254 /nfs/dbraw/zinc/10/52/54/1055105254.db2.gz OMXFALRXIHPQNU-IFXJQAMLSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@H]1[C@H]([NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420832 1055105258 /nfs/dbraw/zinc/10/52/58/1055105258.db2.gz OMXFALRXIHPQNU-IFXJQAMLSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420833 1055105306 /nfs/dbraw/zinc/10/53/06/1055105306.db2.gz OMXFALRXIHPQNU-KUHUBIRLSA-N 2 1 314.860 4.319 20 0 DIADMP C[C@@H]1[C@@H]([NH3+])CCC[N@H+]1Cc1ccc(-c2ccccc2Cl)cc1 ZINC001236420833 1055105313 /nfs/dbraw/zinc/10/53/13/1055105313.db2.gz OMXFALRXIHPQNU-KUHUBIRLSA-N 2 1 314.860 4.319 20 0 DIADMP CC(C)(C)C[N@@H+](CCCc1cccc(Cl)c1)C1CC[NH2+]CC1 ZINC001236454368 1055122073 /nfs/dbraw/zinc/12/20/73/1055122073.db2.gz KJRVUENPSHOSEP-UHFFFAOYSA-N 2 1 322.924 4.373 20 0 DIADMP CCCc1ccc(C[N@@H+](CC(C)(C)C)C2CC[NH2+]CC2)s1 ZINC001236456491 1055123854 /nfs/dbraw/zinc/12/38/54/1055123854.db2.gz FJHJNKBEFDLMKO-UHFFFAOYSA-N 2 1 308.535 4.301 20 0 DIADMP CC(C)(C)C[N@H+](Cc1ccc(Cl)cc1F)C1CC[NH2+]CC1 ZINC001236456512 1055124165 /nfs/dbraw/zinc/12/41/65/1055124165.db2.gz FPSBHASLVSRBBC-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(Cl)cc1F)C1CC[NH2+]CC1 ZINC001236456512 1055124172 /nfs/dbraw/zinc/12/41/72/1055124172.db2.gz FPSBHASLVSRBBC-UHFFFAOYSA-N 2 1 312.860 4.079 20 0 DIADMP CCCCCC[N@@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001236454589 1055125480 /nfs/dbraw/zinc/12/54/80/1055125480.db2.gz ZRDUTJFQYAZXFY-UHFFFAOYSA-N 2 1 308.897 4.474 20 0 DIADMP Cc1c2ccccc2sc1C[N@@H+](C(C)C)[C@@H]1CCC[NH2+]C1 ZINC001236468096 1055129914 /nfs/dbraw/zinc/12/99/14/1055129914.db2.gz GCDWYSZHDYRUCD-OAHLLOKOSA-N 2 1 302.487 4.172 20 0 DIADMP Cc1c2ccccc2sc1C[N@H+](C(C)C)[C@@H]1CCC[NH2+]C1 ZINC001236468096 1055129920 /nfs/dbraw/zinc/12/99/20/1055129920.db2.gz GCDWYSZHDYRUCD-OAHLLOKOSA-N 2 1 302.487 4.172 20 0 DIADMP CC1(C)CCC[C@H]([NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380898079 1055133895 /nfs/dbraw/zinc/13/38/95/1055133895.db2.gz DNPLEMLHKAULLZ-OALUTQOASA-N 2 1 300.490 4.067 20 0 DIADMP CC[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000380908915 1055136458 /nfs/dbraw/zinc/13/64/58/1055136458.db2.gz JOJVBLZFPFALGC-RLLQIKCJSA-N 2 1 300.490 4.067 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](CC2CCCCC2)C2CC[NH2+]CC2)c1 ZINC001236481067 1055139278 /nfs/dbraw/zinc/13/92/78/1055139278.db2.gz OBWWOJGHUMHSCD-UHFFFAOYSA-N 2 1 318.480 4.268 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H](C4CC4)C3)C2)cc1 ZINC000380958118 1055141275 /nfs/dbraw/zinc/14/12/75/1055141275.db2.gz VMQMTJIKALGLIG-HLAWJBBLSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](C[C@@H]1CC=CCC1)C1CC[NH2+]CC1 ZINC001236509717 1055152341 /nfs/dbraw/zinc/15/23/41/1055152341.db2.gz QCNZGIPKILKLRR-QGZVFWFLSA-N 2 1 316.464 4.044 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+](CCC(C)(C)C)C1CC[NH2+]CC1 ZINC001236508794 1055152952 /nfs/dbraw/zinc/15/29/52/1055152952.db2.gz AOWMLOSJSZIKPV-UHFFFAOYSA-N 2 1 306.469 4.124 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C[C@@H]1CC=CCC1)C1CC[NH2+]CC1 ZINC001236518898 1055157626 /nfs/dbraw/zinc/15/76/26/1055157626.db2.gz YHLCRTCLWHUNHR-QGZVFWFLSA-N 2 1 316.464 4.044 20 0 DIADMP Cc1cccc(C[N@@H+](CC2CC3(C2)CC[NH2+]CC3)C2CC2)c1C ZINC001236533390 1055164794 /nfs/dbraw/zinc/16/47/94/1055164794.db2.gz OQNXQQNHWUWVBE-UHFFFAOYSA-N 2 1 312.501 4.048 20 0 DIADMP CCCCCC[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236534009 1055164868 /nfs/dbraw/zinc/16/48/68/1055164868.db2.gz MPMUFWUBUGOAIF-IYARVYRRSA-N 2 1 306.469 4.478 20 0 DIADMP Cc1cc(F)c(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c(F)c1 ZINC001236539418 1055168120 /nfs/dbraw/zinc/16/81/20/1055168120.db2.gz CYTKVFYODPJMBQ-WKILWMFISA-N 2 1 322.443 4.145 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc3[nH]ccc32)CC2CCC2)CC1 ZINC001236539894 1055168647 /nfs/dbraw/zinc/16/86/47/1055168647.db2.gz DAKCDEMOGGRZHF-IYARVYRRSA-N 2 1 311.473 4.040 20 0 DIADMP Cc1cccc(F)c1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236542128 1055170149 /nfs/dbraw/zinc/17/01/49/1055170149.db2.gz XQTWNEZFWGPXCT-QAQDUYKDSA-N 2 1 304.453 4.006 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236542140 1055170721 /nfs/dbraw/zinc/17/07/21/1055170721.db2.gz YEDCFGNHLMYFRK-WGSAOQKQSA-N 2 1 318.480 4.315 20 0 DIADMP Cc1cccc(C[N@@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1C ZINC001236541631 1055170749 /nfs/dbraw/zinc/17/07/49/1055170749.db2.gz NUVLXINXAQIACG-MXVIHJGJSA-N 2 1 300.490 4.175 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2sccc2Cl)CC2CCC2)CC1 ZINC001236542420 1055173316 /nfs/dbraw/zinc/17/33/16/1055173316.db2.gz VTPNSOURXPKCCO-HDJSIYSDSA-N 2 1 312.910 4.274 20 0 DIADMP Cc1ccc([C@H](C)CC[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236549978 1055177321 /nfs/dbraw/zinc/17/73/21/1055177321.db2.gz ASCINKXTWKMMLK-ZTFGCOKTSA-N 2 1 304.478 4.064 20 0 DIADMP CC(C)C[N@@H+](Cc1cc(Cl)ccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550900 1055177624 /nfs/dbraw/zinc/17/76/24/1055177624.db2.gz OLGPKNWACCKNGF-WKILWMFISA-N 2 1 312.860 4.207 20 0 DIADMP CCCc1ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236550782 1055178020 /nfs/dbraw/zinc/17/80/20/1055178020.db2.gz HCEMEZMHHRONQD-WKILWMFISA-N 2 1 306.519 4.183 20 0 DIADMP COc1cc(Cl)cc(C[N@@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236550334 1055178093 /nfs/dbraw/zinc/17/80/93/1055178093.db2.gz DFPMXJABXNRTCB-QAQDUYKDSA-N 2 1 324.896 4.077 20 0 DIADMP CCSc1ccccc1C[N@@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550355 1055178314 /nfs/dbraw/zinc/17/83/14/1055178314.db2.gz FHILBCLHTJUGRV-IYARVYRRSA-N 2 1 318.530 4.281 20 0 DIADMP Cc1ccc2c(C[N@H+](CC(C)C)[C@H]3CC[C@H]([NH3+])CC3)c[nH]c2c1 ZINC001236552492 1055179254 /nfs/dbraw/zinc/17/92/54/1055179254.db2.gz WHVJXLRMRAXYSK-IYARVYRRSA-N 2 1 313.489 4.204 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(C3CCC3)cc2)CC2CC2)CC1 ZINC001236552300 1055179596 /nfs/dbraw/zinc/17/95/96/1055179596.db2.gz UGJUXZWEKAVOOG-MEMLXQNLSA-N 2 1 312.501 4.436 20 0 DIADMP Cc1c(Cl)ccc(C[N@@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1C ZINC001236551310 1055180205 /nfs/dbraw/zinc/18/02/05/1055180205.db2.gz OAZYKFFUYXTULU-IYARVYRRSA-N 2 1 320.908 4.439 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554461 1055181067 /nfs/dbraw/zinc/18/10/67/1055181067.db2.gz GIFKRFYSEHZXIW-IYARVYRRSA-N 2 1 306.469 4.170 20 0 DIADMP Cc1ccccc1C[N@@H+](C[C@@H]1CC=CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236554333 1055181182 /nfs/dbraw/zinc/18/11/82/1055181182.db2.gz GADFVNIDAQCIFE-HMXCVIKNSA-N 2 1 312.501 4.423 20 0 DIADMP Cc1cc(C)c(C[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236553079 1055182349 /nfs/dbraw/zinc/18/23/49/1055182349.db2.gz WQXIKJHFQSEQFR-MXVIHJGJSA-N 2 1 302.506 4.340 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCC2CCCCC2)Cc2ccncc2)CC1 ZINC001236560093 1055184436 /nfs/dbraw/zinc/18/44/36/1055184436.db2.gz IKVIOKQZOYHAIK-MXVIHJGJSA-N 2 1 315.505 4.124 20 0 DIADMP CCCC[C@H](CC)C[N@@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236561212 1055184493 /nfs/dbraw/zinc/18/44/93/1055184493.db2.gz OZKMFIDXBWPUQD-IHPCNDPISA-N 2 1 317.521 4.370 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C[C@@H]2C[C@H]3C=C[C@@H]2C3)C2CCCCC2)CC1 ZINC001236565517 1055185870 /nfs/dbraw/zinc/18/58/70/1055185870.db2.gz IZEQLOCCEMSJFW-STEXWYFWSA-N 2 1 302.506 4.103 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)cnc1C ZINC001236565388 1055186173 /nfs/dbraw/zinc/18/61/73/1055186173.db2.gz BYNQXPPILLECNB-KESTWPANSA-N 2 1 315.505 4.103 20 0 DIADMP Cc1ccc(CCC[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236565288 1055186223 /nfs/dbraw/zinc/18/62/23/1055186223.db2.gz CIBZUQREJKGCIN-UAPYVXQJSA-N 2 1 318.505 4.425 20 0 DIADMP COc1cccc(C[N@@H+](C2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236565852 1055186507 /nfs/dbraw/zinc/18/65/07/1055186507.db2.gz PHTBXZBGIMUJKH-UAPYVXQJSA-N 2 1 316.489 4.100 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](C[C@H]2C[C@H]3C=C[C@@H]2C3)C2CCCCC2)CC1 ZINC001236565515 1055186744 /nfs/dbraw/zinc/18/67/44/1055186744.db2.gz IZEQLOCCEMSJFW-JAYZULETSA-N 2 1 302.506 4.103 20 0 DIADMP COc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1C ZINC001236566866 1055187995 /nfs/dbraw/zinc/18/79/95/1055187995.db2.gz NTHKLNPLWKDZOD-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP CC1=C[C@@H](C)[C@H](C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001236567127 1055188484 /nfs/dbraw/zinc/18/84/84/1055188484.db2.gz UDPBXRRYDSCGDM-AJYBTWMASA-N 2 1 304.522 4.493 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccccc2Cl)C2CCCC2)CC1 ZINC001236567016 1055188634 /nfs/dbraw/zinc/18/86/34/1055188634.db2.gz RDGIYTCWAPQYJC-JCNLHEQBSA-N 2 1 306.881 4.355 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892934 1055189535 /nfs/dbraw/zinc/18/95/35/1055189535.db2.gz FFKTZUYQLVCJOU-MJGOQNOKSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892934 1055189548 /nfs/dbraw/zinc/18/95/48/1055189548.db2.gz FFKTZUYQLVCJOU-MJGOQNOKSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892909 1055189902 /nfs/dbraw/zinc/18/99/02/1055189902.db2.gz FFKTZUYQLVCJOU-HKUYNNGSSA-N 2 1 312.457 4.233 20 0 DIADMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccco1 ZINC000381892909 1055189908 /nfs/dbraw/zinc/18/99/08/1055189908.db2.gz FFKTZUYQLVCJOU-HKUYNNGSSA-N 2 1 312.457 4.233 20 0 DIADMP Cc1cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)cc(C)c1O ZINC001236570804 1055191986 /nfs/dbraw/zinc/19/19/86/1055191986.db2.gz BTLFCXPJCBROTC-UAPYVXQJSA-N 2 1 316.489 4.024 20 0 DIADMP CCCc1ccc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236571130 1055192050 /nfs/dbraw/zinc/19/20/50/1055192050.db2.gz AEKXHNLVGPEXPF-KOMQPUFPSA-N 2 1 306.519 4.325 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc(Cl)c(F)c2)C2CCC2)CC1 ZINC001236571754 1055192748 /nfs/dbraw/zinc/19/27/48/1055192748.db2.gz FTJPNKKJMJRTNI-CTYIDZIISA-N 2 1 310.844 4.104 20 0 DIADMP COc1cc(C)cc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236571531 1055193127 /nfs/dbraw/zinc/19/31/27/1055193127.db2.gz IFBKKAHTJCICDB-UAPYVXQJSA-N 2 1 316.489 4.018 20 0 DIADMP C[C@H]([NH2+]C1CCCCCC1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381945455 1055193242 /nfs/dbraw/zinc/19/32/42/1055193242.db2.gz YXIYNDNPVYXKBT-PKOBYXMFSA-N 2 1 300.490 4.209 20 0 DIADMP CCc1ccc(C[N@@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236572402 1055193651 /nfs/dbraw/zinc/19/36/51/1055193651.db2.gz XJWSEUDHSFSGJX-KOMQPUFPSA-N 2 1 306.519 4.325 20 0 DIADMP Cc1cc(Cl)cc(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236572592 1055193465 /nfs/dbraw/zinc/19/34/65/1055193465.db2.gz OZZTYXQDSJNLPR-SAABIXHNSA-N 2 1 306.881 4.273 20 0 DIADMP CC(C)Oc1ccccc1C[N@@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236572277 1055193888 /nfs/dbraw/zinc/19/38/88/1055193888.db2.gz OJGKUSOVORVYKA-UAPYVXQJSA-N 2 1 316.489 4.098 20 0 DIADMP Cc1cccc2c(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)c[nH]c21 ZINC001236572831 1055195254 /nfs/dbraw/zinc/19/52/54/1055195254.db2.gz UQCGJHVSEGBJFW-SAABIXHNSA-N 2 1 311.473 4.101 20 0 DIADMP Cc1cccc2[nH]cc(C[N@@H+](C3CCC3)[C@H]3CC[C@H]([NH3+])CC3)c21 ZINC001236572893 1055195602 /nfs/dbraw/zinc/19/56/02/1055195602.db2.gz WIIOTTJZCYEUFA-SAABIXHNSA-N 2 1 311.473 4.101 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](Cc2ccc3cccccc2-3)C2CCC2)CC1 ZINC001236576341 1055196597 /nfs/dbraw/zinc/19/65/97/1055196597.db2.gz KDICBYMAQMGGNM-KESTWPANSA-N 2 1 308.469 4.416 20 0 DIADMP Cc1cc(F)cc(C)c1C[N@@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236574891 1055197225 /nfs/dbraw/zinc/19/72/25/1055197225.db2.gz WZVIMKUIUIIQSX-UAPYVXQJSA-N 2 1 318.480 4.457 20 0 DIADMP Cc1ccc(Cl)c(C[N@@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236576586 1055197360 /nfs/dbraw/zinc/19/73/60/1055197360.db2.gz OBBMSSCXBBMNRY-JCNLHEQBSA-N 2 1 306.881 4.273 20 0 DIADMP Cc1ccc2ccccc2c1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236598151 1055202351 /nfs/dbraw/zinc/20/23/51/1055202351.db2.gz HNELFMOFDSOGDF-KRWDZBQOSA-N 2 1 308.469 4.112 20 0 DIADMP CCCCc1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CC2)s1 ZINC001236598500 1055202510 /nfs/dbraw/zinc/20/25/10/1055202510.db2.gz KIAWMWBGVIILPY-HNNXBMFYSA-N 2 1 306.519 4.055 20 0 DIADMP Cc1cccc(C)c1-c1cccc(C[N@H+]2CC[C@@](C)(C[NH3+])C2)c1 ZINC001236617918 1055206538 /nfs/dbraw/zinc/20/65/38/1055206538.db2.gz YRDAFQRJJNJSLV-NRFANRHFSA-N 2 1 308.469 4.141 20 0 DIADMP C[C@]1(C[NH3+])CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001236616466 1055206603 /nfs/dbraw/zinc/20/66/03/1055206603.db2.gz NRUCAKIPLDEXNL-LJQANCHMSA-N 2 1 314.860 4.178 20 0 DIADMP Clc1cc(Cl)cc(C[N@@H+](C2CCC2)C2CC[NH2+]CC2)c1 ZINC001236633685 1055209126 /nfs/dbraw/zinc/20/91/26/1055209126.db2.gz JZRAJPWLTNCZBV-UHFFFAOYSA-N 2 1 313.272 4.100 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)CCC12CC([NH3+])(C1)C2 ZINC001236661247 1055216964 /nfs/dbraw/zinc/21/69/64/1055216964.db2.gz AJJXGKFJJISNGB-QNGMFEMESA-N 2 1 314.517 4.381 20 0 DIADMP CCc1ccc(C[N@@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)o1 ZINC001236681169 1055228506 /nfs/dbraw/zinc/22/85/06/1055228506.db2.gz CXNOMCYWFSBAAL-IYARVYRRSA-N 2 1 312.457 4.114 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2cccs2)Cc2ccccc2)CC1 ZINC001236681941 1055230060 /nfs/dbraw/zinc/23/00/60/1055230060.db2.gz LVHSCCFSUJAQHT-IYARVYRRSA-N 2 1 314.498 4.063 20 0 DIADMP CCC[C@@H](C)C[N@@H+](Cc1ccccc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236701417 1055232994 /nfs/dbraw/zinc/23/29/94/1055232994.db2.gz SLFFWSWWMLGKKR-BHIYHBOVSA-N 2 1 318.505 4.203 20 0 DIADMP Cc1ccc(C[N@@H+](Cc2ccsc2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236713807 1055238049 /nfs/dbraw/zinc/23/80/49/1055238049.db2.gz GUJMQDJROBPREQ-WGSAOQKQSA-N 2 1 314.498 4.329 20 0 DIADMP Cc1ccc(C[N@@H+](C[C@H]2CC=CCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001236715558 1055240171 /nfs/dbraw/zinc/24/01/71/1055240171.db2.gz VGNSPIAIQKKHBR-JBACZVJFSA-N 2 1 312.501 4.423 20 0 DIADMP c1cc2cccc(CN3CCC4(CCC[N@@H+]4CC4CC4)CC3)c2o1 ZINC001236728860 1055242824 /nfs/dbraw/zinc/24/28/24/1055242824.db2.gz AVXFRKIZROSGDI-UHFFFAOYSA-N 2 1 324.468 4.273 20 0 DIADMP c1cc2cccc(C[NH+]3CCC4(CCC[N@H+]4CC4CC4)CC3)c2o1 ZINC001236728860 1055242842 /nfs/dbraw/zinc/24/28/42/1055242842.db2.gz AVXFRKIZROSGDI-UHFFFAOYSA-N 2 1 324.468 4.273 20 0 DIADMP c1cc2cccc(C[NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)c2o1 ZINC001236728860 1055242865 /nfs/dbraw/zinc/24/28/65/1055242865.db2.gz AVXFRKIZROSGDI-UHFFFAOYSA-N 2 1 324.468 4.273 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCC2CCCC2)Cc2ccc(F)cc2)CC1 ZINC001236741336 1055248548 /nfs/dbraw/zinc/24/85/48/1055248548.db2.gz FUMMMBPOFRPQNG-MXVIHJGJSA-N 2 1 318.480 4.478 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc2cc[nH]c2c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236766992 1055250434 /nfs/dbraw/zinc/25/04/34/1055250434.db2.gz JWUIDIRUCOTLSQ-IYARVYRRSA-N 2 1 313.489 4.286 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CCc2ccccc2)CC2CCCCC2)CC1 ZINC001236754416 1055250798 /nfs/dbraw/zinc/25/07/98/1055250798.db2.gz GKUWYVVAARAZRZ-MEMLXQNLSA-N 2 1 314.517 4.381 20 0 DIADMP Cc1ccc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)nc1 ZINC001236758582 1055250928 /nfs/dbraw/zinc/25/09/28/1055250928.db2.gz KXNIZTSQHHGOHK-KESTWPANSA-N 2 1 315.505 4.042 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236765940 1055251932 /nfs/dbraw/zinc/25/19/32/1055251932.db2.gz BNBUEZCRDBGDPC-IYARVYRRSA-N 2 1 306.469 4.252 20 0 DIADMP Cc1ncc(C[N@@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236755107 1055251952 /nfs/dbraw/zinc/25/19/52/1055251952.db2.gz JYNYANJMMPPSMK-QAQDUYKDSA-N 2 1 321.534 4.104 20 0 DIADMP C[C@@H](C[N@@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)c1ccccc1 ZINC001236766855 1055253034 /nfs/dbraw/zinc/25/30/34/1055253034.db2.gz DDDQRZZRSNGDRM-WDSOQIARSA-N 2 1 302.506 4.408 20 0 DIADMP CC(C)(C)C[N@@H+](CCCc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236769644 1055253980 /nfs/dbraw/zinc/25/39/80/1055253980.db2.gz YIWFZLUOMNZYIS-IYARVYRRSA-N 2 1 320.496 4.376 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cc(F)cc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768996 1055254535 /nfs/dbraw/zinc/25/45/35/1055254535.db2.gz UBCWIMLOHALLBW-QAQDUYKDSA-N 2 1 310.432 4.083 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1cccc2cc[nH]c21)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236778923 1055255723 /nfs/dbraw/zinc/25/57/23/1055255723.db2.gz CCMLLSPCKXNSJL-IYARVYRRSA-N 2 1 313.489 4.286 20 0 DIADMP CC(C)(C)C[N@@H+](Cc1ccc(F)cc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236768708 1055255917 /nfs/dbraw/zinc/25/59/17/1055255917.db2.gz PBQUCIYRESRHNP-WKILWMFISA-N 2 1 310.432 4.083 20 0 DIADMP COCc1ccc(C[N@@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC001236768779 1055256268 /nfs/dbraw/zinc/25/62/68/1055256268.db2.gz WJEGFNYLOWCSEJ-SHTZXODSSA-N 2 1 324.534 4.013 20 0 DIADMP CCOc1cccc(C[N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001236783028 1055258988 /nfs/dbraw/zinc/25/89/88/1055258988.db2.gz YBRMYXATWQMHGA-UAPYVXQJSA-N 2 1 318.505 4.346 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)c2ccccc21 ZINC000383287359 1055263302 /nfs/dbraw/zinc/26/33/02/1055263302.db2.gz MGYUYAQOQFQTQF-JTSKRJEESA-N 2 1 320.480 4.489 20 0 DIADMP CCC(CC)[N@@H+](Cc1ccc(F)cc1OC)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790569 1055263346 /nfs/dbraw/zinc/26/33/46/1055263346.db2.gz KXXBQFKKEHMWBB-SAABIXHNSA-N 2 1 322.468 4.095 20 0 DIADMP CCC(CC)[N@@H+](Cc1c(C)cccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236790342 1055264142 /nfs/dbraw/zinc/26/41/42/1055264142.db2.gz GHHBVLALCIHFQG-JCNLHEQBSA-N 2 1 306.469 4.395 20 0 DIADMP C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383436559 1055275462 /nfs/dbraw/zinc/27/54/62/1055275462.db2.gz FKLQRLCYCSHUAD-UGKGYDQZSA-N 2 1 322.496 4.119 20 0 DIADMP CC(C)=CCCC1=CC[C@H](C[N@H+]2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)CC1 ZINC001236821969 1055277235 /nfs/dbraw/zinc/27/72/35/1055277235.db2.gz XBMYIHBQFCXBRD-VNTMZGSJSA-N 2 1 302.506 4.128 20 0 DIADMP [NH3+][C@@H]1CC[C@@H]2C[N@@H+](Cc3ccc(/C=C/c4ccccc4)cc3)C[C@@H]12 ZINC001236826271 1055279415 /nfs/dbraw/zinc/27/94/15/1055279415.db2.gz BFHYOMCWFPLQDH-LDVMJDGHSA-N 2 1 318.464 4.026 20 0 DIADMP C[C@@H]1C[C@@H]1c1ccc(CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC000383482369 1055281679 /nfs/dbraw/zinc/28/16/79/1055281679.db2.gz SQYUZFGHPIYEQI-KPFFTGBYSA-N 2 1 324.468 4.015 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2ccc(C)o2)cc1)C[C@H]1CC[NH2+]C1 ZINC001236844606 1055286975 /nfs/dbraw/zinc/28/69/75/1055286975.db2.gz WQHZHJITAODILA-SFHVURJKSA-N 2 1 312.457 4.077 20 0 DIADMP CCC[N@H+](Cc1c(C)sc2ccccc21)C[C@H]1CC[NH2+]C1 ZINC001236842318 1055287996 /nfs/dbraw/zinc/28/79/96/1055287996.db2.gz DYOCAUACDGPSDY-HNNXBMFYSA-N 2 1 302.487 4.031 20 0 DIADMP CCC[N@H+](Cc1ccc(-c2cccs2)cc1)C[C@@H]1CC[NH2+]C1 ZINC001236845228 1055289321 /nfs/dbraw/zinc/28/93/21/1055289321.db2.gz ZXHAWTYGCNZEOH-QGZVFWFLSA-N 2 1 314.498 4.237 20 0 DIADMP C[N@@H+](Cc1cccs1)Cc1ccc(-n2ccnc2)c(Cl)c1 ZINC001236906346 1055311285 /nfs/dbraw/zinc/31/12/85/1055311285.db2.gz VJQKUHXWQFKIHU-UHFFFAOYSA-N 2 1 317.845 4.219 20 0 DIADMP c1ccc(CC[C@H]2CCC[N@@H+](Cc3ccc4c(c3)C[NH2+]C4)C2)cc1 ZINC001236948439 1055320894 /nfs/dbraw/zinc/32/08/94/1055320894.db2.gz DZJDKYVAYJNBCI-LJQANCHMSA-N 2 1 320.480 4.135 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)C1 ZINC001237055229 1055355177 /nfs/dbraw/zinc/35/51/77/1055355177.db2.gz BPPPHKDMAGANAI-HXUWFJFHSA-N 2 1 310.441 4.040 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2ccc(Oc3ccccc3)cc2)C1 ZINC001237055227 1055356338 /nfs/dbraw/zinc/35/63/38/1055356338.db2.gz BPPPHKDMAGANAI-FQEVSTJZSA-N 2 1 310.441 4.040 20 0 DIADMP Cc1c(C[N@H+]2CCC[C@@](C)(C[NH3+])C2)cccc1-c1ccccc1 ZINC001237080191 1055361814 /nfs/dbraw/zinc/36/18/14/1055361814.db2.gz DRKRSPJDYWEZOS-NRFANRHFSA-N 2 1 308.469 4.223 20 0 DIADMP [NH3+]CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(F)c(-c2ccccc2)c1 ZINC001237081975 1055362038 /nfs/dbraw/zinc/36/20/38/1055362038.db2.gz LYTFTBISYZYROV-JLYLLQBASA-N 2 1 324.443 4.194 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+](Cc2sc(Cl)c3ccccc32)C1 ZINC001237081228 1055362442 /nfs/dbraw/zinc/36/24/42/1055362442.db2.gz JKNUOWAJPWSPLJ-MRXNPFEDSA-N 2 1 308.878 4.116 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@@H+](Cc2sc(Cl)c3ccccc32)C1 ZINC001237081228 1055362453 /nfs/dbraw/zinc/36/24/53/1055362453.db2.gz JKNUOWAJPWSPLJ-MRXNPFEDSA-N 2 1 308.878 4.116 20 0 DIADMP Cc1c(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)ccc(F)c1F ZINC001237161507 1055389923 /nfs/dbraw/zinc/38/99/23/1055389923.db2.gz LFDNVXPLVIHOFL-IRXDYDNUSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(C[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)ccc(F)c1F ZINC001237161507 1055389935 /nfs/dbraw/zinc/38/99/35/1055389935.db2.gz LFDNVXPLVIHOFL-IRXDYDNUSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(C[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)ccc(F)c1F ZINC001237161507 1055389948 /nfs/dbraw/zinc/38/99/48/1055389948.db2.gz LFDNVXPLVIHOFL-IRXDYDNUSA-N 2 1 322.443 4.112 20 0 DIADMP Cc1c(C[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)ccc(F)c1F ZINC001237161507 1055389955 /nfs/dbraw/zinc/38/99/55/1055389955.db2.gz LFDNVXPLVIHOFL-IRXDYDNUSA-N 2 1 322.443 4.112 20 0 DIADMP CC(C)[NH+]1CCC(C[N@@H+](C)Cc2ccc3cccccc2-3)CC1 ZINC001237189878 1055399256 /nfs/dbraw/zinc/39/92/56/1055399256.db2.gz HFCFQFUVTRKRTR-UHFFFAOYSA-N 2 1 310.485 4.344 20 0 DIADMP c1cc(C[NH+]2CCC([NH+]3CCCCC3)CC2)c2cccccc1-2 ZINC001237187810 1055399274 /nfs/dbraw/zinc/39/92/74/1055399274.db2.gz RFLVYMOEVGSMPD-UHFFFAOYSA-N 2 1 308.469 4.242 20 0 DIADMP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccc4sc5ccccc5c4c3)C[C@@H]2C1 ZINC001237197306 1055401405 /nfs/dbraw/zinc/40/14/05/1055401405.db2.gz BMLLVCUXGJEIOC-IYBDPMFKSA-N 2 1 322.477 4.048 20 0 DIADMP C[NH+]1C[C@@H]2C[N@@H+](Cc3ccc4sc5ccccc5c4c3)C[C@@H]2C1 ZINC001237197306 1055401416 /nfs/dbraw/zinc/40/14/16/1055401416.db2.gz BMLLVCUXGJEIOC-IYBDPMFKSA-N 2 1 322.477 4.048 20 0 DIADMP C[NH+]1C[C@@H]2C[N@H+](Cc3ccc4sc5ccccc5c4c3)C[C@@H]2C1 ZINC001237197306 1055401425 /nfs/dbraw/zinc/40/14/25/1055401425.db2.gz BMLLVCUXGJEIOC-IYBDPMFKSA-N 2 1 322.477 4.048 20 0 DIADMP c1ccc(CCCC[N@@H+]2Cc3ccccc3C23CC[NH2+]CC3)cc1 ZINC001237300551 1055420416 /nfs/dbraw/zinc/42/04/16/1055420416.db2.gz NHCNFADBAGRGEM-UHFFFAOYSA-N 2 1 320.480 4.104 20 0 DIADMP c1ccc(CCCC[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)cc1 ZINC001237300551 1055420422 /nfs/dbraw/zinc/42/04/22/1055420422.db2.gz NHCNFADBAGRGEM-UHFFFAOYSA-N 2 1 320.480 4.104 20 0 DIADMP c1csc(-c2ccc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)s2)c1 ZINC001237389389 1055444871 /nfs/dbraw/zinc/44/48/71/1055444871.db2.gz FZUJQXGAQAWRLD-ZFWWWQNUSA-N 2 1 318.511 4.051 20 0 DIADMP c1csc(-c2ccc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@H]4C3)s2)c1 ZINC001237389389 1055444879 /nfs/dbraw/zinc/44/48/79/1055444879.db2.gz FZUJQXGAQAWRLD-ZFWWWQNUSA-N 2 1 318.511 4.051 20 0 DIADMP Cc1c(C[N@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)cccc1-c1ccccc1 ZINC001237410959 1055450062 /nfs/dbraw/zinc/45/00/62/1055450062.db2.gz DYGIPLRZTZVKAN-UNMCSNQZSA-N 2 1 320.480 4.236 20 0 DIADMP c1cc(-c2csc(C[N@@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)c2)cs1 ZINC001237410687 1055451388 /nfs/dbraw/zinc/45/13/88/1055451388.db2.gz CTTVDRYXLDHBTA-DYVFJYSZSA-N 2 1 318.511 4.051 20 0 DIADMP c1cc(-c2csc(C[N@H+]3CC[C@@H]4[NH2+]CCC[C@@H]4C3)c2)cs1 ZINC001237410687 1055451393 /nfs/dbraw/zinc/45/13/93/1055451393.db2.gz CTTVDRYXLDHBTA-DYVFJYSZSA-N 2 1 318.511 4.051 20 0 DIADMP Cc1oc(C(C)(C)C)cc1C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001620898635 1055524075 /nfs/dbraw/zinc/52/40/75/1055524075.db2.gz ZQVPPEDQVZZXGN-OAHLLOKOSA-N 2 1 306.494 4.240 20 0 DIADMP C[C@@H]1C[N@H+](CCC[NH2+][C@@H]2CCC[C@@H](C(C)(C)C)CC2)CCCO1 ZINC001620899760 1055525636 /nfs/dbraw/zinc/52/56/36/1055525636.db2.gz NJIDZIJYFSMHSN-GUDVDZBRSA-N 2 1 324.553 4.072 20 0 DIADMP C[C@@H]1C[N@@H+](CCC[NH2+][C@@H]2CCC[C@@H](C(C)(C)C)CC2)CCCO1 ZINC001620899760 1055525646 /nfs/dbraw/zinc/52/56/46/1055525646.db2.gz NJIDZIJYFSMHSN-GUDVDZBRSA-N 2 1 324.553 4.072 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[N@@H+](C)C(C)(C)C1)CC2 ZINC001620910379 1055533334 /nfs/dbraw/zinc/53/33/34/1055533334.db2.gz PUKBMODOEPKXGT-HKUYNNGSSA-N 2 1 300.490 4.260 20 0 DIADMP CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[N@@H+](C)C(C)(C)C1)CC2 ZINC001620910381 1055534055 /nfs/dbraw/zinc/53/40/55/1055534055.db2.gz PUKBMODOEPKXGT-MJGOQNOKSA-N 2 1 300.490 4.260 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001620921243 1055542949 /nfs/dbraw/zinc/54/29/49/1055542949.db2.gz RPBDRMXVUJKFFM-SESVDKBCSA-N 2 1 312.501 4.091 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)CC1(C)C ZINC001620926644 1055545330 /nfs/dbraw/zinc/54/53/30/1055545330.db2.gz AAEQPPBYVPKUAQ-OTWHNJEPSA-N 2 1 300.490 4.175 20 0 DIADMP C[N@H+]1CC[C@H]([NH2+][C@H]2CCC[C@H](c3ccccc3)C2)CC1(C)C ZINC001620926643 1055546042 /nfs/dbraw/zinc/54/60/42/1055546042.db2.gz AAEQPPBYVPKUAQ-FHWLQOOXSA-N 2 1 300.490 4.175 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3CCCC[C@@H](F)C3)cc21 ZINC001237881469 1055546170 /nfs/dbraw/zinc/54/61/70/1055546170.db2.gz STMIHVAPMLTCSN-QGZVFWFLSA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCCC[C@@H](F)C3)cc21 ZINC001237881469 1055546183 /nfs/dbraw/zinc/54/61/83/1055546183.db2.gz STMIHVAPMLTCSN-QGZVFWFLSA-N 2 1 302.437 4.012 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)cc21 ZINC001237881854 1055546987 /nfs/dbraw/zinc/54/69/87/1055546987.db2.gz WWXVNUIKLYCNPO-KDURUIRLSA-N 2 1 310.485 4.310 20 0 DIADMP CC(C)C1=[NH+]CCc2ccc(C[N@H+]3CCC(F)(F)[C@H](C)C3)cc21 ZINC001237880755 1055549234 /nfs/dbraw/zinc/54/92/34/1055549234.db2.gz JYPYXAAJUMYRPN-CQSZACIVSA-N 2 1 320.427 4.165 20 0 DIADMP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]Cc1cccc2ccoc21 ZINC001620946219 1055560708 /nfs/dbraw/zinc/56/07/08/1055560708.db2.gz JFWRLXGNZHPVIO-SFHVURJKSA-N 2 1 300.446 4.033 20 0 DIADMP c1ccc(C[N@H+]2CC[C@@H]([NH2+]CC3=CCCCC3)CC23CC3)cc1 ZINC001620953183 1055573705 /nfs/dbraw/zinc/57/37/05/1055573705.db2.gz AGOTYHYAIIIEKM-HXUWFJFHSA-N 2 1 310.485 4.274 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@@H]([NH2+]CC3=CCCCC3)CC23CC3)cc1 ZINC001620953183 1055573718 /nfs/dbraw/zinc/57/37/18/1055573718.db2.gz AGOTYHYAIIIEKM-HXUWFJFHSA-N 2 1 310.485 4.274 20 0 DIADMP Cc1cc(Cl)c(Cl)cc1C[N@@H+](C)CC1CC[NH+](C)CC1 ZINC001238260845 1055632299 /nfs/dbraw/zinc/63/22/99/1055632299.db2.gz VZIXZKHLZMEPPA-UHFFFAOYSA-N 2 1 315.288 4.075 20 0 DIADMP CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+]C1CC[NH+](Cc2ccccc2)CC1 ZINC001620966792 1055700338 /nfs/dbraw/zinc/70/03/38/1055700338.db2.gz KMEGOJTYJAZGPQ-UXHICEINSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000061029075 1055860055 /nfs/dbraw/zinc/86/00/55/1055860055.db2.gz XLUZDGRVOSFBED-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000061029075 1055860064 /nfs/dbraw/zinc/86/00/64/1055860064.db2.gz XLUZDGRVOSFBED-AWEZNQCLSA-N 2 1 314.395 4.060 20 0 DIADMP CC(C)c1ccc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1 ZINC001620983626 1055946365 /nfs/dbraw/zinc/94/63/65/1055946365.db2.gz OLJBXCQXPWHFAM-YADHBBJMSA-N 2 1 322.496 4.245 20 0 DIADMP CC1(C)C[N@@H+](CC2CC2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001620462947 1055953588 /nfs/dbraw/zinc/95/35/88/1055953588.db2.gz PYOGUCRLAJFEDC-FQEVSTJZSA-N 2 1 312.501 4.019 20 0 DIADMP CC1(C)C[N@@H+](CC2CC2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001620462948 1055954494 /nfs/dbraw/zinc/95/44/94/1055954494.db2.gz PYOGUCRLAJFEDC-HXUWFJFHSA-N 2 1 312.501 4.019 20 0 DIADMP C[N@H+]1CCC[C@H](C[NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)C1 ZINC001620786081 1055959273 /nfs/dbraw/zinc/95/92/73/1055959273.db2.gz XKHLUBCWFYIXKX-MISYRCLQSA-N 2 1 300.490 4.034 20 0 DIADMP CC[N@@H+](CCC[NH2+][C@H]1CCC[C@H](SC)C1)C1CCCCC1 ZINC001620997132 1055966127 /nfs/dbraw/zinc/96/61/27/1055966127.db2.gz XTDDAXJZKVSDOA-WMZOPIPTSA-N 2 1 312.567 4.295 20 0 DIADMP CC(C)[NH+]1CCC([NH2+]Cc2ccc(-c3cccs3)cc2)CC1 ZINC001620704273 1055980615 /nfs/dbraw/zinc/98/06/15/1055980615.db2.gz DLGQSBPAAWJHQC-UHFFFAOYSA-N 2 1 314.498 4.378 20 0 DIADMP C[C@H](CCc1ccccc1)C[NH2+]C[C@H](C1CCCCC1)[NH+](C)C ZINC001620724578 1055986215 /nfs/dbraw/zinc/98/62/15/1055986215.db2.gz DFBDMAYAJSXDPX-WIYYLYMNSA-N 2 1 316.533 4.355 20 0 DIADMP Cc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCCC[C@@H]3C)[nH]c2c1 ZINC001620725130 1055986245 /nfs/dbraw/zinc/98/62/45/1055986245.db2.gz XCEUFWAVZPILRU-KRWDZBQOSA-N 2 1 313.489 4.221 20 0 DIADMP COCCC1(C[NH2+]C[C@H](C2CCCCC2)[NH+](C)C)CCCCC1 ZINC001620724172 1055986430 /nfs/dbraw/zinc/98/64/30/1055986430.db2.gz LKCCLSIWTPZXMI-LJQANCHMSA-N 2 1 324.553 4.074 20 0 DIADMP CC(C)c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)cc1 ZINC001620724551 1055986453 /nfs/dbraw/zinc/98/64/53/1055986453.db2.gz CDDDUWKSRFMUKW-SFHVURJKSA-N 2 1 302.506 4.412 20 0 DIADMP c1c2ccccc2sc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC001621020282 1055987808 /nfs/dbraw/zinc/98/78/08/1055987808.db2.gz GUSGYXKRAUHLRS-INIZCTEOSA-N 2 1 314.498 4.113 20 0 DIADMP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)CC1 ZINC001620798697 1055994746 /nfs/dbraw/zinc/99/47/46/1055994746.db2.gz TVPCHKMDKWZXMF-UGNRZPKXSA-N 2 1 312.501 4.380 20 0 DIADMP CCOC(=[NH2+])c1ccc(-c2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC001240060402 1056295647 /nfs/dbraw/zinc/29/56/47/1056295647.db2.gz KNYGAUGKAQDZKD-UHFFFAOYSA-N 2 1 308.425 4.311 20 0 DIADMP CC[C@H](C)[N@H+](C)CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614456 1056328747 /nfs/dbraw/zinc/32/87/47/1056328747.db2.gz SJOKGMKAWPRXGJ-ZUJMUWTESA-N 2 1 308.432 4.064 20 0 DIADMP CC[C@H](C)[N@@H+](C)CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474614456 1056328760 /nfs/dbraw/zinc/32/87/60/1056328760.db2.gz SJOKGMKAWPRXGJ-ZUJMUWTESA-N 2 1 308.432 4.064 20 0 DIADMP CC[NH+](CC)C[C@@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474727507 1056344829 /nfs/dbraw/zinc/34/48/29/1056344829.db2.gz REZWACPMZOUWQQ-ZOBORPQBSA-N 2 1 314.926 4.213 20 0 DIADMP CCC[N@H+](CC)CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474823629 1056359921 /nfs/dbraw/zinc/35/99/21/1056359921.db2.gz VHVAFTJUIUQUHP-WLYUNCDWSA-N 2 1 308.432 4.065 20 0 DIADMP CCC[N@@H+](CC)CC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1 ZINC000474823629 1056359939 /nfs/dbraw/zinc/35/99/39/1056359939.db2.gz VHVAFTJUIUQUHP-WLYUNCDWSA-N 2 1 308.432 4.065 20 0 DIADMP C[N@H+]1CCc2cc(-c3ccc(C[NH2+]C(C)(C)C)cc3)ccc2C1 ZINC001240373389 1056460541 /nfs/dbraw/zinc/46/05/41/1056460541.db2.gz IOBHZJHBUOPTAL-UHFFFAOYSA-N 2 1 308.469 4.230 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2CF)CC1 ZINC001615200876 1056476242 /nfs/dbraw/zinc/47/62/42/1056476242.db2.gz PCGRPYGYTPOJRH-UHFFFAOYSA-N 2 1 306.469 4.100 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccccc2SC)CC1 ZINC001615200673 1056476869 /nfs/dbraw/zinc/47/68/69/1056476869.db2.gz IHQKCFATPGMPOQ-UHFFFAOYSA-N 2 1 320.546 4.352 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H]1c1cccc2ccccc21 ZINC001615252271 1056484292 /nfs/dbraw/zinc/48/42/92/1056484292.db2.gz XRTPIEZEUMIMCG-NQIIRXRSSA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC001615252271 1056484302 /nfs/dbraw/zinc/48/43/02/1056484302.db2.gz XRTPIEZEUMIMCG-NQIIRXRSSA-N 2 1 308.469 4.461 20 0 DIADMP C[NH+]1CCC[C@@H]1CC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC001615252271 1056484309 /nfs/dbraw/zinc/48/43/09/1056484309.db2.gz XRTPIEZEUMIMCG-NQIIRXRSSA-N 2 1 308.469 4.461 20 0 DIADMP CC(C)(C)C[N@@H+](CCC[NH+]1CCCCC1)Cc1ccccc1 ZINC001615469957 1056516776 /nfs/dbraw/zinc/51/67/76/1056516776.db2.gz RQPXKVOHXQJINO-UHFFFAOYSA-N 2 1 302.506 4.411 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001615540640 1056531991 /nfs/dbraw/zinc/53/19/91/1056531991.db2.gz ZLKJFJZWCAREST-ZWKOTPCHSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001615540640 1056532002 /nfs/dbraw/zinc/53/20/02/1056532002.db2.gz ZLKJFJZWCAREST-ZWKOTPCHSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001615540640 1056532012 /nfs/dbraw/zinc/53/20/12/1056532012.db2.gz ZLKJFJZWCAREST-ZWKOTPCHSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1ccc(F)cc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC001615540640 1056532023 /nfs/dbraw/zinc/53/20/23/1056532023.db2.gz ZLKJFJZWCAREST-ZWKOTPCHSA-N 2 1 318.480 4.221 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC001615540414 1056532422 /nfs/dbraw/zinc/53/24/22/1056532422.db2.gz UVMUVHCEPZQGCO-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615540414 1056532435 /nfs/dbraw/zinc/53/24/35/1056532435.db2.gz UVMUVHCEPZQGCO-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC001615540414 1056532450 /nfs/dbraw/zinc/53/24/50/1056532450.db2.gz UVMUVHCEPZQGCO-WOJBJXKFSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC001615540413 1056534437 /nfs/dbraw/zinc/53/44/37/1056534437.db2.gz UVMUVHCEPZQGCO-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615540413 1056534449 /nfs/dbraw/zinc/53/44/49/1056534449.db2.gz UVMUVHCEPZQGCO-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cc(C)cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC001615540413 1056534459 /nfs/dbraw/zinc/53/44/59/1056534459.db2.gz UVMUVHCEPZQGCO-VQTJNVASSA-N 2 1 314.517 4.390 20 0 DIADMP Clc1cccc(CCCC[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC001615596305 1056544103 /nfs/dbraw/zinc/54/41/03/1056544103.db2.gz YAZDKAIAWVQGAY-GOSISDBHSA-N 2 1 320.908 4.080 20 0 DIADMP CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668610 1056557988 /nfs/dbraw/zinc/55/79/88/1056557988.db2.gz JAUMAGDUPGHHBJ-SFHVURJKSA-N 2 1 318.505 4.170 20 0 DIADMP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668610 1056558002 /nfs/dbraw/zinc/55/80/02/1056558002.db2.gz JAUMAGDUPGHHBJ-SFHVURJKSA-N 2 1 318.505 4.170 20 0 DIADMP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668610 1056558014 /nfs/dbraw/zinc/55/80/14/1056558014.db2.gz JAUMAGDUPGHHBJ-SFHVURJKSA-N 2 1 318.505 4.170 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668610 1056558030 /nfs/dbraw/zinc/55/80/30/1056558030.db2.gz JAUMAGDUPGHHBJ-SFHVURJKSA-N 2 1 318.505 4.170 20 0 DIADMP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cccc(OC(C)(C)C)c1 ZINC001615668610 1056558045 /nfs/dbraw/zinc/55/80/45/1056558045.db2.gz JAUMAGDUPGHHBJ-SFHVURJKSA-N 2 1 318.505 4.170 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001615665352 1056559385 /nfs/dbraw/zinc/55/93/85/1056559385.db2.gz MXFBHVOEKDBGAS-HLAWJBBLSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001615665352 1056559402 /nfs/dbraw/zinc/55/94/02/1056559402.db2.gz MXFBHVOEKDBGAS-HLAWJBBLSA-N 2 1 314.517 4.267 20 0 DIADMP C[C@@H]1CCCC[C@@H]1C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001615665352 1056559418 /nfs/dbraw/zinc/55/94/18/1056559418.db2.gz MXFBHVOEKDBGAS-HLAWJBBLSA-N 2 1 314.517 4.267 20 0 DIADMP C=C/C=C\CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001615846785 1056585562 /nfs/dbraw/zinc/58/55/62/1056585562.db2.gz ONQAOYCLKHFOIZ-HSSJFEOCSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C\CC[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001615846785 1056585575 /nfs/dbraw/zinc/58/55/75/1056585575.db2.gz ONQAOYCLKHFOIZ-HSSJFEOCSA-N 2 1 310.485 4.105 20 0 DIADMP C=C/C=C\CC[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001615846785 1056585590 /nfs/dbraw/zinc/58/55/90/1056585590.db2.gz ONQAOYCLKHFOIZ-HSSJFEOCSA-N 2 1 310.485 4.105 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccccc2CC(C)C)[C@@H](C)C1 ZINC001615896637 1056592080 /nfs/dbraw/zinc/59/20/80/1056592080.db2.gz YZEJGEMLSDCJND-FXAWDEMLSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccccc2CC(C)C)[C@@H](C)C1 ZINC001615896637 1056592087 /nfs/dbraw/zinc/59/20/87/1056592087.db2.gz YZEJGEMLSDCJND-FXAWDEMLSA-N 2 1 302.506 4.047 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccccc2CC(C)C)[C@@H](C)C1 ZINC001615896637 1056592099 /nfs/dbraw/zinc/59/20/99/1056592099.db2.gz YZEJGEMLSDCJND-FXAWDEMLSA-N 2 1 302.506 4.047 20 0 DIADMP C[N@@H+]1CCCC12CC[NH+](Cc1ccc(C3CCCC3)cc1)CC2 ZINC001616593819 1056683058 /nfs/dbraw/zinc/68/30/58/1056683058.db2.gz YLDKXZRKYGTOKY-UHFFFAOYSA-N 2 1 312.501 4.404 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](Cc1ccc(C3CCCC3)cc1)CC2 ZINC001616593819 1056683059 /nfs/dbraw/zinc/68/30/59/1056683059.db2.gz YLDKXZRKYGTOKY-UHFFFAOYSA-N 2 1 312.501 4.404 20 0 DIADMP C[C@H]1CCC[C@@H](CC[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)C1 ZINC001616879867 1056730692 /nfs/dbraw/zinc/73/06/92/1056730692.db2.gz GZTHYCOLEHZRRZ-ROUUACIJSA-N 2 1 302.506 4.396 20 0 DIADMP C=C/C=C\CC[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC001616935792 1056743364 /nfs/dbraw/zinc/74/33/64/1056743364.db2.gz OGBBLJVFLPWPKR-ARJAWSKDSA-N 2 1 310.485 4.107 20 0 DIADMP CC[C@H](C[N@@H+](CC)CCC[NH+]1CCCCC1)c1ccccc1 ZINC001617352976 1056818416 /nfs/dbraw/zinc/81/84/16/1056818416.db2.gz ROYZLGABRXHYOJ-LJQANCHMSA-N 2 1 302.506 4.378 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H]2CCCCC2(C)C)CC1 ZINC001617563139 1056849152 /nfs/dbraw/zinc/84/91/52/1056849152.db2.gz ZEYFTBWUHUULLZ-QGZVFWFLSA-N 2 1 316.489 4.450 20 0 DIADMP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H]2CCCCC2(C)C)CC1 ZINC001617563138 1056849350 /nfs/dbraw/zinc/84/93/50/1056849350.db2.gz ZEYFTBWUHUULLZ-KRWDZBQOSA-N 2 1 316.489 4.450 20 0 DIADMP CC(C)C[N@@H+]([C@H]1Cc2cccc(Cl)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168713580 1056977602 /nfs/dbraw/zinc/97/76/02/1056977602.db2.gz FOVQIDNWSGDIBJ-ULQDDVLXSA-N 2 1 320.908 4.035 20 0 DIADMP CC(C)CC1([NH2+]C2CC[NH+](CCc3ccc(F)cc3)CC2)CC1 ZINC000657774727 1057012835 /nfs/dbraw/zinc/01/28/35/1057012835.db2.gz JSXOPMFYWJEZGA-UHFFFAOYSA-N 2 1 318.480 4.001 20 0 DIADMP CC(C)[N@H+](C)CCC[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000359646065 1057013456 /nfs/dbraw/zinc/01/34/56/1057013456.db2.gz TYKDZJPWQHMFAG-HNNXBMFYSA-N 2 1 312.910 4.197 20 0 DIADMP CC(C)[N@@H+](C)CCC[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000359646065 1057013459 /nfs/dbraw/zinc/01/34/59/1057013459.db2.gz TYKDZJPWQHMFAG-HNNXBMFYSA-N 2 1 312.910 4.197 20 0 DIADMP Cc1cccc(C2(C[NH2+][C@@H]3CC[N@H+]4CCC[C@@H]4C3)CCCC2)c1 ZINC000166460310 1057027091 /nfs/dbraw/zinc/02/70/91/1057027091.db2.gz GTVRKZSDTBSOEU-WOJBJXKFSA-N 2 1 312.501 4.023 20 0 DIADMP C[N@H+]1CCc2cc(-c3ccc(C[NH+]4CCCCC4)cc3)ccc2C1 ZINC001241388553 1057034638 /nfs/dbraw/zinc/03/46/38/1057034638.db2.gz DVKPOGXDKKNIBJ-UHFFFAOYSA-N 2 1 320.480 4.327 20 0 DIADMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1 ZINC000390791446 1057049908 /nfs/dbraw/zinc/04/99/08/1057049908.db2.gz WTJYVYOLBYSZJC-AZUAARDMSA-N 2 1 308.469 4.249 20 0 DIADMP c1ccc(C[N@@H+]2CC=C(c3ccc([C@@H]4CCC[NH2+]4)cc3)CC2)cc1 ZINC001241504633 1057075218 /nfs/dbraw/zinc/07/52/18/1057075218.db2.gz XESSAMRMMJUACT-QFIPXVFZSA-N 2 1 318.464 4.400 20 0 DIADMP CC[NH+](CC)Cc1ccc(-c2cc(N)c(C(F)(F)F)c[nH+]2)cc1 ZINC001241573563 1057093966 /nfs/dbraw/zinc/09/39/66/1057093966.db2.gz NWSLAKXMGAENQV-UHFFFAOYSA-N 2 1 323.362 4.191 20 0 DIADMP C[N@H+]1CC[C@@H](c2ccc(-c3cccc(C[NH+]4CCCC4)c3)cc2)C1 ZINC001242119745 1057268997 /nfs/dbraw/zinc/26/89/97/1057268997.db2.gz CQQIBVGMRPFHMG-JOCHJYFZSA-N 2 1 320.480 4.369 20 0 DIADMP CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000674698857 1057275095 /nfs/dbraw/zinc/27/50/95/1057275095.db2.gz GFCRMKYOTJSIMN-SFHVURJKSA-N 2 1 315.848 4.008 20 0 DIADMP C[C@@H](c1ccncc1)[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000675641660 1057391544 /nfs/dbraw/zinc/39/15/44/1057391544.db2.gz RDJZYEAINAYOGW-ROUUACIJSA-N 2 1 315.505 4.119 20 0 DIADMP C[C@@H](c1ccncc1)[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000675641657 1057391677 /nfs/dbraw/zinc/39/16/77/1057391677.db2.gz RDJZYEAINAYOGW-MSOLQXFVSA-N 2 1 315.505 4.119 20 0 DIADMP Cc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000675752418 1057406943 /nfs/dbraw/zinc/40/69/43/1057406943.db2.gz SGWNKSIGJIFGTR-BJLQDIEVSA-N 2 1 300.490 4.299 20 0 DIADMP CC(C)CC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1)C(C)(C)C ZINC000675747061 1057408815 /nfs/dbraw/zinc/40/88/15/1057408815.db2.gz DWANLEPPEYSKKM-MOPGFXCFSA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1)C(C)(C)C ZINC000675747063 1057408833 /nfs/dbraw/zinc/40/88/33/1057408833.db2.gz DWANLEPPEYSKKM-RBUKOAKNSA-N 2 1 324.553 4.070 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000675777251 1057412585 /nfs/dbraw/zinc/41/25/85/1057412585.db2.gz PPVFQQPBTOYTMR-JBYIUTFZSA-N 2 1 322.496 4.357 20 0 DIADMP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000675777251 1057412587 /nfs/dbraw/zinc/41/25/87/1057412587.db2.gz PPVFQQPBTOYTMR-JBYIUTFZSA-N 2 1 322.496 4.357 20 0 DIADMP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2nc(C)sc2C)c1 ZINC000676489790 1057479085 /nfs/dbraw/zinc/47/90/85/1057479085.db2.gz LEQCNRPETRYYBN-ZDUSSCGKSA-N 2 1 317.502 4.062 20 0 DIADMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2nc(C)sc2C)c1 ZINC000676489790 1057479089 /nfs/dbraw/zinc/47/90/89/1057479089.db2.gz LEQCNRPETRYYBN-ZDUSSCGKSA-N 2 1 317.502 4.062 20 0 DIADMP Cc1nc([C@@H](C)[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)s1 ZINC000676488427 1057479421 /nfs/dbraw/zinc/47/94/21/1057479421.db2.gz GEAMYILFESFNRD-QLFBSQMISA-N 2 1 323.550 4.169 20 0 DIADMP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366759 1057501950 /nfs/dbraw/zinc/50/19/50/1057501950.db2.gz XHIJNPBGYAODJH-NVXWUHKLSA-N 2 1 324.459 4.168 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC(C)(C)CC(F)F ZINC000710366759 1057501956 /nfs/dbraw/zinc/50/19/56/1057501956.db2.gz XHIJNPBGYAODJH-NVXWUHKLSA-N 2 1 324.459 4.168 20 0 DIADMP C[N@@H+](CCC[NH2+][C@@H]1CCCNc2ccccc21)C1CCCCC1 ZINC000347923605 1057552541 /nfs/dbraw/zinc/55/25/41/1057552541.db2.gz OOBKXBIIQOZDNZ-HXUWFJFHSA-N 2 1 315.505 4.178 20 0 DIADMP CC(C)(C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)Cc1cccc(Cl)c1 ZINC000166828402 1057677797 /nfs/dbraw/zinc/67/77/97/1057677797.db2.gz ZYPDATVVEKCYFP-QZTJIDSGSA-N 2 1 320.908 4.125 20 0 DIADMP CCC[N@H+]1CCCC[C@@H]1c1ccc(/C=C/C2CC[NH2+]CC2)nc1 ZINC001243893481 1057800981 /nfs/dbraw/zinc/80/09/81/1057800981.db2.gz FQXMCBNYURAOJP-CPSHHHPTSA-N 2 1 313.489 4.031 20 0 DIADMP CCOC(=[NH2+])c1ccc(-c2ccc(C3CC[NH2+]CC3)cc2)cc1 ZINC001245527808 1058205408 /nfs/dbraw/zinc/20/54/08/1058205408.db2.gz YFQXDENFWXVYMM-UHFFFAOYSA-N 2 1 308.425 4.182 20 0 DIADMP Cn1cc[nH+]c1[C@H]1CC[C@@H]([NH2+]C2CCC(C3CCC3)CC2)C1 ZINC001550520145 1058342336 /nfs/dbraw/zinc/34/23/36/1058342336.db2.gz IKCXNYUWLDZMNZ-JYSRZZCRSA-N 2 1 301.478 4.005 20 0 DIADMP Cc1ccccc1C1([NH2+][C@H]2CC[C@@H](c3[nH+]ccn3C)C2)CCC1 ZINC001550512555 1058343011 /nfs/dbraw/zinc/34/30/11/1058343011.db2.gz AGRCEEZECUPSSL-SJORKVTESA-N 2 1 309.457 4.034 20 0 DIADMP Cc1ccccc1C1CC([NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)C1 ZINC001552080670 1058427043 /nfs/dbraw/zinc/42/70/43/1058427043.db2.gz AHQJXAFFNJMXTN-OYZUSSLQSA-N 2 1 320.480 4.324 20 0 DIADMP C[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc(C(C)(C)[NH3+])cc2)nc1 ZINC001245907365 1058609847 /nfs/dbraw/zinc/60/98/47/1058609847.db2.gz SUOCGXHGAMKZMQ-INIZCTEOSA-N 2 1 323.484 4.317 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+]C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246070751 1058663616 /nfs/dbraw/zinc/66/36/16/1058663616.db2.gz FFUBJPYODICYQZ-UXHICEINSA-N 2 1 308.469 4.142 20 0 DIADMP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1Cl ZINC001246076918 1058667853 /nfs/dbraw/zinc/66/78/53/1058667853.db2.gz QDIRPWFSZVULHQ-SCUASFONSA-N 2 1 313.272 4.317 20 0 DIADMP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C(C)(C)C)C1)c1cccc(Cl)c1F ZINC001246101790 1058676764 /nfs/dbraw/zinc/67/67/64/1058676764.db2.gz AYTDDAKLUMGGQR-XUJVJEKNSA-N 2 1 312.860 4.296 20 0 DIADMP CC[C@H]1CC([NH2+][C@H](C)c2cccc(Cl)c2F)C[C@H](CC)[NH2+]1 ZINC001246107721 1058681498 /nfs/dbraw/zinc/68/14/98/1058681498.db2.gz UMLAZFXKQMBNJA-AGIUHOORSA-N 2 1 312.860 4.439 20 0 DIADMP Cc1ccc(CCC[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC001246127700 1058689713 /nfs/dbraw/zinc/68/97/13/1058689713.db2.gz MMVIIVPYLFQFDM-HKUYNNGSSA-N 2 1 314.498 4.072 20 0 DIADMP Cc1ccc(CCC[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)s1 ZINC001246127705 1058689795 /nfs/dbraw/zinc/68/97/95/1058689795.db2.gz MMVIIVPYLFQFDM-MJGOQNOKSA-N 2 1 314.498 4.072 20 0 DIADMP CC(C)c1ccc(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246163121 1058706927 /nfs/dbraw/zinc/70/69/27/1058706927.db2.gz VUSKCOTUAZVGJD-LEWJYISDSA-N 2 1 308.469 4.393 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@H]([NH2+][C@H](C)c2ccccc2)CC[NH2+]1 ZINC001246176793 1058719827 /nfs/dbraw/zinc/71/98/27/1058719827.db2.gz QHTDZJZVOHGYJR-XFQXTVEOSA-N 2 1 312.432 4.278 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+]CCC2CCCC2)CC[NH2+]1 ZINC001246177760 1058722244 /nfs/dbraw/zinc/72/22/44/1058722244.db2.gz UASZMBPOKCGTSA-MJGOQNOKSA-N 2 1 304.453 4.097 20 0 DIADMP c1ccc([C@@H]2C[C@@H]([NH2+]C34CC5CC(CC(C5)C3)C4)CC[NH2+]2)cc1 ZINC001246178563 1058723684 /nfs/dbraw/zinc/72/36/84/1058723684.db2.gz IYFUPGLSLJEMII-LEIKXDBLSA-N 2 1 310.485 4.038 20 0 DIADMP CC[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246179788 1058728282 /nfs/dbraw/zinc/72/82/82/1058728282.db2.gz RRWXPZVBKIYNPQ-SLFFLAALSA-N 2 1 312.432 4.360 20 0 DIADMP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccc(F)cc1F ZINC001246188105 1058729220 /nfs/dbraw/zinc/72/92/20/1058729220.db2.gz QWSMJWZJFXRPRQ-ZFWWWQNUSA-N 2 1 308.416 4.070 20 0 DIADMP c1ccc([C@H]2C[C@H]([NH2+]Cc3ccccc3C3CC3)CC[NH2+]2)cc1 ZINC001246186991 1058730753 /nfs/dbraw/zinc/73/07/53/1058730753.db2.gz DXFDWVBBDQRLAM-TZIWHRDSSA-N 2 1 306.453 4.147 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c(C)c1 ZINC001246185947 1058732343 /nfs/dbraw/zinc/73/23/43/1058732343.db2.gz XLAAMPLIAAQCRW-CTNGQTDRSA-N 2 1 308.469 4.195 20 0 DIADMP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@]1(C)CCC[NH2+]C1 ZINC001246191670 1058733444 /nfs/dbraw/zinc/73/34/44/1058733444.db2.gz WXJFMIIJJPRJFE-MLGOLLRUSA-N 2 1 315.288 4.046 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc32)CC[NH2+]1 ZINC001246191562 1058733923 /nfs/dbraw/zinc/73/39/23/1058733923.db2.gz WEBFENQSQISXQT-IOMROCGXSA-N 2 1 324.443 4.204 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)CC[NH2+]1 ZINC001246195459 1058737659 /nfs/dbraw/zinc/73/76/59/1058737659.db2.gz OFPLYFVYQQLVBT-WFASDCNBSA-N 2 1 315.288 4.250 20 0 DIADMP C[C@@]1(C[NH2+][C@H]2CCCC3(CCCCC3)C2)CC[NH2+]CC1(F)F ZINC001246224097 1058749779 /nfs/dbraw/zinc/74/97/79/1058749779.db2.gz ZDFOTVAFSPADQP-HOTGVXAUSA-N 2 1 314.464 4.104 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H](C)CCC(C)C)CC[NH2+]1 ZINC001246230856 1058753350 /nfs/dbraw/zinc/75/33/50/1058753350.db2.gz UBEMFJSDSNTTBJ-SUMDDJOVSA-N 2 1 306.469 4.342 20 0 DIADMP CC[C@H](C)C[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246235098 1058756406 /nfs/dbraw/zinc/75/64/06/1058756406.db2.gz XTTBGAYMSMXGMM-VGDUNAEUSA-N 2 1 306.469 4.342 20 0 DIADMP CC(C)(C)[C@H]1C[C@H]([NH2+]C2(c3cccc(Cl)c3)CC2)CC[NH2+]1 ZINC001246240296 1058759521 /nfs/dbraw/zinc/75/95/21/1058759521.db2.gz UHMZWXLYDRMCID-HZPDHXFCSA-N 2 1 306.881 4.085 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC[NH2+]1 ZINC001246251547 1058769728 /nfs/dbraw/zinc/76/97/28/1058769728.db2.gz DQQVWUBVYBDLGA-XZJROXQQSA-N 2 1 315.288 4.421 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H](C)C2CCCCC2)CC[NH2+]1 ZINC001246252347 1058770977 /nfs/dbraw/zinc/77/09/77/1058770977.db2.gz VNAZQYLRVATTEM-BPAFIMBUSA-N 2 1 318.480 4.486 20 0 DIADMP C[C@H]([NH2+]C1C[C@@H](C)[NH2+][C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246251849 1058771127 /nfs/dbraw/zinc/77/11/27/1058771127.db2.gz FLIRLJVEVVEYRO-MXWKQRLJSA-N 2 1 301.261 4.173 20 0 DIADMP C[C@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1cc(Cl)cc(Cl)c1 ZINC001246255283 1058774720 /nfs/dbraw/zinc/77/47/20/1058774720.db2.gz VNJHYQWKUYLWIE-IINYFYTJSA-N 2 1 301.261 4.175 20 0 DIADMP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c2ccccc21 ZINC001246260333 1058780463 /nfs/dbraw/zinc/78/04/63/1058780463.db2.gz RZDLTYRSCVDZIZ-SLWXAUBPSA-N 2 1 306.453 4.318 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@H](C)CC2)CC[NH2+]1 ZINC001246266712 1058780563 /nfs/dbraw/zinc/78/05/63/1058780563.db2.gz QYOLWRVKKXHAFU-UHEFJODHSA-N 2 1 304.453 4.096 20 0 DIADMP CC(C)([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1Cl ZINC001246264563 1058780901 /nfs/dbraw/zinc/78/09/01/1058780901.db2.gz CGHYCWQSDKFACR-ITGUQSILSA-N 2 1 313.272 4.101 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246274683 1058790244 /nfs/dbraw/zinc/79/02/44/1058790244.db2.gz ZTQYMYOGAHDYKS-BVOGOJNSSA-N 2 1 324.443 4.073 20 0 DIADMP CC[C@@H]1CC([NH2+]C(C)(C)c2cc(F)cc(F)c2)C[C@@H](CC)[NH2+]1 ZINC001246275588 1058791022 /nfs/dbraw/zinc/79/10/22/1058791022.db2.gz AQICQYRSGGEXOF-HZPDHXFCSA-N 2 1 310.432 4.099 20 0 DIADMP CC(C)([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001246280518 1058794179 /nfs/dbraw/zinc/79/41/79/1058794179.db2.gz PJXUYKPYFXCLIM-KRWDZBQOSA-N 2 1 322.443 4.244 20 0 DIADMP CCCC[C@H]1C[C@@H]([NH2+]C(C)(C)c2cc(F)cc(F)c2)CC[NH2+]1 ZINC001246281734 1058798504 /nfs/dbraw/zinc/79/85/04/1058798504.db2.gz UYHCDUPWJONXLA-IRXDYDNUSA-N 2 1 310.432 4.100 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C1(C[NH3+])CCCC1 ZINC001246285624 1058799069 /nfs/dbraw/zinc/79/90/69/1058799069.db2.gz IHLSAFVHFRUIRS-LBPRGKRZSA-N 2 1 315.288 4.176 20 0 DIADMP [NH3+]CC1([NH2+]C2CCC(c3ccc(Cl)cc3)CC2)CCCC1 ZINC001246284688 1058799732 /nfs/dbraw/zinc/79/97/32/1058799732.db2.gz CLJMIHYSGAQUMO-UHFFFAOYSA-N 2 1 306.881 4.227 20 0 DIADMP CCCC[C@H]1C[C@H]([NH2+]C(C)(C)c2ccccc2Cl)CC[NH2+]1 ZINC001246309260 1058816770 /nfs/dbraw/zinc/81/67/70/1058816770.db2.gz JEBUKQNABJUZPB-LSDHHAIUSA-N 2 1 308.897 4.476 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2F)C2CC2)CC[NH2+]1 ZINC001246307661 1058817399 /nfs/dbraw/zinc/81/73/99/1058817399.db2.gz NADLNIPUCIXZQF-FHLIZLRMSA-N 2 1 304.453 4.033 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1cccc(OC)c1 ZINC001246310950 1058821336 /nfs/dbraw/zinc/82/13/36/1058821336.db2.gz AQANMXPWTUPQGX-TYPHKJRUSA-N 2 1 324.468 4.229 20 0 DIADMP CC[C@H]([NH2+]C1C[C@@H](CC)[NH2+][C@H](CC)C1)c1ccccc1OC ZINC001246316575 1058825709 /nfs/dbraw/zinc/82/57/09/1058825709.db2.gz JNGPNMLMUKONLI-RKVPGOIHSA-N 2 1 304.478 4.045 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccccc2Cl)C[C@H](CC)[NH2+]1 ZINC001246314266 1058826894 /nfs/dbraw/zinc/82/68/94/1058826894.db2.gz XCKZLUOUGCNMAA-QDMKHBRRSA-N 2 1 308.897 4.474 20 0 DIADMP C[C@H](CC1CCCCC1)[NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246317712 1058830245 /nfs/dbraw/zinc/83/02/45/1058830245.db2.gz XOFAEMYSYJTLON-UXPWSPDFSA-N 2 1 300.490 4.428 20 0 DIADMP C[C@H](CC1CCCCC1)[NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246317708 1058831706 /nfs/dbraw/zinc/83/17/06/1058831706.db2.gz XOFAEMYSYJTLON-AHRSYUTCSA-N 2 1 300.490 4.428 20 0 DIADMP CC[C@@H]1CC([NH2+][C@H](CC(C)C)c2ccccn2)C[C@@H](CC)[NH2+]1 ZINC001246325070 1058833844 /nfs/dbraw/zinc/83/38/44/1058833844.db2.gz IAEAOBJYLPQWSZ-GPMSIDNRSA-N 2 1 303.494 4.068 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CCC[NH2+][C@@H]1C ZINC001246325233 1058837782 /nfs/dbraw/zinc/83/77/82/1058837782.db2.gz ITWFCPKBJQSBDW-OZVIIMIRSA-N 2 1 315.288 4.045 20 0 DIADMP CC[C@@H]1C[C@@H]([NH2+][C@@H](CC(C)C)c2ccccn2)C[C@H](CC)[NH2+]1 ZINC001246325074 1058838212 /nfs/dbraw/zinc/83/82/12/1058838212.db2.gz IAEAOBJYLPQWSZ-ZMMAXQRCSA-N 2 1 303.494 4.068 20 0 DIADMP CC(C)C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCCCC2)C1)c1ccccn1 ZINC001246328518 1058838300 /nfs/dbraw/zinc/83/83/00/1058838300.db2.gz YORRYTGRDCTTRQ-PKOBYXMFSA-N 2 1 315.505 4.213 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](CC(C)C)c2ccccn2)CC[NH2+]1 ZINC001246328097 1058840174 /nfs/dbraw/zinc/84/01/74/1058840174.db2.gz VXEBCNUEIQLBAZ-LMMKCTJWSA-N 2 1 303.494 4.069 20 0 DIADMP CC(C)C1CCC([NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246332591 1058840874 /nfs/dbraw/zinc/84/08/74/1058840874.db2.gz FXMOFYDFHNSKBF-PEVDHWGLSA-N 2 1 300.490 4.284 20 0 DIADMP CC(C)C1CCC([NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246332589 1058842479 /nfs/dbraw/zinc/84/24/79/1058842479.db2.gz FXMOFYDFHNSKBF-DXBWTPJFSA-N 2 1 300.490 4.284 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH2+][C@H]2CC23CCCCC3)CC[NH2+]1 ZINC001246333545 1058844325 /nfs/dbraw/zinc/84/43/25/1058844325.db2.gz JVTFJCVZQSENFL-NEWSRXKRSA-N 2 1 316.464 4.240 20 0 DIADMP CCC(C)(C)C1CCC([NH2+][C@H]2CC[NH2+]C[C@@H]2C(F)(F)F)CC1 ZINC001246341893 1058854898 /nfs/dbraw/zinc/85/48/98/1058854898.db2.gz QEOKKKLSUCMVQJ-WUCCLRPBSA-N 2 1 320.443 4.111 20 0 DIADMP FC(F)(F)[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001246343018 1058854999 /nfs/dbraw/zinc/85/49/99/1058854999.db2.gz ULBQFYPIVKGFHN-RRFJBIMHSA-N 2 1 318.427 4.010 20 0 DIADMP CC(C)([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc(F)cc1 ZINC001246349706 1058860228 /nfs/dbraw/zinc/86/02/28/1058860228.db2.gz NYOYWEOCMOCUCK-MOPGFXCFSA-N 2 1 312.432 4.144 20 0 DIADMP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)c(F)c1F ZINC001246350943 1058860526 /nfs/dbraw/zinc/86/05/26/1058860526.db2.gz OIPCDEGLXHZIKD-LSDHHAIUSA-N 2 1 322.443 4.379 20 0 DIADMP CCc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)cc1 ZINC001246370682 1058873086 /nfs/dbraw/zinc/87/30/86/1058873086.db2.gz FXISSSARWNASDW-MAODMQOUSA-N 2 1 308.469 4.393 20 0 DIADMP CCCCCC[C@H](C)[NH2+]C1(c2ccccc2OC)CC[NH2+]CC1 ZINC001246375706 1058882141 /nfs/dbraw/zinc/88/21/41/1058882141.db2.gz JISDKPDMUWGKOV-KRWDZBQOSA-N 2 1 318.505 4.222 20 0 DIADMP Cc1cccc(C(C)(C)[NH2+][C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246384133 1058886290 /nfs/dbraw/zinc/88/62/90/1058886290.db2.gz ADQOOGKGRYHYAV-UXHICEINSA-N 2 1 308.469 4.313 20 0 DIADMP Cc1cccc(C(C)(C)[NH2+][C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246384132 1058888220 /nfs/dbraw/zinc/88/82/20/1058888220.db2.gz ADQOOGKGRYHYAV-PMACEKPBSA-N 2 1 308.469 4.313 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([NH2+]C(C)(C)CC2CC2)CC[NH2+]1 ZINC001246386104 1058893863 /nfs/dbraw/zinc/89/38/63/1058893863.db2.gz DQUFZMXQIDKVQA-FUHWJXTLSA-N 2 1 304.453 4.096 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246401008 1058904191 /nfs/dbraw/zinc/90/41/91/1058904191.db2.gz QUBFULLMNXGRMA-JFIYKMOQSA-N 2 1 321.896 4.085 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@@H+](C(CC)CC)[C@H]2CC[C@H]([NH3+])CC2)CC[NH2+]1 ZINC001246403484 1058905278 /nfs/dbraw/zinc/90/52/78/1058905278.db2.gz MUHBWKIHDRHXQW-ZULIPRJHSA-N 3 1 323.569 4.058 20 0 DIADMP Fc1ccccc1[C@@H](CC1CCC1)[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246405212 1058909026 /nfs/dbraw/zinc/90/90/26/1058909026.db2.gz OPZFPBBCKBRPIL-NHAYFPRASA-N 2 1 316.464 4.320 20 0 DIADMP CC(C)[C@@H]1C[C@H]([NH2+][C@H](CC2CCC2)c2ccccc2F)CC[NH2+]1 ZINC001246408658 1058910821 /nfs/dbraw/zinc/91/08/21/1058910821.db2.gz VOLOFWJCBVRWMX-LSTHTHJFSA-N 2 1 318.480 4.423 20 0 DIADMP CC1(C[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246427285 1058920930 /nfs/dbraw/zinc/92/09/30/1058920930.db2.gz KEBDLXVNSFZNMY-DLBZAZTESA-N 2 1 322.443 4.285 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]CC(C)(C)CC2CC2)CC[NH2+]1 ZINC001246430067 1058922718 /nfs/dbraw/zinc/92/27/18/1058922718.db2.gz FMCDXEMECSWTCG-HKUYNNGSSA-N 2 1 318.480 4.343 20 0 DIADMP CC1(C[NH2+][C@@H]2CC[NH2+][C@@H](c3ccccc3)C2)CCC(F)(F)CC1 ZINC001246427287 1058923717 /nfs/dbraw/zinc/92/37/17/1058923717.db2.gz KEBDLXVNSFZNMY-IAGOWNOFSA-N 2 1 322.443 4.285 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(C)(C)C2)CC[NH2+]1 ZINC001246437847 1058931423 /nfs/dbraw/zinc/93/14/23/1058931423.db2.gz WFDVKGNMUQVNKZ-AYBZRNKSSA-N 2 1 318.480 4.343 20 0 DIADMP C[C@H]1[C@H]2C[C@@H](C[C@H]1[NH2+][C@@H]1CC[NH2+][C@@H](c3ccccc3)C1)C2(C)C ZINC001246443640 1058932802 /nfs/dbraw/zinc/93/28/02/1058932802.db2.gz NUGTXWOEZSRGAR-ZABSUHAISA-N 2 1 312.501 4.140 20 0 DIADMP CCCCCC[C@@H](C)[NH2+]C1(c2ccccc2F)CC[NH2+]CC1 ZINC001246439321 1058935396 /nfs/dbraw/zinc/93/53/96/1058935396.db2.gz XJNLUHWBMKDFPV-MRXNPFEDSA-N 2 1 306.469 4.353 20 0 DIADMP CC[C@@H]1CC([NH2+][C@@H](c2cccnc2Cl)C2CC2)C[C@@H](CC)[NH2+]1 ZINC001246455779 1058942473 /nfs/dbraw/zinc/94/24/73/1058942473.db2.gz HOYRKTMHURPUPX-CKEIUWERSA-N 2 1 321.896 4.085 20 0 DIADMP CCCC[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(Cl)cn2)C2CC2)CC[NH2+]1 ZINC001246457550 1058943527 /nfs/dbraw/zinc/94/35/27/1058943527.db2.gz NEMVXBHDDOVKOQ-JFIYKMOQSA-N 2 1 321.896 4.087 20 0 DIADMP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCCCC2)C1)c1cc(F)cc(F)c1 ZINC001246463332 1058950720 /nfs/dbraw/zinc/95/07/20/1058950720.db2.gz RJTWCSQWTYRCRL-QZTJIDSGSA-N 2 1 322.443 4.460 20 0 DIADMP Cc1cccc([C@@H](C)[NH2+][C@H]2CC[NH2+][C@@H](c3ccccc3)C2)c1C ZINC001246469369 1058955760 /nfs/dbraw/zinc/95/57/60/1058955760.db2.gz CRZZYNGGJCWJLW-SLYNCCJLSA-N 2 1 308.469 4.447 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[NH2+]CC[C@H]1CC[NH2+]CC1(F)F ZINC001246483096 1058961829 /nfs/dbraw/zinc/96/18/29/1058961829.db2.gz RHGUOBJVADRYPL-MSOLQXFVSA-N 2 1 324.459 4.012 20 0 DIADMP CCCC(C[NH3+])(CCC)[NH2+][C@@H](C)CSc1ccc(C)cc1 ZINC001246496516 1058969546 /nfs/dbraw/zinc/96/95/46/1058969546.db2.gz OOLRCVIKGGQMEJ-INIZCTEOSA-N 2 1 308.535 4.363 20 0 DIADMP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[NH2+][C@H](c3ccccc3)C1)CCC2 ZINC001246496892 1058969761 /nfs/dbraw/zinc/96/97/61/1058969761.db2.gz DCWQEPCNJBICCW-NNWRFLSQSA-N 2 1 320.480 4.455 20 0 DIADMP CC(C)[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246521811 1058982296 /nfs/dbraw/zinc/98/22/96/1058982296.db2.gz RMFVKNBGMGPBAB-LJQANCHMSA-N 2 1 300.490 4.352 20 0 DIADMP CC(C)(C)[N@@H+](Cc1ccccc1)[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246519402 1058983829 /nfs/dbraw/zinc/98/38/29/1058983829.db2.gz NEZNPJSPNDQVLX-ICSRJNTNSA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)[C@@H]1C[C@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530059 1058986745 /nfs/dbraw/zinc/98/67/45/1058986745.db2.gz NMFWZHVBTDIFHZ-RTWAWAEBSA-N 2 1 322.496 4.484 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246529935 1058988257 /nfs/dbraw/zinc/98/82/57/1058988257.db2.gz LKTASDSBYYYAOS-LJQANCHMSA-N 2 1 308.469 4.238 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534848 1058988565 /nfs/dbraw/zinc/98/85/65/1058988565.db2.gz ZPKXMRJJRHDMDN-PKOBYXMFSA-N 2 1 304.453 4.192 20 0 DIADMP Cc1cc(F)ccc1[C@H]1C[C@@H]([N@@H+](C)C2CCCCC2)CC[NH2+]1 ZINC001246534848 1058988585 /nfs/dbraw/zinc/98/85/85/1058988585.db2.gz ZPKXMRJJRHDMDN-PKOBYXMFSA-N 2 1 304.453 4.192 20 0 DIADMP C[N@@H+](C(c1ccccc1)c1ccccc1)C1CCC2(C[NH2+]C2)CC1 ZINC001246531534 1058989808 /nfs/dbraw/zinc/98/98/08/1058989808.db2.gz UTTPZRGQTFPCHE-UHFFFAOYSA-N 2 1 320.480 4.240 20 0 DIADMP CC(C)[C@H]1C[C@@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)CC[NH2+]1 ZINC001246530056 1058989836 /nfs/dbraw/zinc/98/98/36/1058989836.db2.gz NMFWZHVBTDIFHZ-LEWJYISDSA-N 2 1 322.496 4.484 20 0 DIADMP CC[N@@H+](C1CCCCC1)[C@@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246533153 1058990051 /nfs/dbraw/zinc/99/00/51/1058990051.db2.gz TTYWYYFIABNKJG-UYAOXDASSA-N 2 1 300.490 4.004 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+](C)C(c2ccccc2)c2ccccc2)C[C@H](C)[NH2+]1 ZINC001246526919 1058990582 /nfs/dbraw/zinc/99/05/82/1058990582.db2.gz DEXZRDVNHGFESA-XEMDLRDOSA-N 2 1 308.469 4.237 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCC[C@H]2c2cccc(C)c2)CC[NH2+]1 ZINC001246542656 1058993392 /nfs/dbraw/zinc/99/33/92/1058993392.db2.gz WRIFSFWBDJCMJC-AQNXPRMDSA-N 2 1 300.490 4.443 20 0 DIADMP Cc1cccc([C@H]2CCC[N@H+]2C2CCC3(CC[NH2+]CC3)CC2)c1 ZINC001246542144 1058994332 /nfs/dbraw/zinc/99/43/32/1058994332.db2.gz WOAQUKLZODEFFK-HXUWFJFHSA-N 2 1 312.501 4.444 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CCC[C@H](c3ccccc3)C2)CC[C@@H]1C[NH3+] ZINC001246555346 1058999641 /nfs/dbraw/zinc/99/96/41/1058999641.db2.gz DTXXRRTVTKHXAH-GSEOLPGOSA-N 2 1 300.490 4.020 20 0 DIADMP [NH3+][C@H]1CCC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC1 ZINC001246548166 1058999981 /nfs/dbraw/zinc/99/99/81/1058999981.db2.gz RTAFJLOBYMWUMQ-NXYGQSRBSA-N 2 1 306.881 4.179 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CC[C@H](C)[C@@H](C[NH3+])CC1 ZINC001246556941 1059000115 /nfs/dbraw/zinc/00/01/15/1059000115.db2.gz IOOVIEKXBRKZEZ-DFQSSKMNSA-N 2 1 302.506 4.095 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1[C@@H](C)CC[C@H]1CN ZINC001246549198 1059000824 /nfs/dbraw/zinc/00/08/24/1059000824.db2.gz VMARJHBAXOOYCV-OBJOEFQTSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1[C@@H](C)CC[C@H]1C[NH3+] ZINC001246549198 1059000846 /nfs/dbraw/zinc/00/08/46/1059000846.db2.gz VMARJHBAXOOYCV-OBJOEFQTSA-N 2 1 315.288 4.126 20 0 DIADMP C[C@@H]1C[N@H+](C2CCC(Cc3ccccc3)CC2)CCC[C@@H]1C[NH3+] ZINC001246563421 1059002532 /nfs/dbraw/zinc/00/25/32/1059002532.db2.gz QUPHXSPJKBOBGW-MAKTXDPSSA-N 2 1 314.517 4.095 20 0 DIADMP CCC[C@H](CCc1ccccc1)[N@H+]1CCC[C@@H](C[NH3+])[C@H](C)C1 ZINC001246568538 1059002927 /nfs/dbraw/zinc/00/29/27/1059002927.db2.gz PCZXKPRBOHSALB-YZGWKJHDSA-N 2 1 302.506 4.095 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CCC[C@](C)(F)CC2)CC[NH2+]1 ZINC001246567501 1059005162 /nfs/dbraw/zinc/00/51/62/1059005162.db2.gz KRVCYQVHVZORAJ-WDSOQIARSA-N 2 1 322.443 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CCC[C@](C)(F)CC2)CC[NH2+]1 ZINC001246567501 1059005182 /nfs/dbraw/zinc/00/51/82/1059005182.db2.gz KRVCYQVHVZORAJ-WDSOQIARSA-N 2 1 322.443 4.141 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC001246572726 1059005881 /nfs/dbraw/zinc/00/58/81/1059005881.db2.gz KITGZQJAXJAJPZ-CAUGKJMWSA-N 2 1 318.480 4.295 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@@H](C)[C@@H](C)C2)CC[NH2+]1 ZINC001246572726 1059005904 /nfs/dbraw/zinc/00/59/04/1059005904.db2.gz KITGZQJAXJAJPZ-CAUGKJMWSA-N 2 1 318.480 4.295 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(F)cc2)C[C@H](CC)[NH2+]1 ZINC001246565035 1059007289 /nfs/dbraw/zinc/00/72/89/1059007289.db2.gz ZZEDGMQKQAEKGU-RDGPPVDQSA-N 2 1 304.453 4.272 20 0 DIADMP [NH3+][C@H]1CC[N@@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@@H]1F ZINC001246588329 1059008800 /nfs/dbraw/zinc/00/88/00/1059008800.db2.gz PVGWEWVLUIFPLS-KXIUCKCTSA-N 2 1 324.871 4.127 20 0 DIADMP [NH3+][C@H]1CC[N@H+](C2CCC(c3ccc(Cl)cc3)CC2)CC[C@@H]1F ZINC001246588329 1059008821 /nfs/dbraw/zinc/00/88/21/1059008821.db2.gz PVGWEWVLUIFPLS-KXIUCKCTSA-N 2 1 324.871 4.127 20 0 DIADMP C[C@@]1(C[NH3+])CCC[N@H+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001246575558 1059009733 /nfs/dbraw/zinc/00/97/33/1059009733.db2.gz JRRNTHRGELMOEM-VAMGGRTRSA-N 2 1 300.490 4.164 20 0 DIADMP C[C@]1(C[NH3+])CCC[N@H+]([C@@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC001246575562 1059009909 /nfs/dbraw/zinc/00/99/09/1059009909.db2.gz JRRNTHRGELMOEM-ZCNNSNEGSA-N 2 1 300.490 4.164 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@H+]([C@H]2CCC[C@H](c3ccccc3)C2)C1 ZINC001246586199 1059009971 /nfs/dbraw/zinc/00/99/71/1059009971.db2.gz RNUWTWZPCWQCPF-SLFFLAALSA-N 2 1 300.490 4.164 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@](C)(C[NH3+])CC1 ZINC001246578557 1059013636 /nfs/dbraw/zinc/01/36/36/1059013636.db2.gz SAAKPNLUYPTVPB-PMACEKPBSA-N 2 1 302.506 4.239 20 0 DIADMP C[C@]1(C[NH3+])CCCC[N@H+](C2CCC(c3ccccc3)CC2)C1 ZINC001246585182 1059013715 /nfs/dbraw/zinc/01/37/15/1059013715.db2.gz OOUOMADJPFHADR-SOAGJPPSSA-N 2 1 300.490 4.164 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+](C(C)C)[C@H]2CCC[NH2+]CC2)cc1 ZINC001246589251 1059014363 /nfs/dbraw/zinc/01/43/63/1059014363.db2.gz DQPGACQIQSFIGA-ROUUACIJSA-N 2 1 320.546 4.328 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1ccccc1Cl)[C@H]1CCC[NH2+]CC1 ZINC001246589759 1059014584 /nfs/dbraw/zinc/01/45/84/1059014584.db2.gz FNRUSXPBHTYBJB-WBVHZDCISA-N 2 1 308.897 4.124 20 0 DIADMP CC(C)[N@@H+]([C@H](C)Cc1cccc(Cl)c1)[C@H]1CCC[NH2+]CC1 ZINC001246595982 1059016262 /nfs/dbraw/zinc/01/62/62/1059016262.db2.gz UNZYRWOOTAXHJI-QAPCUYQASA-N 2 1 308.897 4.124 20 0 DIADMP CC(C)[N@@H+]([C@H](C)CSc1ccc(F)cc1)[C@@H]1CCC[NH2+]CC1 ZINC001246595962 1059017588 /nfs/dbraw/zinc/01/75/88/1059017588.db2.gz UJEIBBKIJOPVRH-NVXWUHKLSA-N 2 1 324.509 4.159 20 0 DIADMP Cc1ccc(SC[C@H](C)[N@H+](C(C)C)[C@@H]2CCC[NH2+]CC2)cc1 ZINC001246589252 1059017965 /nfs/dbraw/zinc/01/79/65/1059017965.db2.gz DQPGACQIQSFIGA-ZWKOTPCHSA-N 2 1 320.546 4.328 20 0 DIADMP CC(C)[N@@H+]([C@H](C)CSc1ccc(F)cc1)[C@H]1CCC[NH2+]CC1 ZINC001246595965 1059018173 /nfs/dbraw/zinc/01/81/73/1059018173.db2.gz UJEIBBKIJOPVRH-WBVHZDCISA-N 2 1 324.509 4.159 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001246604626 1059021246 /nfs/dbraw/zinc/02/12/46/1059021246.db2.gz HPWOWKPGKYWMBV-SFTDATJTSA-N 2 1 314.517 4.396 20 0 DIADMP c1ccc(C[N@@H+](C2CCCCC2)C2CCC3(C[NH2+]C3)CC2)cc1 ZINC001246602271 1059022427 /nfs/dbraw/zinc/02/24/27/1059022427.db2.gz VTKOZSXOIOKSMK-UHFFFAOYSA-N 2 1 312.501 4.354 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001246612324 1059025056 /nfs/dbraw/zinc/02/50/56/1059025056.db2.gz VPFGORKOLUPMEO-PXNSSMCTSA-N 2 1 318.480 4.003 20 0 DIADMP C[C@@H](Cc1cccc(F)c1)[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001246612320 1059027297 /nfs/dbraw/zinc/02/72/97/1059027297.db2.gz VPFGORKOLUPMEO-FXAWDEMLSA-N 2 1 318.480 4.003 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001246615205 1059032734 /nfs/dbraw/zinc/03/27/34/1059032734.db2.gz QUCJPPDCNUBMSW-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001246619855 1059034071 /nfs/dbraw/zinc/03/40/71/1059034071.db2.gz JAAPAMDEOFYISC-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001246619362 1059035254 /nfs/dbraw/zinc/03/52/54/1059035254.db2.gz LWLCUPAERRXSPC-PMACEKPBSA-N 2 1 300.490 4.006 20 0 DIADMP CCCC1CCC([N@H+]2C[C@@H](c3ccccc3)C3(C[NH2+]C3)C2)CC1 ZINC001246619068 1059035393 /nfs/dbraw/zinc/03/53/93/1059035393.db2.gz JIZQCKVHKMXDTD-UUKMXZOPSA-N 2 1 312.501 4.034 20 0 DIADMP FC(F)(F)CCN1CCC[C@]2(CCC[N@H+](C3CCCC3)C2)C1 ZINC001278458340 1059035695 /nfs/dbraw/zinc/03/56/95/1059035695.db2.gz GARXKJCBZUBUEF-INIZCTEOSA-N 2 1 318.427 4.059 20 0 DIADMP CC(C)C[C@@H](Cc1ccccc1)[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001246629981 1059039038 /nfs/dbraw/zinc/03/90/38/1059039038.db2.gz GUJFOWAYWRGHSM-SFTDATJTSA-N 2 1 314.517 4.252 20 0 DIADMP CCCCC(CCCC)[N@H+]1CC[C@]2(C1)C[NH2+]CCC2(F)F ZINC001246639303 1059043257 /nfs/dbraw/zinc/04/32/57/1059043257.db2.gz PNBZLHOXLPZXEG-MRXNPFEDSA-N 2 1 302.453 4.056 20 0 DIADMP C1C[NH2+][C@]2(C1)CCC[N@@H+](C1CCC3(CCCCC3)CC1)CC2 ZINC001246635375 1059045768 /nfs/dbraw/zinc/04/57/68/1059045768.db2.gz QVUOPWPHDWLUPW-HXUWFJFHSA-N 2 1 304.522 4.488 20 0 DIADMP C1C[NH2+][C@]2(C1)CCC[N@H+](C1CCC3(CCCCC3)CC1)CC2 ZINC001246635375 1059045790 /nfs/dbraw/zinc/04/57/90/1059045790.db2.gz QVUOPWPHDWLUPW-HXUWFJFHSA-N 2 1 304.522 4.488 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001246641238 1059046183 /nfs/dbraw/zinc/04/61/83/1059046183.db2.gz CIXLZQSGGYSVMU-VQTJNVASSA-N 2 1 300.490 4.006 20 0 DIADMP c1ccc2c(c1)CCC21CCC([N@@H+]2CCCC[C@@]23CC[NH2+]C3)CC1 ZINC001246644045 1059047960 /nfs/dbraw/zinc/04/79/60/1059047960.db2.gz PCPWSGNCKMQKAQ-VTLFHKLASA-N 2 1 324.512 4.031 20 0 DIADMP C[C@@H](CSc1ccc(Cl)cc1)[N@H+]1CCCC12CC[NH2+]CC2 ZINC001246644545 1059048482 /nfs/dbraw/zinc/04/84/82/1059048482.db2.gz KLQQPANXICVUPA-AWEZNQCLSA-N 2 1 324.921 4.039 20 0 DIADMP CCC[C@@H](CCc1ccccc1)[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001246645433 1059050849 /nfs/dbraw/zinc/05/08/49/1059050849.db2.gz AKOJMUPDFJCSFH-FQEVSTJZSA-N 2 1 314.517 4.396 20 0 DIADMP c1ccc(C2CCC([N@@H+]3CCCC[C@@]34CCC[NH2+]C4)CC2)cc1 ZINC001246653430 1059054837 /nfs/dbraw/zinc/05/48/37/1059054837.db2.gz SXJAFSANYOISDV-CBNMVNINSA-N 2 1 312.501 4.321 20 0 DIADMP CC(C)CC[C@H](C)[N@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246675158 1059057274 /nfs/dbraw/zinc/05/72/74/1059057274.db2.gz WHBXALSBHSFGON-SESVDKBCSA-N 2 1 314.517 4.064 20 0 DIADMP Cc1ccc(CC[C@@H](C)[N@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)cc1 ZINC001246662974 1059058085 /nfs/dbraw/zinc/05/80/85/1059058085.db2.gz WLQNFQLFOBCTHD-WIYYLYMNSA-N 2 1 314.517 4.170 20 0 DIADMP CC(C)CC[C@H](C)[N@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246675160 1059058573 /nfs/dbraw/zinc/05/85/73/1059058573.db2.gz WHBXALSBHSFGON-TYPHKJRUSA-N 2 1 314.517 4.064 20 0 DIADMP CCCCC1CC[NH+]([C@H]2CC[NH2+][C@@H](c3ccccc3)C2)CC1 ZINC001246681731 1059062019 /nfs/dbraw/zinc/06/20/19/1059062019.db2.gz PUYWCPWNHWGDHT-VQTJNVASSA-N 2 1 300.490 4.382 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC001246678042 1059063065 /nfs/dbraw/zinc/06/30/65/1059063065.db2.gz MBIPSYQJYZKXBG-PWRODBHTSA-N 2 1 314.517 4.109 20 0 DIADMP CC[C@@H](C)C[C@@H](CC)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246675954 1059063101 /nfs/dbraw/zinc/06/31/01/1059063101.db2.gz BQWODRXYFVZAID-CWJKEVGVSA-N 2 1 314.517 4.280 20 0 DIADMP CC(C)CCC[C@@H](C)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246683255 1059063439 /nfs/dbraw/zinc/06/34/39/1059063439.db2.gz QGAHRLQHFKGAMU-HMXCVIKNSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246677123 1059063577 /nfs/dbraw/zinc/06/35/77/1059063577.db2.gz BVLSHEKPGCILNP-LVCYWYKZSA-N 2 1 308.469 4.390 20 0 DIADMP CC[C@H](C)C[C@H](CC)[N@H+]1CC[C@@]2(C[NH2+]C[C@@H]2c2ccccc2)C1 ZINC001246675961 1059063758 /nfs/dbraw/zinc/06/37/58/1059063758.db2.gz BQWODRXYFVZAID-MJUUVYJYSA-N 2 1 314.517 4.280 20 0 DIADMP C[C@H]1CC([N@H+]2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)C[C@H](C)C1 ZINC001246678482 1059063915 /nfs/dbraw/zinc/06/39/15/1059063915.db2.gz XLZJLERSDNKNKI-DEPWHIHDSA-N 2 1 312.501 4.033 20 0 DIADMP Cc1ccccc1[C@@H]1CCC[N@H+]1C1CCC2(CCC[NH2+]C2)CC1 ZINC001246682179 1059064357 /nfs/dbraw/zinc/06/43/57/1059064357.db2.gz TZTCGXGBXRNZEC-CKHPTIKVSA-N 2 1 312.501 4.444 20 0 DIADMP C1CCC2(C1)CCC([N@H+]1CCC[C@H]([C@H]3CCC[NH2+]C3)C1)CC2 ZINC001246679637 1059064392 /nfs/dbraw/zinc/06/43/92/1059064392.db2.gz XCKQXXBUNWGIEL-ROUUACIJSA-N 2 1 304.522 4.201 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC001246678040 1059064800 /nfs/dbraw/zinc/06/48/00/1059064800.db2.gz MBIPSYQJYZKXBG-NJDAHSKKSA-N 2 1 314.517 4.109 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246770305 1059072934 /nfs/dbraw/zinc/07/29/34/1059072934.db2.gz PZCQFWUFALXODB-LJQANCHMSA-N 2 1 300.490 4.211 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246773333 1059075642 /nfs/dbraw/zinc/07/56/42/1059075642.db2.gz AVFPPWWSSZDIEM-FSSWDIPSSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@@H]2CCC[N@@H+]([C@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246773333 1059075653 /nfs/dbraw/zinc/07/56/53/1059075653.db2.gz AVFPPWWSSZDIEM-FSSWDIPSSA-N 2 1 320.480 4.359 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246775577 1059076240 /nfs/dbraw/zinc/07/62/40/1059076240.db2.gz IXRVZEILBJHBDC-ICSRJNTNSA-N 2 1 310.485 4.438 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@@H]3CC[NH2+]C4(CCCCC4)C3)C2)cc1 ZINC001246779309 1059077052 /nfs/dbraw/zinc/07/70/52/1059077052.db2.gz RTMXOXNCEWPCJF-WOJBJXKFSA-N 2 1 312.501 4.321 20 0 DIADMP C[N@@H+](Cc1cccc2ccccc21)[C@@H]1CCC[C@@]2(CC[NH2+]C2)C1 ZINC001246779232 1059080295 /nfs/dbraw/zinc/08/02/95/1059080295.db2.gz QKKPNRCXFVWAJV-TZIWHRDSSA-N 2 1 308.469 4.194 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+](C3CCC4(CCC[NH2+]C4)CC3)C2)cc1 ZINC001246781989 1059080337 /nfs/dbraw/zinc/08/03/37/1059080337.db2.gz ZNFULJHOCCYANO-MWXLCCTBSA-N 2 1 312.501 4.178 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCCC[C@@H]2c2ccccc2F)CC[NH2+]1 ZINC001246785606 1059083180 /nfs/dbraw/zinc/08/31/80/1059083180.db2.gz KMGPCVSZJTXMCG-ZYSHUDEJSA-N 2 1 304.453 4.129 20 0 DIADMP c1csc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785693 1059084047 /nfs/dbraw/zinc/08/40/47/1059084047.db2.gz KWNUWCUSRXCYIU-BZSNNMDCSA-N 2 1 312.482 4.378 20 0 DIADMP c1csc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785693 1059084072 /nfs/dbraw/zinc/08/40/72/1059084072.db2.gz KWNUWCUSRXCYIU-BZSNNMDCSA-N 2 1 312.482 4.378 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@]3(CC[NH2+]C3)C2)cc1 ZINC001246786599 1059084463 /nfs/dbraw/zinc/08/44/63/1059084463.db2.gz MCDJPKZPHXEERM-QYZOEREBSA-N 2 1 318.892 4.399 20 0 DIADMP c1csc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785701 1059085522 /nfs/dbraw/zinc/08/55/22/1059085522.db2.gz KWNUWCUSRXCYIU-FGTMMUONSA-N 2 1 312.482 4.378 20 0 DIADMP c1csc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC001246785701 1059085542 /nfs/dbraw/zinc/08/55/42/1059085542.db2.gz KWNUWCUSRXCYIU-FGTMMUONSA-N 2 1 312.482 4.378 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([NH+]2CCC(C)(C)CC2)CC[NH2+]1 ZINC001246783916 1059085675 /nfs/dbraw/zinc/08/56/75/1059085675.db2.gz RAVYYLTYRJJZPX-AEFFLSMTSA-N 2 1 304.453 4.049 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@H+]2CCC[C@H](C)[C@@H]2C)CC[NH2+]1 ZINC001246786933 1059086501 /nfs/dbraw/zinc/08/65/01/1059086501.db2.gz BFNDGEHZMNLAFC-YRMAPFEESA-N 2 1 304.453 4.048 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@H]([N@@H+]2CCC[C@H](C)[C@@H]2C)CC[NH2+]1 ZINC001246786933 1059086523 /nfs/dbraw/zinc/08/65/23/1059086523.db2.gz BFNDGEHZMNLAFC-YRMAPFEESA-N 2 1 304.453 4.048 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787545 1059086737 /nfs/dbraw/zinc/08/67/37/1059086737.db2.gz QIMHNFIIKHCDPP-QHAWAJNXSA-N 2 1 306.453 4.317 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]2[C@@H]2CC[NH2+][C@H](c3ccccc3)C2)cc1 ZINC001246787545 1059086755 /nfs/dbraw/zinc/08/67/55/1059086755.db2.gz QIMHNFIIKHCDPP-QHAWAJNXSA-N 2 1 306.453 4.317 20 0 DIADMP Fc1ccccc1[C@@H]1CCCC[N@H+]1[C@H]1CCC[C@]2(CC[NH2+]C2)C1 ZINC001246784699 1059087129 /nfs/dbraw/zinc/08/71/29/1059087129.db2.gz IKGAKRLWTSTPLT-VDGAXYAQSA-N 2 1 316.464 4.275 20 0 DIADMP C[N@@H+]([C@@H]1CC[NH2+][C@H](C(C)(C)C)C1)C12CC3CC(CC(C3)C1)C2 ZINC001246783593 1059088229 /nfs/dbraw/zinc/08/82/29/1059088229.db2.gz PKALHRVIAYPQLS-KQCPESONSA-N 2 1 304.522 4.054 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1 ZINC001246791942 1059092895 /nfs/dbraw/zinc/09/28/95/1059092895.db2.gz ZIEHGHYHVZFLDM-VSZNYVQBSA-N 2 1 304.865 4.150 20 0 DIADMP Fc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246796032 1059095098 /nfs/dbraw/zinc/09/50/98/1059095098.db2.gz KMZXGMUDALFIOX-APWZRJJASA-N 2 1 316.464 4.418 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2F)CC[NH2+]1 ZINC001246793061 1059095269 /nfs/dbraw/zinc/09/52/69/1059095269.db2.gz ALJGYBQAIHUFFT-OLMNPRSZSA-N 2 1 304.453 4.129 20 0 DIADMP CCCC[C@@H](Cc1ccccc1)[N@@H+](C)CCC1CC[NH2+]CC1 ZINC001246795251 1059097867 /nfs/dbraw/zinc/09/78/67/1059097867.db2.gz IQKZPQRYEGPBCC-FQEVSTJZSA-N 2 1 302.506 4.109 20 0 DIADMP Clc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001246794217 1059097963 /nfs/dbraw/zinc/09/79/63/1059097963.db2.gz XKGPKYQAAREALB-KRXQYRFLSA-N 2 1 304.865 4.150 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2F)CC[NH2+]1 ZINC001246793063 1059098787 /nfs/dbraw/zinc/09/87/87/1059098787.db2.gz ALJGYBQAIHUFFT-QGTPRVQTSA-N 2 1 304.453 4.129 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@@H+]2CCSC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246807471 1059099863 /nfs/dbraw/zinc/09/98/63/1059099863.db2.gz KCJZOOQTDZGMTL-GUDVDZBRSA-N 2 1 318.530 4.087 20 0 DIADMP CCCC[C@@H]1C[C@H]([N@H+]2CCSC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246807471 1059099887 /nfs/dbraw/zinc/09/98/87/1059099887.db2.gz KCJZOOQTDZGMTL-GUDVDZBRSA-N 2 1 318.530 4.087 20 0 DIADMP Fc1cccc([C@H]2CCC[N@H+]2C2CCC3(CCC[NH2+]C3)CC2)c1 ZINC001246803494 1059100702 /nfs/dbraw/zinc/10/07/02/1059100702.db2.gz YLVKMPOUSOTHTJ-IOJLRTSASA-N 2 1 316.464 4.275 20 0 DIADMP C[N@@H+](Cc1cccc2cccnc21)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246800707 1059101229 /nfs/dbraw/zinc/10/12/29/1059101229.db2.gz GDKIVFLEQQSNES-IBGZPJMESA-N 2 1 323.484 4.122 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+]2CCSC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246807473 1059101545 /nfs/dbraw/zinc/10/15/45/1059101545.db2.gz KCJZOOQTDZGMTL-QYZOEREBSA-N 2 1 318.530 4.087 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@H+]2CCSC[C@H]2c2ccccc2)CC[NH2+]1 ZINC001246807473 1059101552 /nfs/dbraw/zinc/10/15/52/1059101552.db2.gz KCJZOOQTDZGMTL-QYZOEREBSA-N 2 1 318.530 4.087 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2cccc(F)c2)CC[NH2+]1 ZINC001246803505 1059101853 /nfs/dbraw/zinc/10/18/53/1059101853.db2.gz YRXSZDQTDMQAHA-KURKYZTESA-N 2 1 304.453 4.129 20 0 DIADMP CC[C@@H]1C[C@H]([N@@H+](C)CCc2ccc(Cl)cc2)C[C@H](CC)[NH2+]1 ZINC001246813008 1059105463 /nfs/dbraw/zinc/10/54/63/1059105463.db2.gz HHXBBJHDGRHOPN-PIIMJCKOSA-N 2 1 308.897 4.124 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CC[C@H](c3ccccc3Cl)C2)C[C@H](CC)[NH2+]1 ZINC001246809841 1059107049 /nfs/dbraw/zinc/10/70/49/1059107049.db2.gz KXRVRYPDTDLWRG-NXOAAHMSSA-N 2 1 320.908 4.439 20 0 DIADMP C[N@@H+](CCc1ccc(Cl)cc1)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246814136 1059107231 /nfs/dbraw/zinc/10/72/31/1059107231.db2.gz NSZSEBXJRFLYSZ-UHFFFAOYSA-N 2 1 320.908 4.127 20 0 DIADMP CCCC[C@@H]1C[C@@H]([N@@H+](C)CCc2cccc(Cl)c2)CC[NH2+]1 ZINC001246822589 1059109991 /nfs/dbraw/zinc/10/99/91/1059109991.db2.gz LZJUUBCUWJUSEC-MSOLQXFVSA-N 2 1 308.897 4.125 20 0 DIADMP C[N@@H+](CCc1ccc(Cl)cc1)[C@H]1CC[NH2+]C2(CCCCC2)C1 ZINC001246815608 1059110800 /nfs/dbraw/zinc/11/08/00/1059110800.db2.gz ZGGRSXCVAWDXFG-SFHVURJKSA-N 2 1 320.908 4.269 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821018 1059110918 /nfs/dbraw/zinc/11/09/18/1059110918.db2.gz HPIUYGROLAEZEM-STQMWFEESA-N 2 1 310.894 4.213 20 0 DIADMP Clc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC001246821018 1059110928 /nfs/dbraw/zinc/11/09/28/1059110928.db2.gz HPIUYGROLAEZEM-STQMWFEESA-N 2 1 310.894 4.213 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@@H+]2CCC[C@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826345 1059111689 /nfs/dbraw/zinc/11/16/89/1059111689.db2.gz WVOKABUWORYFSU-IHRRRGAJSA-N 2 1 312.910 4.315 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccc(Cl)s2)CC[NH2+]1 ZINC001246826345 1059111707 /nfs/dbraw/zinc/11/17/07/1059111707.db2.gz WVOKABUWORYFSU-IHRRRGAJSA-N 2 1 312.910 4.315 20 0 DIADMP Clc1ccc([C@H]2CCC[N@@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821828 1059112152 /nfs/dbraw/zinc/11/21/52/1059112152.db2.gz JMXYHCTWXKPTPS-ZOBORPQBSA-N 2 1 310.894 4.212 20 0 DIADMP Clc1ccc([C@H]2CCC[N@H+]2[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1 ZINC001246821828 1059112160 /nfs/dbraw/zinc/11/21/60/1059112160.db2.gz JMXYHCTWXKPTPS-ZOBORPQBSA-N 2 1 310.894 4.212 20 0 DIADMP CC[C@H]1CC([N@@H+]2CCc3cc(Cl)ccc3C2)C[C@H](CC)[NH2+]1 ZINC001246835651 1059114650 /nfs/dbraw/zinc/11/46/50/1059114650.db2.gz KYTGXORPQMUOLC-IRXDYDNUSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@H]1CC([N@H+]2CCc3cc(Cl)ccc3C2)C[C@H](CC)[NH2+]1 ZINC001246835651 1059114657 /nfs/dbraw/zinc/11/46/57/1059114657.db2.gz KYTGXORPQMUOLC-IRXDYDNUSA-N 2 1 306.881 4.007 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)[C@H]1CC[NH2+][C@@H](Cc2ccccc2)C1 ZINC001246842856 1059118012 /nfs/dbraw/zinc/11/80/12/1059118012.db2.gz CQMBRGKBSBFUOF-FDFHNCONSA-N 2 1 322.496 4.433 20 0 DIADMP COc1ccccc1[C@@H](C)[N@@H+](C)C1CCC2(CC[NH2+]CC2)CC1 ZINC001246840344 1059118044 /nfs/dbraw/zinc/11/80/44/1059118044.db2.gz NCTNOJKYIDRUPA-MRXNPFEDSA-N 2 1 316.489 4.000 20 0 DIADMP CC[C@H](c1ccccc1)[N@@H+](C)[C@H]1CC[NH2+][C@H](Cc2ccccc2)C1 ZINC001246842846 1059118130 /nfs/dbraw/zinc/11/81/30/1059118130.db2.gz CQMBRGKBSBFUOF-BHIFYINESA-N 2 1 322.496 4.433 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246839258 1059118543 /nfs/dbraw/zinc/11/85/43/1059118543.db2.gz IGCOQYMHZFRTHQ-KRWDZBQOSA-N 2 1 306.881 4.084 20 0 DIADMP CC[N@H+](Cc1cccc(OC)c1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838712 1059119520 /nfs/dbraw/zinc/11/95/20/1059119520.db2.gz FEPATKHOFDXSJJ-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@@H+](Cc1cccc(OC)c1)[C@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838712 1059119525 /nfs/dbraw/zinc/11/95/25/1059119525.db2.gz FEPATKHOFDXSJJ-FPOVZHCZSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@H+](Cc1ccc(F)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838433 1059119767 /nfs/dbraw/zinc/11/97/67/1059119767.db2.gz BVVNIHKRNGXUQX-UXHICEINSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(F)cc1)[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246838433 1059119776 /nfs/dbraw/zinc/11/97/76/1059119776.db2.gz BVVNIHKRNGXUQX-UXHICEINSA-N 2 1 312.432 4.141 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[NH2+][C@H](C(C)(C)C)C1 ZINC001246844611 1059122039 /nfs/dbraw/zinc/12/20/39/1059122039.db2.gz JUVGNERSPHMZJQ-SJORKVTESA-N 2 1 308.897 4.329 20 0 DIADMP CCc1ccc(C[N@@H+](C)[C@@H]2CC[NH2+]C3(CCCCC3)C2)cc1 ZINC001246845243 1059122738 /nfs/dbraw/zinc/12/27/38/1059122738.db2.gz LUFUBXLBFSJPCE-LJQANCHMSA-N 2 1 300.490 4.136 20 0 DIADMP CC[C@@H]1CCCC[N@@H+]1[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246845039 1059122831 /nfs/dbraw/zinc/12/28/31/1059122831.db2.gz KLYUVNGMXUGAPN-ZHALLVOQSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246845039 1059122837 /nfs/dbraw/zinc/12/28/37/1059122837.db2.gz KLYUVNGMXUGAPN-ZHALLVOQSA-N 2 1 304.453 4.192 20 0 DIADMP C[C@@H]1CC([N@H+](C)Cc2ccccc2Oc2ccccc2)C[C@@H](C)[NH2+]1 ZINC001246845650 1059123174 /nfs/dbraw/zinc/12/31/74/1059123174.db2.gz QAZDBSAIZFTEHA-IAGOWNOFSA-N 2 1 324.468 4.440 20 0 DIADMP C[C@@H]1CC([N@@H+](C)Cc2ccccc2Oc2ccccc2)C[C@@H](C)[NH2+]1 ZINC001246845650 1059123181 /nfs/dbraw/zinc/12/31/81/1059123181.db2.gz QAZDBSAIZFTEHA-IAGOWNOFSA-N 2 1 324.468 4.440 20 0 DIADMP CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[NH2+][C@@H](C(C)(C)C)C1 ZINC001246844604 1059123367 /nfs/dbraw/zinc/12/33/67/1059123367.db2.gz JUVGNERSPHMZJQ-DLBZAZTESA-N 2 1 308.897 4.329 20 0 DIADMP C[C@H](CC(C)(C)SCc1ccco1)[N@@H+](C)C[C@H]1CCC[NH2+]C1 ZINC001246843739 1059124108 /nfs/dbraw/zinc/12/41/08/1059124108.db2.gz WALIRTNYZXJHEG-CVEARBPZSA-N 2 1 324.534 4.001 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246844912 1059124678 /nfs/dbraw/zinc/12/46/78/1059124678.db2.gz DJNFCDSBGJWGHU-RHSMWYFYSA-N 2 1 306.881 4.255 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(OC)c2)C[C@H](CC)[NH2+]1 ZINC001246849073 1059127082 /nfs/dbraw/zinc/12/70/82/1059127082.db2.gz PWPZPQYHOTWWDS-DMUMMCEESA-N 2 1 316.489 4.141 20 0 DIADMP C[C@H](c1ccc(Cl)cc1)[N@@H+](C)C1CCC2(CC[NH2+]C2)CC1 ZINC001246849065 1059127814 /nfs/dbraw/zinc/12/78/14/1059127814.db2.gz PVJVFASGHNBSIO-RWBZWWBESA-N 2 1 306.881 4.255 20 0 DIADMP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H]2CC[C@]2([NH3+])C1 ZINC001246849758 1059128822 /nfs/dbraw/zinc/12/88/22/1059128822.db2.gz AYKCAYNDOYBYIO-AGHHOFFYSA-N 2 1 320.480 4.020 20 0 DIADMP c1ccc([C@@H]2CCC[N@H+]([C@@H]3CCC[C@@]4(CC[NH2+]C4)C3)CC2)cc1 ZINC001246847543 1059128928 /nfs/dbraw/zinc/12/89/28/1059128928.db2.gz UBAKEFXYYRLPNH-NJDAHSKKSA-N 2 1 312.501 4.178 20 0 DIADMP C1C[N@H+]([C@@H]2CC[NH2+]C3(CCCCC3)C2)C[C@H]1C1CCCCC1 ZINC001246847679 1059129016 /nfs/dbraw/zinc/12/90/16/1059129016.db2.gz KZFSYGSEJUGTSW-RBUKOAKNSA-N 2 1 304.522 4.344 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)C[C@H](CC)[NH2+]1 ZINC001246850127 1059129411 /nfs/dbraw/zinc/12/94/11/1059129411.db2.gz HBEVLSNJBWIHPB-OQIJWPOYSA-N 2 1 320.908 4.439 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@@H+]2CC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246847654 1059129493 /nfs/dbraw/zinc/12/94/93/1059129493.db2.gz JWVCKYOUAXMANF-SESVDKBCSA-N 2 1 324.443 4.374 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([N@H+]2CC[C@@H]2c2ccccc2)CC[NH2+]1 ZINC001246847654 1059129500 /nfs/dbraw/zinc/12/95/00/1059129500.db2.gz JWVCKYOUAXMANF-SESVDKBCSA-N 2 1 324.443 4.374 20 0 DIADMP c1ccc([C@H]2CCC[N@H+](C3CCC4(CC[NH2+]C4)CC3)CC2)cc1 ZINC001246847481 1059129863 /nfs/dbraw/zinc/12/98/63/1059129863.db2.gz SLEFTPIURIWZBI-MWXLCCTBSA-N 2 1 312.501 4.178 20 0 DIADMP Clc1cccc2c1CC[N@H+](C1CCC3(CCC[NH2+]C3)CC1)C2 ZINC001246851618 1059131042 /nfs/dbraw/zinc/13/10/42/1059131042.db2.gz YWYPBYLCINSYNC-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP CC[C@@H]1CCC[N@@H+]([C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)C1 ZINC001246850743 1059131555 /nfs/dbraw/zinc/13/15/55/1059131555.db2.gz WREUHTMLEIKOQH-SUMDDJOVSA-N 2 1 304.453 4.049 20 0 DIADMP CC[C@@H]1CCC[N@H+]([C@@H]2CC[NH2+][C@H](c3ccc(F)cc3C)C2)C1 ZINC001246850743 1059131560 /nfs/dbraw/zinc/13/15/60/1059131560.db2.gz WREUHTMLEIKOQH-SUMDDJOVSA-N 2 1 304.453 4.049 20 0 DIADMP Clc1cccc([C@H]2CC[N@H+](C3CCC4(CC[NH2+]C4)CC3)C2)c1 ZINC001246854422 1059131980 /nfs/dbraw/zinc/13/19/80/1059131980.db2.gz TXROGAAFSOIMLP-IVMQYODDSA-N 2 1 318.892 4.052 20 0 DIADMP CC[C@H]1C[C@H]([N@@H+](C)Cc2ccc(Oc3ccccc3)cc2)CC[NH2+]1 ZINC001246852149 1059132059 /nfs/dbraw/zinc/13/20/59/1059132059.db2.gz NDSVEXRZBOTZMJ-RBUKOAKNSA-N 2 1 324.468 4.441 20 0 DIADMP C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246854508 1059133605 /nfs/dbraw/zinc/13/36/05/1059133605.db2.gz VETXEIAKIQCLKJ-REPLKXPHSA-N 2 1 322.452 4.194 20 0 DIADMP CCCC[C@H]1C[C@H]([N@H+]2CCC[C@H](c3ccccc3)C2)CC[NH2+]1 ZINC001246865381 1059135534 /nfs/dbraw/zinc/13/55/34/1059135534.db2.gz UHUQBVLVVHTLPQ-SLFFLAALSA-N 2 1 300.490 4.177 20 0 DIADMP c1ccc([C@H]2CCC[N@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246860749 1059136639 /nfs/dbraw/zinc/13/66/39/1059136639.db2.gz AVFPPWWSSZDIEM-BDTNDASRSA-N 2 1 320.480 4.359 20 0 DIADMP c1ccc([C@H]2CCC[N@@H+]([C@@H]3CC[NH2+][C@H](c4ccccc4)C3)C2)cc1 ZINC001246860749 1059136652 /nfs/dbraw/zinc/13/66/52/1059136652.db2.gz AVFPPWWSSZDIEM-BDTNDASRSA-N 2 1 320.480 4.359 20 0 DIADMP Clc1cccc2c1C[N@@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866744 1059138299 /nfs/dbraw/zinc/13/82/99/1059138299.db2.gz CUIXZJNDUDUVDA-HNNXBMFYSA-N 2 1 304.865 4.111 20 0 DIADMP Clc1cccc2c1C[N@H+]([C@H]1CC[NH2+]C3(CCCCC3)C1)C2 ZINC001246866744 1059138307 /nfs/dbraw/zinc/13/83/07/1059138307.db2.gz CUIXZJNDUDUVDA-HNNXBMFYSA-N 2 1 304.865 4.111 20 0 DIADMP c1ccc(C2=CC[N@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)cc1 ZINC001246859335 1059138868 /nfs/dbraw/zinc/13/88/68/1059138868.db2.gz NQVIIWIEQYGNJA-FCHUYYIVSA-N 2 1 318.464 4.269 20 0 DIADMP c1ccc(C2=CC[N@@H+]([C@H]3CC[NH2+][C@@H](c4ccccc4)C3)CC2)cc1 ZINC001246859335 1059138877 /nfs/dbraw/zinc/13/88/77/1059138877.db2.gz NQVIIWIEQYGNJA-FCHUYYIVSA-N 2 1 318.464 4.269 20 0 DIADMP Clc1cccc2c1C[N@H+](C1CCC3(CCC[NH2+]C3)CC1)CC2 ZINC001246869709 1059140343 /nfs/dbraw/zinc/14/03/43/1059140343.db2.gz HXWTWDXTZIESEW-UHFFFAOYSA-N 2 1 318.892 4.011 20 0 DIADMP C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@H+]2[C@H]1CCC[NH2+]CC1 ZINC001246878887 1059147072 /nfs/dbraw/zinc/14/70/72/1059147072.db2.gz LIUGZFUESQEFDM-WTOYTKOKSA-N 2 1 318.464 4.005 20 0 DIADMP CC[C@@H]1C[C@H]([N@H+]2CCC[C@@H]2c2ccccc2SC)CC[NH2+]1 ZINC001246886593 1059148183 /nfs/dbraw/zinc/14/81/83/1059148183.db2.gz HOFMHWXSFHSOSQ-BFYDXBDKSA-N 2 1 304.503 4.076 20 0 DIADMP CC[C@@H]1CC([N@@H+]2CCC[C@H]2c2ccc(F)cc2F)C[C@@H](CC)[NH2+]1 ZINC001246884558 1059149807 /nfs/dbraw/zinc/14/98/07/1059149807.db2.gz BLJZKEGRAWTCTQ-CLCXKQKWSA-N 2 1 322.443 4.411 20 0 DIADMP CC[C@@H]1CC([N@H+]2CCC[C@H]2c2ccc(F)cc2F)C[C@@H](CC)[NH2+]1 ZINC001246884558 1059149812 /nfs/dbraw/zinc/14/98/12/1059149812.db2.gz BLJZKEGRAWTCTQ-CLCXKQKWSA-N 2 1 322.443 4.411 20 0 DIADMP Cc1cc(F)ccc1[C@@H]1C[C@@H]([NH+]2CC3CCC(CC3)C2)CC[NH2+]1 ZINC001246882872 1059149903 /nfs/dbraw/zinc/14/99/03/1059149903.db2.gz OWDZYXSGUYQWCE-BPCFOJMASA-N 2 1 316.464 4.049 20 0 DIADMP CC[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2ccccc2SC)CC[NH2+]1 ZINC001246886625 1059150527 /nfs/dbraw/zinc/15/05/27/1059150527.db2.gz HOFMHWXSFHSOSQ-VYDXJSESSA-N 2 1 304.503 4.076 20 0 DIADMP Fc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c(F)c1 ZINC001246884388 1059150758 /nfs/dbraw/zinc/15/07/58/1059150758.db2.gz AOFJZXVKLXRBCH-AYOQOUSVSA-N 2 1 320.427 4.024 20 0 DIADMP CCC[N@@H+]([C@@H](Cc1ccccc1)CC(C)C)C1CC[NH2+]CC1 ZINC001246892426 1059153081 /nfs/dbraw/zinc/15/30/81/1059153081.db2.gz CWDDYJJSCWLLJE-HXUWFJFHSA-N 2 1 302.506 4.108 20 0 DIADMP Clc1cccc([C@@H]2CCC[N@H+]2[C@H]2CCC[C@]3(CC[NH2+]C3)C2)c1 ZINC001246886930 1059153944 /nfs/dbraw/zinc/15/39/44/1059153944.db2.gz FZDWEXXHQOYJOE-FHWLQOOXSA-N 2 1 318.892 4.399 20 0 DIADMP CC(C)[C@@H]1C[C@@H]([N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC[NH2+]1 ZINC001246886992 1059155902 /nfs/dbraw/zinc/15/59/02/1059155902.db2.gz HOTCNZPWJBPNQC-BZSNNMDCSA-N 2 1 306.881 4.254 20 0 DIADMP Fc1ccc([C@H]2CCC[N@H+]2[C@@H]2CCC3(C2)CC[NH2+]CC3)c(F)c1 ZINC001246889724 1059156006 /nfs/dbraw/zinc/15/60/06/1059156006.db2.gz YWNPOSZNUKNPHH-CRAIPNDOSA-N 2 1 320.427 4.024 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246896682 1059159426 /nfs/dbraw/zinc/15/94/26/1059159426.db2.gz YXLZMSVRMATREF-FQEVSTJZSA-N 2 1 308.469 4.194 20 0 DIADMP C[N@@H+](Cc1ccc2ccccc2c1)C1CCC2(CC[NH2+]C2)CC1 ZINC001246893464 1059159628 /nfs/dbraw/zinc/15/96/28/1059159628.db2.gz KAYGMEYAJVOQNO-UHFFFAOYSA-N 2 1 308.469 4.194 20 0 DIADMP CCC[N@@H+](C1CC[NH2+]CC1)[C@H]1CCC[C@H](c2ccccc2)C1 ZINC001246898383 1059160503 /nfs/dbraw/zinc/16/05/03/1059160503.db2.gz MYPOGBXDSSEEST-ICSRJNTNSA-N 2 1 300.490 4.177 20 0 DIADMP CC(C)(C)[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccc(F)cc2)CC[NH2+]1 ZINC001246893406 1059160948 /nfs/dbraw/zinc/16/09/48/1059160948.db2.gz JMAPEFPRSRMLRT-RCCFBDPRSA-N 2 1 304.453 4.129 20 0 DIADMP CCC[NH+]1CCC([N@@H+]2CCC[C@H]2c2c[nH]c3ccccc23)CC1 ZINC001246898131 1059161060 /nfs/dbraw/zinc/16/10/60/1059161060.db2.gz AHOBKFFKDVCPBO-FQEVSTJZSA-N 2 1 311.473 4.179 20 0 DIADMP CCC[NH+]1CCC([N@H+]2CCC[C@H]2c2c[nH]c3ccccc23)CC1 ZINC001246898131 1059161073 /nfs/dbraw/zinc/16/10/73/1059161073.db2.gz AHOBKFFKDVCPBO-FQEVSTJZSA-N 2 1 311.473 4.179 20 0 DIADMP c1[nH]c2ccccc2c1[C@@H]1CCC[N@H+]1[C@H]1CCC2(C1)CC[NH2+]CC2 ZINC001246903550 1059164342 /nfs/dbraw/zinc/16/43/42/1059164342.db2.gz ZBFDOGSYNGMNJE-JXFKEZNVSA-N 2 1 323.484 4.227 20 0 DIADMP c1ccc2c(c1)C[N@@H+]([C@@H]1CC[NH2+]C3(CCCCC3)C1)CCS2 ZINC001246905048 1059164700 /nfs/dbraw/zinc/16/47/00/1059164700.db2.gz KGBJPEOODQCGGQ-QGZVFWFLSA-N 2 1 316.514 4.049 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2C2CCC3(C[NH2+]C3)CC2)cc1C ZINC001246907948 1059167783 /nfs/dbraw/zinc/16/77/83/1059167783.db2.gz KMCHORZCMXIROW-FQEVSTJZSA-N 2 1 312.501 4.363 20 0 DIADMP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1C[C@H](C)[NH2+][C@@H](C)C1 ZINC001246909066 1059170544 /nfs/dbraw/zinc/17/05/44/1059170544.db2.gz ZDHXOBHPEUSVDD-STQMWFEESA-N 2 1 314.395 4.056 20 0 DIADMP CC1(C)[C@@H]2C[C@H]([N@@H+](Cc3ccccc3)C3CCC([NH3+])CC3)C[C@@H]21 ZINC001246912042 1059172201 /nfs/dbraw/zinc/17/22/01/1059172201.db2.gz QKPVLGDVRCKJBM-DAKUTMNPSA-N 2 1 312.501 4.193 20 0 DIADMP Cc1ccc(C[C@H](C)[N@@H+](Cc2ccccc2)C2CC[NH2+]CC2)cc1 ZINC001246914456 1059175501 /nfs/dbraw/zinc/17/55/01/1059175501.db2.gz LDOWNLNCSXQDHB-IBGZPJMESA-N 2 1 322.496 4.180 20 0 DIADMP C[C@H](Cc1ccc(F)cc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932813 1059181073 /nfs/dbraw/zinc/18/10/73/1059181073.db2.gz HLDWZDGNGHLCNY-AEFFLSMTSA-N 2 1 318.480 4.001 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246932816 1059181549 /nfs/dbraw/zinc/18/15/49/1059181549.db2.gz HLDWZDGNGHLCNY-WMZOPIPTSA-N 2 1 318.480 4.001 20 0 DIADMP CC[C@H]1CCCC[N@@H+]1[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246937949 1059184432 /nfs/dbraw/zinc/18/44/32/1059184432.db2.gz KLYUVNGMXUGAPN-JENIJYKNSA-N 2 1 304.453 4.192 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@H]1CC[NH2+][C@@H](c2ccc(F)cc2C)C1 ZINC001246937949 1059184439 /nfs/dbraw/zinc/18/44/39/1059184439.db2.gz KLYUVNGMXUGAPN-JENIJYKNSA-N 2 1 304.453 4.192 20 0 DIADMP [NH3+][C@@H]1CC[N@H+]([C@@H]2CCCC3(CCCCC3)C2)C[C@H]1C(F)(F)F ZINC001246940798 1059184567 /nfs/dbraw/zinc/18/45/67/1059184567.db2.gz VKDQMZGYNJUSRS-RBSFLKMASA-N 2 1 318.427 4.091 20 0 DIADMP C[C@H](Cc1cccc(F)c1)[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246937861 1059185381 /nfs/dbraw/zinc/18/53/81/1059185381.db2.gz NDZUPLFFUPKWLG-SJLPKXTDSA-N 2 1 318.480 4.001 20 0 DIADMP CSC(C)(C)C[C@H](C)[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001246934937 1059185907 /nfs/dbraw/zinc/18/59/07/1059185907.db2.gz DCXXALPSLYGNLR-HOTGVXAUSA-N 2 1 312.567 4.151 20 0 DIADMP CCCCCC1CCC([N@H+]2CC[C@H]([NH3+])[C@@H](C(F)(F)F)C2)CC1 ZINC001246933816 1059186322 /nfs/dbraw/zinc/18/63/22/1059186322.db2.gz JCNNCELZYMGECG-CKUJCDMFSA-N 2 1 320.443 4.337 20 0 DIADMP C[C@@H](Cc1ccccc1Cl)[N@@H+](CC(C)(C)C)C1CC[NH2+]CC1 ZINC001246945306 1059189030 /nfs/dbraw/zinc/18/90/30/1059189030.db2.gz GMYBOVUDXONSBI-HNNXBMFYSA-N 2 1 322.924 4.371 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246946117 1059189475 /nfs/dbraw/zinc/18/94/75/1059189475.db2.gz FZDWEXXHQOYJOE-GUDVDZBRSA-N 2 1 318.892 4.399 20 0 DIADMP Clc1cccc([C@H]2CCC[N@H+]2[C@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001246946118 1059190964 /nfs/dbraw/zinc/19/09/64/1059190964.db2.gz FZDWEXXHQOYJOE-IPMKNSEASA-N 2 1 318.892 4.399 20 0 DIADMP [NH3+][C@@H]1CC[N@H+](C2CCC3(CCCCC3)CC2)C[C@H]1C(F)(F)F ZINC001246943228 1059191219 /nfs/dbraw/zinc/19/12/19/1059191219.db2.gz ZSGSBKSRGMXHLV-HUUCEWRRSA-N 2 1 318.427 4.091 20 0 DIADMP Cc1cc(F)cc(C[N@@H+](C2CC[NH2+]CC2)[C@H]2CCC[C@H](C)C2)c1 ZINC001246950704 1059193638 /nfs/dbraw/zinc/19/36/38/1059193638.db2.gz DWBGBKGQTMSJNH-YWZLYKJASA-N 2 1 318.480 4.267 20 0 DIADMP CC[C@H]1CC[C@@H]([N@@H+](Cc2cc(C)cc(F)c2)C2CC[NH2+]CC2)C1 ZINC001246952442 1059194322 /nfs/dbraw/zinc/19/43/22/1059194322.db2.gz SKYUFOCMNIDOQV-OXJNMPFZSA-N 2 1 318.480 4.267 20 0 DIADMP C[C@@H](CC1CC1)[N@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246949580 1059194917 /nfs/dbraw/zinc/19/49/17/1059194917.db2.gz ANJCMCFKDZRQCE-AWEZNQCLSA-N 2 1 306.881 4.083 20 0 DIADMP C[C@@H](CC1CC1)[N@@H+](Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001246949580 1059194926 /nfs/dbraw/zinc/19/49/26/1059194926.db2.gz ANJCMCFKDZRQCE-AWEZNQCLSA-N 2 1 306.881 4.083 20 0 DIADMP CCCC[C@H](C)[N@@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1 ZINC001246954056 1059198464 /nfs/dbraw/zinc/19/84/64/1059198464.db2.gz DJSYCTFTQFLXEV-AWEZNQCLSA-N 2 1 310.432 4.098 20 0 DIADMP CCCC[C@@H](C)[N@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954959 1059198641 /nfs/dbraw/zinc/19/86/41/1059198641.db2.gz JZGIKNRPOUCGLA-CQSZACIVSA-N 2 1 310.432 4.098 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(F)cc1F)C1CC[NH2+]CC1 ZINC001246954959 1059198644 /nfs/dbraw/zinc/19/86/44/1059198644.db2.gz JZGIKNRPOUCGLA-CQSZACIVSA-N 2 1 310.432 4.098 20 0 DIADMP C[C@H]1CCC[C@@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246956244 1059198774 /nfs/dbraw/zinc/19/87/74/1059198774.db2.gz XCJPGZZCWMAJHS-MAUKXSAKSA-N 2 1 320.908 4.473 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](Cc2ccccc2Cl)C2CC[NH2+]CC2)C1 ZINC001246956242 1059202264 /nfs/dbraw/zinc/20/22/64/1059202264.db2.gz XCJPGZZCWMAJHS-CRAIPNDOSA-N 2 1 320.908 4.473 20 0 DIADMP Fc1ccc(C[N@@H+](C2CC[NH2+]CC2)C2CCCCCC2)cc1F ZINC001246955097 1059202597 /nfs/dbraw/zinc/20/25/97/1059202597.db2.gz IDQDANNIZRAJHD-UHFFFAOYSA-N 2 1 322.443 4.242 20 0 DIADMP CC[C@@H]1CC[C@H]([N@@H+](Cc2ccc(F)cc2C)C2CC[NH2+]CC2)C1 ZINC001246963881 1059204837 /nfs/dbraw/zinc/20/48/37/1059204837.db2.gz ZUQUPPFBABLZIX-UZLBHIALSA-N 2 1 318.480 4.267 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246962762 1059204914 /nfs/dbraw/zinc/20/49/14/1059204914.db2.gz DPEWODLAJCBKOQ-DJIMGWMZSA-N 2 1 312.567 4.279 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1ccc(F)cc1C)C1CC[NH2+]CC1 ZINC001246961956 1059204970 /nfs/dbraw/zinc/20/49/70/1059204970.db2.gz RSIPAMPHGAYPCB-GOSISDBHSA-N 2 1 306.469 4.267 20 0 DIADMP CC[C@H]1CC[C@H]([N@@H+](Cc2cc(F)ccc2C)C2CC[NH2+]CC2)C1 ZINC001246961464 1059205234 /nfs/dbraw/zinc/20/52/34/1059205234.db2.gz FOCICISDCREXBI-JXFKEZNVSA-N 2 1 318.480 4.267 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(C)cc1F)C1CC[NH2+]CC1 ZINC001246961183 1059207588 /nfs/dbraw/zinc/20/75/88/1059207588.db2.gz IMEZUIJGFCWJPY-MRXNPFEDSA-N 2 1 306.469 4.267 20 0 DIADMP Cc1cc(F)ccc1C[N@@H+](C1CCCCC1)C1CC[NH2+]CC1 ZINC001246959999 1059207865 /nfs/dbraw/zinc/20/78/65/1059207865.db2.gz KLGCZJGPGTZIQL-UHFFFAOYSA-N 2 1 304.453 4.021 20 0 DIADMP C[C@@H](Cc1ccc(F)cc1)[N@@H+](CC1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246970035 1059214225 /nfs/dbraw/zinc/21/42/25/1059214225.db2.gz NKRSMPCMRQBBSG-YSSFQJQWSA-N 2 1 318.480 4.129 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CCC2(C[NH2+]C2)C1 ZINC001246974428 1059214985 /nfs/dbraw/zinc/21/49/85/1059214985.db2.gz ALLVMAXWPFJUAQ-VQTJNVASSA-N 2 1 314.517 4.252 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)[C@@H]1CC[NH2+][C@H](C)C1 ZINC001246975278 1059216092 /nfs/dbraw/zinc/21/60/92/1059216092.db2.gz BNSDPRXJMGOJIA-YZGWKJHDSA-N 2 1 302.506 4.250 20 0 DIADMP C([C@H]1CCC[NH2+]C1)[N@@H+](C1CC1)C1CCC2(CCCCC2)CC1 ZINC001246972057 1059218634 /nfs/dbraw/zinc/21/86/34/1059218634.db2.gz JDMAEFVMQXQWSM-KRWDZBQOSA-N 2 1 304.522 4.344 20 0 DIADMP c1ccc(C2CCC([N@@H+](C3CCC3)C3CC[NH2+]CC3)CC2)cc1 ZINC001246978042 1059220434 /nfs/dbraw/zinc/22/04/34/1059220434.db2.gz RWYCMDJTRJESOO-UHFFFAOYSA-N 2 1 312.501 4.319 20 0 DIADMP CCC[C@H](Cc1ccccc1)[N@@H+](CCC)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC001246978857 1059220619 /nfs/dbraw/zinc/22/06/19/1059220619.db2.gz NBFOANZQTREMJM-JQKXYWIWSA-N 2 1 314.517 4.393 20 0 DIADMP CSCC[C@H](C)[N@@H+](Cc1cccc(C)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001246977146 1059225775 /nfs/dbraw/zinc/22/57/75/1059225775.db2.gz ZSAJEZUCQPTWPR-WDSOQIARSA-N 2 1 320.546 4.209 20 0 DIADMP C[C@H]1c2ccccc2CC[N@@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246988868 1059226636 /nfs/dbraw/zinc/22/66/36/1059226636.db2.gz ZOLGGBYPYHCFBW-SCWSEQNSSA-N 2 1 306.453 4.099 20 0 DIADMP C[C@H]1c2ccccc2CC[N@H+]1[C@@H]1CC[NH2+][C@H](c2ccccc2)C1 ZINC001246988868 1059226650 /nfs/dbraw/zinc/22/66/50/1059226650.db2.gz ZOLGGBYPYHCFBW-SCWSEQNSSA-N 2 1 306.453 4.099 20 0 DIADMP C[N@H+]([C@@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246998855 1059227047 /nfs/dbraw/zinc/22/70/47/1059227047.db2.gz HDZNYLKDHMLLQE-HMXCVIKNSA-N 2 1 306.453 4.099 20 0 DIADMP C[N@@H+]([C@@H]1CCc2ccccc21)[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001246998855 1059227063 /nfs/dbraw/zinc/22/70/63/1059227063.db2.gz HDZNYLKDHMLLQE-HMXCVIKNSA-N 2 1 306.453 4.099 20 0 DIADMP c1ccc(C[C@@H]2C[C@@H]([N@H+]3CCC4(C3)CCCCC4)CC[NH2+]2)cc1 ZINC001246999559 1059227724 /nfs/dbraw/zinc/22/77/24/1059227724.db2.gz QXDAMULSRIXNGY-UXHICEINSA-N 2 1 312.501 4.006 20 0 DIADMP c1ccc(C[C@H]2C[C@@H]([N@H+]3CCC4(C3)CCCCC4)CC[NH2+]2)cc1 ZINC001246999557 1059229690 /nfs/dbraw/zinc/22/96/90/1059229690.db2.gz QXDAMULSRIXNGY-PMACEKPBSA-N 2 1 312.501 4.006 20 0 DIADMP Fc1cc(F)cc([C@H]2CCC[N@H+]2[C@@H]2CCC[C@@]3(CC[NH2+]C3)C2)c1 ZINC001247000312 1059230419 /nfs/dbraw/zinc/23/04/19/1059230419.db2.gz HKUSWEKOTXUGLA-GUDVDZBRSA-N 2 1 320.427 4.024 20 0 DIADMP CCCC[C@H]1C[C@@H]([N@H+]2CCC[C@@H]2c2ccccc2C)CC[NH2+]1 ZINC001247002686 1059235562 /nfs/dbraw/zinc/23/55/62/1059235562.db2.gz OBQOWYHEGKSHHT-CMKODMSKSA-N 2 1 300.490 4.443 20 0 DIADMP Fc1cc(F)cc([C@H]2CCC[N@H+]2[C@H]2CCC3(C2)CC[NH2+]CC3)c1 ZINC001247003729 1059235853 /nfs/dbraw/zinc/23/58/53/1059235853.db2.gz PTNGZQJROPNKIG-ZWKOTPCHSA-N 2 1 320.427 4.024 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2Cc3ccccc3C23CC[NH2+]CC3)CC(C)(C)C1 ZINC001247013549 1059245114 /nfs/dbraw/zinc/24/51/14/1059245114.db2.gz ZUOWRJWDUXOQRA-WMZOPIPTSA-N 2 1 312.501 4.296 20 0 DIADMP CCCC[C@@H](CCC)[NH+]1CCC2(CC1)[NH2+]Cc1ccccc12 ZINC001247016205 1059247598 /nfs/dbraw/zinc/24/75/98/1059247598.db2.gz SPQDMDBBJFSPDR-GOSISDBHSA-N 2 1 300.490 4.440 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)CC(C)(C)C1 ZINC001247016348 1059248324 /nfs/dbraw/zinc/24/83/24/1059248324.db2.gz UBYNXCGUWQAMRL-FUHWJXTLSA-N 2 1 312.501 4.296 20 0 DIADMP Cc1ccc(C[C@@H]2CCC[N@@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC001559510991 1059302877 /nfs/dbraw/zinc/30/28/77/1059302877.db2.gz BOOZDXDKJVTIGY-NRFANRHFSA-N 2 1 314.517 4.126 20 0 DIADMP C([C@@H]1CCC[N@@H+](CC23CCC(CC2)C3)C1)[NH+]1CCCCCC1 ZINC001559524981 1059321756 /nfs/dbraw/zinc/32/17/56/1059321756.db2.gz WVQSZGQAUNWKSC-GPJFCIFZSA-N 2 1 304.522 4.155 20 0 DIADMP Cc1cc(C)cc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC001559525338 1059324230 /nfs/dbraw/zinc/32/42/30/1059324230.db2.gz JDIJJXBCKHRMFA-HXUWFJFHSA-N 2 1 314.517 4.391 20 0 DIADMP C[C@@H]1CCC[C@@H](C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)C1 ZINC001559525069 1059325404 /nfs/dbraw/zinc/32/54/04/1059325404.db2.gz YWWARUVSEDSYEA-AQNXPRMDSA-N 2 1 306.538 4.401 20 0 DIADMP Clc1ccc(/C=C/C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547492 1059355916 /nfs/dbraw/zinc/35/59/16/1059355916.db2.gz XFRFLVPTIYDFRU-SHCNBLLESA-N 2 1 318.892 4.161 20 0 DIADMP Clc1ccc(/C=C/C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC001559547492 1059355938 /nfs/dbraw/zinc/35/59/38/1059355938.db2.gz XFRFLVPTIYDFRU-SHCNBLLESA-N 2 1 318.892 4.161 20 0 DIADMP C[N@H+](Cc1cc(Cl)cc2ccccc21)C[C@H]1CCC[NH+](C)C1 ZINC001559557971 1059377093 /nfs/dbraw/zinc/37/70/93/1059377093.db2.gz LGLUHQGDEKJQHI-HNNXBMFYSA-N 2 1 316.876 4.267 20 0 DIADMP C[NH+](Cc1cc(Cl)cc2ccccc21)C[C@H]1CCC[N@H+](C)C1 ZINC001559557971 1059377115 /nfs/dbraw/zinc/37/71/15/1059377115.db2.gz LGLUHQGDEKJQHI-HNNXBMFYSA-N 2 1 316.876 4.267 20 0 DIADMP C[NH+](Cc1cc(Cl)cc2ccccc21)C[C@H]1CCC[N@@H+](C)C1 ZINC001559557971 1059377136 /nfs/dbraw/zinc/37/71/36/1059377136.db2.gz LGLUHQGDEKJQHI-HNNXBMFYSA-N 2 1 316.876 4.267 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1CCCCCC1 ZINC001559565557 1059391479 /nfs/dbraw/zinc/39/14/79/1059391479.db2.gz NDCGWEYRFZQESR-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC1CCCCCC1 ZINC001559565557 1059391503 /nfs/dbraw/zinc/39/15/03/1059391503.db2.gz NDCGWEYRFZQESR-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC1CCCCCC1 ZINC001559565557 1059391523 /nfs/dbraw/zinc/39/15/23/1059391523.db2.gz NDCGWEYRFZQESR-OAQYLSRUSA-N 2 1 314.517 4.411 20 0 DIADMP C[N@@H+](CCCC(C)(C)C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001559565969 1059392124 /nfs/dbraw/zinc/39/21/24/1059392124.db2.gz VQOJZSQFCSNBLN-LJQANCHMSA-N 2 1 302.506 4.267 20 0 DIADMP C[NH+](CCCC(C)(C)C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001559565969 1059392149 /nfs/dbraw/zinc/39/21/49/1059392149.db2.gz VQOJZSQFCSNBLN-LJQANCHMSA-N 2 1 302.506 4.267 20 0 DIADMP C[NH+](CCCC(C)(C)C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001559565969 1059392168 /nfs/dbraw/zinc/39/21/68/1059392168.db2.gz VQOJZSQFCSNBLN-LJQANCHMSA-N 2 1 302.506 4.267 20 0 DIADMP CCC[N@@H+](C)C[C@H]1CC[NH+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559578803 1059412376 /nfs/dbraw/zinc/41/23/76/1059412376.db2.gz SVPCSGJXTYKHIC-SFHLNBCPSA-N 2 1 314.517 4.234 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559578803 1059412383 /nfs/dbraw/zinc/41/23/83/1059412383.db2.gz SVPCSGJXTYKHIC-SFHLNBCPSA-N 2 1 314.517 4.234 20 0 DIADMP CCC[NH+](C)C[C@H]1CC[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)C2)C1 ZINC001559578803 1059412386 /nfs/dbraw/zinc/41/23/86/1059412386.db2.gz SVPCSGJXTYKHIC-SFHLNBCPSA-N 2 1 314.517 4.234 20 0 DIADMP C[N@@H+](Cc1cccc(O)c1)Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001559584476 1059417650 /nfs/dbraw/zinc/41/76/50/1059417650.db2.gz MYOCUAYJUYPJRT-UHFFFAOYSA-N 2 1 324.468 4.010 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)C[C@@H]1C ZINC001559584392 1059417718 /nfs/dbraw/zinc/41/77/18/1059417718.db2.gz KVCHGKHHDCPBGA-LPHOPBHVSA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@@H]1C ZINC001559584392 1059417727 /nfs/dbraw/zinc/41/77/27/1059417727.db2.gz KVCHGKHHDCPBGA-LPHOPBHVSA-N 2 1 302.506 4.289 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)C[C@@H]1C ZINC001559584392 1059417733 /nfs/dbraw/zinc/41/77/33/1059417733.db2.gz KVCHGKHHDCPBGA-LPHOPBHVSA-N 2 1 302.506 4.289 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccccc2F)CC1 ZINC001559596414 1059432630 /nfs/dbraw/zinc/43/26/30/1059432630.db2.gz SHHCIPPRGZSHEI-QGZVFWFLSA-N 2 1 318.480 4.302 20 0 DIADMP CCCc1ccc([C@@H]([NH2+]CC[C@H]2CCC[N@H+]2C)C(C)C)cc1 ZINC001559670012 1059496708 /nfs/dbraw/zinc/49/67/08/1059496708.db2.gz XTBBZRCKNPBGCI-UXHICEINSA-N 2 1 302.506 4.410 20 0 DIADMP Cc1c2ccccc2sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+]1C ZINC001559729563 1059560759 /nfs/dbraw/zinc/56/07/59/1059560759.db2.gz BKEPHXKFMZZPJC-CABCVRRESA-N 2 1 302.487 4.345 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC12CCC(CC1)C2 ZINC001559775106 1059611710 /nfs/dbraw/zinc/61/17/10/1059611710.db2.gz HWTBCUGIQWZCLI-OMZYAQQMSA-N 2 1 312.501 4.067 20 0 DIADMP CCCCCC[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001559829290 1059661707 /nfs/dbraw/zinc/66/17/07/1059661707.db2.gz PRLIMFXTCXDOEB-HXUWFJFHSA-N 2 1 300.490 4.165 20 0 DIADMP CCCCCC[NH+]1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC001559829290 1059661715 /nfs/dbraw/zinc/66/17/15/1059661715.db2.gz PRLIMFXTCXDOEB-HXUWFJFHSA-N 2 1 300.490 4.165 20 0 DIADMP CCCCCC[NH+]1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001559829290 1059661723 /nfs/dbraw/zinc/66/17/23/1059661723.db2.gz PRLIMFXTCXDOEB-HXUWFJFHSA-N 2 1 300.490 4.165 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](C)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC001559911514 1059728156 /nfs/dbraw/zinc/72/81/56/1059728156.db2.gz LTZDQYMPGDUGKC-VQTJNVASSA-N 2 1 302.506 4.377 20 0 DIADMP FCC[C@H]1CCC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001559998419 1059800664 /nfs/dbraw/zinc/80/06/64/1059800664.db2.gz CLZLKIAVCGKZAZ-GOSISDBHSA-N 2 1 318.480 4.244 20 0 DIADMP CC1(C)[C@H](c2cccc(F)c2)CC[N@H+]1CCC[NH+]1CCCCC1 ZINC001560057085 1059865451 /nfs/dbraw/zinc/86/54/51/1059865451.db2.gz FVXHWELEBNSDMR-IBGZPJMESA-N 2 1 318.480 4.270 20 0 DIADMP Cc1cccc(Cl)c1C[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001560090860 1059899877 /nfs/dbraw/zinc/89/98/77/1059899877.db2.gz PIVCHVXLCLAYCP-UHFFFAOYSA-N 2 1 322.924 4.448 20 0 DIADMP Cc1[nH+]ccn1CCCC[NH2+][C@@H]1CCc2cccc3cccc1c32 ZINC001560161038 1059954790 /nfs/dbraw/zinc/95/47/90/1059954790.db2.gz KADLUIBNRKGBOF-HXUWFJFHSA-N 2 1 319.452 4.402 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1CCC[C@H]1[C@@H](C)c1ccccc1 ZINC001560162775 1059958814 /nfs/dbraw/zinc/95/88/14/1059958814.db2.gz ALIKTNJMIYUTHG-PXNSSMCTSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1CCC[C@H]1[C@@H](C)c1ccccc1 ZINC001560162775 1059958839 /nfs/dbraw/zinc/95/88/39/1059958839.db2.gz ALIKTNJMIYUTHG-PXNSSMCTSA-N 2 1 311.473 4.240 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1CCC(C)(C)[C@H](c2ccccc2)C1 ZINC001560181250 1059974149 /nfs/dbraw/zinc/97/41/49/1059974149.db2.gz MKSRGCJYTIFXKD-IBGZPJMESA-N 2 1 302.506 4.234 20 0 DIADMP Cc1cc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cs1 ZINC001248803866 1059988576 /nfs/dbraw/zinc/98/85/76/1059988576.db2.gz XKCNQLNHUFLRFP-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1cc(C[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cs1 ZINC001248803866 1059988590 /nfs/dbraw/zinc/98/85/90/1059988590.db2.gz XKCNQLNHUFLRFP-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1cc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cs1 ZINC001248803866 1059988606 /nfs/dbraw/zinc/98/86/06/1059988606.db2.gz XKCNQLNHUFLRFP-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP Cc1cc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cs1 ZINC001248803866 1059988618 /nfs/dbraw/zinc/98/86/18/1059988618.db2.gz XKCNQLNHUFLRFP-SFHVURJKSA-N 2 1 314.498 4.010 20 0 DIADMP CC(C)c1cnc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)s1 ZINC001560270608 1060044868 /nfs/dbraw/zinc/04/48/68/1060044868.db2.gz BMOHDYICDNXHGY-HNNXBMFYSA-N 2 1 309.523 4.011 20 0 DIADMP c1csc(-c2ccc(CN[C@H]3CC[N@H+]4CCCC[C@@H]34)cc2)c1 ZINC001560271558 1060046695 /nfs/dbraw/zinc/04/66/95/1060046695.db2.gz PHHYBHKDZUUYOK-ROUUACIJSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CCN4CCCC[C@@H]34)cc2)c1 ZINC001560271558 1060046716 /nfs/dbraw/zinc/04/67/16/1060046716.db2.gz PHHYBHKDZUUYOK-ROUUACIJSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCCC[C@@H]34)cc2)c1 ZINC001560271558 1060046734 /nfs/dbraw/zinc/04/67/34/1060046734.db2.gz PHHYBHKDZUUYOK-ROUUACIJSA-N 2 1 312.482 4.132 20 0 DIADMP c1csc(-c2ccc(C[NH2+][C@H]3CC[N@H+]4CCCC[C@@H]34)cc2)c1 ZINC001560271558 1060046751 /nfs/dbraw/zinc/04/67/51/1060046751.db2.gz PHHYBHKDZUUYOK-ROUUACIJSA-N 2 1 312.482 4.132 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]C2CCC(C3CCCCC3)CC2)C1 ZINC001560291110 1060070498 /nfs/dbraw/zinc/07/04/98/1060070498.db2.gz DCURXZXKHOPSKS-QHGAOEGBSA-N 2 1 306.538 4.447 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[NH2+]CC(C)(C)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001560292651 1060075551 /nfs/dbraw/zinc/07/55/51/1060075551.db2.gz RLLHLGJCPCCOFQ-OGWHTMIXSA-N 2 1 306.538 4.325 20 0 DIADMP Cc1cc(C)c(/C=C/C[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1C ZINC001560321018 1060107385 /nfs/dbraw/zinc/10/73/85/1060107385.db2.gz XRERKAFUJAJNAG-ZGBFETHSSA-N 2 1 314.517 4.335 20 0 DIADMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)c1 ZINC001560347661 1060132235 /nfs/dbraw/zinc/13/22/35/1060132235.db2.gz UKGJINBIEYBVJM-YRWFTTLQSA-N 2 1 302.506 4.441 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC001560349501 1060135898 /nfs/dbraw/zinc/13/58/98/1060135898.db2.gz NCCGAWDNHGUZBP-HKUYNNGSSA-N 2 1 314.498 4.229 20 0 DIADMP Cc1ccccc1C[NH2+]C[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC001560349501 1060135901 /nfs/dbraw/zinc/13/59/01/1060135901.db2.gz NCCGAWDNHGUZBP-HKUYNNGSSA-N 2 1 314.498 4.229 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CC[N@H+](CC3CCCC3)C2)CC(C)(C)C1 ZINC001560360048 1060145796 /nfs/dbraw/zinc/14/57/96/1060145796.db2.gz AEYCUCJJSMGQDE-KRWDZBQOSA-N 2 1 306.538 4.445 20 0 DIADMP CC1(C)CC([NH2+][C@H]2CC[N@@H+](CC3CCCC3)C2)CC(C)(C)C1 ZINC001560360048 1060145808 /nfs/dbraw/zinc/14/58/08/1060145808.db2.gz AEYCUCJJSMGQDE-KRWDZBQOSA-N 2 1 306.538 4.445 20 0 DIADMP CSCc1ccc(C[NH2+]CCC[NH+](C(C)C)C(C)C)cc1 ZINC001560366381 1060153143 /nfs/dbraw/zinc/15/31/43/1060153143.db2.gz BHNPLRNPEVCGLQ-UHFFFAOYSA-N 2 1 308.535 4.148 20 0 DIADMP Cc1cc(C)c(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001560435566 1060224052 /nfs/dbraw/zinc/22/40/52/1060224052.db2.gz TYGHDVKKVGCCMR-MOPGFXCFSA-N 2 1 314.517 4.354 20 0 DIADMP c1ccc2cc(C[NH2+]C[C@@H]3CCC[N@@H+](CC4CC4)C3)ccc2c1 ZINC001560547188 1060354056 /nfs/dbraw/zinc/35/40/56/1060354056.db2.gz YBULRRHPQFVYQA-IBGZPJMESA-N 2 1 308.469 4.051 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001560552467 1060363315 /nfs/dbraw/zinc/36/33/15/1060363315.db2.gz FCPXYMABOFWNSS-BVJIBDCISA-N 2 1 312.501 4.065 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001560552467 1060363336 /nfs/dbraw/zinc/36/33/36/1060363336.db2.gz FCPXYMABOFWNSS-BVJIBDCISA-N 2 1 312.501 4.065 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(F)c3ccccc23)C[C@H]1C ZINC001560636980 1060451061 /nfs/dbraw/zinc/45/10/61/1060451061.db2.gz REZVSIVURMFBNB-WBVHZDCISA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(F)c3ccccc23)C[C@H]1C ZINC001560636980 1060451072 /nfs/dbraw/zinc/45/10/72/1060451072.db2.gz REZVSIVURMFBNB-WBVHZDCISA-N 2 1 314.448 4.284 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(F)c3ccccc23)C[C@H]1C ZINC001560636980 1060451082 /nfs/dbraw/zinc/45/10/82/1060451082.db2.gz REZVSIVURMFBNB-WBVHZDCISA-N 2 1 314.448 4.284 20 0 DIADMP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637352 1060451267 /nfs/dbraw/zinc/45/12/67/1060451267.db2.gz ARRBZVGBDMEHCD-PBHICJAKSA-N 2 1 306.494 4.048 20 0 DIADMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637352 1060451279 /nfs/dbraw/zinc/45/12/79/1060451279.db2.gz ARRBZVGBDMEHCD-PBHICJAKSA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637352 1060451288 /nfs/dbraw/zinc/45/12/88/1060451288.db2.gz ARRBZVGBDMEHCD-PBHICJAKSA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@H](C)C1 ZINC001560637352 1060451296 /nfs/dbraw/zinc/45/12/96/1060451296.db2.gz ARRBZVGBDMEHCD-PBHICJAKSA-N 2 1 306.494 4.048 20 0 DIADMP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637357 1060452844 /nfs/dbraw/zinc/45/28/44/1060452844.db2.gz ARRBZVGBDMEHCD-WMLDXEAASA-N 2 1 306.494 4.048 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637357 1060452855 /nfs/dbraw/zinc/45/28/55/1060452855.db2.gz ARRBZVGBDMEHCD-WMLDXEAASA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637357 1060452869 /nfs/dbraw/zinc/45/28/69/1060452869.db2.gz ARRBZVGBDMEHCD-WMLDXEAASA-N 2 1 306.494 4.048 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(C(C)(C)C)oc2C)[C@@H](C)C1 ZINC001560637357 1060452877 /nfs/dbraw/zinc/45/28/77/1060452877.db2.gz ARRBZVGBDMEHCD-WMLDXEAASA-N 2 1 306.494 4.048 20 0 DIADMP C[C@H]([NH2+]C1CC2(C1)CCCC2)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001560711939 1060571856 /nfs/dbraw/zinc/57/18/56/1060571856.db2.gz XNTSTYZSLGPWKG-HKUYNNGSSA-N 2 1 312.501 4.209 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1C ZINC001560757899 1060624311 /nfs/dbraw/zinc/62/43/11/1060624311.db2.gz YMCOCEOEFSGRJP-ALCCZGGFSA-N 2 1 312.501 4.185 20 0 DIADMP Cc1cc(C)c(/C=C/C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1C ZINC001560757900 1060624583 /nfs/dbraw/zinc/62/45/83/1060624583.db2.gz YMCOCEOEFSGRJP-FNORWQNLSA-N 2 1 312.501 4.185 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)CS1 ZINC001560792045 1060650946 /nfs/dbraw/zinc/65/09/46/1060650946.db2.gz XMNPWRWBSCTOTK-NXHRZFHOSA-N 2 1 324.578 4.293 20 0 DIADMP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)CS1 ZINC001560792045 1060650957 /nfs/dbraw/zinc/65/09/57/1060650957.db2.gz XMNPWRWBSCTOTK-NXHRZFHOSA-N 2 1 324.578 4.293 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)CS1 ZINC001560792047 1060650978 /nfs/dbraw/zinc/65/09/78/1060650978.db2.gz XMNPWRWBSCTOTK-SZMVWBNQSA-N 2 1 324.578 4.293 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+]2C2CCCCC2)CS1 ZINC001560792047 1060650983 /nfs/dbraw/zinc/65/09/83/1060650983.db2.gz XMNPWRWBSCTOTK-SZMVWBNQSA-N 2 1 324.578 4.293 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)CS1 ZINC001560792042 1060651175 /nfs/dbraw/zinc/65/11/75/1060651175.db2.gz XMNPWRWBSCTOTK-JQHSSLGASA-N 2 1 324.578 4.293 20 0 DIADMP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)CS1 ZINC001560792042 1060651179 /nfs/dbraw/zinc/65/11/79/1060651179.db2.gz XMNPWRWBSCTOTK-JQHSSLGASA-N 2 1 324.578 4.293 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc3c(c2)CCCC3)cc1 ZINC001560810495 1060668665 /nfs/dbraw/zinc/66/86/65/1060668665.db2.gz BQKNFPCERFORER-UHFFFAOYSA-N 2 1 322.496 4.259 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCc2cccc(Cl)c2)cc1 ZINC001560810999 1060669487 /nfs/dbraw/zinc/66/94/87/1060669487.db2.gz ULPUWFGIWNMXOZ-UHFFFAOYSA-N 2 1 316.876 4.076 20 0 DIADMP Cc1cc(C)cc(CC[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC001560811146 1060672232 /nfs/dbraw/zinc/67/22/32/1060672232.db2.gz ZTPLMSKSWJKDPF-UHFFFAOYSA-N 2 1 310.485 4.040 20 0 DIADMP CC[NH+](CC)CCC[N@H+](CC)Cc1cc2cc(Cl)cnc2o1 ZINC001560811718 1060672363 /nfs/dbraw/zinc/67/23/63/1060672363.db2.gz UXQAVRIWHKNBBD-UHFFFAOYSA-N 2 1 323.868 4.035 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1cc2cc(Cl)cnc2o1 ZINC001560811718 1060672377 /nfs/dbraw/zinc/67/23/77/1060672377.db2.gz UXQAVRIWHKNBBD-UHFFFAOYSA-N 2 1 323.868 4.035 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c(C)c1 ZINC001560814511 1060673649 /nfs/dbraw/zinc/67/36/49/1060673649.db2.gz ZTTBASPIZBQFGE-DZEDTGDLSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c(C)c1 ZINC001560814511 1060673654 /nfs/dbraw/zinc/67/36/54/1060673654.db2.gz ZTTBASPIZBQFGE-DZEDTGDLSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@H]32)c(C)c1 ZINC001560814511 1060673659 /nfs/dbraw/zinc/67/36/59/1060673659.db2.gz ZTTBASPIZBQFGE-DZEDTGDLSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c(C)c1 ZINC001560814513 1060673799 /nfs/dbraw/zinc/67/37/99/1060673799.db2.gz ZTTBASPIZBQFGE-VJBDLKCCSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c(C)c1 ZINC001560814513 1060673802 /nfs/dbraw/zinc/67/38/02/1060673802.db2.gz ZTTBASPIZBQFGE-VJBDLKCCSA-N 2 1 312.501 4.041 20 0 DIADMP Cc1cc(C)c(/C=C\C[N@@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)c(C)c1 ZINC001560814513 1060673804 /nfs/dbraw/zinc/67/38/04/1060673804.db2.gz ZTTBASPIZBQFGE-VJBDLKCCSA-N 2 1 312.501 4.041 20 0 DIADMP CC[NH+]1CCC(C[N@H+]2CCC[C@](C)(c3ccccc3)CC2)CC1 ZINC001560825208 1060685524 /nfs/dbraw/zinc/68/55/24/1060685524.db2.gz FSLIMLGSKWWHLE-NRFANRHFSA-N 2 1 314.517 4.162 20 0 DIADMP CCC[N@H+](CC)C[C@@H](C)[NH2+][C@@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560861025 1060718784 /nfs/dbraw/zinc/71/87/84/1060718784.db2.gz BWSBVZXNSOHHPR-ZWKOTPCHSA-N 2 1 316.533 4.206 20 0 DIADMP CCC[N@@H+](CC)C[C@@H](C)[NH2+][C@@H](C)Cc1ccc2c(c1)CCCC2 ZINC001560861025 1060718792 /nfs/dbraw/zinc/71/87/92/1060718792.db2.gz BWSBVZXNSOHHPR-ZWKOTPCHSA-N 2 1 316.533 4.206 20 0 DIADMP CCCC[N@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560864207 1060722436 /nfs/dbraw/zinc/72/24/36/1060722436.db2.gz NRBKAWGRDVGTCJ-MISYRCLQSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@@H+](C)C[C@@H](C)[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001560864207 1060722447 /nfs/dbraw/zinc/72/24/47/1060722447.db2.gz NRBKAWGRDVGTCJ-MISYRCLQSA-N 2 1 302.506 4.207 20 0 DIADMP CCCC[N@H+](C)C[C@H](C)[NH2+][C@H](CC)Cc1ccc(Cl)cc1 ZINC001560865086 1060724777 /nfs/dbraw/zinc/72/47/77/1060724777.db2.gz PYCPZTXQERVPSC-MAUKXSAKSA-N 2 1 310.913 4.371 20 0 DIADMP CCCC[N@@H+](C)C[C@H](C)[NH2+][C@H](CC)Cc1ccc(Cl)cc1 ZINC001560865086 1060724785 /nfs/dbraw/zinc/72/47/85/1060724785.db2.gz PYCPZTXQERVPSC-MAUKXSAKSA-N 2 1 310.913 4.371 20 0 DIADMP CCC[N@H+](CC)C[C@H](C)[NH2+][C@@H](C)Cc1ccccc1SC ZINC001560869702 1060729085 /nfs/dbraw/zinc/72/90/85/1060729085.db2.gz OGVCLQZZUDBPKO-HOTGVXAUSA-N 2 1 308.535 4.050 20 0 DIADMP CCC[N@@H+](CC)C[C@H](C)[NH2+][C@@H](C)Cc1ccccc1SC ZINC001560869702 1060729094 /nfs/dbraw/zinc/72/90/94/1060729094.db2.gz OGVCLQZZUDBPKO-HOTGVXAUSA-N 2 1 308.535 4.050 20 0 DIADMP CC(C)CCC[C@@H](C)[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001560900540 1060761794 /nfs/dbraw/zinc/76/17/94/1060761794.db2.gz DVUAWHMRUXDWRU-RLLQIKCJSA-N 2 1 302.506 4.136 20 0 DIADMP CCC[C@@H]([NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)C1CCCC1 ZINC001560901339 1060765762 /nfs/dbraw/zinc/76/57/62/1060765762.db2.gz QCFAJGJXUUITSX-QHAWAJNXSA-N 2 1 314.517 4.280 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@H](C)CCc1ccc(Cl)s1 ZINC001560916585 1060775848 /nfs/dbraw/zinc/77/58/48/1060775848.db2.gz RFCWJMHYOUEHFO-CQSZACIVSA-N 2 1 316.942 4.290 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CC[N@@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972961 1060837489 /nfs/dbraw/zinc/83/74/89/1060837489.db2.gz DOWCHRWFLZFXIF-OXJNMPFZSA-N 2 1 318.480 4.316 20 0 DIADMP C[C@@H](C[NH2+]C[C@H]1CC[N@H+]1C1CCCCCC1)c1ccc(F)cc1 ZINC001560972961 1060837499 /nfs/dbraw/zinc/83/74/99/1060837499.db2.gz DOWCHRWFLZFXIF-OXJNMPFZSA-N 2 1 318.480 4.316 20 0 DIADMP C([NH2+][C@H]1CCC[C@H](C2CC2)C1)[C@H]1CC[N@@H+]1C1CCCCCC1 ZINC001560973519 1060838891 /nfs/dbraw/zinc/83/88/91/1060838891.db2.gz WSWTUDMNDWSASX-CMKODMSKSA-N 2 1 304.522 4.342 20 0 DIADMP C([NH2+][C@H]1CCC[C@H](C2CC2)C1)[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001560973519 1060838901 /nfs/dbraw/zinc/83/89/01/1060838901.db2.gz WSWTUDMNDWSASX-CMKODMSKSA-N 2 1 304.522 4.342 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001560983153 1060847065 /nfs/dbraw/zinc/84/70/65/1060847065.db2.gz QTZJKAKWRDVVNF-UHFFFAOYSA-N 2 1 308.897 4.346 20 0 DIADMP C[N@H+](C/C=C\c1cccc(F)c1)CCCC[NH+]1CCCCC1 ZINC001560982947 1060847769 /nfs/dbraw/zinc/84/77/69/1060847769.db2.gz LTJYIIAKICJGFD-NTMALXAHSA-N 2 1 304.453 4.037 20 0 DIADMP C[N@@H+](C/C=C\c1ccc(Cl)cc1)CC[C@@H]1CCCC[NH+]1C ZINC001473191499 1060947333 /nfs/dbraw/zinc/94/73/33/1060947333.db2.gz GULRAUCVGNDIND-XFHJGTJQSA-N 2 1 306.881 4.159 20 0 DIADMP C[N@H+](C/C=C\c1ccc(Cl)cc1)CC[C@@H]1CCCC[NH+]1C ZINC001473191499 1060947361 /nfs/dbraw/zinc/94/73/61/1060947361.db2.gz GULRAUCVGNDIND-XFHJGTJQSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C\c1ccc(Cl)cc1)CC[C@@H]1CCCC[N@@H+]1C ZINC001473191499 1060947376 /nfs/dbraw/zinc/94/73/76/1060947376.db2.gz GULRAUCVGNDIND-XFHJGTJQSA-N 2 1 306.881 4.159 20 0 DIADMP C[NH+](C/C=C\c1ccc(Cl)cc1)CC[C@@H]1CCCC[N@H+]1C ZINC001473191499 1060947395 /nfs/dbraw/zinc/94/73/95/1060947395.db2.gz GULRAUCVGNDIND-XFHJGTJQSA-N 2 1 306.881 4.159 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@@H]2CCCC[C@@]21c1ccccc1 ZINC001473229629 1061008493 /nfs/dbraw/zinc/00/84/93/1061008493.db2.gz CPYGJXRHOSKXNZ-VQTJNVASSA-N 2 1 300.490 4.120 20 0 DIADMP CC[NH+](CC)CCC[N@H+]1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001473229627 1061009184 /nfs/dbraw/zinc/00/91/84/1061009184.db2.gz CPYGJXRHOSKXNZ-PMACEKPBSA-N 2 1 300.490 4.120 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cccc3ccoc32)cc1 ZINC001462191498 1061014140 /nfs/dbraw/zinc/01/41/40/1061014140.db2.gz LLINNGYZKFMVAV-UHFFFAOYSA-N 2 1 308.425 4.126 20 0 DIADMP CSCC[C@H](C)[N@@H+](C)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001473241081 1061019710 /nfs/dbraw/zinc/01/97/10/1061019710.db2.gz XZUKTYFLBKUZSE-KRWDZBQOSA-N 2 1 320.546 4.246 20 0 DIADMP CC[NH+](CC)CCC[N@@H+](CC)Cc1cc2c(cccc2O)s1 ZINC001462203331 1061023550 /nfs/dbraw/zinc/02/35/50/1061023550.db2.gz WQTNYSFUOCJWTE-UHFFFAOYSA-N 2 1 320.502 4.161 20 0 DIADMP Fc1cccc(C[NH+]2CCC3(CC[N@H+](C4CCCC4)C3)CC2)c1 ZINC001278596792 1061059978 /nfs/dbraw/zinc/05/99/78/1061059978.db2.gz XFVMFCOGNVPGOH-UHFFFAOYSA-N 2 1 316.464 4.056 20 0 DIADMP CCCc1ccc([C@@H]([NH2+]CCCc2c[nH+]cn2C)C(C)C)cc1 ZINC001473299582 1061064399 /nfs/dbraw/zinc/06/43/99/1061064399.db2.gz ODSUZOVBGDYHOY-FQEVSTJZSA-N 2 1 313.489 4.292 20 0 DIADMP c1ccc(C[N@@H+]2CCCC[C@@H](C[NH2+]C3CC4(CCC4)C3)C2)cc1 ZINC001462310141 1061095660 /nfs/dbraw/zinc/09/56/60/1061095660.db2.gz AGUOKAANXWAABY-IBGZPJMESA-N 2 1 312.501 4.211 20 0 DIADMP C[N@@H+](CCC1CCN(c2cc[nH+]cc2)CC1)CC1CCCCC1 ZINC001473342094 1061099739 /nfs/dbraw/zinc/09/97/39/1061099739.db2.gz IWCGLTQHAQDVKE-UHFFFAOYSA-N 2 1 315.505 4.200 20 0 DIADMP CC(C)C[N@H+](C)CCC[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC001462408308 1061153907 /nfs/dbraw/zinc/15/39/07/1061153907.db2.gz ZQCPRSIDHUFPJB-ZFWWWQNUSA-N 2 1 312.548 4.241 20 0 DIADMP CC(C)C[N@@H+](C)CCC[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC001462408308 1061153911 /nfs/dbraw/zinc/15/39/11/1061153911.db2.gz ZQCPRSIDHUFPJB-ZFWWWQNUSA-N 2 1 312.548 4.241 20 0 DIADMP Cc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC(C)(C)C3)C2)s1 ZINC001473455340 1061169476 /nfs/dbraw/zinc/16/94/76/1061169476.db2.gz JHESAERNHYUDLW-INIZCTEOSA-N 2 1 320.546 4.246 20 0 DIADMP CCc1ccccc1C[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC001473490328 1061188324 /nfs/dbraw/zinc/18/83/24/1061188324.db2.gz ZIEQUQVVOXNXLM-UHFFFAOYSA-N 2 1 308.469 4.003 20 0 DIADMP C[N@H+]1CCC[C@]2(CC[NH+](CC3CCC(C(C)(C)C)CC3)C2)C1 ZINC001473501260 1061197895 /nfs/dbraw/zinc/19/78/95/1061197895.db2.gz CLLXASYEYPIOCN-QLOJAFMTSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@H+](CC3CCC(C(C)(C)C)CC3)C2)C1 ZINC001473501260 1061197907 /nfs/dbraw/zinc/19/79/07/1061197907.db2.gz CLLXASYEYPIOCN-QLOJAFMTSA-N 2 1 306.538 4.257 20 0 DIADMP C[NH+]1CCC[C@]2(CC[N@@H+](CC3CCC(C(C)(C)C)CC3)C2)C1 ZINC001473501260 1061197914 /nfs/dbraw/zinc/19/79/14/1061197914.db2.gz CLLXASYEYPIOCN-QLOJAFMTSA-N 2 1 306.538 4.257 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCCC2)c1 ZINC001462516736 1061226032 /nfs/dbraw/zinc/22/60/32/1061226032.db2.gz FGJNILWGZBJEAW-RXVVDRJESA-N 2 1 314.517 4.313 20 0 DIADMP Cc1cccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001462516736 1061226052 /nfs/dbraw/zinc/22/60/52/1061226052.db2.gz FGJNILWGZBJEAW-RXVVDRJESA-N 2 1 314.517 4.313 20 0 DIADMP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCCC1 ZINC001462521216 1061229227 /nfs/dbraw/zinc/22/92/27/1061229227.db2.gz YVFKQLKGRMKOMC-APWZRJJASA-N 2 1 320.546 4.456 20 0 DIADMP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001462521216 1061229247 /nfs/dbraw/zinc/22/92/47/1061229247.db2.gz YVFKQLKGRMKOMC-APWZRJJASA-N 2 1 320.546 4.456 20 0 DIADMP C[C@H]1CC(C)(C)C[N@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001473554254 1061241036 /nfs/dbraw/zinc/24/10/36/1061241036.db2.gz AXCQRPZFHXQANF-KRWDZBQOSA-N 2 1 300.490 4.293 20 0 DIADMP CC(C)C[C@H](C)C[C@H](C)[NH2+][C@@H](CC[NH+](C)C)c1cccnc1 ZINC001462587147 1061280361 /nfs/dbraw/zinc/28/03/61/1061280361.db2.gz FNDSTBMQNRDZTC-LNLFQRSKSA-N 2 1 305.510 4.125 20 0 DIADMP CC[NH+](CC)CC[C@H]([NH2+][C@H](C)[C@H]1CCCCO1)c1ccccc1 ZINC001462674228 1061331123 /nfs/dbraw/zinc/33/11/23/1061331123.db2.gz KIOSOGLYYZUHDJ-YZGWKJHDSA-N 2 1 318.505 4.007 20 0 DIADMP C[C@H](c1cccc2ccccc21)[NH+]1C[C@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC001473689951 1061349816 /nfs/dbraw/zinc/34/98/16/1061349816.db2.gz SWUKMZKCIFFIJA-CZAAIQMYSA-N 2 1 308.469 4.174 20 0 DIADMP Cc1cccc(C)c1C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001473716520 1061364314 /nfs/dbraw/zinc/36/43/14/1061364314.db2.gz HCPOMWDHGXMLSS-FQEVSTJZSA-N 2 1 314.517 4.390 20 0 DIADMP Cc1cccc(C)c1C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001473716521 1061366589 /nfs/dbraw/zinc/36/65/89/1061366589.db2.gz HCPOMWDHGXMLSS-HXUWFJFHSA-N 2 1 314.517 4.390 20 0 DIADMP CCCCCC[N@@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001473718860 1061368587 /nfs/dbraw/zinc/36/85/87/1061368587.db2.gz QQICHCHLZSDGEI-OYRHEFFESA-N 2 1 314.517 4.411 20 0 DIADMP CCCCCC[N@H+]1C[C@]2(C)C[NH+](Cc3ccccc3)C[C@]2(C)C1 ZINC001473718860 1061368603 /nfs/dbraw/zinc/36/86/03/1061368603.db2.gz QQICHCHLZSDGEI-OYRHEFFESA-N 2 1 314.517 4.411 20 0 DIADMP CCCCCC[NH+]1C[C@]2(C)C[N@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001473718860 1061368626 /nfs/dbraw/zinc/36/86/26/1061368626.db2.gz QQICHCHLZSDGEI-OYRHEFFESA-N 2 1 314.517 4.411 20 0 DIADMP CCCCCC[NH+]1C[C@]2(C)C[N@@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC001473718860 1061368644 /nfs/dbraw/zinc/36/86/44/1061368644.db2.gz QQICHCHLZSDGEI-OYRHEFFESA-N 2 1 314.517 4.411 20 0 DIADMP Cc1ccc(C[N@@H+](CC(C)C)CC2CC[NH+](C)CC2)c(Cl)c1 ZINC001473739306 1061384608 /nfs/dbraw/zinc/38/46/08/1061384608.db2.gz NITSPMOEXXKVHM-UHFFFAOYSA-N 2 1 322.924 4.448 20 0 DIADMP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]Cc1ccc(F)cc1 ZINC001473912205 1061460663 /nfs/dbraw/zinc/46/06/63/1061460663.db2.gz FZNLKVYWAHJIFK-UHFFFAOYSA-N 2 1 314.448 4.074 20 0 DIADMP C[N@@H+](Cc1ccccc1)CC(C)(C)C[NH2+]Cc1ccc(F)cc1 ZINC001473912205 1061460669 /nfs/dbraw/zinc/46/06/69/1061460669.db2.gz FZNLKVYWAHJIFK-UHFFFAOYSA-N 2 1 314.448 4.074 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001473922005 1061470841 /nfs/dbraw/zinc/47/08/41/1061470841.db2.gz VMWPNVQXJZYOIZ-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP CC(C)CCC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001473922005 1061470853 /nfs/dbraw/zinc/47/08/53/1061470853.db2.gz VMWPNVQXJZYOIZ-LJQANCHMSA-N 2 1 300.490 4.209 20 0 DIADMP C[N@H+]1CC[C@@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC1(C)C ZINC001473921467 1061471288 /nfs/dbraw/zinc/47/12/88/1061471288.db2.gz MRCDLQQFXVQKDS-RTWAWAEBSA-N 2 1 322.496 4.433 20 0 DIADMP Cc1[nH+]ccn1-c1ccc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)cc1F ZINC001473954841 1061495926 /nfs/dbraw/zinc/49/59/26/1061495926.db2.gz IBLVQNKGWGITHC-ZIAGYGMSSA-N 2 1 315.436 4.234 20 0 DIADMP CCC[N@H+]1CC[C@H](C[NH2+]Cc2ccc(C3CCCC3)cc2)C1 ZINC001473957194 1061499411 /nfs/dbraw/zinc/49/94/11/1061499411.db2.gz MMOHXRPQVHGQQM-GOSISDBHSA-N 2 1 300.490 4.166 20 0 DIADMP CS[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@H+]2CC2CCCCC2)C1 ZINC001473980699 1061522708 /nfs/dbraw/zinc/52/27/08/1061522708.db2.gz YQFORXNCYSADNN-GUDVDZBRSA-N 2 1 324.578 4.295 20 0 DIADMP CCCC[N@@H+]1CCCC[C@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001473989277 1061532552 /nfs/dbraw/zinc/53/25/52/1061532552.db2.gz ZFLGDGPBHOFNSG-NRFANRHFSA-N 2 1 314.517 4.178 20 0 DIADMP CCCC[N@H+]1CCCC[C@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001473989277 1061532563 /nfs/dbraw/zinc/53/25/63/1061532563.db2.gz ZFLGDGPBHOFNSG-NRFANRHFSA-N 2 1 314.517 4.178 20 0 DIADMP C[C@H]1C[C@H](CC[NH2+]CC2CCCCC2)C[N@H+]1Cc1ccccc1 ZINC001474072894 1061619581 /nfs/dbraw/zinc/61/95/81/1061619581.db2.gz AHDBFZXXLPKNMT-RXVVDRJESA-N 2 1 314.517 4.457 20 0 DIADMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC001474078326 1061625003 /nfs/dbraw/zinc/62/50/03/1061625003.db2.gz IVDKZGQVGUQJSH-HNNXBMFYSA-N 2 1 318.436 4.030 20 0 DIADMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2cc3cc(F)ccc3o2)C1 ZINC001474078326 1061625013 /nfs/dbraw/zinc/62/50/13/1061625013.db2.gz IVDKZGQVGUQJSH-HNNXBMFYSA-N 2 1 318.436 4.030 20 0 DIADMP Cc1cc2cc(C[NH2+]CC(C)(C)C[NH+]3CCCC3)oc2cc1C ZINC001474133163 1061679057 /nfs/dbraw/zinc/67/90/57/1061679057.db2.gz JLVTXUDFVKUTKH-UHFFFAOYSA-N 2 1 314.473 4.261 20 0 DIADMP CC1(C[NH2+][C@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)CCC1 ZINC001474294778 1061863638 /nfs/dbraw/zinc/86/36/38/1061863638.db2.gz UHOAIWYVILXAAE-AABGKKOBSA-N 2 1 312.501 4.067 20 0 DIADMP c1ccc(C[NH+]2CCC([NH2+]C[C@H]3C[C@H]3C3CCCC3)CC2)cc1 ZINC001474301249 1061871579 /nfs/dbraw/zinc/87/15/79/1061871579.db2.gz IIAPFNZYBRSMAP-CTNGQTDRSA-N 2 1 312.501 4.067 20 0 DIADMP Cc1ccc(-c2ccccc2C[NH+]2CCC([NH+](C)C)CC2)c(C)c1 ZINC001474332724 1061925770 /nfs/dbraw/zinc/92/57/70/1061925770.db2.gz NUHASUQPSKQZFU-UHFFFAOYSA-N 2 1 322.496 4.496 20 0 DIADMP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](C[C@H](C)CC2CCCCC2)C1 ZINC001474348452 1061958295 /nfs/dbraw/zinc/95/82/95/1061958295.db2.gz IKAHSKNJBDUVJR-UYAOXDASSA-N 2 1 324.553 4.026 20 0 DIADMP C[C@@H](C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)c1ccccc1 ZINC001474371515 1062006974 /nfs/dbraw/zinc/00/69/74/1062006974.db2.gz UGMRHWRLYXWOPV-PMACEKPBSA-N 2 1 314.517 4.378 20 0 DIADMP CC(C)C1(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)CC1 ZINC001474374299 1062016032 /nfs/dbraw/zinc/01/60/32/1062016032.db2.gz NDBQPTSOYYYFKT-GOSISDBHSA-N 2 1 306.538 4.399 20 0 DIADMP CC(C)CCCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001474380860 1062026275 /nfs/dbraw/zinc/02/62/75/1062026275.db2.gz DUZXGGGTACAXFA-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP CC(C)CCCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001474380860 1062026285 /nfs/dbraw/zinc/02/62/85/1062026285.db2.gz DUZXGGGTACAXFA-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP CC(C)CCCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474380860 1062026309 /nfs/dbraw/zinc/02/63/09/1062026309.db2.gz DUZXGGGTACAXFA-HXUWFJFHSA-N 2 1 302.506 4.267 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](CCCc2ccccc2C)CC1 ZINC001459308712 1062078285 /nfs/dbraw/zinc/07/82/85/1062078285.db2.gz AQFXIWHAMKBQPB-UHFFFAOYSA-N 2 1 316.533 4.372 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499332 1062141074 /nfs/dbraw/zinc/14/10/74/1062141074.db2.gz CYWXJPASGBQHIK-DGCLKSJQSA-N 2 1 301.261 4.128 20 0 DIADMP C[C@@H]([NH2+][C@@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499332 1062141084 /nfs/dbraw/zinc/14/10/84/1062141084.db2.gz CYWXJPASGBQHIK-DGCLKSJQSA-N 2 1 301.261 4.128 20 0 DIADMP CCC[C@H](CCc1ccccc1)[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC001254486236 1062127590 /nfs/dbraw/zinc/12/75/90/1062127590.db2.gz WMLRKIJRTOOAQG-VQTJNVASSA-N 2 1 302.506 4.109 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CC[N@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001474451796 1062129311 /nfs/dbraw/zinc/12/93/11/1062129311.db2.gz LDVAUYMZTZOOSJ-AZUAARDMSA-N 2 1 312.501 4.380 20 0 DIADMP CC1(C)CC(C[NH2+][C@H]2CC[N@@H+](C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC001474451796 1062129329 /nfs/dbraw/zinc/12/93/29/1062129329.db2.gz LDVAUYMZTZOOSJ-AZUAARDMSA-N 2 1 312.501 4.380 20 0 DIADMP C[C@@H]1CC[N@H+](Cc2ccnn2-c2cc[nH+]cc2)CC12CCCCC2 ZINC001474462315 1062140010 /nfs/dbraw/zinc/14/00/10/1062140010.db2.gz FUSZLWUVFNIAAA-QGZVFWFLSA-N 2 1 324.472 4.060 20 0 DIADMP C[C@@H]1CC[N@@H+](Cc2ccnn2-c2cc[nH+]cc2)CC12CCCCC2 ZINC001474462315 1062140017 /nfs/dbraw/zinc/14/00/17/1062140017.db2.gz FUSZLWUVFNIAAA-QGZVFWFLSA-N 2 1 324.472 4.060 20 0 DIADMP CCC(CC)C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC001459423980 1062140530 /nfs/dbraw/zinc/14/05/30/1062140530.db2.gz FSXRFWIYNFTSAY-UHFFFAOYSA-N 2 1 302.506 4.267 20 0 DIADMP C[C@@H](N[C@@H]1CCC[N@@H+](C)CC1)c1cc(Cl)ccc1Cl ZINC001254499332 1062141059 /nfs/dbraw/zinc/14/10/59/1062141059.db2.gz CYWXJPASGBQHIK-DGCLKSJQSA-N 2 1 301.261 4.128 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)CC1 ZINC001254498378 1062141517 /nfs/dbraw/zinc/14/15/17/1062141517.db2.gz YFTDXPAFUCJCPI-RTWAWAEBSA-N 2 1 308.469 4.044 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C(C)(C)c2ccc(C(F)(F)F)cc2)CC1 ZINC001254501300 1062146852 /nfs/dbraw/zinc/14/68/52/1062146852.db2.gz RJVKLMKELLBIAL-OAHLLOKOSA-N 2 1 314.395 4.014 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)CC1 ZINC001254505910 1062148349 /nfs/dbraw/zinc/14/83/49/1062148349.db2.gz LOQLLYOXATUZDI-HNNXBMFYSA-N 2 1 314.395 4.014 20 0 DIADMP C[N@H+]1CCC[C@H]([NH2+][C@@H](CC2CCC2)c2ccccc2F)CC1 ZINC001254507449 1062149408 /nfs/dbraw/zinc/14/94/08/1062149408.db2.gz CELUBNWCUGPNEY-LPHOPBHVSA-N 2 1 304.453 4.131 20 0 DIADMP CC[C@H]([NH2+][C@H]1CCC[N@@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC001254510120 1062149679 /nfs/dbraw/zinc/14/96/79/1062149679.db2.gz RXPGPUMDVMCHOW-HOTGVXAUSA-N 2 1 314.395 4.230 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH2+]C2(c3ccccc3)CCC(F)(F)CC2)CC1 ZINC001254511059 1062150814 /nfs/dbraw/zinc/15/08/14/1062150814.db2.gz UIQITPXQZMKWKI-QGZVFWFLSA-N 2 1 322.443 4.165 20 0 DIADMP CC[NH+]1CCC([NH2+][C@H]2CC(C)(C)CCc3ccccc32)CC1 ZINC001474475369 1062154212 /nfs/dbraw/zinc/15/42/12/1062154212.db2.gz AHYZZAJFOOHIES-IBGZPJMESA-N 2 1 300.490 4.164 20 0 DIADMP C[N@H+]1CCC[C@@H]([NH+](Cc2ccccc2)Cc2ccccc2)CC1 ZINC001254527433 1062160110 /nfs/dbraw/zinc/16/01/10/1062160110.db2.gz YHYJHHHAIIXWLQ-OAQYLSRUSA-N 2 1 308.469 4.173 20 0 DIADMP CCCSC[C@@H](C)[NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC001474483873 1062163879 /nfs/dbraw/zinc/16/38/79/1062163879.db2.gz NGOPRGWPIHBGFZ-MJGOQNOKSA-N 2 1 320.546 4.020 20 0 DIADMP Cc1ccc([C@@H]2CCCC[NH+]2[C@@H]2CCC[N@H+](C)CC2)cc1C ZINC001254532377 1062164636 /nfs/dbraw/zinc/16/46/36/1062164636.db2.gz RXLVNWMLOVBGBS-UXHICEINSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@H+]2[C@@H]2CCC[NH+](C)CC2)cc1C ZINC001254532377 1062164656 /nfs/dbraw/zinc/16/46/56/1062164656.db2.gz RXLVNWMLOVBGBS-UXHICEINSA-N 2 1 300.490 4.315 20 0 DIADMP Cc1ccc([C@@H]2CCCC[N@@H+]2[C@@H]2CCC[NH+](C)CC2)cc1C ZINC001254532377 1062164672 /nfs/dbraw/zinc/16/46/72/1062164672.db2.gz RXLVNWMLOVBGBS-UXHICEINSA-N 2 1 300.490 4.315 20 0 DIADMP CCSc1ccccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001459509517 1062173469 /nfs/dbraw/zinc/17/34/69/1062173469.db2.gz OOARXBLEDOHLKB-QGZVFWFLSA-N 2 1 318.530 4.106 20 0 DIADMP CCSc1ccccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001459509517 1062173481 /nfs/dbraw/zinc/17/34/81/1062173481.db2.gz OOARXBLEDOHLKB-QGZVFWFLSA-N 2 1 318.530 4.106 20 0 DIADMP CCc1cccc(Cl)c1C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC001474503451 1062182827 /nfs/dbraw/zinc/18/28/27/1062182827.db2.gz LVTIMWPUCXRNTP-QGZVFWFLSA-N 2 1 320.908 4.066 20 0 DIADMP C[C@H]1CCCC[C@@H]1C[N@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505047 1062186343 /nfs/dbraw/zinc/18/63/43/1062186343.db2.gz NZBMABCXVFTUMB-AZUAARDMSA-N 2 1 314.517 4.409 20 0 DIADMP C[C@H]1CCCC[C@@H]1C[N@@H+](Cc1ccccc1)C1CC[NH+](C)CC1 ZINC001474505047 1062186351 /nfs/dbraw/zinc/18/63/51/1062186351.db2.gz NZBMABCXVFTUMB-AZUAARDMSA-N 2 1 314.517 4.409 20 0 DIADMP CCC[NH+]1CCC([N@H+](C)Cc2ccccc2SCC)CC1 ZINC001459614851 1062247606 /nfs/dbraw/zinc/24/76/06/1062247606.db2.gz RJXCVSVULVOFBY-UHFFFAOYSA-N 2 1 306.519 4.105 20 0 DIADMP CCC[NH+]1CCC([N@@H+](C)Cc2ccccc2SCC)CC1 ZINC001459614851 1062247630 /nfs/dbraw/zinc/24/76/30/1062247630.db2.gz RJXCVSVULVOFBY-UHFFFAOYSA-N 2 1 306.519 4.105 20 0 DIADMP CC(C)[N@@H+](C)C[C@@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001474561977 1062264998 /nfs/dbraw/zinc/26/49/98/1062264998.db2.gz XVVYIJJQUVHJLE-QHGAOEGBSA-N 2 1 302.506 4.205 20 0 DIADMP CC(C)[N@H+](C)C[C@@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC001474561977 1062265010 /nfs/dbraw/zinc/26/50/10/1062265010.db2.gz XVVYIJJQUVHJLE-QHGAOEGBSA-N 2 1 302.506 4.205 20 0 DIADMP C[N@H+]1CCC[C@H](CC[NH2+][C@H]2CCCC[C@H]2C2CCCCC2)C1 ZINC001474573468 1062283713 /nfs/dbraw/zinc/28/37/13/1062283713.db2.gz ZPXLVVPHCDSWBC-HOJAQTOUSA-N 2 1 306.538 4.447 20 0 DIADMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001459668633 1062288409 /nfs/dbraw/zinc/28/84/09/1062288409.db2.gz LVNKDMUUCKRVEI-QFBILLFUSA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001459668633 1062288431 /nfs/dbraw/zinc/28/84/31/1062288431.db2.gz LVNKDMUUCKRVEI-QFBILLFUSA-N 2 1 302.506 4.146 20 0 DIADMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001459668633 1062288447 /nfs/dbraw/zinc/28/84/47/1062288447.db2.gz LVNKDMUUCKRVEI-QFBILLFUSA-N 2 1 302.506 4.146 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CCCC24CCC4)C3)cc1 ZINC001255134826 1062325653 /nfs/dbraw/zinc/32/56/53/1062325653.db2.gz CZFOBHGPUCRIBJ-BURNTYAHSA-N 2 1 324.512 4.494 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CC4(C2)CCCC4)C3)cc1 ZINC001255139110 1062331076 /nfs/dbraw/zinc/33/10/76/1062331076.db2.gz CXYVOPFLRXRYIC-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP C[C@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001474616303 1062332673 /nfs/dbraw/zinc/33/26/73/1062332673.db2.gz NJOQOKDYMWGONP-OJAHFUOMSA-N 2 1 314.517 4.311 20 0 DIADMP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@@H]4CCC[C@@H]42)C3)cc1 ZINC001255143296 1062340240 /nfs/dbraw/zinc/34/02/40/1062340240.db2.gz JRNUMWFLILLAMT-ITBHCLRTSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH+]2CCC[C@@H]4CCC[C@@H]42)C3)cc1 ZINC001255143296 1062340263 /nfs/dbraw/zinc/34/02/63/1062340263.db2.gz JRNUMWFLILLAMT-ITBHCLRTSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@@H+]2CCC[C@@H]4CCC[C@@H]42)C3)cc1 ZINC001255143296 1062340286 /nfs/dbraw/zinc/34/02/86/1062340286.db2.gz JRNUMWFLILLAMT-ITBHCLRTSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@@H]([N@H+]2CCC[C@@H]4CCC[C@@H]42)C3)cc1 ZINC001255143296 1062340307 /nfs/dbraw/zinc/34/03/07/1062340307.db2.gz JRNUMWFLILLAMT-ITBHCLRTSA-N 2 1 324.512 4.447 20 0 DIADMP c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@H]([NH+]2CCC4(CCC4)C2)C3)cc1 ZINC001255143304 1062341984 /nfs/dbraw/zinc/34/19/84/1062341984.db2.gz JURMOKAJNSGXAX-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001255143304 1062342003 /nfs/dbraw/zinc/34/20/03/1062342003.db2.gz JURMOKAJNSGXAX-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[C@H]([N@H+]2CCC4(CCC4)C2)C3)cc1 ZINC001255143304 1062342027 /nfs/dbraw/zinc/34/20/27/1062342027.db2.gz JURMOKAJNSGXAX-ACDBMABISA-N 2 1 310.485 4.058 20 0 DIADMP C[C@H]1C[N@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150150 1062344117 /nfs/dbraw/zinc/34/41/17/1062344117.db2.gz MFUOHKUPEIKHPS-RSPOEFSDSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@H]1C[N@@H+]([C@@H]2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150150 1062344141 /nfs/dbraw/zinc/34/41/41/1062344141.db2.gz MFUOHKUPEIKHPS-RSPOEFSDSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150150 1062344163 /nfs/dbraw/zinc/34/41/63/1062344163.db2.gz MFUOHKUPEIKHPS-RSPOEFSDSA-N 2 1 310.485 4.056 20 0 DIADMP C[C@H]1C[NH+]([C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C2(CC2)C1 ZINC001255150150 1062344189 /nfs/dbraw/zinc/34/41/89/1062344189.db2.gz MFUOHKUPEIKHPS-RSPOEFSDSA-N 2 1 310.485 4.056 20 0 DIADMP CC[C@]1(C)CC[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001459769540 1062380194 /nfs/dbraw/zinc/38/01/94/1062380194.db2.gz NMMAYPZGHUNJIO-HXUWFJFHSA-N 2 1 300.490 4.295 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001255332369 1062405854 /nfs/dbraw/zinc/40/58/54/1062405854.db2.gz NNOGFZNWTUTWIN-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP CCCC[C@H](C)[NH+]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001255332369 1062405869 /nfs/dbraw/zinc/40/58/69/1062405869.db2.gz NNOGFZNWTUTWIN-YSIASYRMSA-N 2 1 300.490 4.019 20 0 DIADMP CCCC[C@@H](C)[N@@H+](Cc1ccc(F)cc1)C1CCN(C)CC1 ZINC001255334448 1062408825 /nfs/dbraw/zinc/40/88/25/1062408825.db2.gz RDFOHIIJVMKUIA-MRXNPFEDSA-N 2 1 306.469 4.301 20 0 DIADMP C[NH+]1CCC([NH2+][C@@H]2CCC(C)(C)C[C@H]2c2ccccc2)CC1 ZINC001474680842 1062414105 /nfs/dbraw/zinc/41/41/05/1062414105.db2.gz WSCOFFKIPMJUDJ-RBUKOAKNSA-N 2 1 300.490 4.033 20 0 DIADMP CCSc1ccc(C[NH2+]C2CC[NH+](CCC(C)C)CC2)cc1 ZINC001474685211 1062417041 /nfs/dbraw/zinc/41/70/41/1062417041.db2.gz VNPQXJLDWXWHRD-UHFFFAOYSA-N 2 1 320.546 4.399 20 0 DIADMP C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255376134 1062417638 /nfs/dbraw/zinc/41/76/38/1062417638.db2.gz IBJOWMPGCBDDNO-YZGWKJHDSA-N 2 1 300.490 4.209 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255376129 1062417780 /nfs/dbraw/zinc/41/77/80/1062417780.db2.gz IBJOWMPGCBDDNO-HOJAQTOUSA-N 2 1 300.490 4.209 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255375133 1062419622 /nfs/dbraw/zinc/41/96/22/1062419622.db2.gz DCEGGBFSFBKLRQ-OAQYLSRUSA-N 2 1 308.469 4.139 20 0 DIADMP Cc1ccccc1C[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255378394 1062421177 /nfs/dbraw/zinc/42/11/77/1062421177.db2.gz NRCHMALWZDSIPM-NRFANRHFSA-N 2 1 308.469 4.139 20 0 DIADMP C[N@@H+]1CCCC12CC[NH+](CC1CCC(C(C)(C)C)CC1)CC2 ZINC001459818033 1062421402 /nfs/dbraw/zinc/42/14/02/1062421402.db2.gz DFAWSCDSDZGDDF-UHFFFAOYSA-N 2 1 306.538 4.399 20 0 DIADMP C[N@H+]1CCCC12CC[NH+](CC1CCC(C(C)(C)C)CC1)CC2 ZINC001459818033 1062421418 /nfs/dbraw/zinc/42/14/18/1062421418.db2.gz DFAWSCDSDZGDDF-UHFFFAOYSA-N 2 1 306.538 4.399 20 0 DIADMP Cc1csc(C[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255382446 1062421736 /nfs/dbraw/zinc/42/17/36/1062421736.db2.gz UIDOHSBXBGURRT-SFHVURJKSA-N 2 1 314.498 4.201 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255383024 1062422042 /nfs/dbraw/zinc/42/20/42/1062422042.db2.gz YTQFZUOYELWNFD-HOJAQTOUSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@H]3CCc4ccccc43)CC2)cc1 ZINC001255383288 1062422136 /nfs/dbraw/zinc/42/21/36/1062422136.db2.gz HAMWHZPAMDRACT-IRLDBZIGSA-N 2 1 320.480 4.318 20 0 DIADMP Cc1csc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC001255382444 1062422179 /nfs/dbraw/zinc/42/21/79/1062422179.db2.gz UIDOHSBXBGURRT-GOSISDBHSA-N 2 1 314.498 4.201 20 0 DIADMP CC[NH+](CC)CCC[NH2+][C@H](c1ccccc1F)C1CCCC1 ZINC001459816618 1062422431 /nfs/dbraw/zinc/42/24/31/1062422431.db2.gz IFCKFOVHGLVNOU-IBGZPJMESA-N 2 1 306.469 4.379 20 0 DIADMP C=Cc1ccc(C[NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC001255384747 1062423323 /nfs/dbraw/zinc/42/33/23/1062423323.db2.gz BCKJQGGGYKZSTD-JOCHJYFZSA-N 2 1 320.480 4.474 20 0 DIADMP Cc1ccccc1CC[NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255380505 1062423652 /nfs/dbraw/zinc/42/36/52/1062423652.db2.gz KYBYEOKAROUTPI-JOCHJYFZSA-N 2 1 322.496 4.182 20 0 DIADMP C[C@H]([NH2+][C@@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccc(O)c1 ZINC001255383958 1062424654 /nfs/dbraw/zinc/42/46/54/1062424654.db2.gz QJSTVSBOEDIUGD-FXAWDEMLSA-N 2 1 324.468 4.098 20 0 DIADMP C[C@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)C1CCCC1 ZINC001255386838 1062427298 /nfs/dbraw/zinc/42/72/98/1062427298.db2.gz CARKRUOPPRGFOO-PXNSSMCTSA-N 2 1 300.490 4.209 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1cccnc1 ZINC001255394542 1062427925 /nfs/dbraw/zinc/42/79/25/1062427925.db2.gz VUWQYJPSQXGAMP-LEWJYISDSA-N 2 1 323.484 4.177 20 0 DIADMP C[C@@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)C1CCCC1 ZINC001255390502 1062427981 /nfs/dbraw/zinc/42/79/81/1062427981.db2.gz CARKRUOPPRGFOO-XLIONFOSSA-N 2 1 300.490 4.209 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255390491 1062428231 /nfs/dbraw/zinc/42/82/31/1062428231.db2.gz HYZUXCAWIIJEGK-RTBURBONSA-N 2 1 300.490 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH2+][C@H]3CC[C@@H]4CCC[C@@H]43)CC2)cc1 ZINC001255390366 1062428322 /nfs/dbraw/zinc/42/83/22/1062428322.db2.gz BMRFVLRHENTNJW-TUFLPTIASA-N 2 1 312.501 4.209 20 0 DIADMP CC1(C)CCC[C@@H]1[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386764 1062428531 /nfs/dbraw/zinc/42/85/31/1062428531.db2.gz BKEWVWFXNRFHQU-OALUTQOASA-N 2 1 300.490 4.209 20 0 DIADMP FC1(F)CCC[C@H]([NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)C1 ZINC001255394173 1062428566 /nfs/dbraw/zinc/42/85/66/1062428566.db2.gz TUUNTSGERWWIPM-ROUUACIJSA-N 2 1 322.443 4.209 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH2+][C@H]3CC34CCCCC4)CC2)cc1 ZINC001255391967 1062428836 /nfs/dbraw/zinc/42/88/36/1062428836.db2.gz WLSBTHVQYNAQNQ-UXHICEINSA-N 2 1 312.501 4.354 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CCC[N@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393221 1062428953 /nfs/dbraw/zinc/42/89/53/1062428953.db2.gz MMQCMHYOQUMUPL-VQTJNVASSA-N 2 1 323.484 4.177 20 0 DIADMP CC[C@@H]([NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1)c1ccccn1 ZINC001255393221 1062428960 /nfs/dbraw/zinc/42/89/60/1062428960.db2.gz MMQCMHYOQUMUPL-VQTJNVASSA-N 2 1 323.484 4.177 20 0 DIADMP CC(C)CC[C@H](C)[NH2+][C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255386203 1062429019 /nfs/dbraw/zinc/42/90/19/1062429019.db2.gz KYSUKBNKCKLCRT-ICSRJNTNSA-N 2 1 302.506 4.455 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@H]2CCC[N@H+](Cc3ccccc3)CC2)n1 ZINC001255393367 1062429321 /nfs/dbraw/zinc/42/93/21/1062429321.db2.gz NLOFKQYTVWXDEC-ICSRJNTNSA-N 2 1 323.484 4.095 20 0 DIADMP Cc1cccc([C@H](C)[NH2+][C@H]2CCC[N@@H+](Cc3ccccc3)CC2)n1 ZINC001255393367 1062429330 /nfs/dbraw/zinc/42/93/30/1062429330.db2.gz NLOFKQYTVWXDEC-ICSRJNTNSA-N 2 1 323.484 4.095 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255399184 1062435200 /nfs/dbraw/zinc/43/52/00/1062435200.db2.gz OHSGFFKZGUHYKJ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@H](C)[N@@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255399184 1062435210 /nfs/dbraw/zinc/43/52/10/1062435210.db2.gz OHSGFFKZGUHYKJ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255399184 1062435223 /nfs/dbraw/zinc/43/52/23/1062435223.db2.gz OHSGFFKZGUHYKJ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CCC[C@H](C)[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255399184 1062435234 /nfs/dbraw/zinc/43/52/34/1062435234.db2.gz OHSGFFKZGUHYKJ-NSHGMRRFSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1CC[N@H+]([C@@H]2CCC[NH+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC001255403228 1062437600 /nfs/dbraw/zinc/43/76/00/1062437600.db2.gz BQXIEOZUARKHFE-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CCC[N@H+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC001255403228 1062437611 /nfs/dbraw/zinc/43/76/11/1062437611.db2.gz BQXIEOZUARKHFE-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@@H]1CC[NH+]([C@@H]2CCC[N@@H+](Cc3ccccc3)CC2)[C@H](C)C1 ZINC001255403228 1062437627 /nfs/dbraw/zinc/43/76/27/1062437627.db2.gz BQXIEOZUARKHFE-QWFCFKBJSA-N 2 1 300.490 4.162 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@@H]([NH+]3CC[C@H]3c3ccccc3)CC2)cc1 ZINC001255408243 1062438696 /nfs/dbraw/zinc/43/86/96/1062438696.db2.gz IUISIWQDXBJHMV-YADHBBJMSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@@H+]3CC[C@H]3c3ccccc3)CC2)cc1 ZINC001255408243 1062438703 /nfs/dbraw/zinc/43/87/03/1062438703.db2.gz IUISIWQDXBJHMV-YADHBBJMSA-N 2 1 320.480 4.488 20 0 DIADMP c1ccc(C[NH+]2CCC[C@@H]([N@H+]3CC[C@H]3c3ccccc3)CC2)cc1 ZINC001255408243 1062438711 /nfs/dbraw/zinc/43/87/11/1062438711.db2.gz IUISIWQDXBJHMV-YADHBBJMSA-N 2 1 320.480 4.488 20 0 DIADMP CC[C@@H]1CCCC[N@H+]1[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407261 1062439228 /nfs/dbraw/zinc/43/92/28/1062439228.db2.gz YAVQOTCUWUDTRY-UXHICEINSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255407261 1062439241 /nfs/dbraw/zinc/43/92/41/1062439241.db2.gz YAVQOTCUWUDTRY-UXHICEINSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@@H]1CCCC[NH+]1[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255407261 1062439254 /nfs/dbraw/zinc/43/92/54/1062439254.db2.gz YAVQOTCUWUDTRY-UXHICEINSA-N 2 1 300.490 4.306 20 0 DIADMP c1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCC[C@H]4CCC[C@H]43)CC2)cc1 ZINC001255406429 1062439626 /nfs/dbraw/zinc/43/96/26/1062439626.db2.gz SECADTOPSXUCLP-QHAWAJNXSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[N@H+]2CCC[C@H]([NH+]3CCC[C@H]4CCC[C@H]43)CC2)cc1 ZINC001255406429 1062439633 /nfs/dbraw/zinc/43/96/33/1062439633.db2.gz SECADTOPSXUCLP-QHAWAJNXSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@@H+]3CCC[C@H]4CCC[C@H]43)CC2)cc1 ZINC001255406429 1062439646 /nfs/dbraw/zinc/43/96/46/1062439646.db2.gz SECADTOPSXUCLP-QHAWAJNXSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC[C@H]([N@H+]3CCC[C@H]4CCC[C@H]43)CC2)cc1 ZINC001255406429 1062439658 /nfs/dbraw/zinc/43/96/58/1062439658.db2.gz SECADTOPSXUCLP-QHAWAJNXSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1CCCCC[N@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255402657 1062440365 /nfs/dbraw/zinc/44/03/65/1062440365.db2.gz LEGNVBHUQAOBOP-AZUAARDMSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255402657 1062440380 /nfs/dbraw/zinc/44/03/80/1062440380.db2.gz LEGNVBHUQAOBOP-AZUAARDMSA-N 2 1 300.490 4.306 20 0 DIADMP C[C@H]1CCCCC[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255402657 1062440394 /nfs/dbraw/zinc/44/03/94/1062440394.db2.gz LEGNVBHUQAOBOP-AZUAARDMSA-N 2 1 300.490 4.306 20 0 DIADMP C[N@@H+](CC1CC(F)(F)C1)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255406972 1062442452 /nfs/dbraw/zinc/44/24/52/1062442452.db2.gz VEMVWPJQLIFWSH-SFHVURJKSA-N 2 1 322.443 4.018 20 0 DIADMP C[NH+](CC1CC(F)(F)C1)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255406972 1062442457 /nfs/dbraw/zinc/44/24/57/1062442457.db2.gz VEMVWPJQLIFWSH-SFHVURJKSA-N 2 1 322.443 4.018 20 0 DIADMP C[NH+](CC1CC(F)(F)C1)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255406972 1062442468 /nfs/dbraw/zinc/44/24/68/1062442468.db2.gz VEMVWPJQLIFWSH-SFHVURJKSA-N 2 1 322.443 4.018 20 0 DIADMP CC[C@H]1CCCC[N@H+]1[C@@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255407262 1062442674 /nfs/dbraw/zinc/44/26/74/1062442674.db2.gz YAVQOTCUWUDTRY-VQTJNVASSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255407262 1062442685 /nfs/dbraw/zinc/44/26/85/1062442685.db2.gz YAVQOTCUWUDTRY-VQTJNVASSA-N 2 1 300.490 4.306 20 0 DIADMP CC[C@H]1CCCC[NH+]1[C@@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255407262 1062442694 /nfs/dbraw/zinc/44/26/94/1062442694.db2.gz YAVQOTCUWUDTRY-VQTJNVASSA-N 2 1 300.490 4.306 20 0 DIADMP CCC[N@@H+](CC(C)C)[C@H]1CCC[NH+](Cc2ccccc2)CC1 ZINC001255409930 1062444967 /nfs/dbraw/zinc/44/49/67/1062444967.db2.gz NNIPMANREZKEGL-FQEVSTJZSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](CC(C)C)[C@H]1CCC[N@H+](Cc2ccccc2)CC1 ZINC001255409930 1062444986 /nfs/dbraw/zinc/44/49/86/1062444986.db2.gz NNIPMANREZKEGL-FQEVSTJZSA-N 2 1 302.506 4.409 20 0 DIADMP CCC[NH+](CC(C)C)[C@H]1CCC[N@@H+](Cc2ccccc2)CC1 ZINC001255409930 1062444993 /nfs/dbraw/zinc/44/49/93/1062444993.db2.gz NNIPMANREZKEGL-FQEVSTJZSA-N 2 1 302.506 4.409 20 0 DIADMP Cc1cccnc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC001474747388 1062462535 /nfs/dbraw/zinc/46/25/35/1062462535.db2.gz BQMQKTDZVOKMOT-VDZJLULYSA-N 2 1 315.505 4.084 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2C[C@@]34C[N@H+](C)C[C@]3(C2)CCCC4)C1 ZINC001474757002 1062465823 /nfs/dbraw/zinc/46/58/23/1062465823.db2.gz GSTYXQXXCZBXBW-WCIQWLHISA-N 2 1 304.522 4.011 20 0 DIADMP CC[C@@H]1CCC[C@H](C[NH+]2C[C@@]34C[N@@H+](C)C[C@]3(C2)CCCC4)C1 ZINC001474757002 1062465837 /nfs/dbraw/zinc/46/58/37/1062465837.db2.gz GSTYXQXXCZBXBW-WCIQWLHISA-N 2 1 304.522 4.011 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1Cl ZINC001255668163 1062506215 /nfs/dbraw/zinc/50/62/15/1062506215.db2.gz FTGBRGIFWRJVSZ-LNRIEFBSSA-N 2 1 306.881 4.314 20 0 DIADMP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1Cl ZINC001255668163 1062506239 /nfs/dbraw/zinc/50/62/39/1062506239.db2.gz FTGBRGIFWRJVSZ-LNRIEFBSSA-N 2 1 306.881 4.314 20 0 DIADMP CCCC[N@H+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255680199 1062509303 /nfs/dbraw/zinc/50/93/03/1062509303.db2.gz JQWMLOMBSKVXAU-YOFSQIOKSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[N@@H+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001255680199 1062509320 /nfs/dbraw/zinc/50/93/20/1062509320.db2.gz JQWMLOMBSKVXAU-YOFSQIOKSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001255680199 1062509336 /nfs/dbraw/zinc/50/93/36/1062509336.db2.gz JQWMLOMBSKVXAU-YOFSQIOKSA-N 2 1 300.490 4.304 20 0 DIADMP CCCC[NH+](Cc1ccccc1)C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001255680199 1062509353 /nfs/dbraw/zinc/50/93/53/1062509353.db2.gz JQWMLOMBSKVXAU-YOFSQIOKSA-N 2 1 300.490 4.304 20 0 DIADMP CCC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1F ZINC001255670103 1062510779 /nfs/dbraw/zinc/51/07/79/1062510779.db2.gz OROMZSNEXHWZRT-IHBAFOEMSA-N 2 1 304.453 4.272 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(C)ccc1C ZINC001255677485 1062511085 /nfs/dbraw/zinc/51/10/85/1062511085.db2.gz VQKABOZXUPHRNZ-AQDPXUSMSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(C)ccc1C ZINC001255677485 1062511107 /nfs/dbraw/zinc/51/11/07/1062511107.db2.gz VQKABOZXUPHRNZ-AQDPXUSMSA-N 2 1 300.490 4.359 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1cc(F)cc(F)c1 ZINC001255672515 1062511787 /nfs/dbraw/zinc/51/17/87/1062511787.db2.gz IBYJJOAPXPIOEU-HQSKLWIPSA-N 2 1 308.416 4.021 20 0 DIADMP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1cc(F)cc(F)c1 ZINC001255672515 1062511808 /nfs/dbraw/zinc/51/18/08/1062511808.db2.gz IBYJJOAPXPIOEU-HQSKLWIPSA-N 2 1 308.416 4.021 20 0 DIADMP CCCn1ccnc1CCC[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001459946684 1062514578 /nfs/dbraw/zinc/51/45/78/1062514578.db2.gz XDHAAOMOJWWBOD-UHFFFAOYSA-N 2 1 303.494 4.128 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@H+](C)CC1CCC2(CC2)CC1 ZINC001459946684 1062514600 /nfs/dbraw/zinc/51/46/00/1062514600.db2.gz XDHAAOMOJWWBOD-UHFFFAOYSA-N 2 1 303.494 4.128 20 0 DIADMP CCCn1cc[nH+]c1CCC[N@@H+](C)CC1CCC2(CC2)CC1 ZINC001459946684 1062514619 /nfs/dbraw/zinc/51/46/19/1062514619.db2.gz XDHAAOMOJWWBOD-UHFFFAOYSA-N 2 1 303.494 4.128 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CC2)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC001255702084 1062530468 /nfs/dbraw/zinc/53/04/68/1062530468.db2.gz XEZLCHRFMMDGQC-KLHDSHLOSA-N 2 1 318.427 4.089 20 0 DIADMP C[C@H](CSc1ccc(F)cc1)[NH2+]CCC[N@H+]1CCCC[C@H]1C ZINC001255727853 1062547714 /nfs/dbraw/zinc/54/77/14/1062547714.db2.gz IFRBEKVDQYYIAO-HZPDHXFCSA-N 2 1 324.509 4.160 20 0 DIADMP CCOCCC[N@H+]1CC[C@@H]([NH2+]CCC2CCCCCC2)[C@@H](C)C1 ZINC001459989648 1062549905 /nfs/dbraw/zinc/54/99/05/1062549905.db2.gz WFINOYKCQPLSCH-AZUAARDMSA-N 2 1 324.553 4.074 20 0 DIADMP CC(C)[N@@H+]([C@@H](C)CSc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001255733251 1062557854 /nfs/dbraw/zinc/55/78/54/1062557854.db2.gz KBXUAXMSLSPCEL-XIRDDKMYSA-N 2 1 324.509 4.287 20 0 DIADMP CC(C)[N@H+]1CC[C@@H]([NH2+][C@H](C)CSc2ccc(F)cc2)[C@@H](C)C1 ZINC001255737449 1062560246 /nfs/dbraw/zinc/56/02/46/1062560246.db2.gz ICQVTYMHUZDDGX-HDMKZQKVSA-N 2 1 324.509 4.015 20 0 DIADMP Cc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001255772786 1062596153 /nfs/dbraw/zinc/59/61/53/1062596153.db2.gz KIMRKBCUHGUEJH-KNQAVFIVSA-N 2 1 322.496 4.038 20 0 DIADMP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001255772788 1062597873 /nfs/dbraw/zinc/59/78/73/1062597873.db2.gz KIMRKBCUHGUEJH-UGKGYDQZSA-N 2 1 322.496 4.038 20 0 DIADMP c1ccc(C[NH+]2C[C@H]3C[N@@H+](CC4CCCCCC4)C[C@H]3C2)cc1 ZINC001460048259 1062600450 /nfs/dbraw/zinc/60/04/50/1062600450.db2.gz STJHFZGGDWRMNS-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@@H+]2C[C@H]3C[NH+](CC4CCCCCC4)C[C@H]3C2)cc1 ZINC001460048259 1062600468 /nfs/dbraw/zinc/60/04/68/1062600468.db2.gz STJHFZGGDWRMNS-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP c1ccc(C[N@H+]2C[C@H]3C[NH+](CC4CCCCCC4)C[C@H]3C2)cc1 ZINC001460048259 1062600481 /nfs/dbraw/zinc/60/04/81/1062600481.db2.gz STJHFZGGDWRMNS-OYRHEFFESA-N 2 1 312.501 4.021 20 0 DIADMP Cc1ccc(C[C@H](C)[N@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)cc1 ZINC001255793141 1062607745 /nfs/dbraw/zinc/60/77/45/1062607745.db2.gz AYQVIEZCAPUZFC-SESVDKBCSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@H](C)[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001255793141 1062607756 /nfs/dbraw/zinc/60/77/56/1062607756.db2.gz AYQVIEZCAPUZFC-SESVDKBCSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@H](C)[NH+]2CCCC[C@@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001255793141 1062607767 /nfs/dbraw/zinc/60/77/67/1062607767.db2.gz AYQVIEZCAPUZFC-SESVDKBCSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@H](C)[N@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)cc1 ZINC001255793139 1062610234 /nfs/dbraw/zinc/61/02/34/1062610234.db2.gz AYQVIEZCAPUZFC-JBACZVJFSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@H](C)[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@@H+]2C)cc1 ZINC001255793139 1062610247 /nfs/dbraw/zinc/61/02/47/1062610247.db2.gz AYQVIEZCAPUZFC-JBACZVJFSA-N 2 1 314.517 4.265 20 0 DIADMP Cc1ccc(C[C@H](C)[NH+]2CCCC[C@H]2C[C@@H]2CCC[N@H+]2C)cc1 ZINC001255793139 1062610257 /nfs/dbraw/zinc/61/02/57/1062610257.db2.gz AYQVIEZCAPUZFC-JBACZVJFSA-N 2 1 314.517 4.265 20 0 DIADMP C[C@@H](Cc1ccccc1F)[NH2+][C@@H](CC[NH+](C)C)c1ccccc1 ZINC001255830699 1062616079 /nfs/dbraw/zinc/61/60/79/1062616079.db2.gz RNWYJYWJDTYFDB-JXFKEZNVSA-N 2 1 314.448 4.039 20 0 DIADMP C[C@@H](Cc1ccccc1F)[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001255851464 1062631233 /nfs/dbraw/zinc/63/12/33/1062631233.db2.gz OYLMPLXLZZREKL-HKUYNNGSSA-N 2 1 318.480 4.097 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC001255946393 1062665599 /nfs/dbraw/zinc/66/55/99/1062665599.db2.gz ULBVAEQJLGFFLK-INIZCTEOSA-N 2 1 308.469 4.466 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)c(F)c1 ZINC001255945736 1062666129 /nfs/dbraw/zinc/66/61/29/1062666129.db2.gz NAIPWGXQYWRYKL-QWHCGFSZSA-N 2 1 300.849 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1ccc(F)c(C(F)(F)F)c1 ZINC001255943934 1062666553 /nfs/dbraw/zinc/66/65/53/1062666553.db2.gz RDOILEASJFTBIJ-LBPRGKRZSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cnc(-c2ccccc2)s1 ZINC001255944802 1062666600 /nfs/dbraw/zinc/66/66/00/1062666600.db2.gz ZKZOTTFRIUXRRR-HNNXBMFYSA-N 2 1 317.502 4.020 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC001255946536 1062666838 /nfs/dbraw/zinc/66/68/38/1062666838.db2.gz WFGWVQWWSFGZKC-QWHCGFSZSA-N 2 1 300.849 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+][C@@H](CC1CC1)c1ccccc1F ZINC001255952654 1062668702 /nfs/dbraw/zinc/66/87/02/1062668702.db2.gz GGNPNTBBGXCYHX-KXBFYZLASA-N 2 1 306.469 4.377 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(F)ccc1C(F)(F)F ZINC001255947942 1062670224 /nfs/dbraw/zinc/67/02/24/1062670224.db2.gz ZKSPIPTXPYAZJS-LBPRGKRZSA-N 2 1 320.374 4.055 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001255963697 1062673768 /nfs/dbraw/zinc/67/37/68/1062673768.db2.gz JQOZVOHWMCPUDH-CVEARBPZSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@@H](C)[N@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001255963697 1062673782 /nfs/dbraw/zinc/67/37/82/1062673782.db2.gz JQOZVOHWMCPUDH-CVEARBPZSA-N 2 1 308.897 4.250 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH+]1CCC(c2ccc(F)cc2F)CC1 ZINC001255968520 1062674592 /nfs/dbraw/zinc/67/45/92/1062674592.db2.gz AHURJNKHGDRTGR-HNNXBMFYSA-N 2 1 324.459 4.265 20 0 DIADMP CC(C)CC1([NH2+]C2CC[NH+](C3CC3)CC2)CCC(F)(F)CC1 ZINC001256072500 1062694276 /nfs/dbraw/zinc/69/42/76/1062694276.db2.gz POBANLYSNCOALE-UHFFFAOYSA-N 2 1 314.464 4.197 20 0 DIADMP CC(C)C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1ccccc1F ZINC001256069639 1062695154 /nfs/dbraw/zinc/69/51/54/1062695154.db2.gz KHMXKNLANZJXMP-IBGZPJMESA-N 2 1 304.453 4.129 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@@H+]1C1CC[NH+](C2CC2)CC1 ZINC001256080826 1062697789 /nfs/dbraw/zinc/69/77/89/1062697789.db2.gz DAFUNEDZGZQJHY-GOSISDBHSA-N 2 1 316.514 4.172 20 0 DIADMP CSc1ccccc1[C@H]1CCC[N@H+]1C1CC[NH+](C2CC2)CC1 ZINC001256080826 1062697798 /nfs/dbraw/zinc/69/77/98/1062697798.db2.gz DAFUNEDZGZQJHY-GOSISDBHSA-N 2 1 316.514 4.172 20 0 DIADMP C[C@@H](c1ccccc1)[N@@H+](Cc1ccccc1)C1CCN(C)CC1 ZINC001256204581 1062745005 /nfs/dbraw/zinc/74/50/05/1062745005.db2.gz TVJPINGMKOJQLK-SFHVURJKSA-N 2 1 308.469 4.344 20 0 DIADMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(C(F)(F)F)c(Cl)c1 ZINC001256201558 1062746395 /nfs/dbraw/zinc/74/63/95/1062746395.db2.gz HIXPZDAYLILJEV-SNVBAGLBSA-N 2 1 320.786 4.104 20 0 DIADMP C[C@]1(Cc2cccc(F)c2)CCC[N@H+]1CCC[NH+]1CCCCC1 ZINC001460274474 1062750756 /nfs/dbraw/zinc/75/07/56/1062750756.db2.gz DZPSLLPOKIRJFF-HXUWFJFHSA-N 2 1 318.480 4.099 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001256519707 1062843413 /nfs/dbraw/zinc/84/34/13/1062843413.db2.gz CJONQGWOGAIFFP-PKOBYXMFSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@H]1C[C@H]([NH2+]C2(C)CCCCC2)CC[N@H+]1Cc1ccccc1 ZINC001256519707 1062843431 /nfs/dbraw/zinc/84/34/31/1062843431.db2.gz CJONQGWOGAIFFP-PKOBYXMFSA-N 2 1 300.490 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@@H+]1Cc1ccccc1 ZINC001256528330 1062846917 /nfs/dbraw/zinc/84/69/17/1062846917.db2.gz ZUMIMXSORHXOEW-GVVDHYSOSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)CC[N@H+]1Cc1ccccc1 ZINC001256528330 1062846942 /nfs/dbraw/zinc/84/69/42/1062846942.db2.gz ZUMIMXSORHXOEW-GVVDHYSOSA-N 2 1 312.501 4.208 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC23CCCCC3)CC[N@@H+]1Cc1ccccc1 ZINC001256529476 1062854465 /nfs/dbraw/zinc/85/44/65/1062854465.db2.gz TVSLXEURTJDKPT-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1C[C@@H]([NH2+][C@@H]2CC23CCCCC3)CC[N@H+]1Cc1ccccc1 ZINC001256529476 1062854486 /nfs/dbraw/zinc/85/44/86/1062854486.db2.gz TVSLXEURTJDKPT-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1cccc(C[NH+](C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538667 1062861806 /nfs/dbraw/zinc/86/18/06/1062861806.db2.gz UZQKEQNVACIMAO-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[NH+](C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538667 1062861827 /nfs/dbraw/zinc/86/18/27/1062861827.db2.gz UZQKEQNVACIMAO-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538667 1062861848 /nfs/dbraw/zinc/86/18/48/1062861848.db2.gz UZQKEQNVACIMAO-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1cccc(C[N@H+](C)[C@H]2CC[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001256538667 1062861868 /nfs/dbraw/zinc/86/18/68/1062861868.db2.gz UZQKEQNVACIMAO-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC3(CCCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256550761 1062867595 /nfs/dbraw/zinc/86/75/95/1062867595.db2.gz NPTUYUPDWOPAOE-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCC3(CCCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256550761 1062867610 /nfs/dbraw/zinc/86/76/10/1062867610.db2.gz NPTUYUPDWOPAOE-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550761 1062867628 /nfs/dbraw/zinc/86/76/28/1062867628.db2.gz NPTUYUPDWOPAOE-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCC3(CCCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256550761 1062867644 /nfs/dbraw/zinc/86/76/44/1062867644.db2.gz NPTUYUPDWOPAOE-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCCC[C@H]2C)CC[N@@H+]1Cc1ccccc1 ZINC001256548163 1062868879 /nfs/dbraw/zinc/86/88/79/1062868879.db2.gz AMRLEMRIKFDNLZ-QWFCFKBJSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([NH+]2CCCCC[C@H]2C)CC[N@H+]1Cc1ccccc1 ZINC001256548163 1062868895 /nfs/dbraw/zinc/86/88/95/1062868895.db2.gz AMRLEMRIKFDNLZ-QWFCFKBJSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([N@@H+]2CCCCC[C@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548163 1062868919 /nfs/dbraw/zinc/86/89/19/1062868919.db2.gz AMRLEMRIKFDNLZ-QWFCFKBJSA-N 2 1 300.490 4.304 20 0 DIADMP C[C@@H]1C[C@H]([N@H+]2CCCCC[C@H]2C)CC[NH+]1Cc1ccccc1 ZINC001256548163 1062868944 /nfs/dbraw/zinc/86/89/44/1062868944.db2.gz AMRLEMRIKFDNLZ-QWFCFKBJSA-N 2 1 300.490 4.304 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256548947 1062869374 /nfs/dbraw/zinc/86/93/74/1062869374.db2.gz CSUAKBICHMBMCY-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[NH+](C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001256548947 1062869401 /nfs/dbraw/zinc/86/94/01/1062869401.db2.gz CSUAKBICHMBMCY-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256548947 1062869427 /nfs/dbraw/zinc/86/94/27/1062869427.db2.gz CSUAKBICHMBMCY-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP Cc1ccccc1C[N@H+](C)[C@H]1CC[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001256548947 1062869452 /nfs/dbraw/zinc/86/94/52/1062869452.db2.gz CSUAKBICHMBMCY-KNQAVFIVSA-N 2 1 322.496 4.480 20 0 DIADMP CC(C)[C@@H]1CCC[N@@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552489 1062879684 /nfs/dbraw/zinc/87/96/84/1062879684.db2.gz BECPXIWIMKIQMP-SXLOBPIMSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[N@H+]1[C@@H]1CC[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552489 1062879703 /nfs/dbraw/zinc/87/97/03/1062879703.db2.gz BECPXIWIMKIQMP-SXLOBPIMSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552489 1062879716 /nfs/dbraw/zinc/87/97/16/1062879716.db2.gz BECPXIWIMKIQMP-SXLOBPIMSA-N 2 1 300.490 4.160 20 0 DIADMP CC(C)[C@@H]1CCC[NH+]1[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001256552489 1062879731 /nfs/dbraw/zinc/87/97/31/1062879731.db2.gz BECPXIWIMKIQMP-SXLOBPIMSA-N 2 1 300.490 4.160 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001256557397 1062883503 /nfs/dbraw/zinc/88/35/03/1062883503.db2.gz IVQSMSCRENJNHO-VMXMFDLUSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@H]1C[C@@H]([NH+]2C[C@@H]3CCCC[C@H]3C2)CC[N@H+]1Cc1ccccc1 ZINC001256557397 1062883524 /nfs/dbraw/zinc/88/35/24/1062883524.db2.gz IVQSMSCRENJNHO-VMXMFDLUSA-N 2 1 312.501 4.162 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@H]2c2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001256555723 1062883710 /nfs/dbraw/zinc/88/37/10/1062883710.db2.gz WACMRBGVTQTDNZ-COPCDDAFSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@@H]([NH+]2CC[C@H]2c2ccccc2)CC[N@H+]1Cc1ccccc1 ZINC001256555723 1062883730 /nfs/dbraw/zinc/88/37/30/1062883730.db2.gz WACMRBGVTQTDNZ-COPCDDAFSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@@H]([N@@H+]2CC[C@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555723 1062883754 /nfs/dbraw/zinc/88/37/54/1062883754.db2.gz WACMRBGVTQTDNZ-COPCDDAFSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@@H]1C[C@@H]([N@H+]2CC[C@H]2c2ccccc2)CC[NH+]1Cc1ccccc1 ZINC001256555723 1062883775 /nfs/dbraw/zinc/88/37/75/1062883775.db2.gz WACMRBGVTQTDNZ-COPCDDAFSA-N 2 1 320.480 4.487 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCC3(CCC3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001256559260 1062884279 /nfs/dbraw/zinc/88/42/79/1062884279.db2.gz KCYRFVIECUPHQN-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([NH+]2CCCC3(CCC3)C2)CC[N@H+]1Cc1ccccc1 ZINC001256559260 1062884297 /nfs/dbraw/zinc/88/42/97/1062884297.db2.gz KCYRFVIECUPHQN-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([N@@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559260 1062884312 /nfs/dbraw/zinc/88/43/12/1062884312.db2.gz KCYRFVIECUPHQN-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP C[C@H]1C[C@H]([N@H+]2CCCC3(CCC3)C2)CC[NH+]1Cc1ccccc1 ZINC001256559260 1062884335 /nfs/dbraw/zinc/88/43/35/1062884335.db2.gz KCYRFVIECUPHQN-AZUAARDMSA-N 2 1 312.501 4.306 20 0 DIADMP CC(C)(C)[NH+]1CCC([NH+]2CCC(c3cccs3)CC2)CC1 ZINC001256571027 1062896326 /nfs/dbraw/zinc/89/63/26/1062896326.db2.gz AGBBMCMRMXMEPF-UHFFFAOYSA-N 2 1 306.519 4.190 20 0 DIADMP CC[N@@H+](Cc1ccc(C)c(C)c1)C1CC[NH+](C(C)(C)C)CC1 ZINC001256576268 1062898664 /nfs/dbraw/zinc/89/86/64/1062898664.db2.gz DDCKECWBESUFSV-UHFFFAOYSA-N 2 1 302.506 4.388 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1C1CC[NH+](C(C)(C)C)CC1 ZINC001256575529 1062899237 /nfs/dbraw/zinc/89/92/37/1062899237.db2.gz POWWPFAAIFZHKK-LJQANCHMSA-N 2 1 300.490 4.259 20 0 DIADMP CC(C)(C)[NH+]1CCC([N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 ZINC001256575223 1062900605 /nfs/dbraw/zinc/90/06/05/1062900605.db2.gz IZRKZGJMNSRUNX-MRXNPFEDSA-N 2 1 320.908 4.392 20 0 DIADMP Cc1cccc(C(C)(C)[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001256600345 1062910982 /nfs/dbraw/zinc/91/09/82/1062910982.db2.gz CPBFXZQZWDGAQN-UHFFFAOYSA-N 2 1 322.496 4.484 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CC[C@@H](c4ccccc4)C3)CC2)cc1 ZINC001256604041 1062916194 /nfs/dbraw/zinc/91/61/94/1062916194.db2.gz MCMFLFSVULGEGH-OAQYLSRUSA-N 2 1 320.480 4.141 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CC[C@@H](c4ccccc4)C3)CC2)cc1 ZINC001256604041 1062916218 /nfs/dbraw/zinc/91/62/18/1062916218.db2.gz MCMFLFSVULGEGH-OAQYLSRUSA-N 2 1 320.480 4.141 20 0 DIADMP c1ccc(C[NH+]2CCC([N@@H+]3CCC[C@@H]4CCCC[C@@H]43)CC2)cc1 ZINC001256611710 1062917203 /nfs/dbraw/zinc/91/72/03/1062917203.db2.gz ULYGJOXMERUVQB-FPOVZHCZSA-N 2 1 312.501 4.306 20 0 DIADMP c1ccc(C[NH+]2CCC([N@H+]3CCC[C@@H]4CCCC[C@@H]43)CC2)cc1 ZINC001256611710 1062917225 /nfs/dbraw/zinc/91/72/25/1062917225.db2.gz ULYGJOXMERUVQB-FPOVZHCZSA-N 2 1 312.501 4.306 20 0 DIADMP CC(C)C[N@H+](Cc1ccccc1C1CC1)CC1CC[NH+](C)CC1 ZINC001460670411 1062975380 /nfs/dbraw/zinc/97/53/80/1062975380.db2.gz IRMBSIVXQJLRGF-UHFFFAOYSA-N 2 1 314.517 4.364 20 0 DIADMP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cc2ccccc2o1 ZINC001460688292 1062986116 /nfs/dbraw/zinc/98/61/16/1062986116.db2.gz GOLHSPBKSVWKDW-UHFFFAOYSA-N 2 1 300.446 4.131 20 0 DIADMP Cc1ccccc1CCC[N@@H+](C)CCCC[NH+]1CCCCC1 ZINC001460689487 1062986342 /nfs/dbraw/zinc/98/63/42/1062986342.db2.gz IVOFBDSNYUEVJE-UHFFFAOYSA-N 2 1 302.506 4.126 20 0 DIADMP C[C@@H]1C[N@@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C(C)(C)C1 ZINC001460711474 1063006189 /nfs/dbraw/zinc/00/61/89/1063006189.db2.gz VLJGPHMAACYINX-KRWDZBQOSA-N 2 1 300.490 4.293 20 0 DIADMP Cc1cccc([C@@H]2CCC[N@H+]2C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC001256855149 1063018743 /nfs/dbraw/zinc/01/87/43/1063018743.db2.gz FWUPVKBFRQXXKC-NRFANRHFSA-N 2 1 321.468 4.196 20 0 DIADMP CC[C@@H]1c2ccccc2CC[N@H+]1C1CCN(c2cc[nH+]cc2)CC1 ZINC001256861829 1063019438 /nfs/dbraw/zinc/01/94/38/1063019438.db2.gz COTKYFWRBBLQKT-OAQYLSRUSA-N 2 1 321.468 4.060 20 0 DIADMP c1ccc(C[N@@H+](C2CCC2)C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC001256864931 1063024073 /nfs/dbraw/zinc/02/40/73/1063024073.db2.gz MXRUPDIJNCQEGZ-UHFFFAOYSA-N 2 1 321.468 4.105 20 0 DIADMP C[C@H]([NH3+])c1ccc2c(ccn2[C@@H]2CCC[N@H+](C3CCCC3)C2)c1 ZINC001256894852 1063031914 /nfs/dbraw/zinc/03/19/14/1063031914.db2.gz NFQBCPQBLUVWCA-HNAYVOBHSA-N 2 1 311.473 4.241 20 0 DIADMP CCC1([NH+]2CCC2)CC[NH+]([C@@H](C)c2ccc3c(c2)CCC3)CC1 ZINC001460795310 1063062927 /nfs/dbraw/zinc/06/29/27/1063062927.db2.gz OZFUAFFJONHZEO-KRWDZBQOSA-N 2 1 312.501 4.187 20 0 DIADMP CCCCc1ccc(C[NH+]2CCC3(CC[N@@H+](C)C3)CC2)s1 ZINC001278988917 1063101196 /nfs/dbraw/zinc/10/11/96/1063101196.db2.gz IPDIFXXJONCWCS-UHFFFAOYSA-N 2 1 306.519 4.008 20 0 DIADMP CC(C)[NH+]1CCC([N@H+](Cc2ccccn2)C2CCCCC2)CC1 ZINC001257222079 1063146849 /nfs/dbraw/zinc/14/68/49/1063146849.db2.gz RZYSNUCATJJPQC-UHFFFAOYSA-N 2 1 315.505 4.089 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+](Cc2ccccn2)C2CCCCC2)CC1 ZINC001257222079 1063146854 /nfs/dbraw/zinc/14/68/54/1063146854.db2.gz RZYSNUCATJJPQC-UHFFFAOYSA-N 2 1 315.505 4.089 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001257220457 1063147445 /nfs/dbraw/zinc/14/74/45/1063147445.db2.gz QATWLFKNCVOKPW-GOSISDBHSA-N 2 1 306.881 4.350 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H]2c2ccccc2Cl)CC1 ZINC001257220457 1063147461 /nfs/dbraw/zinc/14/74/61/1063147461.db2.gz QATWLFKNCVOKPW-GOSISDBHSA-N 2 1 306.881 4.350 20 0 DIADMP CC(C)[NH+]1CCC([N@@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001257223854 1063148464 /nfs/dbraw/zinc/14/84/64/1063148464.db2.gz FTUXIFGBNPCSAY-SFHVURJKSA-N 2 1 306.881 4.350 20 0 DIADMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001257223854 1063148477 /nfs/dbraw/zinc/14/84/77/1063148477.db2.gz FTUXIFGBNPCSAY-SFHVURJKSA-N 2 1 306.881 4.350 20 0 DIADMP CCC[C@@H](CC)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001257253512 1063159188 /nfs/dbraw/zinc/15/91/88/1063159188.db2.gz PKUDGURKLXCWAH-GUDVDZBRSA-N 2 1 306.469 4.476 20 0 DIADMP CC(C)Cc1ncc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)s1 ZINC001460990803 1063168322 /nfs/dbraw/zinc/16/83/22/1063168322.db2.gz XYRRTFLTERYCGE-UHFFFAOYSA-N 2 1 323.550 4.086 20 0 DIADMP CC(C)Cc1ncc(C[NH2+]CCC[N@H+](C)C2CCCCC2)s1 ZINC001460990803 1063168308 /nfs/dbraw/zinc/16/83/08/1063168308.db2.gz XYRRTFLTERYCGE-UHFFFAOYSA-N 2 1 323.550 4.086 20 0 DIADMP CCC[C@@H](CC)[N@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001257264630 1063170352 /nfs/dbraw/zinc/17/03/52/1063170352.db2.gz PLJSQKFVANYKKV-WOJBJXKFSA-N 2 1 300.490 4.163 20 0 DIADMP CCC[NH+](CCC)CCC[NH2+]Cc1ccc(F)c(Cl)c1 ZINC001460994331 1063172623 /nfs/dbraw/zinc/17/26/23/1063172623.db2.gz SLGUEZQJSZVXLF-UHFFFAOYSA-N 2 1 300.849 4.081 20 0 DIADMP CCC[C@H](C)[NH+]1CCC2(CC[C@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001257321293 1063203489 /nfs/dbraw/zinc/20/34/89/1063203489.db2.gz ZWTXVJVGHBROJY-FUHWJXTLSA-N 2 1 304.478 4.145 20 0 DIADMP CCC[C@H](C)[NH+]1CCC2(CC[N@@H+](Cc3cccs3)C2)CC1 ZINC001257319591 1063204365 /nfs/dbraw/zinc/20/43/65/1063204365.db2.gz QHZSIRYJRNDSPG-INIZCTEOSA-N 2 1 306.519 4.225 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035749 1063204800 /nfs/dbraw/zinc/20/48/00/1063204800.db2.gz CVLPZEFKQSSLSP-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035749 1063204822 /nfs/dbraw/zinc/20/48/22/1063204822.db2.gz CVLPZEFKQSSLSP-RLLQIKCJSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035752 1063206149 /nfs/dbraw/zinc/20/61/49/1063206149.db2.gz CVLPZEFKQSSLSP-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)C1 ZINC001461035752 1063206171 /nfs/dbraw/zinc/20/61/71/1063206171.db2.gz CVLPZEFKQSSLSP-YZGWKJHDSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c(F)c1 ZINC001461046988 1063211570 /nfs/dbraw/zinc/21/15/70/1063211570.db2.gz CJPUSXWRFPYDET-UHFFFAOYSA-N 2 1 314.448 4.264 20 0 DIADMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]CC(C)(C)c1ccccc1 ZINC001461049528 1063214106 /nfs/dbraw/zinc/21/41/06/1063214106.db2.gz FLPVXKVNQRXTAE-GOSISDBHSA-N 2 1 302.506 4.208 20 0 DIADMP CCCC(CCC)[N@H+]1CC[C@@H]2[C@@H](CCN2Cc2nccs2)C1 ZINC001257337151 1063216641 /nfs/dbraw/zinc/21/66/41/1063216641.db2.gz RYHNAZBNQFEPNW-DOTOQJQBSA-N 2 1 321.534 4.008 20 0 DIADMP CCCCCC[C@H](C)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001257374021 1063241516 /nfs/dbraw/zinc/24/15/16/1063241516.db2.gz YFJVZEXCEBIPQC-KRWDZBQOSA-N 2 1 303.494 4.307 20 0 DIADMP CCc1cccc(C[NH2+]Cc2ccc(-n3cc[nH+]c3C)c(F)c2)c1 ZINC001461097144 1063251080 /nfs/dbraw/zinc/25/10/80/1063251080.db2.gz CJYHAAOXGBCOCN-UHFFFAOYSA-N 2 1 323.415 4.172 20 0 DIADMP CCC(C)(C)C1CCC([N@H+]2CCC3(C2)CC[NH+](C)CC3)CC1 ZINC001257408097 1063258060 /nfs/dbraw/zinc/25/80/60/1063258060.db2.gz YUKAUWPBCQKNLM-UHFFFAOYSA-N 2 1 306.538 4.399 20 0 DIADMP CCCC[C@@H](CC)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001257415998 1063265974 /nfs/dbraw/zinc/26/59/74/1063265974.db2.gz ZYVJHXNXIUJZSB-LJQANCHMSA-N 2 1 302.506 4.252 20 0 DIADMP CCCC[C@@H](CC)[N@@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001257424080 1063267399 /nfs/dbraw/zinc/26/73/99/1063267399.db2.gz AFRDFXGDMIXQMP-WOJBJXKFSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@@H](CC)[NH+](C)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001257424080 1063267413 /nfs/dbraw/zinc/26/74/13/1063267413.db2.gz AFRDFXGDMIXQMP-WOJBJXKFSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@@H](CC)[NH+](C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001257424080 1063267430 /nfs/dbraw/zinc/26/74/30/1063267430.db2.gz AFRDFXGDMIXQMP-WOJBJXKFSA-N 2 1 302.506 4.409 20 0 DIADMP CCCC[C@H](CC)[N@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257421176 1063269114 /nfs/dbraw/zinc/26/91/14/1063269114.db2.gz UGXLEYWSQJMNCW-BBWFWOEESA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[C@H](CC)[N@@H+]1C[C@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257421176 1063269136 /nfs/dbraw/zinc/26/91/36/1063269136.db2.gz UGXLEYWSQJMNCW-BBWFWOEESA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[C@H](CC)[NH+]1C[C@H]2C[N@@H+](Cc3cccs3)C[C@H]2C1 ZINC001257421176 1063269160 /nfs/dbraw/zinc/26/91/60/1063269160.db2.gz UGXLEYWSQJMNCW-BBWFWOEESA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[C@H](CC)[NH+]1C[C@H]2C[N@H+](Cc3cccs3)C[C@H]2C1 ZINC001257421176 1063269179 /nfs/dbraw/zinc/26/91/79/1063269179.db2.gz UGXLEYWSQJMNCW-BBWFWOEESA-N 2 1 306.519 4.081 20 0 DIADMP CCCC[C@H](CC)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001257425472 1063272178 /nfs/dbraw/zinc/27/21/78/1063272178.db2.gz RVLZZNSXIGMSMH-FQEVSTJZSA-N 2 1 314.517 4.478 20 0 DIADMP CCCC[C@H](CC)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001257425472 1063272195 /nfs/dbraw/zinc/27/21/95/1063272195.db2.gz RVLZZNSXIGMSMH-FQEVSTJZSA-N 2 1 314.517 4.478 20 0 DIADMP CCCC[C@@H](CC)[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001257425473 1063272582 /nfs/dbraw/zinc/27/25/82/1063272582.db2.gz RVLZZNSXIGMSMH-HXUWFJFHSA-N 2 1 314.517 4.478 20 0 DIADMP CCCC[C@@H](CC)[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001257425473 1063272605 /nfs/dbraw/zinc/27/26/05/1063272605.db2.gz RVLZZNSXIGMSMH-HXUWFJFHSA-N 2 1 314.517 4.478 20 0 DIADMP C[N@@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](C1CCCCC1)CC2 ZINC001257455270 1063283341 /nfs/dbraw/zinc/28/33/41/1063283341.db2.gz DPMZQTDZBWWZFO-LJQANCHMSA-N 2 1 316.489 4.289 20 0 DIADMP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)c1C ZINC001461173825 1063309828 /nfs/dbraw/zinc/30/98/28/1063309828.db2.gz WXQNDNKUWOODSM-KRWDZBQOSA-N 2 1 313.489 4.056 20 0 DIADMP CCCCC[C@H](C)[NH+]1C[C@@H]2C[NH+](Cc3cccs3)C[C@H]2C1 ZINC001257512926 1063323192 /nfs/dbraw/zinc/32/31/92/1063323192.db2.gz QMJSQWOWBKQWKC-ULQDDVLXSA-N 2 1 306.519 4.081 20 0 DIADMP [NH3+][C@H]1CC[C@H]([N@@H+](CC2CCCCC2)[C@H]2CCCSC2)CC1 ZINC001257667154 1063363681 /nfs/dbraw/zinc/36/36/81/1063363681.db2.gz VUIUGHNNZXVVQQ-BZSNNMDCSA-N 2 1 310.551 4.034 20 0 DIADMP CC(C)OCC[NH+]1CCC([NH2+]C2CC(C)(C)CC(C)(C)C2)CC1 ZINC001461277863 1063384198 /nfs/dbraw/zinc/38/41/98/1063384198.db2.gz ZWDMRDFZFKUBNE-UHFFFAOYSA-N 2 1 324.553 4.070 20 0 DIADMP CC(C)CC[N@@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001473113402 1063415613 /nfs/dbraw/zinc/41/56/13/1063415613.db2.gz GGGPCAWZYXFZIB-UHFFFAOYSA-N 2 1 316.533 4.309 20 0 DIADMP CC[C@H](C)[N@@H+](CCC[NH+]1CCCCC1)CCc1ccccc1F ZINC001473128294 1063433345 /nfs/dbraw/zinc/43/33/45/1063433345.db2.gz ICSVVHSAQDYALG-SFHVURJKSA-N 2 1 320.496 4.345 20 0 DIADMP CC1CC[NH+](C[C@H]2CCC[N@@H+](CC3CCCCCC3)C2)CC1 ZINC001473133464 1063440961 /nfs/dbraw/zinc/44/09/61/1063440961.db2.gz XAZMVMCPSIWTBW-HXUWFJFHSA-N 2 1 306.538 4.401 20 0 DIADMP CC(C)c1ccccc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC001473148937 1063453287 /nfs/dbraw/zinc/45/32/87/1063453287.db2.gz HJXLNYYHOPBDGW-UHFFFAOYSA-N 2 1 302.506 4.362 20 0 DIADMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001461372323 1063455129 /nfs/dbraw/zinc/45/51/29/1063455129.db2.gz CNEMZIZYJIGOJZ-GOSISDBHSA-N 2 1 306.538 4.447 20 0 DIADMP C[N@@H+](CCC[NH+]1CCCC1)C1CCC(c2ccccc2)CC1 ZINC001257999234 1063458526 /nfs/dbraw/zinc/45/85/26/1063458526.db2.gz IZPXIIIHFQJIRF-UHFFFAOYSA-N 2 1 300.490 4.131 20 0 DIADMP CC(C)C[NH+]1CCC([N@@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001258014015 1063461019 /nfs/dbraw/zinc/46/10/19/1063461019.db2.gz CJAMFHNCYHUROS-FQEVSTJZSA-N 2 1 318.480 4.473 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCCC[C@H]2c2ccccc2F)CC1 ZINC001258014015 1063461029 /nfs/dbraw/zinc/46/10/29/1063461029.db2.gz CJAMFHNCYHUROS-FQEVSTJZSA-N 2 1 318.480 4.473 20 0 DIADMP CC(C)C[NH+]1CCC([N@H+]2CCC[C@@H](Cc3ccccc3)C2)CC1 ZINC001258014017 1063461210 /nfs/dbraw/zinc/46/12/10/1063461210.db2.gz CMJDRSHHIIOKLZ-FQEVSTJZSA-N 2 1 314.517 4.062 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)c1 ZINC001473182420 1063490231 /nfs/dbraw/zinc/49/02/31/1063490231.db2.gz DAGNJSWENXFCEV-GOSISDBHSA-N 2 1 310.485 4.230 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)c1 ZINC001473182420 1063490240 /nfs/dbraw/zinc/49/02/40/1063490240.db2.gz DAGNJSWENXFCEV-GOSISDBHSA-N 2 1 310.485 4.230 20 0 DIADMP Cc1ccc2c(ccc(C)c2C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC001473182420 1063490254 /nfs/dbraw/zinc/49/02/54/1063490254.db2.gz DAGNJSWENXFCEV-GOSISDBHSA-N 2 1 310.485 4.230 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+]([C@H](C)C[C@H](C)CC(C)C)CC1 ZINC001258061918 1063490723 /nfs/dbraw/zinc/49/07/23/1063490723.db2.gz AMIWCHMQNUEWFG-IAGOWNOFSA-N 2 1 317.521 4.390 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC001461425892 1063493965 /nfs/dbraw/zinc/49/39/65/1063493965.db2.gz KTVUGFWYHIBWKT-CABCVRRESA-N 2 1 321.534 4.009 20 0 DIADMP CC(C)c1ncc(C[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)s1 ZINC001461425892 1063493969 /nfs/dbraw/zinc/49/39/69/1063493969.db2.gz KTVUGFWYHIBWKT-CABCVRRESA-N 2 1 321.534 4.009 20 0 DIADMP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+]([C@H](C)C[C@H](C)CC(C)C)CC1 ZINC001258075254 1063503192 /nfs/dbraw/zinc/50/31/92/1063503192.db2.gz TXKWKJCLWDYXPS-GGPKGHCWSA-N 2 1 324.553 4.022 20 0 DIADMP CC(C)=CCC[C@H](C)N(c1cccc(C)[nH+]1)C1CC[NH2+]CC1 ZINC001258098160 1063516646 /nfs/dbraw/zinc/51/66/46/1063516646.db2.gz SUFNQDAKLBTBAY-KRWDZBQOSA-N 2 1 301.478 4.083 20 0 DIADMP CC(C)=CCC[C@@H](C)N(c1[nH+]cccc1C)C1CC[NH2+]CC1 ZINC001258097896 1063517455 /nfs/dbraw/zinc/51/74/55/1063517455.db2.gz QDXXIDDMFPXXLY-QGZVFWFLSA-N 2 1 301.478 4.083 20 0 DIADMP c1ccc(C[N@@H+]2CC[C@H](C[NH2+]C3CCC4(CCC4)CC3)C2)cc1 ZINC001461459720 1063520586 /nfs/dbraw/zinc/52/05/86/1063520586.db2.gz IAENZCQURJCJDB-LJQANCHMSA-N 2 1 312.501 4.211 20 0 DIADMP Cc1ccc(C2(C[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)CCC2)cc1C ZINC001461473547 1063527226 /nfs/dbraw/zinc/52/72/26/1063527226.db2.gz PRSSSXVDMPTHIB-IBGZPJMESA-N 2 1 314.517 4.188 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC001461485294 1063531305 /nfs/dbraw/zinc/53/13/05/1063531305.db2.gz NJPQRQFMTADDOG-WLRLJWMZSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC001461485294 1063531310 /nfs/dbraw/zinc/53/13/10/1063531310.db2.gz NJPQRQFMTADDOG-WLRLJWMZSA-N 2 1 314.517 4.423 20 0 DIADMP Cc1cccc(C[N@@H+](C)C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC001258140656 1063531666 /nfs/dbraw/zinc/53/16/66/1063531666.db2.gz BDNBPQBXYAYVAU-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP Cc1cccc(C[N@H+](C)C2CC[NH+](CCc3ccccc3)CC2)c1 ZINC001258140656 1063531686 /nfs/dbraw/zinc/53/16/86/1063531686.db2.gz BDNBPQBXYAYVAU-UHFFFAOYSA-N 2 1 322.496 4.134 20 0 DIADMP CCC[N@@H+]1CCC[C@H]1C[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC001461485291 1063532204 /nfs/dbraw/zinc/53/22/04/1063532204.db2.gz NJPQRQFMTADDOG-WJMWBRGCSA-N 2 1 314.517 4.423 20 0 DIADMP CCC[N@H+]1CCC[C@H]1C[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC001461485291 1063532217 /nfs/dbraw/zinc/53/22/17/1063532217.db2.gz NJPQRQFMTADDOG-WJMWBRGCSA-N 2 1 314.517 4.423 20 0 DIADMP C=Cc1ccc(C[NH2+]C2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC001258135289 1063533783 /nfs/dbraw/zinc/53/37/83/1063533783.db2.gz YQTVFQDTQNPTPN-UHFFFAOYSA-N 2 1 320.480 4.126 20 0 DIADMP CC(C)(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)CC1CC1 ZINC001258137151 1063534025 /nfs/dbraw/zinc/53/40/25/1063534025.db2.gz BSWFXBUTIIEXEV-UHFFFAOYSA-N 2 1 314.517 4.109 20 0 DIADMP C[C@H]1CC[C@H]([N@H+](C)C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC001258149877 1063534073 /nfs/dbraw/zinc/53/40/73/1063534073.db2.gz RUPSCZLMBVUAKA-KESTWPANSA-N 2 1 314.517 4.204 20 0 DIADMP C[C@H]1CC[C@H]([N@@H+](C)C2CC[NH+](CCc3ccccc3)CC2)CC1 ZINC001258149877 1063534088 /nfs/dbraw/zinc/53/40/88/1063534088.db2.gz RUPSCZLMBVUAKA-KESTWPANSA-N 2 1 314.517 4.204 20 0 DIADMP CSCC[C@H](C)[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258209742 1063563606 /nfs/dbraw/zinc/56/36/06/1063563606.db2.gz SJCWRPRLBNGNIG-XIRDDKMYSA-N 2 1 324.509 4.039 20 0 DIADMP Cc1ccc[nH+]c1N(C1CC[NH2+]CC1)C1CCCCCCC1 ZINC001258242204 1063579799 /nfs/dbraw/zinc/57/97/99/1063579799.db2.gz VFWIJHRAVVXYRL-UHFFFAOYSA-N 2 1 301.478 4.061 20 0 DIADMP CC1(C)CCC[C@H]([NH+]2C[C@H]3C[NH+](Cc4cccs4)C[C@@H]3C2)C1 ZINC001258285512 1063586069 /nfs/dbraw/zinc/58/60/69/1063586069.db2.gz MOICOTCICNTSGJ-ZACQAIPSSA-N 2 1 318.530 4.081 20 0 DIADMP CC1(C)CCC[C@@H]([N@@H+](Cc2ccncc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001258282596 1063587046 /nfs/dbraw/zinc/58/70/46/1063587046.db2.gz ZJICGFNZZAKMDE-GUDVDZBRSA-N 2 1 315.505 4.122 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@@H+](CC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258330638 1063614882 /nfs/dbraw/zinc/61/48/82/1063614882.db2.gz ZTRSKLMLYSXVFF-BZUAXINKSA-N 2 1 300.556 4.135 20 0 DIADMP CC[C@H]1CCC[C@H]([NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)CC1 ZINC001461591224 1063599876 /nfs/dbraw/zinc/59/98/76/1063599876.db2.gz YCEFSEZZWHWPFG-NRDMVMEKSA-N 2 1 314.517 4.280 20 0 DIADMP CSC(C)(C)C[C@@H](C)[N@H+](Cc1ccccc1)C[C@H](C)C[NH3+] ZINC001258333988 1063616784 /nfs/dbraw/zinc/61/67/84/1063616784.db2.gz QQASSIUUEZSNES-HZPDHXFCSA-N 2 1 308.535 4.004 20 0 DIADMP CC[N@@H+](CCC[NH2+]Cc1c(C)cccc1C)C1CCCCC1 ZINC001461624199 1063620641 /nfs/dbraw/zinc/62/06/41/1063620641.db2.gz SLTVHZKECNPXHG-UHFFFAOYSA-N 2 1 302.506 4.438 20 0 DIADMP CCCCC[C@@H](CC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258433447 1063650110 /nfs/dbraw/zinc/65/01/10/1063650110.db2.gz FZYLIBALKPFRRE-MRXNPFEDSA-N 2 1 306.469 4.434 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+]1CCC2(CC[N@H+](C)C2)CC1 ZINC001279100362 1063654555 /nfs/dbraw/zinc/65/45/55/1063654555.db2.gz FLLYHSOHNZRSFN-UHFFFAOYSA-N 2 1 308.469 4.066 20 0 DIADMP C[C@@H](CC1CC1)[N@@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258453617 1063660802 /nfs/dbraw/zinc/66/08/02/1063660802.db2.gz SSVHTDHHXHLTHQ-JVPBZIDWSA-N 2 1 304.453 4.086 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CCC2(CC[C@@H]2[N@@H+](C)Cc2ccco2)CC1 ZINC001258460630 1063663102 /nfs/dbraw/zinc/66/31/02/1063663102.db2.gz JPJLMKUVJOUAQI-APWZRJJASA-N 2 1 316.489 4.145 20 0 DIADMP CC[N@@H+](Cc1ccccc1)C1CC[NH+]([C@@H](C)CC2CC2)CC1 ZINC001258461711 1063664055 /nfs/dbraw/zinc/66/40/55/1063664055.db2.gz DYYDCWKPJJFDHS-KRWDZBQOSA-N 2 1 300.490 4.162 20 0 DIADMP C[C@H](CC1CC1)[N@@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001258463635 1063665331 /nfs/dbraw/zinc/66/53/31/1063665331.db2.gz BGSLARXJEKNZPI-QGZVFWFLSA-N 2 1 300.490 4.019 20 0 DIADMP Cc1ccc2ccccc2c1C[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC001279101640 1063667562 /nfs/dbraw/zinc/66/75/62/1063667562.db2.gz VRGCXASOZLIMQO-NRFANRHFSA-N 2 1 308.469 4.066 20 0 DIADMP C[C@H](CC1CC1)[N@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001258471751 1063668755 /nfs/dbraw/zinc/66/87/55/1063668755.db2.gz FBGWALMFGZWBTD-DUXKGJEZSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001258471751 1063668761 /nfs/dbraw/zinc/66/87/61/1063668761.db2.gz FBGWALMFGZWBTD-DUXKGJEZSA-N 2 1 312.501 4.019 20 0 DIADMP C[C@H](CC1CC1)[NH+]1CC[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001258471751 1063668763 /nfs/dbraw/zinc/66/87/63/1063668763.db2.gz FBGWALMFGZWBTD-DUXKGJEZSA-N 2 1 312.501 4.019 20 0 DIADMP CC1(C)CC[C@@H]([N@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC001258604940 1063705005 /nfs/dbraw/zinc/70/50/05/1063705005.db2.gz MHQLTEQCKAJWAU-TZIWHRDSSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604940 1063705017 /nfs/dbraw/zinc/70/50/17/1063705017.db2.gz MHQLTEQCKAJWAU-TZIWHRDSSA-N 2 1 312.501 4.163 20 0 DIADMP CC1(C)CC[C@@H]([NH+]2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)C1 ZINC001258604940 1063705030 /nfs/dbraw/zinc/70/50/30/1063705030.db2.gz MHQLTEQCKAJWAU-TZIWHRDSSA-N 2 1 312.501 4.163 20 0 DIADMP C[N@@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCC(C)(C)C1 ZINC001258607117 1063708021 /nfs/dbraw/zinc/70/80/21/1063708021.db2.gz GMHWFKGHHQRKIR-FQEVSTJZSA-N 2 1 314.517 4.409 20 0 DIADMP CCC[C@@H](Cc1ccccc1)[N@@H+](C(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258653259 1063726550 /nfs/dbraw/zinc/72/65/50/1063726550.db2.gz NCQJCCMCCYWEDG-UFYCRDLUSA-N 2 1 302.506 4.378 20 0 DIADMP CC[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1(C(C)C)CC1 ZINC001461863384 1063757056 /nfs/dbraw/zinc/75/70/56/1063757056.db2.gz FKOGMECJNIUULH-FQEVSTJZSA-N 2 1 314.517 4.267 20 0 DIADMP CC[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC1(C(C)C)CC1 ZINC001461863384 1063757062 /nfs/dbraw/zinc/75/70/62/1063757062.db2.gz FKOGMECJNIUULH-FQEVSTJZSA-N 2 1 314.517 4.267 20 0 DIADMP CC[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC1(C(C)C)CC1 ZINC001461863384 1063757074 /nfs/dbraw/zinc/75/70/74/1063757074.db2.gz FKOGMECJNIUULH-FQEVSTJZSA-N 2 1 314.517 4.267 20 0 DIADMP Cc1c(Cl)cccc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001461863430 1063757165 /nfs/dbraw/zinc/75/71/65/1063757165.db2.gz OOQNOJMLTNHWKD-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001461863430 1063757174 /nfs/dbraw/zinc/75/71/74/1063757174.db2.gz OOQNOJMLTNHWKD-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001461863430 1063757185 /nfs/dbraw/zinc/75/71/85/1063757185.db2.gz OOQNOJMLTNHWKD-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP Cc1c(Cl)cccc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001461863430 1063757195 /nfs/dbraw/zinc/75/71/95/1063757195.db2.gz OOQNOJMLTNHWKD-APWZRJJASA-N 2 1 318.892 4.097 20 0 DIADMP CCCC[C@H](Cc1ccccc1)n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001258711432 1063768108 /nfs/dbraw/zinc/76/81/08/1063768108.db2.gz AVXLIVXNTVRFDZ-LJQANCHMSA-N 2 1 311.473 4.324 20 0 DIADMP CCCC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[N@H+](C(C)C)C[C@H]1C ZINC001258710803 1063769378 /nfs/dbraw/zinc/76/93/78/1063769378.db2.gz WGRRWPACVXXJTM-NRSPTQNISA-N 2 1 316.533 4.496 20 0 DIADMP CC[C@H]1C[N@@H+](CC2CC[NH+](CC)CC2)CC[C@H]1c1ccccc1 ZINC001461880564 1063770432 /nfs/dbraw/zinc/77/04/32/1063770432.db2.gz JVQGKPGJZXIHDX-PZJWPPBQSA-N 2 1 314.517 4.234 20 0 DIADMP CCCC[C@@H](CCC)[NH2+]C1CCN(c2[nH+]cccc2C)CC1 ZINC001258755333 1063801158 /nfs/dbraw/zinc/80/11/58/1063801158.db2.gz LIICFTKCOJGJGV-QGZVFWFLSA-N 2 1 303.494 4.307 20 0 DIADMP CC(C)c1ccc(CC[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)cc1 ZINC001461920284 1063801823 /nfs/dbraw/zinc/80/18/23/1063801823.db2.gz JZVZPFFFSIEMFS-FQEVSTJZSA-N 2 1 302.506 4.159 20 0 DIADMP CC(C)c1ccc(CC[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)cc1 ZINC001461920284 1063801841 /nfs/dbraw/zinc/80/18/41/1063801841.db2.gz JZVZPFFFSIEMFS-FQEVSTJZSA-N 2 1 302.506 4.159 20 0 DIADMP CC(C)c1ccc(CC[NH+](C)CC[C@@H]2CCCC[N@H+]2C)cc1 ZINC001461920284 1063801865 /nfs/dbraw/zinc/80/18/65/1063801865.db2.gz JZVZPFFFSIEMFS-FQEVSTJZSA-N 2 1 302.506 4.159 20 0 DIADMP CCCC[C@H](CCC)[NH+]1CCC([NH3+])(c2ccccc2F)CC1 ZINC001258756355 1063802372 /nfs/dbraw/zinc/80/23/72/1063802372.db2.gz OXVVGASSDDMICI-INIZCTEOSA-N 2 1 306.469 4.434 20 0 DIADMP CCCC[C@@H](CCC)[NH+]1CCC([NH3+])(c2ccccc2OC)CC1 ZINC001258755975 1063803419 /nfs/dbraw/zinc/80/34/19/1063803419.db2.gz FAHOXGXYCVYZNA-QGZVFWFLSA-N 2 1 318.505 4.304 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@@H+]1C ZINC001461922099 1063805008 /nfs/dbraw/zinc/80/50/08/1063805008.db2.gz SISOILSELOGWOL-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@H]([NH+](C)Cc2cccc(C3CCCC3)c2)CC[N@H+]1C ZINC001461922099 1063805021 /nfs/dbraw/zinc/80/50/21/1063805021.db2.gz SISOILSELOGWOL-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@H]([N@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922099 1063805037 /nfs/dbraw/zinc/80/50/37/1063805037.db2.gz SISOILSELOGWOL-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H]1C[C@H]([N@@H+](C)Cc2cccc(C3CCCC3)c2)CC[NH+]1C ZINC001461922099 1063805055 /nfs/dbraw/zinc/80/50/55/1063805055.db2.gz SISOILSELOGWOL-OXJNMPFZSA-N 2 1 300.490 4.259 20 0 DIADMP C[C@H](c1nccc2ccccc21)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001461921451 1063806418 /nfs/dbraw/zinc/80/64/18/1063806418.db2.gz OTHUZALDSIHHEE-AEFFLSMTSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@H](c1nccc2ccccc21)[N@@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC001461921451 1063806428 /nfs/dbraw/zinc/80/64/28/1063806428.db2.gz OTHUZALDSIHHEE-AEFFLSMTSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@H](c1nccc2ccccc21)[NH+](C)CC[C@@H]1CCCC[N@@H+]1C ZINC001461921451 1063806435 /nfs/dbraw/zinc/80/64/35/1063806435.db2.gz OTHUZALDSIHHEE-AEFFLSMTSA-N 2 1 311.473 4.102 20 0 DIADMP C[C@H](c1nccc2ccccc21)[NH+](C)CC[C@@H]1CCCC[N@H+]1C ZINC001461921451 1063806446 /nfs/dbraw/zinc/80/64/46/1063806446.db2.gz OTHUZALDSIHHEE-AEFFLSMTSA-N 2 1 311.473 4.102 20 0 DIADMP CCC[NH+]1CCC([NH2+][C@@H](c2ccccc2F)C2CCC2)CC1 ZINC001258768772 1063813141 /nfs/dbraw/zinc/81/31/41/1063813141.db2.gz WGERMIZFGQHOQN-LJQANCHMSA-N 2 1 304.453 4.131 20 0 DIADMP CC[C@H](C[C@@H](C)CC)[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC001258781808 1063818695 /nfs/dbraw/zinc/81/86/95/1063818695.db2.gz FWRFSGHBBXKETO-AZUAARDMSA-N 2 1 316.533 4.498 20 0 DIADMP C[C@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)C1 ZINC001258808950 1063838318 /nfs/dbraw/zinc/83/83/18/1063838318.db2.gz SSQNDJQVROLEAC-BWUHRYBWSA-N 2 1 312.501 4.350 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH3+])(c3ccccc3Cl)CC2)C1 ZINC001258812854 1063842360 /nfs/dbraw/zinc/84/23/60/1063842360.db2.gz NAKYAJGEMQTZJG-HUUCEWRRSA-N 2 1 306.881 4.169 20 0 DIADMP C[C@H]1CCC[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001258814516 1063845091 /nfs/dbraw/zinc/84/50/91/1063845091.db2.gz PMJMWYPENNUMEJ-YOEHRIQHSA-N 2 1 306.881 4.169 20 0 DIADMP C[C@@H]1CCC[C@H]([NH+]2CCC([NH3+])(c3cccc(Cl)c3)CC2)C1 ZINC001258814511 1063845846 /nfs/dbraw/zinc/84/58/46/1063845846.db2.gz PMJMWYPENNUMEJ-PBHICJAKSA-N 2 1 306.881 4.169 20 0 DIADMP C[C@H]1CCC[C@@H]([NH+]2CCC3(CC[N@@H+](Cc4ccoc4)C3)CC2)C1 ZINC001258825522 1063849750 /nfs/dbraw/zinc/84/97/50/1063849750.db2.gz WWHWATZONGHQFL-PKOBYXMFSA-N 2 1 316.489 4.146 20 0 DIADMP C[C@@H]1CCC[C@@H]([N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)C1 ZINC001258827727 1063853554 /nfs/dbraw/zinc/85/35/54/1063853554.db2.gz UOQJGBQZCMMQAS-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC001258827727 1063853561 /nfs/dbraw/zinc/85/35/61/1063853561.db2.gz UOQJGBQZCMMQAS-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC001258827727 1063853568 /nfs/dbraw/zinc/85/35/68/1063853568.db2.gz UOQJGBQZCMMQAS-MISYRCLQSA-N 2 1 300.490 4.019 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([N@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828386 1063854656 /nfs/dbraw/zinc/85/46/56/1063854656.db2.gz MHJXQTRMDVJHFO-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP C[C@@H]1CCC[C@@H]([NH+]2CCC([N@@H+](C)Cc3cccc(F)c3)CC2)C1 ZINC001258828386 1063854666 /nfs/dbraw/zinc/85/46/66/1063854666.db2.gz MHJXQTRMDVJHFO-OXQOHEQNSA-N 2 1 318.480 4.301 20 0 DIADMP Cc1c[nH+]c2n1CCC21CC[NH+](C(CC(C)C)CC(C)C)CC1 ZINC001258834738 1063856189 /nfs/dbraw/zinc/85/61/89/1063856189.db2.gz MAIUBMJVFZDFTO-UHFFFAOYSA-N 2 1 317.521 4.390 20 0 DIADMP CC[NH+]1CCC(C[N@@H+](Cc2ccc(F)cc2)C(C)(C)C)CC1 ZINC001461981773 1063856816 /nfs/dbraw/zinc/85/68/16/1063856816.db2.gz JPLUUODBDWXJST-UHFFFAOYSA-N 2 1 306.469 4.158 20 0 DIADMP CC(C)CC(CC(C)C)[N@@H+](C1CCOCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001258832821 1063856627 /nfs/dbraw/zinc/85/66/27/1063856627.db2.gz PJNZRJOUPVREPZ-IYARVYRRSA-N 2 1 324.553 4.198 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001258852168 1063867338 /nfs/dbraw/zinc/86/73/38/1063867338.db2.gz ZNQDIQFLNOGCBT-ACRUOGEOSA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258852168 1063867344 /nfs/dbraw/zinc/86/73/44/1063867344.db2.gz ZNQDIQFLNOGCBT-ACRUOGEOSA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C ZINC001258852168 1063867346 /nfs/dbraw/zinc/86/73/46/1063867346.db2.gz ZNQDIQFLNOGCBT-ACRUOGEOSA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@@H](Cc1ccccc1)[N@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001258852170 1063867546 /nfs/dbraw/zinc/86/75/46/1063867546.db2.gz ZNQDIQFLNOGCBT-PCCBWWKXSA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@@H+]1C ZINC001258852170 1063867562 /nfs/dbraw/zinc/86/75/62/1063867562.db2.gz ZNQDIQFLNOGCBT-PCCBWWKXSA-N 2 1 314.517 4.347 20 0 DIADMP CC[C@@H](Cc1ccccc1)[NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C ZINC001258852170 1063867574 /nfs/dbraw/zinc/86/75/74/1063867574.db2.gz ZNQDIQFLNOGCBT-PCCBWWKXSA-N 2 1 314.517 4.347 20 0 DIADMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC001258907136 1063878336 /nfs/dbraw/zinc/87/83/36/1063878336.db2.gz GJQVNEFLCDIGLA-HNNXBMFYSA-N 2 1 319.518 4.239 20 0 DIADMP Cc1ccc(CC[NH2+][C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1C ZINC001462079487 1063918972 /nfs/dbraw/zinc/91/89/72/1063918972.db2.gz JKCFAMXTCNIPBM-QUCCMNQESA-N 2 1 314.517 4.089 20 0 DIADMP C[C@@H](CC1CCC1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390615766 1064165295 /nfs/dbraw/zinc/16/52/95/1064165295.db2.gz YDNKPGOSVRKXII-FXAWDEMLSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H](CC1CCC1)[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390615766 1064165301 /nfs/dbraw/zinc/16/53/01/1064165301.db2.gz YDNKPGOSVRKXII-FXAWDEMLSA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612888 1064165631 /nfs/dbraw/zinc/16/56/31/1064165631.db2.gz XHXBBPNNGUUHLY-RTBURBONSA-N 2 1 314.517 4.455 20 0 DIADMP CC1(C)CC[C@@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390612888 1064165636 /nfs/dbraw/zinc/16/56/36/1064165636.db2.gz XHXBBPNNGUUHLY-RTBURBONSA-N 2 1 314.517 4.455 20 0 DIADMP CCC(CC)C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000390658049 1064166036 /nfs/dbraw/zinc/16/60/36/1064166036.db2.gz LCXCGQYLTDCQMI-IBGZPJMESA-N 2 1 302.506 4.313 20 0 DIADMP CCC(CC)C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000390658049 1064166042 /nfs/dbraw/zinc/16/60/42/1064166042.db2.gz LCXCGQYLTDCQMI-IBGZPJMESA-N 2 1 302.506 4.313 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660909 1064166369 /nfs/dbraw/zinc/16/63/69/1064166369.db2.gz PRUIYQBLHFQQSW-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)C1 ZINC000390660909 1064166375 /nfs/dbraw/zinc/16/63/75/1064166375.db2.gz PRUIYQBLHFQQSW-YZGWKJHDSA-N 2 1 314.517 4.455 20 0 DIADMP C[C@@H]1CCC[C@H](C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390772159 1064168627 /nfs/dbraw/zinc/16/86/27/1064168627.db2.gz KGEAWOAINWKFHL-GIVPXCGWSA-N 2 1 314.517 4.315 20 0 DIADMP C[C@@H]1CCC[C@@H](C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000390772161 1064168875 /nfs/dbraw/zinc/16/88/75/1064168875.db2.gz KGEAWOAINWKFHL-HMXCVIKNSA-N 2 1 314.517 4.315 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390876401 1064174002 /nfs/dbraw/zinc/17/40/02/1064174002.db2.gz RESZAZQMLSQUOL-OAQYLSRUSA-N 2 1 322.496 4.385 20 0 DIADMP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)cc1 ZINC000390876401 1064174005 /nfs/dbraw/zinc/17/40/05/1064174005.db2.gz RESZAZQMLSQUOL-OAQYLSRUSA-N 2 1 322.496 4.385 20 0 DIADMP CCCC[C@H](CC)C[N@@H+]1CCC2(C[NH+](CCC(C)(C)OC)C2)C1 ZINC001279266446 1064340117 /nfs/dbraw/zinc/34/01/17/1064340117.db2.gz BMHOSGNKIFRYKW-SFHVURJKSA-N 2 1 324.553 4.026 20 0 DIADMP CCCC[C@H](CC)C[N@H+]1CCC2(C[NH+](CCC(C)(C)OC)C2)C1 ZINC001279266446 1064340124 /nfs/dbraw/zinc/34/01/24/1064340124.db2.gz BMHOSGNKIFRYKW-SFHVURJKSA-N 2 1 324.553 4.026 20 0 DIADMP Cc1ccc(F)c(C[NH+]2CCC3(CCC[N@@H+](C)C3)CC2)c1Cl ZINC001279445909 1064351624 /nfs/dbraw/zinc/35/16/24/1064351624.db2.gz STWXRHRSMPQZBC-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP Cc1ccc(F)c(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)c1Cl ZINC001279445909 1064351635 /nfs/dbraw/zinc/35/16/35/1064351635.db2.gz STWXRHRSMPQZBC-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP Cc1cc(F)cc(C[NH+]2CCC3(CCC[N@H+](C)C3)CC2)c1Cl ZINC001280223383 1064386199 /nfs/dbraw/zinc/38/61/99/1064386199.db2.gz JGNYNZWWCMCJMW-UHFFFAOYSA-N 2 1 324.871 4.095 20 0 DIADMP Fc1ccc(C2([NH2+][C@@H]3CC[NH2+][C@H](c4ccccc4)C3)CCC2)cc1 ZINC000643467824 1064413484 /nfs/dbraw/zinc/41/34/84/1064413484.db2.gz VTKDBAQBGQHABF-UXHICEINSA-N 2 1 324.443 4.288 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC001307433856 1065392647 /nfs/dbraw/zinc/39/26/47/1065392647.db2.gz LSARWBWKLIZZOJ-JSGCOSHPSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CC[C@@H]1CCC[NH+]1C ZINC001307433856 1065392654 /nfs/dbraw/zinc/39/26/54/1065392654.db2.gz LSARWBWKLIZZOJ-JSGCOSHPSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@@H]1CCC[N@@H+]1C ZINC001307433856 1065392661 /nfs/dbraw/zinc/39/26/61/1065392661.db2.gz LSARWBWKLIZZOJ-JSGCOSHPSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@@H]1CCC[N@H+]1C ZINC001307433856 1065392670 /nfs/dbraw/zinc/39/26/70/1065392670.db2.gz LSARWBWKLIZZOJ-JSGCOSHPSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CC[C@@H]1CCC[NH+]1C ZINC001307433857 1065394877 /nfs/dbraw/zinc/39/48/77/1065394877.db2.gz LSARWBWKLIZZOJ-OCCSQVGLSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CC[C@@H]1CCC[NH+]1C ZINC001307433857 1065394885 /nfs/dbraw/zinc/39/48/85/1065394885.db2.gz LSARWBWKLIZZOJ-OCCSQVGLSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@@H]1CCC[N@@H+]1C ZINC001307433857 1065394896 /nfs/dbraw/zinc/39/48/96/1065394896.db2.gz LSARWBWKLIZZOJ-OCCSQVGLSA-N 2 1 315.288 4.471 20 0 DIADMP C[C@H](c1ccc(Cl)c(Cl)c1)[NH+](C)CC[C@@H]1CCC[N@H+]1C ZINC001307433857 1065394900 /nfs/dbraw/zinc/39/49/00/1065394900.db2.gz LSARWBWKLIZZOJ-OCCSQVGLSA-N 2 1 315.288 4.471 20 0 DIADMP CC(C)C[N@H+](CCC[NH+]1CCCCC1)Cc1ccccc1F ZINC001307437572 1065398077 /nfs/dbraw/zinc/39/80/77/1065398077.db2.gz IOHZEWSPMHKMGP-UHFFFAOYSA-N 2 1 306.469 4.160 20 0 DIADMP CC(C)C[N@@H+](CCC[NH+]1CCCCC1)Cc1ccccc1F ZINC001307437572 1065398082 /nfs/dbraw/zinc/39/80/82/1065398082.db2.gz IOHZEWSPMHKMGP-UHFFFAOYSA-N 2 1 306.469 4.160 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3CF)C2)CC1 ZINC001307440743 1065402742 /nfs/dbraw/zinc/40/27/42/1065402742.db2.gz SGBWWUSZJSTJGY-SFHVURJKSA-N 2 1 318.480 4.100 20 0 DIADMP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3CF)C2)CC1 ZINC001307440743 1065402746 /nfs/dbraw/zinc/40/27/46/1065402746.db2.gz SGBWWUSZJSTJGY-SFHVURJKSA-N 2 1 318.480 4.100 20 0 DIADMP CC(C)=CCC[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC001307453167 1065408482 /nfs/dbraw/zinc/40/84/82/1065408482.db2.gz UWSHRPCUYRDJSX-UHFFFAOYSA-N 2 1 300.490 4.187 20 0 DIADMP CC(C)[N@@H+]1CCCC[C@@H]1C[NH2+]C(C)(C)CCc1ccccc1 ZINC001307456302 1065410600 /nfs/dbraw/zinc/41/06/00/1065410600.db2.gz PZGDWEFCRKDKET-LJQANCHMSA-N 2 1 302.506 4.250 20 0 DIADMP CC(C)[N@H+]1CCCC[C@@H]1C[NH2+]C(C)(C)CCc1ccccc1 ZINC001307456302 1065410606 /nfs/dbraw/zinc/41/06/06/1065410606.db2.gz PZGDWEFCRKDKET-LJQANCHMSA-N 2 1 302.506 4.250 20 0 DIADMP c1ccc2c(c1)CC[C@@H]2[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001307455201 1065410690 /nfs/dbraw/zinc/41/06/90/1065410690.db2.gz HNWIWFYJPBJTQB-NQIIRXRSSA-N 2 1 312.501 4.262 20 0 DIADMP c1cc(C2CCCC2)ccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC001307484101 1065430231 /nfs/dbraw/zinc/43/02/31/1065430231.db2.gz ZGVDGDKFLPPZTE-IBGZPJMESA-N 2 1 312.501 4.262 20 0 DIADMP C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC12CCC(CC1)C2 ZINC001307495145 1065440157 /nfs/dbraw/zinc/44/01/57/1065440157.db2.gz AMVYBZOXQDFVSZ-VEDCXYSMSA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)CC12CCC(CC1)C2 ZINC001307495145 1065440163 /nfs/dbraw/zinc/44/01/63/1065440163.db2.gz AMVYBZOXQDFVSZ-VEDCXYSMSA-N 2 1 312.501 4.021 20 0 DIADMP C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC12CCC(CC1)C2 ZINC001307495145 1065440172 /nfs/dbraw/zinc/44/01/72/1065440172.db2.gz AMVYBZOXQDFVSZ-VEDCXYSMSA-N 2 1 312.501 4.021 20 0 DIADMP CC(C)C[C@@H](C)C[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001307496414 1065440564 /nfs/dbraw/zinc/44/05/64/1065440564.db2.gz LMQVIDDPLUUGSA-QUCCMNQESA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001307496414 1065440566 /nfs/dbraw/zinc/44/05/66/1065440566.db2.gz LMQVIDDPLUUGSA-QUCCMNQESA-N 2 1 302.506 4.123 20 0 DIADMP CC(C)C[C@@H](C)C[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001307496414 1065440567 /nfs/dbraw/zinc/44/05/67/1065440567.db2.gz LMQVIDDPLUUGSA-QUCCMNQESA-N 2 1 302.506 4.123 20 0 DIADMP CC[N@@H+](C)C[C@@H]1CC[NH+](CC2CCC(c3ccccc3)CC2)C1 ZINC001307514891 1065452967 /nfs/dbraw/zinc/45/29/67/1065452967.db2.gz WWJPJMQMORSDMZ-SCCNAQOGSA-N 2 1 314.517 4.234 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC001307514891 1065452971 /nfs/dbraw/zinc/45/29/71/1065452971.db2.gz WWJPJMQMORSDMZ-SCCNAQOGSA-N 2 1 314.517 4.234 20 0 DIADMP CC[NH+](C)C[C@@H]1CC[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC001307514891 1065452978 /nfs/dbraw/zinc/45/29/78/1065452978.db2.gz WWJPJMQMORSDMZ-SCCNAQOGSA-N 2 1 314.517 4.234 20 0 DIADMP CC(C)=CCC[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001307514931 1065454744 /nfs/dbraw/zinc/45/47/44/1065454744.db2.gz QLYJNQBEEPXSHO-OAQYLSRUSA-N 2 1 312.501 4.331 20 0 DIADMP C[N@@H+](Cc1ccc(C[NH+]2CCCCC2)cc1)Cc1cccc(O)c1 ZINC001307515200 1065456287 /nfs/dbraw/zinc/45/62/87/1065456287.db2.gz IQGKRBQSDPOWLR-UHFFFAOYSA-N 2 1 324.468 4.010 20 0 DIADMP CC[C@H](C)C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001307523981 1065462052 /nfs/dbraw/zinc/46/20/52/1065462052.db2.gz QYPGHDRIUSVMLT-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2ccccc2)C1 ZINC001307523981 1065462056 /nfs/dbraw/zinc/46/20/56/1065462056.db2.gz QYPGHDRIUSVMLT-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP CC[C@H](C)C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001307523981 1065462064 /nfs/dbraw/zinc/46/20/64/1065462064.db2.gz QYPGHDRIUSVMLT-SXLOBPIMSA-N 2 1 300.490 4.019 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001307593432 1065504280 /nfs/dbraw/zinc/50/42/80/1065504280.db2.gz ZDYDRGDKUFKUNI-PZJWPPBQSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001307593432 1065504292 /nfs/dbraw/zinc/50/42/92/1065504292.db2.gz ZDYDRGDKUFKUNI-PZJWPPBQSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001307593432 1065504301 /nfs/dbraw/zinc/50/43/01/1065504301.db2.gz ZDYDRGDKUFKUNI-PZJWPPBQSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC001307593431 1065504481 /nfs/dbraw/zinc/50/44/81/1065504481.db2.gz ZDYDRGDKUFKUNI-FPOVZHCZSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)cc1 ZINC001307593431 1065504494 /nfs/dbraw/zinc/50/44/94/1065504494.db2.gz ZDYDRGDKUFKUNI-FPOVZHCZSA-N 2 1 312.501 4.088 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC001307593431 1065504508 /nfs/dbraw/zinc/50/45/08/1065504508.db2.gz ZDYDRGDKUFKUNI-FPOVZHCZSA-N 2 1 312.501 4.088 20 0 DIADMP CC(C)Cc1ccc([C@@H]([NH2+]CC[C@H]2CCC[N@H+]2C)C2CC2)cc1 ZINC001307614335 1065518531 /nfs/dbraw/zinc/51/85/31/1065518531.db2.gz GEYZCXBTFBNKQH-NHCUHLMSSA-N 2 1 314.517 4.410 20 0 DIADMP C[N@H+]1CCC[C@@H]1CC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC001307628306 1065527615 /nfs/dbraw/zinc/52/76/15/1065527615.db2.gz HERCSQBENOXXCE-QZTJIDSGSA-N 2 1 306.881 4.255 20 0 DIADMP C[NH+](C)Cc1ccc(C[N@@H+](C)CCSC2CCCCC2)cc1 ZINC001307643628 1065536289 /nfs/dbraw/zinc/53/62/89/1065536289.db2.gz MXVLUGJGMKDHTQ-UHFFFAOYSA-N 2 1 320.546 4.246 20 0 DIADMP c1cc(C[NH+]2CCCCC2)cc(C[N@H+]2CCC[C@@H](C3CC3)C2)c1 ZINC001307812110 1065634166 /nfs/dbraw/zinc/63/41/66/1065634166.db2.gz FRURDFKSWVISFQ-OAQYLSRUSA-N 2 1 312.501 4.295 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@@H+]2C[C@@]3(C)C[NH+](C)C[C@@]3(C)C2)cc1 ZINC001307979326 1065709850 /nfs/dbraw/zinc/70/98/50/1065709850.db2.gz WVBKUUJKJFGWCU-FFZOFVMBSA-N 2 1 300.490 4.145 20 0 DIADMP CC(C)c1ccc([C@H](C)[N@H+]2C[C@@]3(C)C[NH+](C)C[C@@]3(C)C2)cc1 ZINC001307979326 1065709862 /nfs/dbraw/zinc/70/98/62/1065709862.db2.gz WVBKUUJKJFGWCU-FFZOFVMBSA-N 2 1 300.490 4.145 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2C[C@@]3(C)C[N@H+](C)C[C@@]3(C)C2)cc1 ZINC001307979326 1065709877 /nfs/dbraw/zinc/70/98/77/1065709877.db2.gz WVBKUUJKJFGWCU-FFZOFVMBSA-N 2 1 300.490 4.145 20 0 DIADMP CC(C)c1ccc([C@H](C)[NH+]2C[C@@]3(C)C[N@@H+](C)C[C@@]3(C)C2)cc1 ZINC001307979326 1065709891 /nfs/dbraw/zinc/70/98/91/1065709891.db2.gz WVBKUUJKJFGWCU-FFZOFVMBSA-N 2 1 300.490 4.145 20 0 DIADMP CC[C@H](C)[C@@H](C)[N@@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009094 1065723312 /nfs/dbraw/zinc/72/33/12/1065723312.db2.gz PLLGXGSLDSYBRK-IZZBFERCSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@H](C)[C@@H](C)[N@H+]1C[C@@]2(C)C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009094 1065723321 /nfs/dbraw/zinc/72/33/21/1065723321.db2.gz PLLGXGSLDSYBRK-IZZBFERCSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH+]1C[C@@]2(C)C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009094 1065723331 /nfs/dbraw/zinc/72/33/31/1065723331.db2.gz PLLGXGSLDSYBRK-IZZBFERCSA-N 2 1 314.517 4.265 20 0 DIADMP CC[C@H](C)[C@@H](C)[NH+]1C[C@@]2(C)C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001308009094 1065723338 /nfs/dbraw/zinc/72/33/38/1065723338.db2.gz PLLGXGSLDSYBRK-IZZBFERCSA-N 2 1 314.517 4.265 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2ccc3cc[nH]c3c2)CC1 ZINC001308056839 1065743488 /nfs/dbraw/zinc/74/34/88/1065743488.db2.gz PVDPHYLPQLGAAO-UHFFFAOYSA-N 2 1 311.473 4.008 20 0 DIADMP Cc1[nH]c(C2CC[NH+](Cc3ccc(Cl)s3)CC2)[nH+]c1C ZINC001308083480 1065755107 /nfs/dbraw/zinc/75/51/07/1065755107.db2.gz VAGTVYGDQLQMNI-UHFFFAOYSA-N 2 1 309.866 4.121 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@@H+]1C[C@H](c2ccccc2)CC1(C)C ZINC001308121270 1065771405 /nfs/dbraw/zinc/77/14/05/1065771405.db2.gz MCMLNLDTHZTXFX-LJQANCHMSA-N 2 1 311.473 4.240 20 0 DIADMP Cc1[nH+]ccn1CCCC[N@H+]1C[C@H](c2ccccc2)CC1(C)C ZINC001308121270 1065771421 /nfs/dbraw/zinc/77/14/21/1065771421.db2.gz MCMLNLDTHZTXFX-LJQANCHMSA-N 2 1 311.473 4.240 20 0 DIADMP CC(C)CCn1cccc1C[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC001308180585 1065792644 /nfs/dbraw/zinc/79/26/44/1065792644.db2.gz MJJLJYJAJXOGPI-UHFFFAOYSA-N 2 1 319.537 4.278 20 0 DIADMP CC(C)CCn1cccc1C[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC001308180585 1065792659 /nfs/dbraw/zinc/79/26/59/1065792659.db2.gz MJJLJYJAJXOGPI-UHFFFAOYSA-N 2 1 319.537 4.278 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182565 1065793187 /nfs/dbraw/zinc/79/31/87/1065793187.db2.gz ZPHUCELUIOLSPJ-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1 ZINC001308182565 1065793200 /nfs/dbraw/zinc/79/32/00/1065793200.db2.gz ZPHUCELUIOLSPJ-HOJAQTOUSA-N 2 1 312.501 4.352 20 0 DIADMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H]1CCC[C@@H](C(C)(C)C)CC1 ZINC001308196609 1065803103 /nfs/dbraw/zinc/80/31/03/1065803103.db2.gz DKMYCKQTJBXFKY-NXHRZFHOSA-N 2 1 305.510 4.412 20 0 DIADMP CC[C@H](C[NH2+]C/C(C)=C/c1ccc(Cl)cc1)[NH+]1CCCC1 ZINC001308195070 1065804322 /nfs/dbraw/zinc/80/43/22/1065804322.db2.gz XPHWQEGWLODAAD-NKAIQICCSA-N 2 1 306.881 4.207 20 0 DIADMP CC[C@@H](C[NH2+]C/C(C)=C\c1ccc(Cl)cc1)[NH+]1CCCC1 ZINC001308195071 1065804807 /nfs/dbraw/zinc/80/48/07/1065804807.db2.gz XPHWQEGWLODAAD-NZHZHZHDSA-N 2 1 306.881 4.207 20 0 DIADMP CN(C)c1cc[nH+]cc1C[NH2+]CC1CCC(c2ccccc2)CC1 ZINC001308259005 1065861719 /nfs/dbraw/zinc/86/17/19/1065861719.db2.gz VXAAGKFARYEVHH-UHFFFAOYSA-N 2 1 323.484 4.211 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c1 ZINC001308433316 1065985208 /nfs/dbraw/zinc/98/52/08/1065985208.db2.gz VAGNALCLLMVGGT-IBGZPJMESA-N 2 1 322.496 4.484 20 0 DIADMP Cc1ccccc1-c1cccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)c1 ZINC001308433317 1065985463 /nfs/dbraw/zinc/98/54/63/1065985463.db2.gz VAGNALCLLMVGGT-LJQANCHMSA-N 2 1 322.496 4.484 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@@H+]1Cc1ccccc1 ZINC001308455625 1066000414 /nfs/dbraw/zinc/00/04/14/1066000414.db2.gz AYHAHKFNNLXNDD-IJXRJRJASA-N 2 1 314.517 4.454 20 0 DIADMP C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2CC(C)(C)C)CC[N@H+]1Cc1ccccc1 ZINC001308455625 1066000428 /nfs/dbraw/zinc/00/04/28/1066000428.db2.gz AYHAHKFNNLXNDD-IJXRJRJASA-N 2 1 314.517 4.454 20 0 DIADMP Cc1cc2cc(CNCCC[N@H+](C)CC(C)C)oc2cc1C ZINC001308458438 1066002296 /nfs/dbraw/zinc/00/22/96/1066002296.db2.gz WSGFHQMXCARQEM-UHFFFAOYSA-N 2 1 302.462 4.117 20 0 DIADMP Cc1cc2cc(C[NH2+]CCC[N@@H+](C)CC(C)C)oc2cc1C ZINC001308458438 1066002307 /nfs/dbraw/zinc/00/23/07/1066002307.db2.gz WSGFHQMXCARQEM-UHFFFAOYSA-N 2 1 302.462 4.117 20 0 DIADMP Cc1cc2cc(C[NH2+]CCC[N@H+](C)CC(C)C)oc2cc1C ZINC001308458438 1066002317 /nfs/dbraw/zinc/00/23/17/1066002317.db2.gz WSGFHQMXCARQEM-UHFFFAOYSA-N 2 1 302.462 4.117 20 0 DIADMP C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC001308547957 1066061676 /nfs/dbraw/zinc/06/16/76/1066061676.db2.gz JLOVFKAJWPWVIL-BVJIBDCISA-N 2 1 312.501 4.065 20 0 DIADMP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cnc(-c2cccs2)s1 ZINC001308555536 1066068160 /nfs/dbraw/zinc/06/81/60/1066068160.db2.gz RWHOLBZNJAVQCC-ZDUSSCGKSA-N 2 1 323.531 4.082 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)s1 ZINC001308576061 1066091833 /nfs/dbraw/zinc/09/18/33/1066091833.db2.gz YJKMXAOOFVWKDU-KXBFYZLASA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC001308576061 1066091842 /nfs/dbraw/zinc/09/18/42/1066091842.db2.gz YJKMXAOOFVWKDU-KXBFYZLASA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)s1 ZINC001308576061 1066091853 /nfs/dbraw/zinc/09/18/53/1066091853.db2.gz YJKMXAOOFVWKDU-KXBFYZLASA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)s1 ZINC001308576060 1066091910 /nfs/dbraw/zinc/09/19/10/1066091910.db2.gz YJKMXAOOFVWKDU-HNAYVOBHSA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)s1 ZINC001308576060 1066091913 /nfs/dbraw/zinc/09/19/13/1066091913.db2.gz YJKMXAOOFVWKDU-HNAYVOBHSA-N 2 1 318.530 4.149 20 0 DIADMP CCCc1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)s1 ZINC001308576060 1066091926 /nfs/dbraw/zinc/09/19/26/1066091926.db2.gz YJKMXAOOFVWKDU-HNAYVOBHSA-N 2 1 318.530 4.149 20 0 DIADMP CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001308589572 1066103311 /nfs/dbraw/zinc/10/33/11/1066103311.db2.gz HBCCEMCRJPGIPU-PCCBWWKXSA-N 2 1 318.549 4.423 20 0 DIADMP CCCC[N@@H+](C)CC1CC[NH+](C/C=C\c2cccc(F)c2)CC1 ZINC001308605165 1066112833 /nfs/dbraw/zinc/11/28/33/1066112833.db2.gz GPWYSPDOOUMAGP-VURMDHGXSA-N 2 1 318.480 4.283 20 0 DIADMP C[C@]1(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)C[C@@H]1c1ccccc1 ZINC001308612030 1066117826 /nfs/dbraw/zinc/11/78/26/1066117826.db2.gz VHVFVNRRQONWEA-PWRODBHTSA-N 2 1 312.501 4.131 20 0 DIADMP C[C@H]([NH2+]C1CCC2(CCC2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001308682046 1066153849 /nfs/dbraw/zinc/15/38/49/1066153849.db2.gz KCQDSAZLUSFWTQ-DLBZAZTESA-N 2 1 304.522 4.342 20 0 DIADMP Cc1ccc([C@@H](C)C[NH2+]C[C@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC001308721520 1066198885 /nfs/dbraw/zinc/19/88/85/1066198885.db2.gz CNGHBYNENJHQAV-GHTZIAJQSA-N 2 1 314.517 4.485 20 0 DIADMP C[NH+]1CCC(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)CC1 ZINC001308725050 1066200193 /nfs/dbraw/zinc/20/01/93/1066200193.db2.gz MYQHYPQWIJBYRA-SFHVURJKSA-N 2 1 306.881 4.209 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001308735031 1066209020 /nfs/dbraw/zinc/20/90/20/1066209020.db2.gz CQIACQNILUGZMJ-HFTRVMKXSA-N 2 1 308.897 4.296 20 0 DIADMP CC[NH+](CC)[C@H](C)C[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001308735034 1066209755 /nfs/dbraw/zinc/20/97/55/1066209755.db2.gz CQIACQNILUGZMJ-QGPMSJSTSA-N 2 1 308.897 4.296 20 0 DIADMP Cc1ccc(-c2ccccc2C[N@H+](C)CCC[NH+](C)C)c(C)c1 ZINC001308748884 1066220652 /nfs/dbraw/zinc/22/06/52/1066220652.db2.gz VTDSPSKTLRERBL-UHFFFAOYSA-N 2 1 310.485 4.354 20 0 DIADMP CC[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001308772729 1066245204 /nfs/dbraw/zinc/24/52/04/1066245204.db2.gz WIHQRASXJFHRSS-CWJKEVGVSA-N 2 1 314.517 4.313 20 0 DIADMP CC(C)CC[NH+]1CCC([NH2+]Cc2coc3ccccc23)CC1 ZINC001308781047 1066255842 /nfs/dbraw/zinc/25/58/42/1066255842.db2.gz XWJJZXAMWYIVHQ-UHFFFAOYSA-N 2 1 300.446 4.033 20 0 DIADMP C([NH2+][C@H]1CCCCC12CCCC2)[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001308884344 1066362865 /nfs/dbraw/zinc/36/28/65/1066362865.db2.gz PZFJEUJSKGZOGC-MOPGFXCFSA-N 2 1 304.522 4.201 20 0 DIADMP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1C[C@@H](C)c1cc(F)cc(F)c1 ZINC001308882866 1066363322 /nfs/dbraw/zinc/36/33/22/1066363322.db2.gz SGRJSRMUBUEBSD-CLCXKQKWSA-N 2 1 324.459 4.121 20 0 DIADMP CC1([NH+]2CCCCC2)CC[NH+](Cc2ccc3[nH]ccc3c2)CC1 ZINC001308933922 1066407408 /nfs/dbraw/zinc/40/74/08/1066407408.db2.gz SSIGNFSJNDPWOU-UHFFFAOYSA-N 2 1 311.473 4.008 20 0 DIADMP